NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
627159 | 5ydy | 36115 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 SER 8 HT1 SER 8 32.069 -14.651 -1.267 2 H2 SER 8 HT2 SER 8 32.366 -16.291 -0.939 3 H3 SER 8 HT3 SER 8 33.602 -15.312 -1.568 4 HA SER 8 HA SER 8 33.017 -15.819 1.106 5 HB2 SER 8 HB2 SER 8 34.846 -13.661 0.055 6 HB3 SER 8 HB1 SER 8 35.065 -14.684 1.471 7 HG SER 8 HG SER 8 34.753 -16.007 -0.937 8 H GLY 9 HN GLY 9 32.694 -12.803 -0.779 9 HA2 GLY 9 HA2 GLY 9 31.145 -11.045 -0.354 10 HA3 GLY 9 HA1 GLY 9 30.698 -11.844 1.154 11 HA PRO 10 HA PRO 10 32.833 -8.201 2.811 12 HB2 PRO 10 HB2 PRO 10 32.355 -9.815 5.280 13 HB3 PRO 10 HB1 PRO 10 32.030 -8.099 4.975 14 HG2 PRO 10 HG2 PRO 10 30.073 -9.910 5.009 15 HG3 PRO 10 HG1 PRO 10 30.048 -8.521 3.908 16 HD2 PRO 10 HD2 PRO 10 30.566 -11.390 3.300 17 HD3 PRO 10 HD1 PRO 10 29.889 -10.119 2.259 18 H LEU 11 HN LEU 11 34.682 -8.105 4.614 19 HA LEU 11 HA LEU 11 36.765 -9.965 3.711 20 HB2 LEU 11 HB2 LEU 11 36.662 -7.496 5.438 21 HB3 LEU 11 HB1 LEU 11 38.113 -8.480 5.383 22 HG LEU 11 HG LEU 11 36.737 -7.354 2.935 23 HD11 LEU 11 HD11 LEU 11 39.412 -6.395 3.810 24 HD12 LEU 11 HD12 LEU 11 38.029 -5.830 4.745 25 HD13 LEU 11 HD13 LEU 11 38.110 -5.517 3.011 26 HD21 LEU 11 HD21 LEU 11 38.802 -9.336 3.340 27 HD22 LEU 11 HD22 LEU 11 39.460 -7.950 2.476 28 HD23 LEU 11 HD23 LEU 11 38.059 -8.805 1.834 29 HA PRO 12 HA PRO 12 37.639 -12.828 7.053 30 HB2 PRO 12 HB2 PRO 12 38.448 -10.518 8.796 31 HB3 PRO 12 HB1 PRO 12 39.176 -12.132 8.669 32 HG2 PRO 12 HG2 PRO 12 40.056 -9.880 7.327 33 HG3 PRO 12 HG1 PRO 12 40.421 -11.550 6.876 34 HD2 PRO 12 HD2 PRO 12 38.920 -9.699 5.344 35 HD3 PRO 12 HD1 PRO 12 39.062 -11.437 5.034 36 H ASP 13 HN ASP 13 36.340 -9.792 8.432 37 HA ASP 13 HA ASP 13 33.748 -10.380 8.907 38 HB2 ASP 13 HB2 ASP 13 33.922 -12.470 9.893 39 HB3 ASP 13 HB1 ASP 13 35.468 -12.095 10.656 40 H GLY 14 HN GLY 14 33.302 -8.305 9.413 41 HA2 GLY 14 HA2 GLY 14 33.006 -6.728 11.291 42 HA3 GLY 14 HA1 GLY 14 34.627 -7.165 11.834 43 H TRP 15 HN TRP 15 34.960 -7.073 8.594 44 HA TRP 15 HA TRP 15 35.086 -4.158 8.298 45 HB2 TRP 15 HB2 TRP 15 37.416 -3.956 8.057 46 HB3 TRP 15 HB1 TRP 15 37.194 -4.930 9.503 47 HD1 TRP 15 HD1 TRP 15 37.048 -7.797 8.637 48 HE1 TRP 15 HE1 TRP 15 38.920 -8.939 7.292 49 HE3 TRP 15 HE3 TRP 15 39.303 -3.703 6.601 50 HZ2 TRP 15 HZ2 TRP 15 41.097 -8.215 5.589 51 HZ3 TRP 15 HZ3 TRP 15 41.263 -3.948 5.132 52 HH2 TRP 15 HH2 TRP 15 42.176 -6.198 4.624 53 H GLU 16 HN GLU 16 36.230 -3.671 6.037 54 HA GLU 16 HA GLU 16 35.987 -5.790 4.057 55 HB2 GLU 16 HB2 GLU 16 33.640 -4.237 4.754 56 HB3 GLU 16 HB1 GLU 16 34.079 -3.992 3.063 57 HG2 GLU 16 HG2 GLU 16 34.286 -6.536 2.898 58 HG3 GLU 16 HG1 GLU 16 33.482 -6.599 4.466 59 H GLN 17 HN GLN 17 36.204 -4.834 1.792 60 HA GLN 17 HA GLN 17 38.023 -2.494 1.925 61 HB2 GLN 17 HB2 GLN 17 38.905 -4.548 0.867 62 HB3 GLN 17 HB1 GLN 17 37.578 -4.514 -0.293 63 HG2 GLN 17 HG2 GLN 17 38.354 -2.467 -1.262 64 HG3 GLN 17 HG1 GLN 17 39.505 -2.208 0.049 65 HE21 GLN 17 HE21 GLN 17 41.574 -2.556 -0.772 66 HE22 GLN 17 HE22 GLN 17 42.014 -3.845 -1.786 67 H ALA 18 HN ALA 18 37.595 -0.634 0.683 68 HA ALA 18 HA ALA 18 35.264 -0.631 -1.117 69 HB1 ALA 18 HB1 ALA 18 34.688 1.623 0.310 70 HB2 ALA 18 HB2 ALA 18 35.271 0.558 1.589 71 HB3 ALA 18 HB3 ALA 18 33.911 0.064 0.582 72 H MET 19 HN MET 19 34.989 2.029 -1.588 73 HA MET 19 HA MET 19 37.727 3.072 -2.079 74 HB2 MET 19 HB2 MET 19 36.849 3.796 -4.382 75 HB3 MET 19 HB1 MET 19 37.208 2.081 -4.180 76 HG2 MET 19 HG2 MET 19 34.459 2.902 -3.441 77 HG3 MET 19 HG1 MET 19 34.848 3.008 -5.157 78 HE1 MET 19 HE1 MET 19 36.285 1.402 -6.244 79 HE2 MET 19 HE2 MET 19 34.774 0.655 -6.759 80 HE3 MET 19 HE3 MET 19 36.089 -0.354 -6.164 81 H THR 20 HN THR 20 37.780 5.400 -2.341 82 HA THR 20 HA THR 20 35.578 6.732 -0.915 83 HB THR 20 HB THR 20 37.224 8.740 -1.277 84 HG1 THR 20 HG1 THR 20 38.567 7.881 -2.777 85 HG21 THR 20 HG21 THR 20 36.941 6.796 0.699 86 HG22 THR 20 HG22 THR 20 37.825 8.315 0.854 87 HG23 THR 20 HG23 THR 20 38.676 6.842 0.388 88 H GLN 21 HN GLN 21 35.803 9.303 -2.146 89 HA GLN 21 HA GLN 21 34.165 8.811 -4.533 90 HB2 GLN 21 HB2 GLN 21 33.999 10.728 -2.668 91 HB3 GLN 21 HB1 GLN 21 35.078 11.558 -3.790 92 HG2 GLN 21 HG2 GLN 21 32.964 12.177 -4.589 93 HG3 GLN 21 HG1 GLN 21 33.358 10.792 -5.608 94 HE21 GLN 21 HE21 GLN 21 32.926 8.859 -3.337 95 HE22 GLN 21 HE22 GLN 21 31.242 8.763 -3.144 96 H ASP 22 HN ASP 22 37.443 9.171 -3.842 97 HA ASP 22 HA ASP 22 38.008 10.067 -6.618 98 HB2 ASP 22 HB2 ASP 22 38.930 11.550 -4.855 99 HB3 ASP 22 HB1 ASP 22 39.808 10.176 -4.183 100 H GLY 23 HN GLY 23 37.446 7.372 -5.276 101 HA2 GLY 23 HA2 GLY 23 38.189 5.163 -5.511 102 HA3 GLY 23 HA1 GLY 23 38.991 5.738 -6.972 103 H GLU 24 HN GLU 24 39.541 6.453 -3.509 104 HA GLU 24 HA GLU 24 42.428 6.047 -3.964 105 HB2 GLU 24 HB2 GLU 24 41.093 6.852 -1.383 106 HB3 GLU 24 HB1 GLU 24 42.760 7.148 -1.880 107 HG2 GLU 24 HG2 GLU 24 41.846 8.545 -3.779 108 HG3 GLU 24 HG1 GLU 24 40.257 8.396 -3.030 109 H ILE 25 HN ILE 25 40.186 4.004 -3.677 110 HA ILE 25 HA ILE 25 39.765 1.978 -2.514 111 HB ILE 25 HB ILE 25 41.468 1.283 -4.065 112 HG12 ILE 25 HG12 ILE 25 42.656 -0.455 -2.717 113 HG13 ILE 25 HG11 ILE 25 42.110 0.353 -1.248 114 HG21 ILE 25 HG21 ILE 25 43.884 1.480 -3.469 115 HG22 ILE 25 HG22 ILE 25 43.429 2.430 -2.058 116 HG23 ILE 25 HG23 ILE 25 43.103 3.047 -3.676 117 HD11 ILE 25 HD11 ILE 25 40.037 -0.527 -1.416 118 HD12 ILE 25 HD12 ILE 25 40.718 -1.618 -2.622 119 HD13 ILE 25 HD13 ILE 25 39.925 -0.126 -3.130 120 H TYR 26 HN TYR 26 39.167 2.066 -0.414 121 HA TYR 26 HA TYR 26 41.319 2.312 1.617 122 HB2 TYR 26 HB2 TYR 26 40.044 3.798 2.956 123 HB3 TYR 26 HB1 TYR 26 39.895 4.435 1.320 124 HD1 TYR 26 HD1 TYR 26 38.194 2.128 3.733 125 HD2 TYR 26 HD2 TYR 26 37.771 4.788 0.387 126 HE1 TYR 26 HE1 TYR 26 35.723 1.916 3.874 127 HE2 TYR 26 HE2 TYR 26 35.304 4.572 0.533 128 HH TYR 26 HH TYR 26 33.745 2.233 1.985 129 H TYR 27 HN TYR 27 40.639 1.370 3.744 130 HA TYR 27 HA TYR 27 38.766 -0.915 3.297 131 HB2 TYR 27 HB2 TYR 27 41.169 -0.654 5.125 132 HB3 TYR 27 HB1 TYR 27 40.041 -2.009 5.179 133 HD1 TYR 27 HD1 TYR 27 39.845 -3.570 3.290 134 HD2 TYR 27 HD2 TYR 27 42.698 -0.364 3.267 135 HE1 TYR 27 HE1 TYR 27 41.020 -4.631 1.386 136 HE2 TYR 27 HE2 TYR 27 43.877 -1.422 1.365 137 HH TYR 27 HH TYR 27 43.334 -3.012 -0.477 138 H ILE 28 HN ILE 28 37.300 -1.418 5.002 139 HA ILE 28 HA ILE 28 36.947 0.758 6.990 140 HB ILE 28 HB ILE 28 35.083 1.229 5.872 141 HG12 ILE 28 HG12 ILE 28 33.132 -0.257 6.232 142 HG13 ILE 28 HG11 ILE 28 34.219 -1.541 6.758 143 HG21 ILE 28 HG21 ILE 28 34.330 0.026 3.953 144 HG22 ILE 28 HG22 ILE 28 35.078 -1.468 4.517 145 HG23 ILE 28 HG23 ILE 28 36.086 -0.132 3.966 146 HD11 ILE 28 HD11 ILE 28 34.417 -0.648 8.809 147 HD12 ILE 28 HD12 ILE 28 33.070 0.398 8.380 148 HD13 ILE 28 HD13 ILE 28 34.728 0.959 8.159 149 H ASN 29 HN ASN 29 36.873 0.097 9.060 150 HA ASN 29 HA ASN 29 36.594 -2.824 9.590 151 HB2 ASN 29 HB2 ASN 29 38.531 -1.139 10.436 152 HB3 ASN 29 HB1 ASN 29 37.383 -0.958 11.762 153 HD21 ASN 29 HD21 ASN 29 38.831 -3.626 9.797 154 HD22 ASN 29 HD22 ASN 29 38.997 -4.691 11.107 155 H HIS 30 HN HIS 30 34.440 -3.255 9.892 156 HA HIS 30 HA HIS 30 32.551 -1.398 10.991 157 HB2 HIS 30 HB2 HIS 30 32.442 -4.424 10.795 158 HB3 HIS 30 HB1 HIS 30 31.067 -3.389 11.185 159 HD1 HIS 30 HD1 HIS 30 30.912 -1.271 9.247 160 HD2 HIS 30 HD2 HIS 30 32.442 -4.979 8.096 161 HE1 HIS 30 HE1 HIS 30 30.722 -1.374 6.722 162 HE2 HIS 30 HE2 HIS 30 31.648 -3.626 6.012 163 H LYS 31 HN LYS 31 35.037 -3.104 12.487 164 HA LYS 31 HA LYS 31 33.645 -3.499 15.041 165 HB2 LYS 31 HB2 LYS 31 36.468 -3.952 14.085 166 HB3 LYS 31 HB1 LYS 31 36.057 -4.055 15.797 167 HG2 LYS 31 HG2 LYS 31 34.451 -5.567 13.745 168 HG3 LYS 31 HG1 LYS 31 35.959 -6.232 14.373 169 HD2 LYS 31 HD2 LYS 31 34.226 -5.178 16.485 170 HD3 LYS 31 HD1 LYS 31 33.470 -6.484 15.570 171 HE2 LYS 31 HE2 LYS 31 36.259 -6.637 16.747 172 HE3 LYS 31 HE1 LYS 31 34.820 -7.282 17.535 173 HZ1 LYS 31 HZ1 LYS 31 36.093 -8.155 15.020 174 HZ2 LYS 31 HZ2 LYS 31 34.461 -8.505 15.337 175 HZ3 LYS 31 HZ3 LYS 31 35.674 -9.082 16.377 176 H ASN 32 HN ASN 32 36.294 -1.463 13.813 177 HA ASN 32 HA ASN 32 36.028 0.253 16.215 178 HB2 ASN 32 HB2 ASN 32 38.102 0.121 14.012 179 HB3 ASN 32 HB1 ASN 32 38.101 1.362 15.266 180 HD21 ASN 32 HD21 ASN 32 40.241 0.365 15.936 181 HD22 ASN 32 HD22 ASN 32 40.220 -1.018 16.921 182 H LYS 33 HN LYS 33 34.243 0.068 13.673 183 HA LYS 33 HA LYS 33 33.228 1.564 12.153 184 HB2 LYS 33 HB2 LYS 33 32.335 3.548 13.278 185 HB3 LYS 33 HB1 LYS 33 32.231 2.157 14.357 186 HG2 LYS 33 HG2 LYS 33 34.158 2.865 15.598 187 HG3 LYS 33 HG1 LYS 33 34.551 4.101 14.402 188 HD2 LYS 33 HD2 LYS 33 31.841 4.465 15.326 189 HD3 LYS 33 HD1 LYS 33 32.940 4.403 16.705 190 HE2 LYS 33 HE2 LYS 33 34.326 6.152 15.745 191 HE3 LYS 33 HE1 LYS 33 33.373 6.146 14.263 192 HZ1 LYS 33 HZ1 LYS 33 32.477 6.953 16.972 193 HZ2 LYS 33 HZ2 LYS 33 31.421 6.742 15.659 194 HZ3 LYS 33 HZ3 LYS 33 32.625 7.940 15.601 195 H THR 34 HN THR 34 36.122 1.510 11.962 196 HA THR 34 HA THR 34 36.545 4.278 10.960 197 HB THR 34 HB THR 34 39.073 3.285 11.697 198 HG1 THR 34 HG1 THR 34 38.415 1.883 13.165 199 HG21 THR 34 HG21 THR 34 38.308 5.630 11.739 200 HG22 THR 34 HG22 THR 34 39.016 5.158 13.285 201 HG23 THR 34 HG23 THR 34 37.263 5.259 13.111 202 H THR 35 HN THR 35 38.189 4.367 9.211 203 HA THR 35 HA THR 35 38.265 1.800 7.720 204 HB THR 35 HB THR 35 38.858 3.575 5.813 205 HG1 THR 35 HG1 THR 35 38.578 5.514 6.519 206 HG21 THR 35 HG21 THR 35 36.193 2.756 6.945 207 HG22 THR 35 HG22 THR 35 36.991 2.188 5.481 208 HG23 THR 35 HG23 THR 35 36.278 3.796 5.525 209 H SER 36 HN SER 36 40.253 1.363 6.470 210 HA SER 36 HA SER 36 42.643 2.893 7.354 211 HB2 SER 36 HB2 SER 36 42.910 -0.058 7.557 212 HB3 SER 36 HB1 SER 36 43.650 1.208 8.533 213 HG SER 36 HG SER 36 41.238 -0.114 8.830 214 H TRP 37 HN TRP 37 44.673 1.835 6.234 215 HA TRP 37 HA TRP 37 43.910 1.410 3.393 216 HB2 TRP 37 HB2 TRP 37 46.646 1.929 4.596 217 HB3 TRP 37 HB1 TRP 37 46.234 1.951 2.882 218 HD1 TRP 37 HD1 TRP 37 46.803 4.251 5.571 219 HE1 TRP 37 HE1 TRP 37 45.634 6.514 5.183 220 HE3 TRP 37 HE3 TRP 37 43.567 2.943 1.838 221 HZ2 TRP 37 HZ2 TRP 37 43.595 7.625 3.510 222 HZ3 TRP 37 HZ3 TRP 37 42.027 4.624 0.867 223 HH2 TRP 37 HH2 TRP 37 42.037 6.959 1.697 224 H LEU 38 HN LEU 38 44.932 -0.335 6.131 225 HA LEU 38 HA LEU 38 46.665 -2.297 5.430 226 HB2 LEU 38 HB2 LEU 38 45.159 -2.246 7.487 227 HB3 LEU 38 HB1 LEU 38 43.934 -3.041 6.499 228 HG LEU 38 HG LEU 38 45.918 -4.697 5.936 229 HD11 LEU 38 HD11 LEU 38 47.672 -3.502 7.102 230 HD12 LEU 38 HD12 LEU 38 47.350 -4.994 7.987 231 HD13 LEU 38 HD13 LEU 38 46.717 -3.458 8.585 232 HD21 LEU 38 HD21 LEU 38 45.126 -6.153 7.698 233 HD22 LEU 38 HD22 LEU 38 43.757 -5.181 7.156 234 HD23 LEU 38 HD23 LEU 38 44.586 -4.775 8.659 235 H ASP 39 HN ASP 39 46.898 -3.751 3.795 236 HA ASP 39 HA ASP 39 44.570 -4.173 1.991 237 HB2 ASP 39 HB2 ASP 39 47.383 -4.838 1.202 238 HB3 ASP 39 HB1 ASP 39 46.034 -4.321 0.189 239 HA PRO 40 HA PRO 40 44.869 -8.314 3.722 240 HB2 PRO 40 HB2 PRO 40 42.533 -9.239 2.624 241 HB3 PRO 40 HB1 PRO 40 42.612 -8.261 4.099 242 HG2 PRO 40 HG2 PRO 40 41.806 -7.493 1.371 243 HG3 PRO 40 HG1 PRO 40 41.294 -6.837 2.929 244 HD2 PRO 40 HD2 PRO 40 43.146 -5.648 1.184 245 HD3 PRO 40 HD1 PRO 40 42.909 -5.223 2.891 246 H ARG 41 HN ARG 41 42.999 -9.175 0.940 247 HA ARG 41 HA ARG 41 45.391 -10.545 -0.179 248 HB2 ARG 41 HB2 ARG 41 43.564 -11.916 -1.393 249 HB3 ARG 41 HB1 ARG 41 43.766 -12.185 0.339 250 HG2 ARG 41 HG2 ARG 41 41.951 -9.981 -0.112 251 HG3 ARG 41 HG1 ARG 41 41.405 -11.405 -1.000 252 HD2 ARG 41 HD2 ARG 41 40.637 -11.145 1.466 253 HD3 ARG 41 HD1 ARG 41 41.251 -12.716 0.952 254 HE ARG 41 HE ARG 41 43.500 -11.394 1.900 255 HH11 ARG 41 HH11 ARG 41 44.163 -11.537 4.057 256 HH12 ARG 41 HH12 ARG 41 43.000 -11.910 5.284 257 HH21 ARG 41 HH21 ARG 41 40.343 -12.139 3.068 258 HH22 ARG 41 HH22 ARG 41 40.837 -12.250 4.724 259 H LEU 42 HN LEU 42 44.796 -7.751 -0.717 260 HA LEU 42 HA LEU 42 44.615 -7.944 -3.657 261 HB2 LEU 42 HB2 LEU 42 42.314 -7.465 -2.937 262 HB3 LEU 42 HB1 LEU 42 42.887 -6.087 -1.997 263 HG LEU 42 HG LEU 42 43.923 -5.840 -4.652 264 HD11 LEU 42 HD11 LEU 42 41.719 -5.606 -5.844 265 HD12 LEU 42 HD12 LEU 42 40.946 -6.387 -4.465 266 HD13 LEU 42 HD13 LEU 42 42.128 -7.271 -5.431 267 HD21 LEU 42 HD21 LEU 42 43.313 -4.098 -2.856 268 HD22 LEU 42 HD22 LEU 42 41.650 -4.270 -3.418 269 HD23 LEU 42 HD23 LEU 42 42.899 -3.694 -4.522 270 H ASP 43 HN ASP 43 46.939 -7.470 -3.344 271 HA ASP 43 HA ASP 43 47.660 -4.813 -3.834 272 HB2 ASP 43 HB2 ASP 43 47.050 -4.007 -1.727 273 HB3 ASP 43 HB1 ASP 43 47.522 -5.499 -0.911 274 HA PRO 44 HA PRO 44 50.767 -8.290 -4.356 275 HB2 PRO 44 HB2 PRO 44 51.330 -6.498 -6.674 276 HB3 PRO 44 HB1 PRO 44 51.203 -8.266 -6.620 277 HG2 PRO 44 HG2 PRO 44 49.262 -6.745 -7.644 278 HG3 PRO 44 HG1 PRO 44 48.918 -8.243 -6.764 279 HD2 PRO 44 HD2 PRO 44 48.531 -5.420 -5.890 280 HD3 PRO 44 HD1 PRO 44 47.641 -6.883 -5.415 281 H ARG 45 HN ARG 45 53.153 -7.250 -5.644 282 HA ARG 45 HA ARG 45 54.627 -6.303 -3.448 283 HB2 ARG 45 HB2 ARG 45 55.048 -6.048 -6.426 284 HB3 ARG 45 HB1 ARG 45 56.205 -5.374 -5.277 285 HG2 ARG 45 HG2 ARG 45 55.473 -8.075 -4.520 286 HG3 ARG 45 HG1 ARG 45 56.085 -8.036 -6.174 287 HD2 ARG 45 HD2 ARG 45 57.918 -8.347 -4.537 288 HD3 ARG 45 HD1 ARG 45 58.089 -6.831 -5.422 289 HE ARG 45 HE ARG 45 56.769 -5.949 -3.249 290 HH11 ARG 45 HH11 ARG 45 57.648 -5.504 -1.214 291 HH12 ARG 45 HH12 ARG 45 59.061 -6.358 -0.690 292 HH21 ARG 45 HH21 ARG 45 59.328 -8.235 -3.592 293 HH22 ARG 45 HH22 ARG 45 60.012 -7.904 -2.036 294 H GLY 46 HN GLY 46 55.807 -4.028 -3.570 295 HA2 GLY 46 HA2 GLY 46 54.971 -1.689 -4.608 296 HA3 GLY 46 HA1 GLY 46 53.647 -2.017 -3.489 297 H GLY 47 HN GLY 47 56.690 -0.601 -3.766 298 HA2 GLY 47 HA2 GLY 47 57.418 -0.960 -0.927 299 HA3 GLY 47 HA1 GLY 47 58.348 -0.063 -2.128 300 H GLY 48 HN GLY 48 55.611 0.107 0.079 301 HA2 GLY 48 HA2 GLY 48 54.718 2.735 -0.579 302 HA3 GLY 48 HA1 GLY 48 54.503 1.964 0.992 303 H GLY 49 HN GLY 49 54.995 3.955 2.086 304 HA2 GLY 49 HA2 GLY 49 57.640 4.279 2.970 305 HA3 GLY 49 HA1 GLY 49 57.437 5.414 1.634 306 H ASN 50 HN ASN 50 54.770 6.168 2.009 307 HA ASN 50 HA ASN 50 54.361 6.988 4.785 308 HB2 ASN 50 HB2 ASN 50 54.741 9.230 2.806 309 HB3 ASN 50 HB1 ASN 50 54.747 9.301 4.569 310 HD21 ASN 50 HD21 ASN 50 56.685 8.450 5.695 311 HD22 ASN 50 HD22 ASN 50 58.159 8.305 4.868 312 H ARG 51 HN ARG 51 52.186 7.205 5.090 313 HA ARG 51 HA ARG 51 50.493 7.957 2.759 314 HB2 ARG 51 HB2 ARG 51 50.693 5.330 3.821 315 HB3 ARG 51 HB1 ARG 51 49.140 5.972 4.353 316 HG2 ARG 51 HG2 ARG 51 48.455 5.251 2.295 317 HG3 ARG 51 HG1 ARG 51 49.121 6.796 1.767 318 HD2 ARG 51 HD2 ARG 51 51.368 5.498 1.565 319 HD3 ARG 51 HD1 ARG 51 50.358 4.056 1.595 320 HE ARG 51 HE ARG 51 49.317 4.807 -0.486 321 HH11 ARG 51 HH11 ARG 51 49.718 5.787 -2.479 322 HH12 ARG 51 HH12 ARG 51 51.007 6.934 -2.624 323 HH21 ARG 51 HH21 ARG 51 51.960 6.685 0.699 324 HH22 ARG 51 HH22 ARG 51 52.275 7.442 -0.825 325 H GLN 52 HN GLN 52 49.958 9.960 3.691 326 HA GLN 52 HA GLN 52 49.514 10.739 6.261 327 HB2 GLN 52 HB2 GLN 52 47.416 11.316 4.160 328 HB3 GLN 52 HB1 GLN 52 47.944 12.357 5.483 329 HG2 GLN 52 HG2 GLN 52 49.248 13.317 3.876 330 HG3 GLN 52 HG1 GLN 52 50.310 11.946 4.196 331 HE21 GLN 52 HE21 GLN 52 50.999 12.134 1.870 332 HE22 GLN 52 HE22 GLN 52 50.011 11.474 0.658 333 HA PRO 53 HA PRO 53 46.817 7.818 8.232 334 HB2 PRO 53 HB2 PRO 53 45.713 10.322 9.449 335 HB3 PRO 53 HB1 PRO 53 46.209 8.811 10.236 336 HG2 PRO 53 HG2 PRO 53 47.741 11.015 10.259 337 HG3 PRO 53 HG1 PRO 53 48.419 9.380 10.240 338 HD2 PRO 53 HD2 PRO 53 48.413 11.411 8.097 339 HD3 PRO 53 HD1 PRO 53 49.446 9.978 8.289 340 HA PRO 54 HA PRO 54 43.186 8.147 5.672 341 HB2 PRO 54 HB2 PRO 54 41.754 6.101 6.796 342 HB3 PRO 54 HB1 PRO 54 43.111 5.849 5.684 343 HG2 PRO 54 HG2 PRO 54 43.026 5.635 8.645 344 HG3 PRO 54 HG1 PRO 54 43.916 4.660 7.464 345 HD2 PRO 54 HD2 PRO 54 45.075 6.646 8.974 346 HD3 PRO 54 HD1 PRO 54 45.688 6.130 7.389 347 HA PRO 55 HA PRO 55 40.298 10.507 8.075 348 HB2 PRO 55 HB2 PRO 55 38.146 10.438 6.395 349 HB3 PRO 55 HB1 PRO 55 39.595 11.411 6.072 350 HG2 PRO 55 HG2 PRO 55 38.779 8.792 4.927 351 HG3 PRO 55 HG1 PRO 55 39.588 10.164 4.151 352 HD2 PRO 55 HD2 PRO 55 40.904 7.889 4.990 353 HD3 PRO 55 HD1 PRO 55 41.682 9.479 4.825 354 HA PRO 56 HA PRO 56 37.939 7.456 10.296 355 HB2 PRO 56 HB2 PRO 56 36.351 9.166 11.744 356 HB3 PRO 56 HB1 PRO 56 38.045 8.819 12.137 357 HG2 PRO 56 HG2 PRO 56 36.864 11.173 10.765 358 HG3 PRO 56 HG1 PRO 56 38.221 11.087 11.899 359 HD2 PRO 56 HD2 PRO 56 38.541 11.345 9.182 360 HD3 PRO 56 HD1 PRO 56 39.747 10.583 10.242 361 H TYR 57 HN TYR 57 36.402 6.311 9.193 362 HA TYR 57 HA TYR 57 34.232 7.715 7.791 363 HB2 TYR 57 HB2 TYR 57 34.282 5.907 6.447 364 HB3 TYR 57 HB1 TYR 57 35.612 5.277 7.419 365 HD1 TYR 57 HD1 TYR 57 32.005 5.123 6.761 366 HD2 TYR 57 HD2 TYR 57 35.196 3.676 9.244 367 HE1 TYR 57 HE1 TYR 57 30.531 3.315 7.600 368 HE2 TYR 57 HE2 TYR 57 33.723 1.868 10.081 369 HH TYR 57 HH TYR 57 31.764 0.818 9.802 370 HA PRO 58 HA PRO 58 31.783 7.093 11.530 371 HB2 PRO 58 HB2 PRO 58 29.784 8.808 10.865 372 HB3 PRO 58 HB1 PRO 58 31.363 9.363 11.457 373 HG2 PRO 58 HG2 PRO 58 30.287 9.319 8.692 374 HG3 PRO 58 HG1 PRO 58 31.349 10.499 9.476 375 HD2 PRO 58 HD2 PRO 58 32.209 8.506 7.730 376 HD3 PRO 58 HD1 PRO 58 33.247 9.349 8.901 377 H LEU 59 HN LEU 59 30.261 5.519 11.889 378 HA LEU 59 HA LEU 59 28.912 4.295 9.594 379 HB2 LEU 59 HB2 LEU 59 29.872 3.281 11.934 380 HB3 LEU 59 HB1 LEU 59 28.161 3.450 12.330 381 HG LEU 59 HG LEU 59 29.154 2.105 9.805 382 HD11 LEU 59 HD11 LEU 59 28.277 0.034 11.200 383 HD12 LEU 59 HD12 LEU 59 28.690 1.057 12.577 384 HD13 LEU 59 HD13 LEU 59 29.932 0.609 11.407 385 HD21 LEU 59 HD21 LEU 59 26.794 3.058 9.942 386 HD22 LEU 59 HD22 LEU 59 26.487 1.888 11.226 387 HD23 LEU 59 HD23 LEU 59 26.889 1.330 9.603 388 H THR 60 HN THR 60 27.380 5.858 8.911 389 HA THR 60 HA THR 60 25.111 6.575 8.908 390 HB THR 60 HB THR 60 24.782 6.108 11.834 391 HG1 THR 60 HG1 THR 60 24.312 3.826 11.064 392 HG21 THR 60 HG21 THR 60 22.612 5.164 10.962 393 HG22 THR 60 HG22 THR 60 23.142 5.606 9.340 394 HG23 THR 60 HG23 THR 60 22.881 6.858 10.553 395 H ALA 61 HN ALA 61 24.098 8.582 9.566 396 HA ALA 61 HA ALA 61 25.721 10.757 10.039 397 HB1 ALA 61 HB1 ALA 61 23.633 11.789 11.194 398 HB2 ALA 61 HB2 ALA 61 22.854 10.250 10.824 399 HB3 ALA 61 HB3 ALA 61 23.478 11.260 9.519 Start of MODEL 2 1 H1 SER 8 HT1 SER 8 27.322 -12.597 -1.507 2 H2 SER 8 HT2 SER 8 28.239 -12.949 -2.893 3 H3 SER 8 HT3 SER 8 27.181 -11.619 -2.886 4 HA SER 8 HA SER 8 29.673 -11.180 -2.585 5 HB2 SER 8 HB2 SER 8 27.406 -9.812 -1.869 6 HB3 SER 8 HB1 SER 8 28.249 -9.922 -0.326 7 HG SER 8 HG SER 8 29.345 -8.994 -2.781 8 H GLY 9 HN GLY 9 29.844 -10.229 0.316 9 HA2 GLY 9 HA2 GLY 9 29.889 -11.894 2.371 10 HA3 GLY 9 HA1 GLY 9 31.040 -12.747 1.344 11 HA PRO 10 HA PRO 10 32.600 -8.286 3.028 12 HB2 PRO 10 HB2 PRO 10 32.277 -9.361 5.797 13 HB3 PRO 10 HB1 PRO 10 32.114 -7.696 5.210 14 HG2 PRO 10 HG2 PRO 10 29.987 -9.196 5.804 15 HG3 PRO 10 HG1 PRO 10 29.968 -8.019 4.481 16 HD2 PRO 10 HD2 PRO 10 30.048 -10.988 4.346 17 HD3 PRO 10 HD1 PRO 10 29.413 -9.821 3.168 18 H LEU 11 HN LEU 11 34.661 -8.161 4.662 19 HA LEU 11 HA LEU 11 36.405 -10.346 3.800 20 HB2 LEU 11 HB2 LEU 11 36.699 -7.689 5.119 21 HB3 LEU 11 HB1 LEU 11 37.967 -8.862 5.428 22 HG LEU 11 HG LEU 11 36.996 -8.278 2.631 23 HD11 LEU 11 HD11 LEU 11 39.533 -7.057 3.180 24 HD12 LEU 11 HD12 LEU 11 38.355 -6.469 4.353 25 HD13 LEU 11 HD13 LEU 11 38.046 -6.292 2.627 26 HD21 LEU 11 HD21 LEU 11 38.381 -10.347 3.159 27 HD22 LEU 11 HD22 LEU 11 39.689 -9.258 3.618 28 HD23 LEU 11 HD23 LEU 11 39.087 -9.263 1.962 29 HA PRO 12 HA PRO 12 37.240 -13.010 7.325 30 HB2 PRO 12 HB2 PRO 12 38.344 -10.645 8.818 31 HB3 PRO 12 HB1 PRO 12 38.915 -12.327 8.808 32 HG2 PRO 12 HG2 PRO 12 39.920 -10.293 7.220 33 HG3 PRO 12 HG1 PRO 12 40.115 -12.024 6.917 34 HD2 PRO 12 HD2 PRO 12 38.710 -10.201 5.271 35 HD3 PRO 12 HD1 PRO 12 38.662 -11.967 5.143 36 H ASP 13 HN ASP 13 36.380 -9.782 8.628 37 HA ASP 13 HA ASP 13 33.730 -10.089 9.178 38 HB2 ASP 13 HB2 ASP 13 35.333 -11.921 10.850 39 HB3 ASP 13 HB1 ASP 13 34.148 -10.961 11.734 40 H GLY 14 HN GLY 14 33.482 -7.953 9.518 41 HA2 GLY 14 HA2 GLY 14 33.364 -6.213 11.257 42 HA3 GLY 14 HA1 GLY 14 34.942 -6.756 11.828 43 H TRP 15 HN TRP 15 35.012 -6.835 8.487 44 HA TRP 15 HA TRP 15 35.491 -4.001 8.037 45 HB2 TRP 15 HB2 TRP 15 37.808 -3.965 7.907 46 HB3 TRP 15 HB1 TRP 15 37.526 -4.992 9.308 47 HD1 TRP 15 HD1 TRP 15 37.315 -7.777 8.511 48 HE1 TRP 15 HE1 TRP 15 39.001 -9.015 7.015 49 HE3 TRP 15 HE3 TRP 15 39.497 -3.805 6.162 50 HZ2 TRP 15 HZ2 TRP 15 41.011 -8.409 5.073 51 HZ3 TRP 15 HZ3 TRP 15 41.288 -4.163 4.495 52 HH2 TRP 15 HH2 TRP 15 42.050 -6.458 3.945 53 H GLU 16 HN GLU 16 36.449 -3.633 5.783 54 HA GLU 16 HA GLU 16 36.321 -5.849 3.898 55 HB2 GLU 16 HB2 GLU 16 33.883 -4.535 4.601 56 HB3 GLU 16 HB1 GLU 16 34.286 -4.094 2.941 57 HG2 GLU 16 HG2 GLU 16 34.793 -6.670 2.695 58 HG3 GLU 16 HG1 GLU 16 33.736 -6.804 4.100 59 H GLN 17 HN GLN 17 37.078 -5.235 1.828 60 HA GLN 17 HA GLN 17 38.628 -2.796 1.696 61 HB2 GLN 17 HB2 GLN 17 38.961 -5.107 0.472 62 HB3 GLN 17 HB1 GLN 17 37.878 -4.408 -0.731 63 HG2 GLN 17 HG2 GLN 17 39.689 -2.360 -0.183 64 HG3 GLN 17 HG1 GLN 17 40.683 -3.819 -0.212 65 HE21 GLN 17 HE21 GLN 17 41.631 -3.167 -2.297 66 HE22 GLN 17 HE22 GLN 17 40.735 -3.285 -3.735 67 H ALA 18 HN ALA 18 38.040 -0.841 0.716 68 HA ALA 18 HA ALA 18 35.611 -0.752 -0.947 69 HB1 ALA 18 HB1 ALA 18 35.846 0.740 1.680 70 HB2 ALA 18 HB2 ALA 18 34.665 -0.505 1.277 71 HB3 ALA 18 HB3 ALA 18 34.610 1.059 0.464 72 H MET 19 HN MET 19 35.240 1.931 -1.175 73 HA MET 19 HA MET 19 37.920 3.079 -1.737 74 HB2 MET 19 HB2 MET 19 37.211 3.805 -3.948 75 HB3 MET 19 HB1 MET 19 36.975 2.061 -3.823 76 HG2 MET 19 HG2 MET 19 34.589 3.137 -2.853 77 HG3 MET 19 HG1 MET 19 34.997 4.166 -4.227 78 HE1 MET 19 HE1 MET 19 32.462 1.361 -4.008 79 HE2 MET 19 HE2 MET 19 32.337 2.040 -5.628 80 HE3 MET 19 HE3 MET 19 32.650 3.102 -4.258 81 H THR 20 HN THR 20 37.827 5.461 -2.044 82 HA THR 20 HA THR 20 35.799 6.630 -0.248 83 HB THR 20 HB THR 20 37.357 8.715 -0.754 84 HG1 THR 20 HG1 THR 20 39.143 6.583 -1.207 85 HG21 THR 20 HG21 THR 20 38.950 7.819 1.018 86 HG22 THR 20 HG22 THR 20 38.054 6.303 0.927 87 HG23 THR 20 HG23 THR 20 37.238 7.779 1.442 88 H GLN 21 HN GLN 21 35.788 9.264 -1.331 89 HA GLN 21 HA GLN 21 33.921 8.848 -3.559 90 HB2 GLN 21 HB2 GLN 21 34.787 11.215 -1.910 91 HB3 GLN 21 HB1 GLN 21 33.903 11.462 -3.416 92 HG2 GLN 21 HG2 GLN 21 31.957 10.845 -2.464 93 HG3 GLN 21 HG1 GLN 21 32.676 9.372 -1.815 94 HE21 GLN 21 HE21 GLN 21 32.728 9.308 0.433 95 HE22 GLN 21 HE22 GLN 21 32.767 10.669 1.448 96 H ASP 22 HN ASP 22 37.235 9.279 -3.209 97 HA ASP 22 HA ASP 22 37.461 10.409 -5.946 98 HB2 ASP 22 HB2 ASP 22 38.529 11.656 -3.961 99 HB3 ASP 22 HB1 ASP 22 39.682 10.323 -3.907 100 H GLY 23 HN GLY 23 37.132 7.602 -4.765 101 HA2 GLY 23 HA2 GLY 23 37.857 5.448 -5.319 102 HA3 GLY 23 HA1 GLY 23 38.573 6.185 -6.752 103 H GLU 24 HN GLU 24 39.466 7.060 -3.449 104 HA GLU 24 HA GLU 24 42.263 6.508 -4.046 105 HB2 GLU 24 HB2 GLU 24 41.114 7.090 -1.319 106 HB3 GLU 24 HB1 GLU 24 42.734 7.455 -1.919 107 HG2 GLU 24 HG2 GLU 24 41.233 8.801 -3.737 108 HG3 GLU 24 HG1 GLU 24 40.196 8.929 -2.316 109 H ILE 25 HN ILE 25 40.015 4.447 -3.733 110 HA ILE 25 HA ILE 25 39.666 2.358 -2.667 111 HB ILE 25 HB ILE 25 41.119 1.701 -4.437 112 HG12 ILE 25 HG12 ILE 25 42.564 -0.047 -3.327 113 HG13 ILE 25 HG11 ILE 25 42.149 0.671 -1.772 114 HG21 ILE 25 HG21 ILE 25 43.359 2.791 -2.710 115 HG22 ILE 25 HG22 ILE 25 42.778 3.475 -4.228 116 HG23 ILE 25 HG23 ILE 25 43.594 1.912 -4.220 117 HD11 ILE 25 HD11 ILE 25 40.263 -0.605 -3.768 118 HD12 ILE 25 HD12 ILE 25 39.713 0.332 -2.379 119 HD13 ILE 25 HD13 ILE 25 40.626 -1.152 -2.131 120 H TYR 26 HN TYR 26 39.328 2.264 -0.520 121 HA TYR 26 HA TYR 26 41.695 2.125 1.243 122 HB2 TYR 26 HB2 TYR 26 40.829 3.651 2.857 123 HB3 TYR 26 HB1 TYR 26 40.695 4.465 1.303 124 HD1 TYR 26 HD1 TYR 26 38.248 2.446 0.569 125 HD2 TYR 26 HD2 TYR 26 39.108 5.231 3.723 126 HE1 TYR 26 HE1 TYR 26 35.822 2.763 0.952 127 HE2 TYR 26 HE2 TYR 26 36.680 5.546 4.105 128 HH TYR 26 HH TYR 26 34.596 5.275 2.985 129 H TYR 27 HN TYR 27 40.965 1.245 3.488 130 HA TYR 27 HA TYR 27 38.921 -0.870 2.951 131 HB2 TYR 27 HB2 TYR 27 41.139 -0.853 5.020 132 HB3 TYR 27 HB1 TYR 27 40.044 -2.190 4.681 133 HD1 TYR 27 HD1 TYR 27 40.254 -1.154 1.531 134 HD2 TYR 27 HD2 TYR 27 42.938 -2.620 4.547 135 HE1 TYR 27 HE1 TYR 27 41.787 -1.963 -0.230 136 HE2 TYR 27 HE2 TYR 27 44.470 -3.434 2.780 137 HH TYR 27 HH TYR 27 44.025 -4.160 0.149 138 H ILE 28 HN ILE 28 37.454 -1.421 4.678 139 HA ILE 28 HA ILE 28 37.103 0.777 6.647 140 HB ILE 28 HB ILE 28 35.253 1.223 5.451 141 HG12 ILE 28 HG12 ILE 28 33.277 -0.027 6.127 142 HG13 ILE 28 HG11 ILE 28 34.271 -1.410 6.587 143 HG21 ILE 28 HG21 ILE 28 35.176 -1.615 4.409 144 HG22 ILE 28 HG22 ILE 28 36.088 -0.316 3.639 145 HG23 ILE 28 HG23 ILE 28 34.331 -0.217 3.747 146 HD11 ILE 28 HD11 ILE 28 33.605 0.924 8.134 147 HD12 ILE 28 HD12 ILE 28 35.354 0.818 7.942 148 HD13 ILE 28 HD13 ILE 28 34.459 -0.531 8.637 149 H ASN 29 HN ASN 29 36.985 0.145 8.741 150 HA ASN 29 HA ASN 29 36.719 -2.784 9.273 151 HB2 ASN 29 HB2 ASN 29 38.816 -1.614 10.031 152 HB3 ASN 29 HB1 ASN 29 37.815 -0.639 11.109 153 HD21 ASN 29 HD21 ASN 29 36.847 -3.957 10.530 154 HD22 ASN 29 HD22 ASN 29 37.318 -4.562 12.044 155 H HIS 30 HN HIS 30 34.564 -3.165 9.639 156 HA HIS 30 HA HIS 30 32.759 -1.267 10.810 157 HB2 HIS 30 HB2 HIS 30 32.578 -4.284 10.573 158 HB3 HIS 30 HB1 HIS 30 31.243 -3.240 11.064 159 HD1 HIS 30 HD1 HIS 30 31.133 -1.023 9.180 160 HD2 HIS 30 HD2 HIS 30 32.312 -4.807 7.879 161 HE1 HIS 30 HE1 HIS 30 30.783 -1.060 6.671 162 HE2 HIS 30 HE2 HIS 30 31.496 -3.359 5.869 163 H LYS 31 HN LYS 31 35.253 -3.038 12.200 164 HA LYS 31 HA LYS 31 33.981 -3.483 14.798 165 HB2 LYS 31 HB2 LYS 31 36.494 -4.183 13.508 166 HB3 LYS 31 HB1 LYS 31 36.759 -3.578 15.143 167 HG2 LYS 31 HG2 LYS 31 34.636 -5.642 14.554 168 HG3 LYS 31 HG1 LYS 31 36.305 -6.105 14.885 169 HD2 LYS 31 HD2 LYS 31 36.068 -5.722 17.097 170 HD3 LYS 31 HD1 LYS 31 35.318 -4.151 16.812 171 HE2 LYS 31 HE2 LYS 31 33.791 -5.761 17.968 172 HE3 LYS 31 HE1 LYS 31 33.156 -5.204 16.420 173 HZ1 LYS 31 HZ1 LYS 31 34.153 -7.239 15.423 174 HZ2 LYS 31 HZ2 LYS 31 32.881 -7.542 16.509 175 HZ3 LYS 31 HZ3 LYS 31 34.492 -7.788 16.991 176 H ASN 32 HN ASN 32 36.436 -1.286 13.471 177 HA ASN 32 HA ASN 32 36.122 0.430 15.875 178 HB2 ASN 32 HB2 ASN 32 38.258 0.211 13.752 179 HB3 ASN 32 HB1 ASN 32 38.162 1.611 14.820 180 HD21 ASN 32 HD21 ASN 32 38.764 1.333 17.046 181 HD22 ASN 32 HD22 ASN 32 39.425 -0.114 17.640 182 H LYS 33 HN LYS 33 34.330 0.148 13.391 183 HA LYS 33 HA LYS 33 33.326 1.560 11.777 184 HB2 LYS 33 HB2 LYS 33 32.783 3.846 13.066 185 HB3 LYS 33 HB1 LYS 33 31.945 2.342 13.445 186 HG2 LYS 33 HG2 LYS 33 33.647 1.897 15.224 187 HG3 LYS 33 HG1 LYS 33 34.348 3.483 14.897 188 HD2 LYS 33 HD2 LYS 33 32.157 4.535 15.410 189 HD3 LYS 33 HD1 LYS 33 31.509 2.944 15.811 190 HE2 LYS 33 HE2 LYS 33 32.654 4.613 17.637 191 HE3 LYS 33 HE1 LYS 33 32.600 2.859 17.810 192 HZ1 LYS 33 HZ1 LYS 33 34.758 2.691 16.805 193 HZ2 LYS 33 HZ2 LYS 33 34.842 3.785 18.102 194 HZ3 LYS 33 HZ3 LYS 33 34.804 4.358 16.503 195 H THR 34 HN THR 34 36.157 1.580 11.561 196 HA THR 34 HA THR 34 36.544 4.344 10.542 197 HB THR 34 HB THR 34 39.081 3.525 11.355 198 HG1 THR 34 HG1 THR 34 38.147 3.330 13.744 199 HG21 THR 34 HG21 THR 34 38.480 5.219 13.292 200 HG22 THR 34 HG22 THR 34 37.016 5.451 12.338 201 HG23 THR 34 HG23 THR 34 38.595 5.771 11.622 202 H THR 35 HN THR 35 38.114 4.442 8.773 203 HA THR 35 HA THR 35 38.369 1.824 7.409 204 HB THR 35 HB THR 35 38.942 3.484 5.433 205 HG1 THR 35 HG1 THR 35 37.358 5.328 5.970 206 HG21 THR 35 HG21 THR 35 37.053 2.225 5.043 207 HG22 THR 35 HG22 THR 35 36.288 3.793 5.286 208 HG23 THR 35 HG23 THR 35 36.337 2.630 6.605 209 H SER 36 HN SER 36 40.388 1.424 6.228 210 HA SER 36 HA SER 36 42.715 3.061 7.026 211 HB2 SER 36 HB2 SER 36 43.481 1.712 8.653 212 HB3 SER 36 HB1 SER 36 41.974 0.807 8.555 213 HG SER 36 HG SER 36 44.442 0.339 7.271 214 H TRP 37 HN TRP 37 44.758 2.187 5.987 215 HA TRP 37 HA TRP 37 44.064 1.019 3.330 216 HB2 TRP 37 HB2 TRP 37 46.756 2.185 3.953 217 HB3 TRP 37 HB1 TRP 37 45.879 2.160 2.425 218 HD1 TRP 37 HD1 TRP 37 46.163 4.077 5.703 219 HE1 TRP 37 HE1 TRP 37 44.931 6.331 5.460 220 HE3 TRP 37 HE3 TRP 37 43.918 3.373 1.168 221 HZ2 TRP 37 HZ2 TRP 37 43.223 7.658 3.587 222 HZ3 TRP 37 HZ3 TRP 37 42.496 5.146 0.183 223 HH2 TRP 37 HH2 TRP 37 42.145 7.285 1.385 224 H LEU 38 HN LEU 38 46.021 0.563 6.203 225 HA LEU 38 HA LEU 38 47.972 -1.217 5.607 226 HB2 LEU 38 HB2 LEU 38 46.680 -0.632 7.909 227 HB3 LEU 38 HB1 LEU 38 46.098 -2.277 7.654 228 HG LEU 38 HG LEU 38 48.704 -2.669 7.113 229 HD11 LEU 38 HD11 LEU 38 48.606 -0.385 9.108 230 HD12 LEU 38 HD12 LEU 38 49.351 -0.346 7.510 231 HD13 LEU 38 HD13 LEU 38 50.034 -1.366 8.777 232 HD21 LEU 38 HD21 LEU 38 47.092 -2.757 9.628 233 HD22 LEU 38 HD22 LEU 38 48.828 -3.036 9.762 234 HD23 LEU 38 HD23 LEU 38 47.845 -4.076 8.732 235 H ASP 39 HN ASP 39 48.089 -3.569 5.363 236 HA ASP 39 HA ASP 39 45.644 -4.716 4.104 237 HB2 ASP 39 HB2 ASP 39 47.649 -6.145 2.955 238 HB3 ASP 39 HB1 ASP 39 46.963 -4.687 2.237 239 HA PRO 40 HA PRO 40 46.470 -7.612 7.461 240 HB2 PRO 40 HB2 PRO 40 44.043 -8.829 7.405 241 HB3 PRO 40 HB1 PRO 40 44.297 -7.235 8.135 242 HG2 PRO 40 HG2 PRO 40 43.100 -7.948 5.516 243 HG3 PRO 40 HG1 PRO 40 42.681 -6.642 6.635 244 HD2 PRO 40 HD2 PRO 40 44.206 -6.323 4.326 245 HD3 PRO 40 HD1 PRO 40 44.196 -5.196 5.700 246 H ARG 41 HN ARG 41 44.226 -9.307 5.300 247 HA ARG 41 HA ARG 41 46.252 -11.446 5.015 248 HB2 ARG 41 HB2 ARG 41 44.004 -12.385 3.751 249 HB3 ARG 41 HB1 ARG 41 44.373 -12.648 5.455 250 HG2 ARG 41 HG2 ARG 41 43.014 -10.097 4.684 251 HG3 ARG 41 HG1 ARG 41 42.059 -11.578 4.708 252 HD2 ARG 41 HD2 ARG 41 42.365 -10.092 6.904 253 HD3 ARG 41 HD1 ARG 41 42.271 -11.850 6.988 254 HE ARG 41 HE ARG 41 44.806 -10.281 7.135 255 HH11 ARG 41 HH11 ARG 41 46.430 -11.369 8.260 256 HH12 ARG 41 HH12 ARG 41 46.157 -12.993 8.799 257 HH21 ARG 41 HH21 ARG 41 42.946 -13.167 7.508 258 HH22 ARG 41 HH22 ARG 41 44.187 -14.009 8.373 259 H LEU 42 HN LEU 42 46.466 -8.921 3.535 260 HA LEU 42 HA LEU 42 46.176 -9.982 0.764 261 HB2 LEU 42 HB2 LEU 42 44.855 -7.850 1.529 262 HB3 LEU 42 HB1 LEU 42 46.417 -7.048 1.367 263 HG LEU 42 HG LEU 42 46.503 -8.212 -0.966 264 HD11 LEU 42 HD11 LEU 42 44.179 -9.351 -0.098 265 HD12 LEU 42 HD12 LEU 42 44.601 -9.156 -1.798 266 HD13 LEU 42 HD13 LEU 42 43.554 -7.976 -1.009 267 HD21 LEU 42 HD21 LEU 42 44.841 -5.843 -0.140 268 HD22 LEU 42 HD22 LEU 42 44.896 -6.323 -1.837 269 HD23 LEU 42 HD23 LEU 42 46.382 -5.873 -0.999 270 H ASP 43 HN ASP 43 48.414 -10.711 2.200 271 HA ASP 43 HA ASP 43 50.617 -8.890 1.993 272 HB2 ASP 43 HB2 ASP 43 50.195 -11.620 2.789 273 HB3 ASP 43 HB1 ASP 43 51.587 -11.544 1.707 274 HA PRO 44 HA PRO 44 51.501 -11.568 -2.119 275 HB2 PRO 44 HB2 PRO 44 48.597 -11.724 -2.823 276 HB3 PRO 44 HB1 PRO 44 49.902 -12.876 -3.163 277 HG2 PRO 44 HG2 PRO 44 48.118 -13.306 -1.224 278 HG3 PRO 44 HG1 PRO 44 49.809 -13.810 -1.074 279 HD2 PRO 44 HD2 PRO 44 48.388 -11.591 0.297 280 HD3 PRO 44 HD1 PRO 44 49.825 -12.500 0.812 281 H ARG 45 HN ARG 45 52.314 -9.587 -2.872 282 HA ARG 45 HA ARG 45 52.317 -7.503 -3.964 283 HB2 ARG 45 HB2 ARG 45 51.161 -9.372 -5.589 284 HB3 ARG 45 HB1 ARG 45 49.885 -8.156 -5.514 285 HG2 ARG 45 HG2 ARG 45 51.613 -6.414 -6.085 286 HG3 ARG 45 HG1 ARG 45 52.768 -7.723 -6.344 287 HD2 ARG 45 HD2 ARG 45 51.880 -8.242 -8.358 288 HD3 ARG 45 HD1 ARG 45 50.232 -8.172 -7.734 289 HE ARG 45 HE ARG 45 51.511 -6.097 -9.234 290 HH11 ARG 45 HH11 ARG 45 50.491 -4.080 -9.336 291 HH12 ARG 45 HH12 ARG 45 49.298 -3.669 -8.150 292 HH21 ARG 45 HH21 ARG 45 49.558 -6.681 -6.453 293 HH22 ARG 45 HH22 ARG 45 48.770 -5.141 -6.519 294 H GLY 46 HN GLY 46 51.282 -7.012 -1.600 295 HA2 GLY 46 HA2 GLY 46 48.560 -5.872 -1.920 296 HA3 GLY 46 HA1 GLY 46 49.423 -6.056 -0.392 297 H GLY 47 HN GLY 47 51.223 -4.774 -3.045 298 HA2 GLY 47 HA2 GLY 47 52.094 -2.630 -3.440 299 HA3 GLY 47 HA1 GLY 47 50.594 -1.997 -2.758 300 H GLY 48 HN GLY 48 50.469 -1.845 -0.377 301 HA2 GLY 48 HA2 GLY 48 51.554 -1.853 1.803 302 HA3 GLY 48 HA1 GLY 48 53.116 -1.867 0.986 303 H GLY 49 HN GLY 49 53.475 0.005 2.543 304 HA2 GLY 49 HA2 GLY 49 54.095 2.345 2.193 305 HA3 GLY 49 HA1 GLY 49 52.660 2.530 1.184 306 H ASN 50 HN ASN 50 53.862 3.346 4.130 307 HA ASN 50 HA ASN 50 51.752 2.816 5.958 308 HB2 ASN 50 HB2 ASN 50 53.317 5.396 5.970 309 HB3 ASN 50 HB1 ASN 50 52.729 4.460 7.345 310 HD21 ASN 50 HD21 ASN 50 55.389 4.859 5.134 311 HD22 ASN 50 HD22 ASN 50 56.339 3.583 5.726 312 H ARG 51 HN ARG 51 52.064 5.203 3.405 313 HA ARG 51 HA ARG 51 50.527 6.765 2.566 314 HB2 ARG 51 HB2 ARG 51 49.167 4.443 2.868 315 HB3 ARG 51 HB1 ARG 51 48.243 5.475 3.960 316 HG2 ARG 51 HG2 ARG 51 47.190 5.765 1.860 317 HG3 ARG 51 HG1 ARG 51 48.224 7.185 2.025 318 HD2 ARG 51 HD2 ARG 51 49.799 5.114 0.865 319 HD3 ARG 51 HD1 ARG 51 48.276 5.183 -0.023 320 HE ARG 51 HE ARG 51 50.343 7.057 -0.339 321 HH11 ARG 51 HH11 ARG 51 49.922 9.106 -1.193 322 HH12 ARG 51 HH12 ARG 51 48.316 9.751 -1.110 323 HH21 ARG 51 HH21 ARG 51 47.000 6.976 0.501 324 HH22 ARG 51 HH22 ARG 51 46.663 8.546 -0.150 325 H GLN 52 HN GLN 52 48.335 8.002 3.541 326 HA GLN 52 HA GLN 52 49.354 9.225 6.058 327 HB2 GLN 52 HB2 GLN 52 47.632 11.032 5.430 328 HB3 GLN 52 HB1 GLN 52 49.045 10.888 4.384 329 HG2 GLN 52 HG2 GLN 52 47.699 9.395 2.878 330 HG3 GLN 52 HG1 GLN 52 46.285 9.746 3.873 331 HE21 GLN 52 HE21 GLN 52 45.283 11.826 3.647 332 HE22 GLN 52 HE22 GLN 52 45.783 12.965 2.492 333 HA PRO 53 HA PRO 53 46.151 7.525 8.539 334 HB2 PRO 53 HB2 PRO 53 45.432 9.797 10.000 335 HB3 PRO 53 HB1 PRO 53 46.767 8.699 10.393 336 HG2 PRO 53 HG2 PRO 53 46.820 11.339 9.045 337 HG3 PRO 53 HG1 PRO 53 48.005 10.596 10.133 338 HD2 PRO 53 HD2 PRO 53 48.397 10.737 7.446 339 HD3 PRO 53 HD1 PRO 53 49.020 9.391 8.426 340 HA PRO 54 HA PRO 54 42.598 8.886 6.112 341 HB2 PRO 54 HB2 PRO 54 41.118 6.622 6.509 342 HB3 PRO 54 HB1 PRO 54 42.418 6.741 5.312 343 HG2 PRO 54 HG2 PRO 54 42.395 5.408 7.945 344 HG3 PRO 54 HG1 PRO 54 43.295 5.007 6.475 345 HD2 PRO 54 HD2 PRO 54 44.350 6.309 8.722 346 HD3 PRO 54 HD1 PRO 54 45.094 6.259 7.110 347 HA PRO 55 HA PRO 55 40.087 10.329 9.506 348 HB2 PRO 55 HB2 PRO 55 38.046 11.403 8.043 349 HB3 PRO 55 HB1 PRO 55 39.638 12.173 8.195 350 HG2 PRO 55 HG2 PRO 55 38.514 10.576 5.955 351 HG3 PRO 55 HG1 PRO 55 39.556 12.007 5.912 352 HD2 PRO 55 HD2 PRO 55 40.479 9.436 5.534 353 HD3 PRO 55 HD1 PRO 55 41.486 10.770 6.136 354 HA PRO 56 HA PRO 56 37.244 7.104 10.550 355 HB2 PRO 56 HB2 PRO 56 35.407 9.344 11.282 356 HB3 PRO 56 HB1 PRO 56 35.886 7.924 12.229 357 HG2 PRO 56 HG2 PRO 56 36.910 10.370 12.671 358 HG3 PRO 56 HG1 PRO 56 37.831 8.881 12.936 359 HD2 PRO 56 HD2 PRO 56 38.171 10.926 10.831 360 HD3 PRO 56 HD1 PRO 56 39.319 9.700 11.408 361 H TYR 57 HN TYR 57 36.285 6.074 8.835 362 HA TYR 57 HA TYR 57 34.870 7.414 6.734 363 HB2 TYR 57 HB2 TYR 57 34.820 5.356 5.772 364 HB3 TYR 57 HB1 TYR 57 35.862 4.877 7.111 365 HD1 TYR 57 HD1 TYR 57 34.403 4.499 9.412 366 HD2 TYR 57 HD2 TYR 57 33.007 3.959 5.386 367 HE1 TYR 57 HE1 TYR 57 32.642 2.957 10.229 368 HE2 TYR 57 HE2 TYR 57 31.247 2.417 6.203 369 HH TYR 57 HH TYR 57 30.945 1.647 9.674 370 HA PRO 58 HA PRO 58 30.952 7.996 8.718 371 HB2 PRO 58 HB2 PRO 58 29.393 8.328 6.500 372 HB3 PRO 58 HB1 PRO 58 30.524 9.564 7.084 373 HG2 PRO 58 HG2 PRO 58 30.818 7.635 4.842 374 HG3 PRO 58 HG1 PRO 58 31.358 9.318 4.966 375 HD2 PRO 58 HD2 PRO 58 33.027 7.145 5.298 376 HD3 PRO 58 HD1 PRO 58 33.328 8.746 6.011 377 H LEU 59 HN LEU 59 29.578 6.487 9.574 378 HA LEU 59 HA LEU 59 29.306 3.865 8.338 379 HB2 LEU 59 HB2 LEU 59 29.153 4.750 10.912 380 HB3 LEU 59 HB1 LEU 59 27.441 4.603 10.515 381 HG LEU 59 HG LEU 59 29.559 2.447 10.338 382 HD11 LEU 59 HD11 LEU 59 26.919 2.159 11.709 383 HD12 LEU 59 HD12 LEU 59 28.148 3.153 12.492 384 HD13 LEU 59 HD13 LEU 59 28.484 1.461 12.128 385 HD21 LEU 59 HD21 LEU 59 27.329 1.132 9.683 386 HD22 LEU 59 HD22 LEU 59 28.325 1.911 8.454 387 HD23 LEU 59 HD23 LEU 59 26.871 2.712 9.049 388 H THR 60 HN THR 60 28.330 4.677 6.288 389 HA THR 60 HA THR 60 25.511 4.272 6.211 390 HB THR 60 HB THR 60 25.188 6.405 7.231 391 HG1 THR 60 HG1 THR 60 23.811 6.498 5.619 392 HG21 THR 60 HG21 THR 60 27.546 7.163 6.921 393 HG22 THR 60 HG22 THR 60 26.368 8.417 6.537 394 HG23 THR 60 HG23 THR 60 27.169 7.535 5.238 395 H ALA 61 HN ALA 61 27.081 3.027 4.620 396 HA ALA 61 HA ALA 61 28.037 4.385 2.278 397 HB1 ALA 61 HB1 ALA 61 27.447 1.791 1.466 398 HB2 ALA 61 HB2 ALA 61 27.741 1.623 3.198 399 HB3 ALA 61 HB3 ALA 61 28.978 2.330 2.158 Start of MODEL 3 1 H1 SER 8 HT1 SER 8 29.978 -5.064 -1.477 2 H2 SER 8 HT2 SER 8 28.453 -4.676 -2.114 3 H3 SER 8 HT3 SER 8 29.464 -5.771 -2.930 4 HA SER 8 HA SER 8 28.175 -6.195 -0.289 5 HB2 SER 8 HB2 SER 8 27.492 -8.233 -2.062 6 HB3 SER 8 HB1 SER 8 26.458 -6.890 -1.580 7 HG SER 8 HG SER 8 26.580 -6.324 -3.595 8 H GLY 9 HN GLY 9 28.791 -8.144 0.755 9 HA2 GLY 9 HA2 GLY 9 30.017 -10.258 0.806 10 HA3 GLY 9 HA1 GLY 9 31.055 -9.641 -0.478 11 HA PRO 10 HA PRO 10 32.430 -7.736 3.737 12 HB2 PRO 10 HB2 PRO 10 32.003 -9.335 5.895 13 HB3 PRO 10 HB1 PRO 10 30.813 -8.146 5.332 14 HG2 PRO 10 HG2 PRO 10 30.853 -11.090 4.990 15 HG3 PRO 10 HG1 PRO 10 29.481 -9.993 5.208 16 HD2 PRO 10 HD2 PRO 10 30.296 -11.066 2.765 17 HD3 PRO 10 HD1 PRO 10 29.270 -9.628 2.956 18 H LEU 11 HN LEU 11 34.460 -8.175 4.891 19 HA LEU 11 HA LEU 11 35.911 -10.464 3.720 20 HB2 LEU 11 HB2 LEU 11 36.560 -7.821 4.872 21 HB3 LEU 11 HB1 LEU 11 37.722 -9.080 5.261 22 HG LEU 11 HG LEU 11 36.952 -9.269 2.473 23 HD11 LEU 11 HD11 LEU 11 38.269 -7.046 1.953 24 HD12 LEU 11 HD12 LEU 11 37.665 -6.562 3.535 25 HD13 LEU 11 HD13 LEU 11 36.533 -6.998 2.258 26 HD21 LEU 11 HD21 LEU 11 39.007 -10.234 3.019 27 HD22 LEU 11 HD22 LEU 11 39.475 -8.893 4.065 28 HD23 LEU 11 HD23 LEU 11 39.516 -8.702 2.312 29 HA PRO 12 HA PRO 12 36.942 -13.203 7.151 30 HB2 PRO 12 HB2 PRO 12 38.396 -10.897 8.441 31 HB3 PRO 12 HB1 PRO 12 38.809 -12.625 8.465 32 HG2 PRO 12 HG2 PRO 12 39.869 -10.830 6.696 33 HG3 PRO 12 HG1 PRO 12 39.726 -12.567 6.386 34 HD2 PRO 12 HD2 PRO 12 38.390 -10.460 4.991 35 HD3 PRO 12 HD1 PRO 12 38.154 -12.199 4.767 36 H ASP 13 HN ASP 13 35.560 -10.056 7.683 37 HA ASP 13 HA ASP 13 33.411 -9.942 8.856 38 HB2 ASP 13 HB2 ASP 13 33.654 -12.329 9.632 39 HB3 ASP 13 HB1 ASP 13 34.717 -11.740 10.914 40 H GLY 14 HN GLY 14 33.426 -7.924 9.566 41 HA2 GLY 14 HA2 GLY 14 33.761 -6.478 11.555 42 HA3 GLY 14 HA1 GLY 14 35.360 -7.202 11.723 43 H TRP 15 HN TRP 15 35.408 -7.013 8.565 44 HA TRP 15 HA TRP 15 35.727 -4.091 8.314 45 HB2 TRP 15 HB2 TRP 15 37.992 -4.033 8.182 46 HB3 TRP 15 HB1 TRP 15 37.872 -5.489 9.165 47 HD1 TRP 15 HD1 TRP 15 38.151 -7.847 7.917 48 HE1 TRP 15 HE1 TRP 15 39.369 -8.449 5.730 49 HE3 TRP 15 HE3 TRP 15 38.558 -3.208 5.828 50 HZ2 TRP 15 HZ2 TRP 15 40.390 -7.128 3.391 51 HZ3 TRP 15 HZ3 TRP 15 39.641 -2.910 3.622 52 HH2 TRP 15 HH2 TRP 15 40.558 -4.863 2.402 53 H GLU 16 HN GLU 16 36.405 -3.493 6.040 54 HA GLU 16 HA GLU 16 35.948 -5.519 3.969 55 HB2 GLU 16 HB2 GLU 16 33.866 -3.593 4.825 56 HB3 GLU 16 HB1 GLU 16 34.108 -3.747 3.084 57 HG2 GLU 16 HG2 GLU 16 33.956 -6.252 3.371 58 HG3 GLU 16 HG1 GLU 16 33.474 -5.967 5.044 59 H GLN 17 HN GLN 17 36.519 -4.720 1.857 60 HA GLN 17 HA GLN 17 38.222 -2.302 1.962 61 HB2 GLN 17 HB2 GLN 17 38.961 -4.585 0.974 62 HB3 GLN 17 HB1 GLN 17 37.943 -4.157 -0.400 63 HG2 GLN 17 HG2 GLN 17 39.253 -2.286 -0.953 64 HG3 GLN 17 HG1 GLN 17 39.984 -2.208 0.651 65 HE21 GLN 17 HE21 GLN 17 41.862 -2.191 -1.269 66 HE22 GLN 17 HE22 GLN 17 42.586 -3.711 -1.482 67 H ALA 18 HN ALA 18 37.721 -0.456 0.768 68 HA ALA 18 HA ALA 18 35.555 -0.582 -1.227 69 HB1 ALA 18 HB1 ALA 18 34.071 -0.054 0.452 70 HB2 ALA 18 HB2 ALA 18 34.638 1.574 0.079 71 HB3 ALA 18 HB3 ALA 18 35.312 0.699 1.454 72 H MET 19 HN MET 19 35.158 2.059 -1.712 73 HA MET 19 HA MET 19 37.866 3.249 -2.000 74 HB2 MET 19 HB2 MET 19 37.655 3.565 -4.299 75 HB3 MET 19 HB1 MET 19 36.868 2.000 -4.099 76 HG2 MET 19 HG2 MET 19 35.538 4.708 -4.346 77 HG3 MET 19 HG1 MET 19 35.403 3.340 -5.451 78 HE1 MET 19 HE1 MET 19 31.881 3.573 -4.121 79 HE2 MET 19 HE2 MET 19 33.077 4.256 -5.219 80 HE3 MET 19 HE3 MET 19 32.810 5.001 -3.645 81 H THR 20 HN THR 20 37.807 5.596 -2.298 82 HA THR 20 HA THR 20 35.529 6.807 -0.894 83 HB THR 20 HB THR 20 37.010 8.894 -1.172 84 HG1 THR 20 HG1 THR 20 38.406 8.449 -2.715 85 HG21 THR 20 HG21 THR 20 37.946 8.382 0.833 86 HG22 THR 20 HG22 THR 20 38.687 6.908 0.214 87 HG23 THR 20 HG23 THR 20 36.993 6.905 0.703 88 H GLN 21 HN GLN 21 35.632 9.380 -2.153 89 HA GLN 21 HA GLN 21 34.000 8.792 -4.520 90 HB2 GLN 21 HB2 GLN 21 34.222 10.939 -2.642 91 HB3 GLN 21 HB1 GLN 21 34.537 11.593 -4.250 92 HG2 GLN 21 HG2 GLN 21 32.121 9.960 -3.416 93 HG3 GLN 21 HG1 GLN 21 32.138 11.682 -3.803 94 HE21 GLN 21 HE21 GLN 21 31.659 8.585 -5.149 95 HE22 GLN 21 HE22 GLN 21 31.772 9.016 -6.787 96 H ASP 22 HN ASP 22 37.262 9.267 -3.866 97 HA ASP 22 HA ASP 22 37.773 10.190 -6.642 98 HB2 ASP 22 HB2 ASP 22 38.650 11.633 -4.749 99 HB3 ASP 22 HB1 ASP 22 39.701 10.286 -4.313 100 H GLY 23 HN GLY 23 37.321 7.474 -5.276 101 HA2 GLY 23 HA2 GLY 23 38.120 5.290 -5.543 102 HA3 GLY 23 HA1 GLY 23 38.890 5.894 -7.009 103 H GLU 24 HN GLU 24 39.439 6.541 -3.528 104 HA GLU 24 HA GLU 24 42.336 6.223 -4.026 105 HB2 GLU 24 HB2 GLU 24 40.981 7.092 -1.471 106 HB3 GLU 24 HB1 GLU 24 42.668 7.337 -1.928 107 HG2 GLU 24 HG2 GLU 24 41.447 8.519 -4.031 108 HG3 GLU 24 HG1 GLU 24 40.243 8.819 -2.779 109 H ILE 25 HN ILE 25 40.109 4.163 -3.642 110 HA ILE 25 HA ILE 25 39.740 2.162 -2.412 111 HB ILE 25 HB ILE 25 41.372 1.435 -4.017 112 HG12 ILE 25 HG12 ILE 25 42.635 -0.260 -2.699 113 HG13 ILE 25 HG11 ILE 25 42.191 0.590 -1.218 114 HG21 ILE 25 HG21 ILE 25 43.416 2.659 -2.144 115 HG22 ILE 25 HG22 ILE 25 43.001 3.227 -3.760 116 HG23 ILE 25 HG23 ILE 25 43.811 1.676 -3.551 117 HD11 ILE 25 HD11 ILE 25 40.099 -0.274 -1.226 118 HD12 ILE 25 HD12 ILE 25 40.715 -1.428 -2.408 119 HD13 ILE 25 HD13 ILE 25 39.891 0.035 -2.949 120 H TYR 26 HN TYR 26 39.242 2.246 -0.286 121 HA TYR 26 HA TYR 26 41.479 2.642 1.636 122 HB2 TYR 26 HB2 TYR 26 40.095 3.995 3.055 123 HB3 TYR 26 HB1 TYR 26 39.951 4.662 1.429 124 HD1 TYR 26 HD1 TYR 26 37.836 4.912 0.442 125 HD2 TYR 26 HD2 TYR 26 38.323 2.229 3.759 126 HE1 TYR 26 HE1 TYR 26 35.382 4.561 0.520 127 HE2 TYR 26 HE2 TYR 26 35.870 1.877 3.833 128 HH TYR 26 HH TYR 26 33.931 2.216 2.750 129 H TYR 27 HN TYR 27 40.899 1.746 3.846 130 HA TYR 27 HA TYR 27 39.311 -0.765 3.500 131 HB2 TYR 27 HB2 TYR 27 41.720 -0.059 5.172 132 HB3 TYR 27 HB1 TYR 27 40.687 -1.416 5.620 133 HD1 TYR 27 HD1 TYR 27 41.791 -0.097 2.286 134 HD2 TYR 27 HD2 TYR 27 41.762 -3.399 5.029 135 HE1 TYR 27 HE1 TYR 27 42.890 -1.515 0.585 136 HE2 TYR 27 HE2 TYR 27 42.862 -4.821 3.327 137 HH TYR 27 HH TYR 27 44.472 -3.751 0.800 138 H ILE 28 HN ILE 28 37.696 -1.239 5.054 139 HA ILE 28 HA ILE 28 37.245 0.876 7.093 140 HB ILE 28 HB ILE 28 35.436 1.355 5.847 141 HG12 ILE 28 HG12 ILE 28 33.445 0.065 6.432 142 HG13 ILE 28 HG11 ILE 28 34.446 -1.305 6.915 143 HG21 ILE 28 HG21 ILE 28 34.619 0.047 4.037 144 HG22 ILE 28 HG22 ILE 28 35.253 -1.444 4.730 145 HG23 ILE 28 HG23 ILE 28 36.357 -0.244 4.057 146 HD11 ILE 28 HD11 ILE 28 35.489 0.855 8.346 147 HD12 ILE 28 HD12 ILE 28 34.463 -0.428 8.983 148 HD13 ILE 28 HD13 ILE 28 33.743 1.077 8.419 149 H ASN 29 HN ASN 29 37.088 0.149 9.147 150 HA ASN 29 HA ASN 29 36.864 -2.800 9.550 151 HB2 ASN 29 HB2 ASN 29 38.450 -0.702 10.774 152 HB3 ASN 29 HB1 ASN 29 37.520 -1.577 11.992 153 HD21 ASN 29 HD21 ASN 29 38.313 -3.612 12.609 154 HD22 ASN 29 HD22 ASN 29 39.541 -4.452 11.792 155 H HIS 30 HN HIS 30 34.708 -3.278 9.796 156 HA HIS 30 HA HIS 30 32.801 -1.471 10.983 157 HB2 HIS 30 HB2 HIS 30 32.667 -4.461 10.489 158 HB3 HIS 30 HB1 HIS 30 31.294 -3.465 10.976 159 HD1 HIS 30 HD1 HIS 30 31.114 -1.177 9.273 160 HD2 HIS 30 HD2 HIS 30 32.733 -4.706 7.747 161 HE1 HIS 30 HE1 HIS 30 30.959 -1.005 6.749 162 HE2 HIS 30 HE2 HIS 30 31.941 -3.147 5.811 163 H LYS 31 HN LYS 31 35.300 -3.033 12.423 164 HA LYS 31 HA LYS 31 33.821 -3.744 14.887 165 HB2 LYS 31 HB2 LYS 31 36.466 -4.413 13.734 166 HB3 LYS 31 HB1 LYS 31 36.430 -4.219 15.487 167 HG2 LYS 31 HG2 LYS 31 34.415 -5.769 15.504 168 HG3 LYS 31 HG1 LYS 31 34.766 -6.110 13.809 169 HD2 LYS 31 HD2 LYS 31 36.722 -7.246 14.297 170 HD3 LYS 31 HD1 LYS 31 37.002 -6.336 15.782 171 HE2 LYS 31 HE2 LYS 31 34.948 -7.514 16.736 172 HE3 LYS 31 HE1 LYS 31 35.020 -8.577 15.329 173 HZ1 LYS 31 HZ1 LYS 31 37.482 -8.162 16.849 174 HZ2 LYS 31 HZ2 LYS 31 36.928 -9.547 16.036 175 HZ3 LYS 31 HZ3 LYS 31 36.284 -9.135 17.554 176 H ASN 32 HN ASN 32 36.239 -1.478 13.675 177 HA ASN 32 HA ASN 32 36.090 -0.029 16.273 178 HB2 ASN 32 HB2 ASN 32 38.365 -0.805 15.488 179 HB3 ASN 32 HB1 ASN 32 38.187 0.281 14.110 180 HD21 ASN 32 HD21 ASN 32 37.232 0.799 17.543 181 HD22 ASN 32 HD22 ASN 32 38.194 2.182 17.757 182 H LYS 33 HN LYS 33 34.384 0.004 13.662 183 HA LYS 33 HA LYS 33 33.432 1.621 12.236 184 HB2 LYS 33 HB2 LYS 33 32.552 3.548 13.468 185 HB3 LYS 33 HB1 LYS 33 32.382 2.087 14.442 186 HG2 LYS 33 HG2 LYS 33 34.277 2.661 15.793 187 HG3 LYS 33 HG1 LYS 33 34.744 3.963 14.698 188 HD2 LYS 33 HD2 LYS 33 33.528 5.362 15.979 189 HD3 LYS 33 HD1 LYS 33 32.086 4.529 15.397 190 HE2 LYS 33 HE2 LYS 33 32.180 4.560 17.874 191 HE3 LYS 33 HE1 LYS 33 32.251 2.915 17.243 192 HZ1 LYS 33 HZ1 LYS 33 34.838 3.564 17.301 193 HZ2 LYS 33 HZ2 LYS 33 34.035 2.775 18.572 194 HZ3 LYS 33 HZ3 LYS 33 34.275 4.455 18.629 195 H THR 34 HN THR 34 36.224 1.491 11.920 196 HA THR 34 HA THR 34 36.788 4.310 11.186 197 HB THR 34 HB THR 34 39.273 3.250 11.889 198 HG1 THR 34 HG1 THR 34 37.253 2.141 13.351 199 HG21 THR 34 HG21 THR 34 37.347 5.210 13.082 200 HG22 THR 34 HG22 THR 34 38.925 5.499 12.347 201 HG23 THR 34 HG23 THR 34 38.819 4.807 13.966 202 H THR 35 HN THR 35 38.458 4.455 9.465 203 HA THR 35 HA THR 35 38.550 1.954 7.866 204 HB THR 35 HB THR 35 39.089 3.822 6.023 205 HG1 THR 35 HG1 THR 35 38.509 5.237 8.117 206 HG21 THR 35 HG21 THR 35 36.467 2.817 7.095 207 HG22 THR 35 HG22 THR 35 37.288 2.388 5.595 208 HG23 THR 35 HG23 THR 35 36.490 3.949 5.746 209 H SER 36 HN SER 36 40.543 1.533 6.683 210 HA SER 36 HA SER 36 42.893 3.138 7.551 211 HB2 SER 36 HB2 SER 36 43.946 1.449 8.685 212 HB3 SER 36 HB1 SER 36 42.290 0.916 8.963 213 HG SER 36 HG SER 36 42.490 -0.440 7.161 214 H TRP 37 HN TRP 37 44.836 1.338 6.529 215 HA TRP 37 HA TRP 37 44.063 1.085 3.656 216 HB2 TRP 37 HB2 TRP 37 46.777 2.064 4.559 217 HB3 TRP 37 HB1 TRP 37 46.100 2.097 2.932 218 HD1 TRP 37 HD1 TRP 37 46.398 4.117 6.034 219 HE1 TRP 37 HE1 TRP 37 45.021 6.286 5.823 220 HE3 TRP 37 HE3 TRP 37 43.703 3.044 1.829 221 HZ2 TRP 37 HZ2 TRP 37 43.038 7.415 4.099 222 HZ3 TRP 37 HZ3 TRP 37 42.079 4.685 0.925 223 HH2 TRP 37 HH2 TRP 37 41.743 6.866 2.054 224 H LEU 38 HN LEU 38 46.385 0.208 6.193 225 HA LEU 38 HA LEU 38 47.886 -1.770 4.990 226 HB2 LEU 38 HB2 LEU 38 46.951 -1.238 7.707 227 HB3 LEU 38 HB1 LEU 38 47.181 -2.962 7.408 228 HG LEU 38 HG LEU 38 49.274 -0.961 6.570 229 HD11 LEU 38 HD11 LEU 38 49.188 -0.445 8.854 230 HD12 LEU 38 HD12 LEU 38 50.374 -1.751 8.811 231 HD13 LEU 38 HD13 LEU 38 48.714 -2.083 9.306 232 HD21 LEU 38 HD21 LEU 38 49.592 -3.815 7.514 233 HD22 LEU 38 HD22 LEU 38 50.702 -2.857 6.533 234 HD23 LEU 38 HD23 LEU 38 49.188 -3.437 5.840 235 H ASP 39 HN ASP 39 47.611 -4.128 4.849 236 HA ASP 39 HA ASP 39 44.778 -4.850 4.306 237 HB2 ASP 39 HB2 ASP 39 47.082 -6.496 3.332 238 HB3 ASP 39 HB1 ASP 39 45.504 -6.237 2.588 239 HA PRO 40 HA PRO 40 45.089 -7.650 7.740 240 HB2 PRO 40 HB2 PRO 40 42.855 -9.130 7.265 241 HB3 PRO 40 HB1 PRO 40 42.791 -7.462 7.867 242 HG2 PRO 40 HG2 PRO 40 42.344 -8.501 5.118 243 HG3 PRO 40 HG1 PRO 40 41.518 -7.195 5.983 244 HD2 PRO 40 HD2 PRO 40 43.481 -6.782 4.082 245 HD3 PRO 40 HD1 PRO 40 43.082 -5.626 5.370 246 H ARG 41 HN ARG 41 43.635 -9.645 5.170 247 HA ARG 41 HA ARG 41 46.081 -11.324 5.148 248 HB2 ARG 41 HB2 ARG 41 44.530 -13.354 5.177 249 HB3 ARG 41 HB1 ARG 41 44.692 -12.490 6.706 250 HG2 ARG 41 HG2 ARG 41 42.368 -12.751 6.514 251 HG3 ARG 41 HG1 ARG 41 42.628 -11.125 5.884 252 HD2 ARG 41 HD2 ARG 41 42.834 -13.319 3.897 253 HD3 ARG 41 HD1 ARG 41 41.224 -13.025 4.553 254 HE ARG 41 HE ARG 41 42.579 -10.586 3.693 255 HH11 ARG 41 HH11 ARG 41 41.649 -9.549 1.913 256 HH12 ARG 41 HH12 ARG 41 40.494 -10.396 0.940 257 HH21 ARG 41 HH21 ARG 41 40.647 -13.305 2.820 258 HH22 ARG 41 HH22 ARG 41 39.926 -12.522 1.453 259 H LEU 42 HN LEU 42 44.840 -9.410 3.261 260 HA LEU 42 HA LEU 42 43.705 -11.019 1.104 261 HB2 LEU 42 HB2 LEU 42 43.461 -8.416 1.683 262 HB3 LEU 42 HB1 LEU 42 44.836 -8.306 0.583 263 HG LEU 42 HG LEU 42 42.314 -9.827 -0.111 264 HD11 LEU 42 HD11 LEU 42 43.047 -6.934 -0.638 265 HD12 LEU 42 HD12 LEU 42 41.632 -7.534 0.228 266 HD13 LEU 42 HD13 LEU 42 41.777 -7.793 -1.511 267 HD21 LEU 42 HD21 LEU 42 44.157 -10.477 -1.486 268 HD22 LEU 42 HD22 LEU 42 44.727 -8.815 -1.631 269 HD23 LEU 42 HD23 LEU 42 43.245 -9.312 -2.445 270 H ASP 43 HN ASP 43 46.261 -11.967 1.993 271 HA ASP 43 HA ASP 43 48.184 -12.835 0.950 272 HB2 ASP 43 HB2 ASP 43 46.489 -12.373 -1.157 273 HB3 ASP 43 HB1 ASP 43 47.861 -11.346 -1.576 274 HA PRO 44 HA PRO 44 50.724 -9.389 2.304 275 HB2 PRO 44 HB2 PRO 44 52.796 -11.134 1.031 276 HB3 PRO 44 HB1 PRO 44 52.805 -10.350 2.624 277 HG2 PRO 44 HG2 PRO 44 52.301 -12.961 2.328 278 HG3 PRO 44 HG1 PRO 44 51.528 -11.984 3.587 279 HD2 PRO 44 HD2 PRO 44 50.345 -13.130 1.122 280 HD3 PRO 44 HD1 PRO 44 49.550 -12.637 2.633 281 H ARG 45 HN ARG 45 49.637 -8.168 0.428 282 HA ARG 45 HA ARG 45 50.771 -8.163 -2.197 283 HB2 ARG 45 HB2 ARG 45 48.566 -7.111 -1.470 284 HB3 ARG 45 HB1 ARG 45 49.518 -5.777 -0.818 285 HG2 ARG 45 HG2 ARG 45 49.468 -4.869 -2.880 286 HG3 ARG 45 HG1 ARG 45 50.547 -6.169 -3.387 287 HD2 ARG 45 HD2 ARG 45 48.388 -7.574 -3.664 288 HD3 ARG 45 HD1 ARG 45 47.542 -6.028 -3.611 289 HE ARG 45 HE ARG 45 49.758 -6.233 -5.553 290 HH11 ARG 45 HH11 ARG 45 49.126 -5.883 -7.694 291 HH12 ARG 45 HH12 ARG 45 47.440 -5.819 -8.085 292 HH21 ARG 45 HH21 ARG 45 46.390 -6.354 -4.824 293 HH22 ARG 45 HH22 ARG 45 45.891 -6.085 -6.461 294 H GLY 46 HN GLY 46 51.170 -5.626 0.305 295 HA2 GLY 46 HA2 GLY 46 53.897 -5.503 0.562 296 HA3 GLY 46 HA1 GLY 46 53.627 -4.700 -0.986 297 H GLY 47 HN GLY 47 50.926 -3.766 0.076 298 HA2 GLY 47 HA2 GLY 47 50.072 -2.019 1.436 299 HA3 GLY 47 HA1 GLY 47 51.636 -1.928 2.248 300 H GLY 48 HN GLY 48 53.274 -0.597 1.348 301 HA2 GLY 48 HA2 GLY 48 53.482 0.616 -1.103 302 HA3 GLY 48 HA1 GLY 48 52.264 1.604 -0.295 303 H GLY 49 HN GLY 49 53.036 2.005 2.177 304 HA2 GLY 49 HA2 GLY 49 55.541 2.199 3.154 305 HA3 GLY 49 HA1 GLY 49 55.604 3.432 1.893 306 H ASN 50 HN ASN 50 54.219 5.295 2.097 307 HA ASN 50 HA ASN 50 53.146 5.674 4.866 308 HB2 ASN 50 HB2 ASN 50 55.229 7.068 3.709 309 HB3 ASN 50 HB1 ASN 50 53.846 8.113 3.382 310 HD21 ASN 50 HD21 ASN 50 54.573 5.987 6.207 311 HD22 ASN 50 HD22 ASN 50 54.445 7.227 7.358 312 H ARG 51 HN ARG 51 51.015 6.235 4.966 313 HA ARG 51 HA ARG 51 49.738 7.306 2.486 314 HB2 ARG 51 HB2 ARG 51 49.293 4.806 3.014 315 HB3 ARG 51 HB1 ARG 51 48.313 5.410 4.350 316 HG2 ARG 51 HG2 ARG 51 46.712 5.301 2.672 317 HG3 ARG 51 HG1 ARG 51 47.279 6.959 2.467 318 HD2 ARG 51 HD2 ARG 51 49.057 5.789 0.875 319 HD3 ARG 51 HD1 ARG 51 47.806 4.552 0.770 320 HE ARG 51 HE ARG 51 47.711 7.109 -0.524 321 HH11 ARG 51 HH11 ARG 51 45.764 7.725 -1.492 322 HH12 ARG 51 HH12 ARG 51 44.293 6.936 -1.028 323 HH21 ARG 51 HH21 ARG 51 45.832 4.841 1.269 324 HH22 ARG 51 HH22 ARG 51 44.333 5.303 0.535 325 H GLN 52 HN GLN 52 48.787 9.234 2.915 326 HA GLN 52 HA GLN 52 48.736 10.672 5.222 327 HB2 GLN 52 HB2 GLN 52 46.235 10.561 3.534 328 HB3 GLN 52 HB1 GLN 52 46.934 11.953 4.361 329 HG2 GLN 52 HG2 GLN 52 49.013 11.425 2.810 330 HG3 GLN 52 HG1 GLN 52 47.792 10.640 1.809 331 HE21 GLN 52 HE21 GLN 52 48.386 13.771 3.500 332 HE22 GLN 52 HE22 GLN 52 47.574 14.714 2.346 333 HA PRO 53 HA PRO 53 46.747 8.115 8.297 334 HB2 PRO 53 HB2 PRO 53 46.012 10.821 9.344 335 HB3 PRO 53 HB1 PRO 53 46.728 9.439 10.196 336 HG2 PRO 53 HG2 PRO 53 48.176 11.565 9.441 337 HG3 PRO 53 HG1 PRO 53 48.843 9.925 9.491 338 HD2 PRO 53 HD2 PRO 53 48.185 11.596 7.141 339 HD3 PRO 53 HD1 PRO 53 49.283 10.205 7.265 340 HA PRO 54 HA PRO 54 42.595 8.516 6.587 341 HB2 PRO 54 HB2 PRO 54 41.703 6.077 7.393 342 HB3 PRO 54 HB1 PRO 54 42.776 6.295 5.999 343 HG2 PRO 54 HG2 PRO 54 43.398 5.338 8.732 344 HG3 PRO 54 HG1 PRO 54 44.111 4.876 7.179 345 HD2 PRO 54 HD2 PRO 54 45.267 6.639 9.015 346 HD3 PRO 54 HD1 PRO 54 45.706 6.510 7.299 347 HA PRO 55 HA PRO 55 40.738 9.793 10.494 348 HB2 PRO 55 HB2 PRO 55 38.638 11.146 9.400 349 HB3 PRO 55 HB1 PRO 55 40.282 11.810 9.471 350 HG2 PRO 55 HG2 PRO 55 38.823 10.603 7.187 351 HG3 PRO 55 HG1 PRO 55 39.984 11.940 7.212 352 HD2 PRO 55 HD2 PRO 55 40.596 9.344 6.439 353 HD3 PRO 55 HD1 PRO 55 41.789 10.538 6.997 354 HA PRO 56 HA PRO 56 37.547 6.888 11.378 355 HB2 PRO 56 HB2 PRO 56 35.593 8.556 12.509 356 HB3 PRO 56 HB1 PRO 56 36.941 7.796 13.373 357 HG2 PRO 56 HG2 PRO 56 36.658 10.567 12.373 358 HG3 PRO 56 HG1 PRO 56 37.522 9.955 13.793 359 HD2 PRO 56 HD2 PRO 56 38.818 10.743 11.536 360 HD3 PRO 56 HD1 PRO 56 39.433 9.440 12.579 361 H TYR 57 HN TYR 57 36.445 6.048 9.656 362 HA TYR 57 HA TYR 57 34.973 7.694 7.783 363 HB2 TYR 57 HB2 TYR 57 34.960 5.816 6.515 364 HB3 TYR 57 HB1 TYR 57 36.004 5.123 7.755 365 HD1 TYR 57 HD1 TYR 57 33.174 4.455 5.909 366 HD2 TYR 57 HD2 TYR 57 34.510 4.451 9.991 367 HE1 TYR 57 HE1 TYR 57 31.404 2.818 6.487 368 HE2 TYR 57 HE2 TYR 57 32.739 2.816 10.569 369 HH TYR 57 HH TYR 57 31.399 1.011 9.228 370 HA PRO 58 HA PRO 58 31.032 8.182 9.706 371 HB2 PRO 58 HB2 PRO 58 29.885 7.099 7.175 372 HB3 PRO 58 HB1 PRO 58 29.519 8.614 8.022 373 HG2 PRO 58 HG2 PRO 58 31.001 8.540 5.790 374 HG3 PRO 58 HG1 PRO 58 31.274 9.725 7.077 375 HD2 PRO 58 HD2 PRO 58 32.914 7.368 6.324 376 HD3 PRO 58 HD1 PRO 58 33.394 8.862 7.157 377 H LEU 59 HN LEU 59 28.772 6.504 8.780 378 HA LEU 59 HA LEU 59 29.535 3.751 9.459 379 HB2 LEU 59 HB2 LEU 59 29.036 5.297 11.599 380 HB3 LEU 59 HB1 LEU 59 27.376 4.863 11.187 381 HG LEU 59 HG LEU 59 28.187 3.187 12.715 382 HD11 LEU 59 HD11 LEU 59 26.994 2.534 10.476 383 HD12 LEU 59 HD12 LEU 59 27.713 1.263 11.466 384 HD13 LEU 59 HD13 LEU 59 28.566 1.859 10.042 385 HD21 LEU 59 HD21 LEU 59 30.673 3.796 11.665 386 HD22 LEU 59 HD22 LEU 59 30.373 2.179 11.030 387 HD23 LEU 59 HD23 LEU 59 30.338 2.464 12.770 388 H THR 60 HN THR 60 28.623 3.227 7.419 389 HA THR 60 HA THR 60 26.356 4.001 6.143 390 HB THR 60 HB THR 60 27.187 1.134 6.673 391 HG1 THR 60 HG1 THR 60 28.719 2.313 5.562 392 HG21 THR 60 HG21 THR 60 25.084 0.735 5.852 393 HG22 THR 60 HG22 THR 60 25.894 1.031 4.313 394 HG23 THR 60 HG23 THR 60 24.970 2.320 5.086 395 H ALA 61 HN ALA 61 24.378 4.507 6.945 396 HA ALA 61 HA ALA 61 22.578 4.513 8.495 397 HB1 ALA 61 HB1 ALA 61 21.475 2.174 8.463 398 HB2 ALA 61 HB2 ALA 61 22.784 1.718 7.373 399 HB3 ALA 61 HB3 ALA 61 21.664 3.003 6.918 Start of MODEL 4 1 H1 SER 8 HT1 SER 8 29.008 -13.241 -1.504 2 H2 SER 8 HT2 SER 8 29.232 -12.686 -3.095 3 H3 SER 8 HT3 SER 8 28.524 -11.672 -1.929 4 HA SER 8 HA SER 8 31.317 -12.677 -1.859 5 HB2 SER 8 HB2 SER 8 30.032 -10.278 -3.017 6 HB3 SER 8 HB1 SER 8 31.449 -9.956 -2.022 7 HG SER 8 HG SER 8 32.653 -10.815 -3.514 8 H GLY 9 HN GLY 9 28.775 -10.639 -0.428 9 HA2 GLY 9 HA2 GLY 9 28.596 -9.727 1.731 10 HA3 GLY 9 HA1 GLY 9 29.384 -11.219 2.247 11 HA PRO 10 HA PRO 10 32.248 -7.620 3.053 12 HB2 PRO 10 HB2 PRO 10 32.571 -8.079 5.727 13 HB3 PRO 10 HB1 PRO 10 31.267 -7.075 5.067 14 HG2 PRO 10 HG2 PRO 10 31.187 -9.877 6.047 15 HG3 PRO 10 HG1 PRO 10 29.979 -8.591 6.195 16 HD2 PRO 10 HD2 PRO 10 29.821 -10.641 4.352 17 HD3 PRO 10 HD1 PRO 10 29.041 -9.058 4.146 18 H LEU 11 HN LEU 11 34.380 -7.979 4.713 19 HA LEU 11 HA LEU 11 35.734 -10.292 3.482 20 HB2 LEU 11 HB2 LEU 11 36.505 -7.736 4.771 21 HB3 LEU 11 HB1 LEU 11 37.620 -9.068 5.036 22 HG LEU 11 HG LEU 11 36.712 -8.957 2.260 23 HD11 LEU 11 HD11 LEU 11 37.629 -6.456 3.559 24 HD12 LEU 11 HD12 LEU 11 36.653 -6.683 2.111 25 HD13 LEU 11 HD13 LEU 11 38.406 -6.860 2.031 26 HD21 LEU 11 HD21 LEU 11 39.330 -8.690 2.051 27 HD22 LEU 11 HD22 LEU 11 38.640 -10.218 2.591 28 HD23 LEU 11 HD23 LEU 11 39.306 -9.086 3.768 29 HA PRO 12 HA PRO 12 36.649 -13.232 6.754 30 HB2 PRO 12 HB2 PRO 12 38.121 -11.007 8.157 31 HB3 PRO 12 HB1 PRO 12 38.510 -12.741 8.112 32 HG2 PRO 12 HG2 PRO 12 39.572 -10.853 6.401 33 HG3 PRO 12 HG1 PRO 12 39.492 -12.590 6.070 34 HD2 PRO 12 HD2 PRO 12 38.145 -10.556 4.619 35 HD3 PRO 12 HD1 PRO 12 37.855 -12.297 4.484 36 H ASP 13 HN ASP 13 36.039 -9.970 8.102 37 HA ASP 13 HA ASP 13 33.523 -10.054 8.973 38 HB2 ASP 13 HB2 ASP 13 33.436 -12.182 9.921 39 HB3 ASP 13 HB1 ASP 13 35.077 -12.072 10.562 40 H GLY 14 HN GLY 14 33.500 -7.977 9.570 41 HA2 GLY 14 HA2 GLY 14 33.755 -6.456 11.508 42 HA3 GLY 14 HA1 GLY 14 35.361 -7.143 11.749 43 H TRP 15 HN TRP 15 35.346 -7.010 8.538 44 HA TRP 15 HA TRP 15 35.730 -4.102 8.267 45 HB2 TRP 15 HB2 TRP 15 37.996 -4.078 8.086 46 HB3 TRP 15 HB1 TRP 15 37.862 -5.495 9.123 47 HD1 TRP 15 HD1 TRP 15 38.072 -7.907 7.942 48 HE1 TRP 15 HE1 TRP 15 39.289 -8.603 5.783 49 HE3 TRP 15 HE3 TRP 15 38.590 -3.347 5.716 50 HZ2 TRP 15 HZ2 TRP 15 40.349 -7.377 3.409 51 HZ3 TRP 15 HZ3 TRP 15 39.685 -3.139 3.506 52 HH2 TRP 15 HH2 TRP 15 40.567 -5.148 2.351 53 H GLU 16 HN GLU 16 36.370 -3.515 5.990 54 HA GLU 16 HA GLU 16 35.855 -5.561 3.945 55 HB2 GLU 16 HB2 GLU 16 33.849 -3.551 4.790 56 HB3 GLU 16 HB1 GLU 16 34.059 -3.762 3.050 57 HG2 GLU 16 HG2 GLU 16 33.859 -6.262 3.443 58 HG3 GLU 16 HG1 GLU 16 33.356 -5.882 5.091 59 H GLN 17 HN GLN 17 36.430 -4.826 1.825 60 HA GLN 17 HA GLN 17 38.223 -2.475 1.850 61 HB2 GLN 17 HB2 GLN 17 39.157 -4.494 0.875 62 HB3 GLN 17 HB1 GLN 17 37.763 -4.671 -0.190 63 HG2 GLN 17 HG2 GLN 17 38.433 -2.955 -1.585 64 HG3 GLN 17 HG1 GLN 17 39.289 -2.103 -0.298 65 HE21 GLN 17 HE21 GLN 17 41.531 -2.424 -0.179 66 HE22 GLN 17 HE22 GLN 17 42.378 -3.614 -1.044 67 H ALA 18 HN ALA 18 37.759 -0.610 0.660 68 HA ALA 18 HA ALA 18 35.532 -0.662 -1.268 69 HB1 ALA 18 HB1 ALA 18 35.395 0.604 1.422 70 HB2 ALA 18 HB2 ALA 18 34.103 -0.073 0.431 71 HB3 ALA 18 HB3 ALA 18 34.739 1.532 0.072 72 H MET 19 HN MET 19 35.203 1.971 -1.767 73 HA MET 19 HA MET 19 37.927 3.109 -2.101 74 HB2 MET 19 HB2 MET 19 37.679 3.432 -4.409 75 HB3 MET 19 HB1 MET 19 36.953 1.842 -4.176 76 HG2 MET 19 HG2 MET 19 34.725 3.080 -3.869 77 HG3 MET 19 HG1 MET 19 35.551 4.497 -4.520 78 HE1 MET 19 HE1 MET 19 34.188 0.939 -5.126 79 HE2 MET 19 HE2 MET 19 33.527 1.256 -6.728 80 HE3 MET 19 HE3 MET 19 33.083 2.297 -5.378 81 H THR 20 HN THR 20 37.908 5.446 -2.389 82 HA THR 20 HA THR 20 35.632 6.704 -1.026 83 HB THR 20 HB THR 20 37.154 8.764 -1.300 84 HG1 THR 20 HG1 THR 20 39.124 6.836 -1.828 85 HG21 THR 20 HG21 THR 20 37.058 6.796 0.596 86 HG22 THR 20 HG22 THR 20 38.036 8.257 0.732 87 HG23 THR 20 HG23 THR 20 38.763 6.761 0.145 88 H GLN 21 HN GLN 21 35.768 9.263 -2.277 89 HA GLN 21 HA GLN 21 34.176 8.698 -4.675 90 HB2 GLN 21 HB2 GLN 21 34.847 11.141 -3.062 91 HB3 GLN 21 HB1 GLN 21 34.248 11.341 -4.710 92 HG2 GLN 21 HG2 GLN 21 32.148 10.662 -4.163 93 HG3 GLN 21 HG1 GLN 21 32.738 9.391 -3.091 94 HE21 GLN 21 HE21 GLN 21 33.984 12.619 -2.588 95 HE22 GLN 21 HE22 GLN 21 33.089 12.959 -1.186 96 H ASP 22 HN ASP 22 37.431 9.110 -3.971 97 HA ASP 22 HA ASP 22 38.003 10.045 -6.731 98 HB2 ASP 22 HB2 ASP 22 38.900 11.507 -4.927 99 HB3 ASP 22 HB1 ASP 22 39.803 10.129 -4.296 100 H GLY 23 HN GLY 23 37.487 7.325 -5.380 101 HA2 GLY 23 HA2 GLY 23 38.261 5.130 -5.636 102 HA3 GLY 23 HA1 GLY 23 39.027 5.720 -7.111 103 H GLU 24 HN GLU 24 39.608 6.370 -3.638 104 HA GLU 24 HA GLU 24 42.498 6.007 -4.155 105 HB2 GLU 24 HB2 GLU 24 41.212 6.906 -1.580 106 HB3 GLU 24 HB1 GLU 24 42.872 7.176 -2.113 107 HG2 GLU 24 HG2 GLU 24 41.435 8.284 -4.173 108 HG3 GLU 24 HG1 GLU 24 40.424 8.668 -2.780 109 H ILE 25 HN ILE 25 40.261 3.974 -3.746 110 HA ILE 25 HA ILE 25 39.869 1.989 -2.502 111 HB ILE 25 HB ILE 25 41.537 1.239 -4.066 112 HG12 ILE 25 HG12 ILE 25 42.738 -0.460 -2.698 113 HG13 ILE 25 HG11 ILE 25 42.274 0.415 -1.238 114 HG21 ILE 25 HG21 ILE 25 43.965 1.458 -3.533 115 HG22 ILE 25 HG22 ILE 25 43.542 2.461 -2.147 116 HG23 ILE 25 HG23 ILE 25 43.179 3.016 -3.781 117 HD11 ILE 25 HD11 ILE 25 40.037 -0.185 -3.068 118 HD12 ILE 25 HD12 ILE 25 40.130 -0.343 -1.315 119 HD13 ILE 25 HD13 ILE 25 40.799 -1.604 -2.350 120 H TYR 26 HN TYR 26 39.328 2.116 -0.390 121 HA TYR 26 HA TYR 26 41.525 2.544 1.569 122 HB2 TYR 26 HB2 TYR 26 40.114 3.908 2.940 123 HB3 TYR 26 HB1 TYR 26 39.972 4.544 1.301 124 HD1 TYR 26 HD1 TYR 26 37.855 4.776 0.322 125 HD2 TYR 26 HD2 TYR 26 38.364 2.100 3.640 126 HE1 TYR 26 HE1 TYR 26 35.406 4.391 0.389 127 HE2 TYR 26 HE2 TYR 26 35.917 1.711 3.702 128 HH TYR 26 HH TYR 26 33.985 1.959 2.500 129 H TYR 27 HN TYR 27 40.911 1.673 3.777 130 HA TYR 27 HA TYR 27 39.336 -0.848 3.441 131 HB2 TYR 27 HB2 TYR 27 41.760 -0.135 5.081 132 HB3 TYR 27 HB1 TYR 27 40.720 -1.470 5.576 133 HD1 TYR 27 HD1 TYR 27 41.725 -3.491 4.991 134 HD2 TYR 27 HD2 TYR 27 41.815 -0.219 2.217 135 HE1 TYR 27 HE1 TYR 27 42.766 -4.959 3.291 136 HE2 TYR 27 HE2 TYR 27 42.858 -1.681 0.519 137 HH TYR 27 HH TYR 27 43.579 -5.105 1.236 138 H ILE 28 HN ILE 28 37.727 -1.316 5.002 139 HA ILE 28 HA ILE 28 37.272 0.822 7.021 140 HB ILE 28 HB ILE 28 35.468 1.268 5.736 141 HG12 ILE 28 HG12 ILE 28 33.478 0.064 6.446 142 HG13 ILE 28 HG11 ILE 28 34.451 -1.320 6.942 143 HG21 ILE 28 HG21 ILE 28 35.264 -1.591 4.781 144 HG22 ILE 28 HG22 ILE 28 36.334 -0.417 4.012 145 HG23 ILE 28 HG23 ILE 28 34.592 -0.147 4.027 146 HD11 ILE 28 HD11 ILE 28 35.493 1.035 8.199 147 HD12 ILE 28 HD12 ILE 28 34.786 -0.393 8.952 148 HD13 ILE 28 HD13 ILE 28 33.756 0.957 8.486 149 H ASN 29 HN ASN 29 37.181 0.107 9.082 150 HA ASN 29 HA ASN 29 36.921 -2.837 9.507 151 HB2 ASN 29 HB2 ASN 29 38.942 -1.323 10.333 152 HB3 ASN 29 HB1 ASN 29 37.836 -0.975 11.663 153 HD21 ASN 29 HD21 ASN 29 40.204 -2.440 12.178 154 HD22 ASN 29 HD22 ASN 29 39.796 -4.047 12.545 155 H HIS 30 HN HIS 30 34.782 -3.278 9.892 156 HA HIS 30 HA HIS 30 32.983 -1.412 11.169 157 HB2 HIS 30 HB2 HIS 30 32.755 -4.393 10.660 158 HB3 HIS 30 HB1 HIS 30 31.438 -3.388 11.265 159 HD1 HIS 30 HD1 HIS 30 31.431 -0.967 9.582 160 HD2 HIS 30 HD2 HIS 30 32.340 -4.698 7.950 161 HE1 HIS 30 HE1 HIS 30 31.012 -0.782 7.089 162 HE2 HIS 30 HE2 HIS 30 31.562 -3.047 6.088 163 H LYS 31 HN LYS 31 35.525 -3.003 12.472 164 HA LYS 31 HA LYS 31 34.218 -3.859 14.965 165 HB2 LYS 31 HB2 LYS 31 36.968 -4.031 13.813 166 HB3 LYS 31 HB1 LYS 31 36.810 -4.077 15.569 167 HG2 LYS 31 HG2 LYS 31 34.898 -5.781 14.086 168 HG3 LYS 31 HG1 LYS 31 36.587 -6.278 13.983 169 HD2 LYS 31 HD2 LYS 31 35.518 -7.345 15.915 170 HD3 LYS 31 HD1 LYS 31 36.743 -6.198 16.459 171 HE2 LYS 31 HE2 LYS 31 35.031 -4.515 16.897 172 HE3 LYS 31 HE1 LYS 31 33.782 -5.579 16.249 173 HZ1 LYS 31 HZ1 LYS 31 35.067 -7.091 18.126 174 HZ2 LYS 31 HZ2 LYS 31 33.559 -6.329 18.311 175 HZ3 LYS 31 HZ3 LYS 31 34.976 -5.556 18.842 176 H ASN 32 HN ASN 32 36.356 -1.279 13.827 177 HA ASN 32 HA ASN 32 35.951 0.090 16.442 178 HB2 ASN 32 HB2 ASN 32 38.333 -0.478 15.739 179 HB3 ASN 32 HB1 ASN 32 38.127 0.682 14.427 180 HD21 ASN 32 HD21 ASN 32 39.731 2.153 15.368 181 HD22 ASN 32 HD22 ASN 32 39.381 3.057 16.761 182 H LYS 33 HN LYS 33 34.653 0.017 13.494 183 HA LYS 33 HA LYS 33 33.464 1.558 12.191 184 HB2 LYS 33 HB2 LYS 33 33.276 2.416 14.945 185 HB3 LYS 33 HB1 LYS 33 33.306 3.822 13.879 186 HG2 LYS 33 HG2 LYS 33 31.495 2.816 12.519 187 HG3 LYS 33 HG1 LYS 33 31.447 1.440 13.621 188 HD2 LYS 33 HD2 LYS 33 31.257 4.105 14.903 189 HD3 LYS 33 HD1 LYS 33 29.875 3.638 13.910 190 HE2 LYS 33 HE2 LYS 33 29.644 2.915 16.292 191 HE3 LYS 33 HE1 LYS 33 29.620 1.563 15.160 192 HZ1 LYS 33 HZ1 LYS 33 31.068 1.151 17.069 193 HZ2 LYS 33 HZ2 LYS 33 32.011 2.501 16.652 194 HZ3 LYS 33 HZ3 LYS 33 31.938 1.158 15.613 195 H THR 34 HN THR 34 36.238 1.530 11.773 196 HA THR 34 HA THR 34 36.674 4.348 10.970 197 HB THR 34 HB THR 34 39.213 3.425 11.671 198 HG1 THR 34 HG1 THR 34 37.221 2.635 13.505 199 HG21 THR 34 HG21 THR 34 38.200 5.711 11.908 200 HG22 THR 34 HG22 THR 34 39.125 5.190 13.316 201 HG23 THR 34 HG23 THR 34 37.362 5.131 13.347 202 H THR 35 HN THR 35 38.467 4.475 9.304 203 HA THR 35 HA THR 35 38.557 1.955 7.733 204 HB THR 35 HB THR 35 39.085 3.823 5.868 205 HG1 THR 35 HG1 THR 35 37.398 5.480 6.455 206 HG21 THR 35 HG21 THR 35 36.453 2.787 6.907 207 HG22 THR 35 HG22 THR 35 37.341 2.281 5.471 208 HG23 THR 35 HG23 THR 35 36.521 3.837 5.494 209 H SER 36 HN SER 36 40.563 1.496 6.608 210 HA SER 36 HA SER 36 42.887 3.173 7.411 211 HB2 SER 36 HB2 SER 36 42.346 0.372 8.269 212 HB3 SER 36 HB1 SER 36 44.001 0.762 7.810 213 HG SER 36 HG SER 36 44.166 2.065 9.486 214 H TRP 37 HN TRP 37 44.846 1.326 6.473 215 HA TRP 37 HA TRP 37 44.087 1.015 3.601 216 HB2 TRP 37 HB2 TRP 37 46.820 1.919 4.527 217 HB3 TRP 37 HB1 TRP 37 46.170 1.939 2.888 218 HD1 TRP 37 HD1 TRP 37 46.531 4.042 5.909 219 HE1 TRP 37 HE1 TRP 37 45.189 6.227 5.654 220 HE3 TRP 37 HE3 TRP 37 43.740 2.889 1.789 221 HZ2 TRP 37 HZ2 TRP 37 43.197 7.340 3.931 222 HZ3 TRP 37 HZ3 TRP 37 42.129 4.530 0.863 223 HH2 TRP 37 HH2 TRP 37 41.854 6.753 1.928 224 H LEU 38 HN LEU 38 46.130 -0.008 6.293 225 HA LEU 38 HA LEU 38 47.606 -2.062 5.058 226 HB2 LEU 38 HB2 LEU 38 46.374 -2.012 7.831 227 HB3 LEU 38 HB1 LEU 38 47.602 -3.162 7.303 228 HG LEU 38 HG LEU 38 48.397 -0.447 6.664 229 HD11 LEU 38 HD11 LEU 38 48.698 0.364 8.961 230 HD12 LEU 38 HD12 LEU 38 47.897 -1.076 9.590 231 HD13 LEU 38 HD13 LEU 38 46.986 0.094 8.635 232 HD21 LEU 38 HD21 LEU 38 49.499 -2.695 8.372 233 HD22 LEU 38 HD22 LEU 38 50.367 -1.186 8.092 234 HD23 LEU 38 HD23 LEU 38 49.990 -2.251 6.737 235 H ASP 39 HN ASP 39 47.164 -4.342 4.801 236 HA ASP 39 HA ASP 39 44.256 -4.985 4.775 237 HB2 ASP 39 HB2 ASP 39 46.268 -6.190 2.879 238 HB3 ASP 39 HB1 ASP 39 44.510 -6.164 2.734 239 HA PRO 40 HA PRO 40 45.382 -8.375 7.385 240 HB2 PRO 40 HB2 PRO 40 43.173 -9.945 7.011 241 HB3 PRO 40 HB1 PRO 40 43.164 -8.471 7.998 242 HG2 PRO 40 HG2 PRO 40 42.179 -8.900 5.229 243 HG3 PRO 40 HG1 PRO 40 41.510 -7.895 6.525 244 HD2 PRO 40 HD2 PRO 40 42.982 -6.892 4.422 245 HD3 PRO 40 HD1 PRO 40 42.860 -6.103 6.009 246 H ARG 41 HN ARG 41 43.684 -9.714 4.522 247 HA ARG 41 HA ARG 41 46.120 -11.221 3.809 248 HB2 ARG 41 HB2 ARG 41 45.038 -13.372 3.850 249 HB3 ARG 41 HB1 ARG 41 44.755 -12.625 5.423 250 HG2 ARG 41 HG2 ARG 41 42.620 -11.682 3.988 251 HG3 ARG 41 HG1 ARG 41 42.834 -13.286 3.285 252 HD2 ARG 41 HD2 ARG 41 41.322 -13.419 5.207 253 HD3 ARG 41 HD1 ARG 41 42.827 -14.265 5.568 254 HE ARG 41 HE ARG 41 42.983 -11.525 6.443 255 HH11 ARG 41 HH11 ARG 41 42.847 -11.147 8.668 256 HH12 ARG 41 HH12 ARG 41 42.196 -12.374 9.702 257 HH21 ARG 41 HH21 ARG 41 41.600 -14.609 7.120 258 HH22 ARG 41 HH22 ARG 41 41.489 -14.334 8.826 259 H LEU 42 HN LEU 42 44.643 -9.051 2.552 260 HA LEU 42 HA LEU 42 43.327 -10.383 0.256 261 HB2 LEU 42 HB2 LEU 42 42.696 -8.081 1.633 262 HB3 LEU 42 HB1 LEU 42 43.527 -7.451 0.211 263 HG LEU 42 HG LEU 42 41.326 -9.517 0.031 264 HD11 LEU 42 HD11 LEU 42 40.777 -6.710 -0.744 265 HD12 LEU 42 HD12 LEU 42 40.898 -7.008 0.990 266 HD13 LEU 42 HD13 LEU 42 39.719 -7.894 0.023 267 HD21 LEU 42 HD21 LEU 42 42.012 -7.555 -2.113 268 HD22 LEU 42 HD22 LEU 42 41.485 -9.232 -2.254 269 HD23 LEU 42 HD23 LEU 42 43.155 -8.867 -1.821 270 H ASP 43 HN ASP 43 45.915 -11.022 0.142 271 HA ASP 43 HA ASP 43 47.915 -10.782 -1.074 272 HB2 ASP 43 HB2 ASP 43 45.931 -10.914 -2.819 273 HB3 ASP 43 HB1 ASP 43 46.375 -9.235 -3.130 274 HA PRO 44 HA PRO 44 48.132 -6.346 0.618 275 HB2 PRO 44 HB2 PRO 44 50.689 -7.624 1.493 276 HB3 PRO 44 HB1 PRO 44 49.623 -6.516 2.377 277 HG2 PRO 44 HG2 PRO 44 49.670 -9.139 2.887 278 HG3 PRO 44 HG1 PRO 44 48.185 -8.181 3.004 279 HD2 PRO 44 HD2 PRO 44 48.963 -10.186 0.954 280 HD3 PRO 44 HD1 PRO 44 47.344 -9.663 1.464 281 H ARG 45 HN ARG 45 50.435 -5.040 0.446 282 HA ARG 45 HA ARG 45 51.937 -5.784 -1.965 283 HB2 ARG 45 HB2 ARG 45 49.783 -3.772 -1.973 284 HB3 ARG 45 HB1 ARG 45 51.314 -3.192 -2.630 285 HG2 ARG 45 HG2 ARG 45 50.283 -5.880 -3.479 286 HG3 ARG 45 HG1 ARG 45 49.601 -4.424 -4.206 287 HD2 ARG 45 HD2 ARG 45 52.020 -3.699 -4.649 288 HD3 ARG 45 HD1 ARG 45 52.475 -5.356 -4.254 289 HE ARG 45 HE ARG 45 50.364 -5.219 -6.257 290 HH11 ARG 45 HH11 ARG 45 50.946 -5.895 -8.332 291 HH12 ARG 45 HH12 ARG 45 52.622 -6.056 -8.738 292 HH21 ARG 45 HH21 ARG 45 53.747 -5.072 -5.609 293 HH22 ARG 45 HH22 ARG 45 54.208 -5.590 -7.196 294 H GLY 46 HN GLY 46 51.825 -4.540 1.063 295 HA2 GLY 46 HA2 GLY 46 53.649 -3.672 2.316 296 HA3 GLY 46 HA1 GLY 46 54.518 -3.395 0.806 297 H GLY 47 HN GLY 47 54.821 -1.269 0.396 298 HA2 GLY 47 HA2 GLY 47 54.049 0.955 -0.088 299 HA3 GLY 47 HA1 GLY 47 52.576 0.612 0.820 300 H GLY 48 HN GLY 48 55.858 -0.010 1.976 301 HA2 GLY 48 HA2 GLY 48 55.339 1.342 4.471 302 HA3 GLY 48 HA1 GLY 48 56.910 0.739 3.941 303 H GLY 49 HN GLY 49 54.981 3.020 2.074 304 HA2 GLY 49 HA2 GLY 49 57.150 5.031 2.499 305 HA3 GLY 49 HA1 GLY 49 56.145 4.940 1.052 306 H ASN 50 HN ASN 50 54.817 4.598 4.286 307 HA ASN 50 HA ASN 50 53.575 6.153 5.586 308 HB2 ASN 50 HB2 ASN 50 55.137 7.857 4.212 309 HB3 ASN 50 HB1 ASN 50 53.593 8.222 3.441 310 HD21 ASN 50 HD21 ASN 50 55.386 8.414 6.475 311 HD22 ASN 50 HD22 ASN 50 54.243 9.357 7.302 312 H ARG 51 HN ARG 51 51.514 7.786 4.813 313 HA ARG 51 HA ARG 51 49.997 6.934 2.558 314 HB2 ARG 51 HB2 ARG 51 48.306 5.514 3.748 315 HB3 ARG 51 HB1 ARG 51 49.895 4.755 3.639 316 HG2 ARG 51 HG2 ARG 51 50.185 6.087 5.978 317 HG3 ARG 51 HG1 ARG 51 48.448 5.780 6.019 318 HD2 ARG 51 HD2 ARG 51 49.236 3.820 6.979 319 HD3 ARG 51 HD1 ARG 51 49.190 3.346 5.282 320 HE ARG 51 HE ARG 51 51.747 4.508 5.963 321 HH11 ARG 51 HH11 ARG 51 53.500 3.088 6.102 322 HH12 ARG 51 HH12 ARG 51 53.209 1.388 6.260 323 HH21 ARG 51 HH21 ARG 51 49.756 1.705 6.214 324 HH22 ARG 51 HH22 ARG 51 51.090 0.605 6.322 325 H GLN 52 HN GLN 52 48.273 8.331 2.335 326 HA GLN 52 HA GLN 52 48.008 10.598 3.983 327 HB2 GLN 52 HB2 GLN 52 45.513 9.726 2.666 328 HB3 GLN 52 HB1 GLN 52 46.409 11.236 2.494 329 HG2 GLN 52 HG2 GLN 52 47.024 8.578 1.177 330 HG3 GLN 52 HG1 GLN 52 46.552 10.081 0.383 331 HE21 GLN 52 HE21 GLN 52 49.009 8.751 -0.279 332 HE22 GLN 52 HE22 GLN 52 50.298 9.730 0.231 333 HA PRO 53 HA PRO 53 46.315 8.810 7.728 334 HB2 PRO 53 HB2 PRO 53 45.169 11.570 7.883 335 HB3 PRO 53 HB1 PRO 53 46.028 10.636 9.122 336 HG2 PRO 53 HG2 PRO 53 47.212 12.607 7.754 337 HG3 PRO 53 HG1 PRO 53 48.090 11.165 8.288 338 HD2 PRO 53 HD2 PRO 53 47.275 11.947 5.548 339 HD3 PRO 53 HD1 PRO 53 48.566 10.843 6.071 340 HA PRO 54 HA PRO 54 42.222 8.069 5.963 341 HB2 PRO 54 HB2 PRO 54 41.661 5.848 7.421 342 HB3 PRO 54 HB1 PRO 54 42.764 5.825 6.033 343 HG2 PRO 54 HG2 PRO 54 43.375 5.819 8.936 344 HG3 PRO 54 HG1 PRO 54 44.209 5.008 7.601 345 HD2 PRO 54 HD2 PRO 54 45.062 7.373 8.801 346 HD3 PRO 54 HD1 PRO 54 45.551 6.820 7.185 347 HA PRO 55 HA PRO 55 40.201 10.096 9.494 348 HB2 PRO 55 HB2 PRO 55 38.257 11.327 8.047 349 HB3 PRO 55 HB1 PRO 55 39.920 11.941 8.134 350 HG2 PRO 55 HG2 PRO 55 38.567 10.444 5.961 351 HG3 PRO 55 HG1 PRO 55 39.786 11.725 5.867 352 HD2 PRO 55 HD2 PRO 55 40.311 9.003 5.569 353 HD3 PRO 55 HD1 PRO 55 41.525 10.236 5.974 354 HA PRO 56 HA PRO 56 36.932 7.387 10.684 355 HB2 PRO 56 HB2 PRO 56 35.197 9.814 10.878 356 HB3 PRO 56 HB1 PRO 56 35.486 8.536 12.073 357 HG2 PRO 56 HG2 PRO 56 36.629 10.955 12.257 358 HG3 PRO 56 HG1 PRO 56 37.430 9.477 12.812 359 HD2 PRO 56 HD2 PRO 56 38.052 11.162 10.458 360 HD3 PRO 56 HD1 PRO 56 39.091 10.016 11.333 361 H TYR 57 HN TYR 57 36.022 6.152 9.084 362 HA TYR 57 HA TYR 57 34.871 7.302 6.691 363 HB2 TYR 57 HB2 TYR 57 34.846 5.159 5.915 364 HB3 TYR 57 HB1 TYR 57 35.870 4.850 7.315 365 HD1 TYR 57 HD1 TYR 57 34.645 4.301 9.559 366 HD2 TYR 57 HD2 TYR 57 32.818 4.010 5.683 367 HE1 TYR 57 HE1 TYR 57 32.917 2.783 10.485 368 HE2 TYR 57 HE2 TYR 57 31.092 2.492 6.609 369 HH TYR 57 HH TYR 57 30.681 1.074 8.435 370 HA PRO 58 HA PRO 58 30.909 7.958 8.719 371 HB2 PRO 58 HB2 PRO 58 29.779 9.404 6.720 372 HB3 PRO 58 HB1 PRO 58 30.991 10.085 7.822 373 HG2 PRO 58 HG2 PRO 58 31.296 9.143 5.023 374 HG3 PRO 58 HG1 PRO 58 32.074 10.501 5.852 375 HD2 PRO 58 HD2 PRO 58 33.275 8.033 5.396 376 HD3 PRO 58 HD1 PRO 58 33.784 9.193 6.643 377 H LEU 59 HN LEU 59 29.470 6.273 8.767 378 HA LEU 59 HA LEU 59 29.047 4.347 6.782 379 HB2 LEU 59 HB2 LEU 59 27.282 5.392 8.991 380 HB3 LEU 59 HB1 LEU 59 26.704 4.138 7.894 381 HG LEU 59 HG LEU 59 28.697 2.761 8.454 382 HD11 LEU 59 HD11 LEU 59 30.328 4.373 9.076 383 HD12 LEU 59 HD12 LEU 59 29.936 3.529 10.574 384 HD13 LEU 59 HD13 LEU 59 29.252 5.123 10.255 385 HD21 LEU 59 HD21 LEU 59 27.111 1.946 9.863 386 HD22 LEU 59 HD22 LEU 59 26.574 3.561 10.327 387 HD23 LEU 59 HD23 LEU 59 27.972 2.836 11.119 388 H THR 60 HN THR 60 29.006 5.566 4.761 389 HA THR 60 HA THR 60 27.853 6.466 2.927 390 HB THR 60 HB THR 60 25.316 6.085 4.525 391 HG1 THR 60 HG1 THR 60 27.017 4.214 3.297 392 HG21 THR 60 HG21 THR 60 24.483 5.517 2.193 393 HG22 THR 60 HG22 THR 60 26.042 6.079 1.588 394 HG23 THR 60 HG23 THR 60 24.966 7.196 2.430 395 H ALA 61 HN ALA 61 28.886 8.526 3.646 396 HA ALA 61 HA ALA 61 27.812 10.425 5.381 397 HB1 ALA 61 HB1 ALA 61 28.653 11.671 2.882 398 HB2 ALA 61 HB2 ALA 61 29.780 10.417 3.399 399 HB3 ALA 61 HB3 ALA 61 29.397 11.757 4.478 Start of MODEL 5 1 H1 SER 8 HT1 SER 8 33.916 -13.947 -2.625 2 H2 SER 8 HT2 SER 8 32.324 -13.956 -2.032 3 H3 SER 8 HT3 SER 8 33.279 -15.356 -1.929 4 HA SER 8 HA SER 8 33.258 -14.422 0.225 5 HB2 SER 8 HB2 SER 8 35.769 -13.352 0.070 6 HB3 SER 8 HB1 SER 8 35.434 -15.081 0.114 7 HG SER 8 HG SER 8 36.779 -14.163 -1.684 8 H GLY 9 HN GLY 9 31.592 -12.655 -0.079 9 HA2 GLY 9 HA2 GLY 9 32.367 -9.997 -0.829 10 HA3 GLY 9 HA1 GLY 9 30.946 -10.406 0.131 11 HA PRO 10 HA PRO 10 32.566 -8.426 3.718 12 HB2 PRO 10 HB2 PRO 10 31.912 -11.004 5.087 13 HB3 PRO 10 HB1 PRO 10 31.477 -9.345 5.541 14 HG2 PRO 10 HG2 PRO 10 29.732 -11.031 4.390 15 HG3 PRO 10 HG1 PRO 10 29.691 -9.280 4.128 16 HD2 PRO 10 HD2 PRO 10 30.470 -11.423 2.248 17 HD3 PRO 10 HD1 PRO 10 29.969 -9.752 1.909 18 H LEU 11 HN LEU 11 34.540 -8.389 4.896 19 HA LEU 11 HA LEU 11 36.515 -10.402 4.061 20 HB2 LEU 11 HB2 LEU 11 36.623 -7.794 5.584 21 HB3 LEU 11 HB1 LEU 11 38.029 -8.836 5.450 22 HG LEU 11 HG LEU 11 36.449 -7.783 3.094 23 HD11 LEU 11 HD11 LEU 11 37.904 -6.031 2.927 24 HD12 LEU 11 HD12 LEU 11 39.263 -6.970 3.541 25 HD13 LEU 11 HD13 LEU 11 38.086 -6.287 4.661 26 HD21 LEU 11 HD21 LEU 11 38.749 -9.659 3.431 27 HD22 LEU 11 HD22 LEU 11 38.801 -8.548 2.064 28 HD23 LEU 11 HD23 LEU 11 37.455 -9.674 2.233 29 HA PRO 12 HA PRO 12 37.455 -12.972 7.606 30 HB2 PRO 12 HB2 PRO 12 38.410 -10.548 9.097 31 HB3 PRO 12 HB1 PRO 12 39.093 -12.186 9.067 32 HG2 PRO 12 HG2 PRO 12 39.920 -10.054 7.478 33 HG3 PRO 12 HG1 PRO 12 40.284 -11.761 7.198 34 HD2 PRO 12 HD2 PRO 12 38.743 -10.118 5.502 35 HD3 PRO 12 HD1 PRO 12 38.814 -11.889 5.437 36 H ASP 13 HN ASP 13 36.246 -9.781 8.712 37 HA ASP 13 HA ASP 13 33.678 -10.279 9.343 38 HB2 ASP 13 HB2 ASP 13 33.856 -12.274 10.506 39 HB3 ASP 13 HB1 ASP 13 35.428 -11.854 11.191 40 H GLY 14 HN GLY 14 33.235 -8.184 9.709 41 HA2 GLY 14 HA2 GLY 14 32.997 -6.414 11.378 42 HA3 GLY 14 HA1 GLY 14 34.576 -6.868 12.021 43 H TRP 15 HN TRP 15 34.802 -6.977 8.694 44 HA TRP 15 HA TRP 15 35.186 -4.113 8.270 45 HB2 TRP 15 HB2 TRP 15 37.510 -4.050 8.117 46 HB3 TRP 15 HB1 TRP 15 37.233 -5.051 9.537 47 HD1 TRP 15 HD1 TRP 15 37.027 -7.858 8.748 48 HE1 TRP 15 HE1 TRP 15 38.748 -9.093 7.287 49 HE3 TRP 15 HE3 TRP 15 39.249 -3.880 6.468 50 HZ2 TRP 15 HZ2 TRP 15 40.809 -8.471 5.393 51 HZ3 TRP 15 HZ3 TRP 15 41.082 -4.221 4.848 52 HH2 TRP 15 HH2 TRP 15 41.869 -6.509 4.303 53 H GLU 16 HN GLU 16 36.172 -3.724 6.006 54 HA GLU 16 HA GLU 16 35.983 -5.933 4.104 55 HB2 GLU 16 HB2 GLU 16 33.627 -4.339 4.742 56 HB3 GLU 16 HB1 GLU 16 34.042 -4.248 3.031 57 HG2 GLU 16 HG2 GLU 16 34.240 -6.791 3.076 58 HG3 GLU 16 HG1 GLU 16 33.488 -6.727 4.671 59 H GLN 17 HN GLN 17 36.274 -5.111 1.826 60 HA GLN 17 HA GLN 17 38.081 -2.781 1.839 61 HB2 GLN 17 HB2 GLN 17 38.830 -4.791 0.657 62 HB3 GLN 17 HB1 GLN 17 37.372 -4.773 -0.337 63 HG2 GLN 17 HG2 GLN 17 39.115 -3.775 -1.655 64 HG3 GLN 17 HG1 GLN 17 38.067 -2.460 -1.124 65 HE21 GLN 17 HE21 GLN 17 41.291 -3.278 -1.395 66 HE22 GLN 17 HE22 GLN 17 41.930 -2.283 -0.177 67 H ALA 18 HN ALA 18 37.610 -0.845 0.757 68 HA ALA 18 HA ALA 18 35.186 -0.692 -0.908 69 HB1 ALA 18 HB1 ALA 18 35.473 0.666 1.768 70 HB2 ALA 18 HB2 ALA 18 34.114 -0.276 1.155 71 HB3 ALA 18 HB3 ALA 18 34.432 1.335 0.511 72 H MET 19 HN MET 19 34.943 2.004 -1.204 73 HA MET 19 HA MET 19 37.676 2.991 -1.825 74 HB2 MET 19 HB2 MET 19 36.880 3.801 -4.015 75 HB3 MET 19 HB1 MET 19 36.712 2.049 -3.893 76 HG2 MET 19 HG2 MET 19 34.309 2.714 -2.944 77 HG3 MET 19 HG1 MET 19 34.598 4.159 -3.913 78 HE1 MET 19 HE1 MET 19 33.932 3.892 -6.901 79 HE2 MET 19 HE2 MET 19 35.460 3.088 -7.254 80 HE3 MET 19 HE3 MET 19 35.382 4.287 -5.967 81 H THR 20 HN THR 20 37.715 5.373 -2.163 82 HA THR 20 HA THR 20 35.726 6.676 -0.392 83 HB THR 20 HB THR 20 37.570 8.607 -0.886 84 HG1 THR 20 HG1 THR 20 38.593 6.265 -1.778 85 HG21 THR 20 HG21 THR 20 37.074 8.048 1.345 86 HG22 THR 20 HG22 THR 20 38.771 7.597 1.182 87 HG23 THR 20 HG23 THR 20 37.520 6.357 1.114 88 H GLN 21 HN GLN 21 36.045 9.323 -1.402 89 HA GLN 21 HA GLN 21 34.301 9.132 -3.761 90 HB2 GLN 21 HB2 GLN 21 35.096 11.240 -1.821 91 HB3 GLN 21 HB1 GLN 21 34.721 11.793 -3.453 92 HG2 GLN 21 HG2 GLN 21 32.679 11.813 -2.125 93 HG3 GLN 21 HG1 GLN 21 32.564 10.535 -3.336 94 HE21 GLN 21 HE21 GLN 21 31.515 10.914 -0.375 95 HE22 GLN 21 HE22 GLN 21 31.875 9.415 0.335 96 H ASP 22 HN ASP 22 37.613 9.286 -3.169 97 HA ASP 22 HA ASP 22 38.117 10.457 -5.852 98 HB2 ASP 22 HB2 ASP 22 39.143 11.632 -3.851 99 HB3 ASP 22 HB1 ASP 22 40.108 10.179 -3.591 100 H GLY 23 HN GLY 23 37.454 7.663 -4.849 101 HA2 GLY 23 HA2 GLY 23 38.074 5.470 -5.379 102 HA3 GLY 23 HA1 GLY 23 38.952 6.183 -6.733 103 H GLU 24 HN GLU 24 39.544 6.761 -3.286 104 HA GLU 24 HA GLU 24 42.375 6.120 -3.673 105 HB2 GLU 24 HB2 GLU 24 41.038 6.698 -1.041 106 HB3 GLU 24 HB1 GLU 24 42.705 7.026 -1.519 107 HG2 GLU 24 HG2 GLU 24 41.462 8.483 -3.392 108 HG3 GLU 24 HG1 GLU 24 40.219 8.548 -2.142 109 H ILE 25 HN ILE 25 40.086 4.138 -3.699 110 HA ILE 25 HA ILE 25 39.471 2.115 -2.521 111 HB ILE 25 HB ILE 25 40.793 1.419 -4.408 112 HG12 ILE 25 HG12 ILE 25 41.839 -0.625 -3.489 113 HG13 ILE 25 HG11 ILE 25 41.796 0.081 -1.872 114 HG21 ILE 25 HG21 ILE 25 42.824 2.399 -4.595 115 HG22 ILE 25 HG22 ILE 25 43.401 1.124 -3.523 116 HG23 ILE 25 HG23 ILE 25 42.935 2.689 -2.861 117 HD11 ILE 25 HD11 ILE 25 39.827 -1.509 -2.868 118 HD12 ILE 25 HD12 ILE 25 39.212 0.085 -3.313 119 HD13 ILE 25 HD13 ILE 25 39.562 -0.286 -1.624 120 H TYR 26 HN TYR 26 39.245 1.986 -0.356 121 HA TYR 26 HA TYR 26 41.696 1.591 1.250 122 HB2 TYR 26 HB2 TYR 26 41.023 3.120 2.968 123 HB3 TYR 26 HB1 TYR 26 40.943 3.992 1.442 124 HD1 TYR 26 HD1 TYR 26 38.269 2.154 0.809 125 HD2 TYR 26 HD2 TYR 26 39.506 4.956 3.822 126 HE1 TYR 26 HE1 TYR 26 35.902 2.715 1.262 127 HE2 TYR 26 HE2 TYR 26 37.133 5.512 4.274 128 HH TYR 26 HH TYR 26 34.837 5.270 2.575 129 H TYR 27 HN TYR 27 40.898 0.902 3.611 130 HA TYR 27 HA TYR 27 38.804 -1.173 3.137 131 HB2 TYR 27 HB2 TYR 27 41.095 -1.121 5.121 132 HB3 TYR 27 HB1 TYR 27 39.884 -2.397 5.016 133 HD1 TYR 27 HD1 TYR 27 42.908 -1.001 3.567 134 HD2 TYR 27 HD2 TYR 27 39.676 -3.749 2.911 135 HE1 TYR 27 HE1 TYR 27 44.197 -2.078 1.751 136 HE2 TYR 27 HE2 TYR 27 40.963 -4.830 1.093 137 HH TYR 27 HH TYR 27 42.795 -4.251 -0.458 138 H ILE 28 HN ILE 28 37.375 -1.659 4.956 139 HA ILE 28 HA ILE 28 37.040 0.633 6.816 140 HB ILE 28 HB ILE 28 35.218 1.060 5.549 141 HG12 ILE 28 HG12 ILE 28 33.209 -0.039 6.341 142 HG13 ILE 28 HG11 ILE 28 34.134 -1.447 6.863 143 HG21 ILE 28 HG21 ILE 28 35.136 -1.852 4.724 144 HG22 ILE 28 HG22 ILE 28 35.955 -0.573 3.826 145 HG23 ILE 28 HG23 ILE 28 34.202 -0.542 4.007 146 HD11 ILE 28 HD11 ILE 28 35.306 0.863 8.058 147 HD12 ILE 28 HD12 ILE 28 34.486 -0.479 8.850 148 HD13 ILE 28 HD13 ILE 28 33.566 0.931 8.333 149 H ASN 29 HN ASN 29 36.938 0.047 8.931 150 HA ASN 29 HA ASN 29 36.571 -2.859 9.531 151 HB2 ASN 29 HB2 ASN 29 38.679 -1.417 10.232 152 HB3 ASN 29 HB1 ASN 29 37.619 -0.903 11.544 153 HD21 ASN 29 HD21 ASN 29 40.045 -2.934 11.248 154 HD22 ASN 29 HD22 ASN 29 39.490 -4.282 12.118 155 H HIS 30 HN HIS 30 34.418 -3.160 9.940 156 HA HIS 30 HA HIS 30 32.707 -1.168 11.117 157 HB2 HIS 30 HB2 HIS 30 32.337 -4.177 10.966 158 HB3 HIS 30 HB1 HIS 30 31.068 -2.997 11.299 159 HD1 HIS 30 HD1 HIS 30 30.688 -1.159 9.315 160 HD2 HIS 30 HD2 HIS 30 32.753 -4.626 8.253 161 HE1 HIS 30 HE1 HIS 30 30.633 -1.283 6.784 162 HE2 HIS 30 HE2 HIS 30 31.882 -3.390 6.128 163 H LYS 31 HN LYS 31 35.194 -2.863 12.491 164 HA LYS 31 HA LYS 31 33.934 -3.445 15.068 165 HB2 LYS 31 HB2 LYS 31 36.864 -3.376 14.282 166 HB3 LYS 31 HB1 LYS 31 36.217 -4.033 15.786 167 HG2 LYS 31 HG2 LYS 31 34.794 -5.586 14.353 168 HG3 LYS 31 HG1 LYS 31 35.763 -5.060 12.976 169 HD2 LYS 31 HD2 LYS 31 37.508 -6.354 13.590 170 HD3 LYS 31 HD1 LYS 31 37.418 -5.804 15.264 171 HE2 LYS 31 HE2 LYS 31 35.628 -7.910 14.016 172 HE3 LYS 31 HE1 LYS 31 36.986 -8.235 15.093 173 HZ1 LYS 31 HZ1 LYS 31 35.036 -8.231 16.406 174 HZ2 LYS 31 HZ2 LYS 31 34.484 -6.775 15.727 175 HZ3 LYS 31 HZ3 LYS 31 35.842 -6.778 16.747 176 H ASN 32 HN ASN 32 36.133 -1.002 13.743 177 HA ASN 32 HA ASN 32 35.716 0.595 16.222 178 HB2 ASN 32 HB2 ASN 32 37.981 0.542 14.219 179 HB3 ASN 32 HB1 ASN 32 37.782 1.855 15.381 180 HD21 ASN 32 HD21 ASN 32 40.019 0.851 16.077 181 HD22 ASN 32 HD22 ASN 32 39.950 -0.380 17.245 182 H LYS 33 HN LYS 33 34.467 0.287 13.249 183 HA LYS 33 HA LYS 33 33.288 1.725 11.824 184 HB2 LYS 33 HB2 LYS 33 33.067 2.788 14.493 185 HB3 LYS 33 HB1 LYS 33 33.158 4.120 13.340 186 HG2 LYS 33 HG2 LYS 33 31.387 2.911 11.975 187 HG3 LYS 33 HG1 LYS 33 31.187 1.824 13.349 188 HD2 LYS 33 HD2 LYS 33 30.966 4.084 14.704 189 HD3 LYS 33 HD1 LYS 33 30.521 4.738 13.127 190 HE2 LYS 33 HE2 LYS 33 29.070 2.378 13.260 191 HE3 LYS 33 HE1 LYS 33 28.994 2.990 14.913 192 HZ1 LYS 33 HZ1 LYS 33 27.202 3.862 13.527 193 HZ2 LYS 33 HZ2 LYS 33 28.341 4.557 12.475 194 HZ3 LYS 33 HZ3 LYS 33 28.218 5.103 14.080 195 H THR 34 HN THR 34 36.127 1.657 11.549 196 HA THR 34 HA THR 34 36.560 4.377 10.449 197 HB THR 34 HB THR 34 39.086 3.549 11.297 198 HG1 THR 34 HG1 THR 34 38.416 2.096 12.741 199 HG21 THR 34 HG21 THR 34 38.577 5.822 11.422 200 HG22 THR 34 HG22 THR 34 38.569 5.353 13.122 201 HG23 THR 34 HG23 THR 34 37.047 5.534 12.250 202 H THR 35 HN THR 35 38.140 4.385 8.680 203 HA THR 35 HA THR 35 38.363 1.709 7.421 204 HB THR 35 HB THR 35 38.914 3.281 5.371 205 HG1 THR 35 HG1 THR 35 38.251 5.290 5.597 206 HG21 THR 35 HG21 THR 35 36.289 3.563 5.170 207 HG22 THR 35 HG22 THR 35 36.291 2.542 6.604 208 HG23 THR 35 HG23 THR 35 37.023 1.965 5.106 209 H SER 36 HN SER 36 40.375 1.386 6.082 210 HA SER 36 HA SER 36 42.703 3.021 6.804 211 HB2 SER 36 HB2 SER 36 42.747 0.138 7.696 212 HB3 SER 36 HB1 SER 36 43.889 1.419 8.091 213 HG SER 36 HG SER 36 41.514 2.266 8.829 214 H TRP 37 HN TRP 37 44.649 2.310 5.638 215 HA TRP 37 HA TRP 37 43.920 0.893 3.137 216 HB2 TRP 37 HB2 TRP 37 46.657 1.990 3.520 217 HB3 TRP 37 HB1 TRP 37 45.595 2.085 2.116 218 HD1 TRP 37 HD1 TRP 37 46.285 3.765 5.479 219 HE1 TRP 37 HE1 TRP 37 45.168 6.089 5.487 220 HE3 TRP 37 HE3 TRP 37 43.692 3.516 1.085 221 HZ2 TRP 37 HZ2 TRP 37 43.407 7.636 3.849 222 HZ3 TRP 37 HZ3 TRP 37 42.305 5.427 0.335 223 HH2 TRP 37 HH2 TRP 37 42.159 7.485 1.710 224 H LEU 38 HN LEU 38 44.408 -0.462 5.793 225 HA LEU 38 HA LEU 38 46.950 -1.812 5.658 226 HB2 LEU 38 HB2 LEU 38 44.955 -1.645 7.528 227 HB3 LEU 38 HB1 LEU 38 44.715 -3.280 6.910 228 HG LEU 38 HG LEU 38 47.324 -3.460 7.170 229 HD11 LEU 38 HD11 LEU 38 48.352 -2.006 8.679 230 HD12 LEU 38 HD12 LEU 38 46.821 -1.518 9.407 231 HD13 LEU 38 HD13 LEU 38 47.274 -0.911 7.814 232 HD21 LEU 38 HD21 LEU 38 46.654 -3.698 9.840 233 HD22 LEU 38 HD22 LEU 38 46.387 -4.939 8.615 234 HD23 LEU 38 HD23 LEU 38 45.087 -3.827 9.042 235 H ASP 39 HN ASP 39 47.477 -3.787 4.706 236 HA ASP 39 HA ASP 39 45.366 -5.018 3.000 237 HB2 ASP 39 HB2 ASP 39 48.319 -4.667 2.421 238 HB3 ASP 39 HB1 ASP 39 47.220 -5.622 1.426 239 HA PRO 40 HA PRO 40 46.872 -8.303 5.811 240 HB2 PRO 40 HB2 PRO 40 44.451 -9.468 6.214 241 HB3 PRO 40 HB1 PRO 40 44.975 -8.025 7.105 242 HG2 PRO 40 HG2 PRO 40 43.087 -8.262 4.832 243 HG3 PRO 40 HG1 PRO 40 43.061 -7.160 6.217 244 HD2 PRO 40 HD2 PRO 40 43.937 -6.486 3.653 245 HD3 PRO 40 HD1 PRO 40 44.331 -5.590 5.134 246 H ARG 41 HN ARG 41 44.138 -9.144 3.642 247 HA ARG 41 HA ARG 41 45.828 -11.367 2.597 248 HB2 ARG 41 HB2 ARG 41 43.602 -12.446 2.023 249 HB3 ARG 41 HB1 ARG 41 43.933 -12.293 3.749 250 HG2 ARG 41 HG2 ARG 41 42.711 -9.886 3.157 251 HG3 ARG 41 HG1 ARG 41 41.837 -11.025 2.133 252 HD2 ARG 41 HD2 ARG 41 40.886 -10.740 4.468 253 HD3 ARG 41 HD1 ARG 41 41.259 -12.403 4.012 254 HE ARG 41 HE ARG 41 43.340 -10.905 5.500 255 HH11 ARG 41 HH11 ARG 41 43.995 -11.935 7.401 256 HH12 ARG 41 HH12 ARG 41 43.115 -13.312 7.974 257 HH21 ARG 41 HH21 ARG 41 40.833 -13.271 5.363 258 HH22 ARG 41 HH22 ARG 41 41.324 -14.067 6.820 259 H LEU 42 HN LEU 42 46.049 -8.792 1.481 260 HA LEU 42 HA LEU 42 44.762 -9.238 -1.167 261 HB2 LEU 42 HB2 LEU 42 43.766 -7.311 0.157 262 HB3 LEU 42 HB1 LEU 42 45.335 -6.516 0.024 263 HG LEU 42 HG LEU 42 44.607 -7.466 -2.572 264 HD11 LEU 42 HD11 LEU 42 42.280 -7.368 -1.477 265 HD12 LEU 42 HD12 LEU 42 42.493 -6.460 -2.974 266 HD13 LEU 42 HD13 LEU 42 42.510 -5.621 -1.422 267 HD21 LEU 42 HD21 LEU 42 44.910 -5.155 -3.164 268 HD22 LEU 42 HD22 LEU 42 46.050 -5.492 -1.862 269 HD23 LEU 42 HD23 LEU 42 44.552 -4.624 -1.521 270 H ASP 43 HN ASP 43 47.400 -10.062 -0.232 271 HA ASP 43 HA ASP 43 49.712 -9.694 -0.694 272 HB2 ASP 43 HB2 ASP 43 48.174 -9.708 -3.283 273 HB3 ASP 43 HB1 ASP 43 49.930 -9.539 -3.290 274 HA PRO 44 HA PRO 44 49.507 -5.084 -0.483 275 HB2 PRO 44 HB2 PRO 44 52.229 -5.690 0.578 276 HB3 PRO 44 HB1 PRO 44 50.981 -4.607 1.224 277 HG2 PRO 44 HG2 PRO 44 51.496 -6.985 2.328 278 HG3 PRO 44 HG1 PRO 44 49.863 -6.302 2.278 279 HD2 PRO 44 HD2 PRO 44 51.009 -8.544 0.686 280 HD3 PRO 44 HD1 PRO 44 49.327 -8.254 1.182 281 H ARG 45 HN ARG 45 49.754 -5.744 -2.992 282 HA ARG 45 HA ARG 45 52.514 -5.026 -3.852 283 HB2 ARG 45 HB2 ARG 45 51.529 -7.252 -4.610 284 HB3 ARG 45 HB1 ARG 45 50.379 -6.313 -5.563 285 HG2 ARG 45 HG2 ARG 45 52.309 -5.170 -6.674 286 HG3 ARG 45 HG1 ARG 45 53.401 -6.244 -5.800 287 HD2 ARG 45 HD2 ARG 45 51.154 -7.389 -7.441 288 HD3 ARG 45 HD1 ARG 45 52.661 -6.902 -8.219 289 HE ARG 45 HE ARG 45 52.986 -8.663 -5.887 290 HH11 ARG 45 HH11 ARG 45 53.933 -10.662 -6.355 291 HH12 ARG 45 HH12 ARG 45 54.089 -11.166 -8.005 292 HH21 ARG 45 HH21 ARG 45 52.627 -8.299 -9.296 293 HH22 ARG 45 HH22 ARG 45 53.349 -9.828 -9.669 294 H GLY 46 HN GLY 46 49.404 -4.829 -5.570 295 HA2 GLY 46 HA2 GLY 46 49.983 -2.376 -6.854 296 HA3 GLY 46 HA1 GLY 46 48.353 -3.000 -6.599 297 H GLY 47 HN GLY 47 50.972 -1.277 -4.890 298 HA2 GLY 47 HA2 GLY 47 50.055 0.980 -3.989 299 HA3 GLY 47 HA1 GLY 47 48.889 -0.041 -3.144 300 H GLY 48 HN GLY 48 51.583 1.651 -2.559 301 HA2 GLY 48 HA2 GLY 48 52.150 0.670 -0.031 302 HA3 GLY 48 HA1 GLY 48 53.180 -0.289 -1.095 303 H GLY 49 HN GLY 49 52.769 2.775 0.428 304 HA2 GLY 49 HA2 GLY 49 55.451 3.585 0.037 305 HA3 GLY 49 HA1 GLY 49 54.487 4.368 -1.216 306 H ASN 50 HN ASN 50 54.158 3.724 2.297 307 HA ASN 50 HA ASN 50 53.337 5.121 4.001 308 HB2 ASN 50 HB2 ASN 50 55.457 6.254 3.650 309 HB3 ASN 50 HB1 ASN 50 54.803 7.128 2.264 310 HD21 ASN 50 HD21 ASN 50 53.442 8.967 2.675 311 HD22 ASN 50 HD22 ASN 50 53.180 9.580 4.236 312 H ARG 51 HN ARG 51 51.149 5.379 4.048 313 HA ARG 51 HA ARG 51 49.904 7.103 1.947 314 HB2 ARG 51 HB2 ARG 51 49.230 4.539 2.698 315 HB3 ARG 51 HB1 ARG 51 48.107 5.513 3.648 316 HG2 ARG 51 HG2 ARG 51 47.010 5.121 1.565 317 HG3 ARG 51 HG1 ARG 51 47.596 6.782 1.489 318 HD2 ARG 51 HD2 ARG 51 49.563 4.807 0.556 319 HD3 ARG 51 HD1 ARG 51 48.089 4.843 -0.411 320 HE ARG 51 HE ARG 51 50.029 7.052 -0.132 321 HH11 ARG 51 HH11 ARG 51 49.703 8.738 -1.603 322 HH12 ARG 51 HH12 ARG 51 48.247 8.780 -2.541 323 HH21 ARG 51 HH21 ARG 51 46.955 5.875 -1.158 324 HH22 ARG 51 HH22 ARG 51 46.692 7.159 -2.289 325 H GLN 52 HN GLN 52 48.582 8.822 2.596 326 HA GLN 52 HA GLN 52 49.144 10.078 5.091 327 HB2 GLN 52 HB2 GLN 52 46.545 10.799 3.940 328 HB3 GLN 52 HB1 GLN 52 47.974 11.800 4.195 329 HG2 GLN 52 HG2 GLN 52 47.493 9.891 1.891 330 HG3 GLN 52 HG1 GLN 52 47.553 11.652 1.806 331 HE21 GLN 52 HE21 GLN 52 49.483 8.775 1.739 332 HE22 GLN 52 HE22 GLN 52 50.999 9.538 1.712 333 HA PRO 53 HA PRO 53 46.503 8.131 8.012 334 HB2 PRO 53 HB2 PRO 53 45.415 10.338 9.309 335 HB3 PRO 53 HB1 PRO 53 47.010 9.641 9.646 336 HG2 PRO 53 HG2 PRO 53 46.287 12.026 8.038 337 HG3 PRO 53 HG1 PRO 53 47.703 11.737 9.064 338 HD2 PRO 53 HD2 PRO 53 47.821 11.612 6.346 339 HD3 PRO 53 HD1 PRO 53 48.856 10.618 7.395 340 HA PRO 54 HA PRO 54 42.545 8.359 5.875 341 HB2 PRO 54 HB2 PRO 54 41.546 6.018 6.827 342 HB3 PRO 54 HB1 PRO 54 42.773 6.087 5.548 343 HG2 PRO 54 HG2 PRO 54 43.078 5.458 8.432 344 HG3 PRO 54 HG1 PRO 54 43.931 4.792 7.031 345 HD2 PRO 54 HD2 PRO 54 44.963 6.740 8.729 346 HD3 PRO 54 HD1 PRO 54 45.531 6.432 7.075 347 HA PRO 55 HA PRO 55 40.281 10.017 9.406 348 HB2 PRO 55 HB2 PRO 55 38.346 11.277 7.970 349 HB3 PRO 55 HB1 PRO 55 39.992 11.920 8.125 350 HG2 PRO 55 HG2 PRO 55 38.728 10.481 5.857 351 HG3 PRO 55 HG1 PRO 55 39.903 11.806 5.845 352 HD2 PRO 55 HD2 PRO 55 40.544 9.134 5.431 353 HD3 PRO 55 HD1 PRO 55 41.697 10.380 5.958 354 HA PRO 56 HA PRO 56 37.122 7.084 10.360 355 HB2 PRO 56 HB2 PRO 56 35.362 9.456 10.828 356 HB3 PRO 56 HB1 PRO 56 35.676 8.061 11.877 357 HG2 PRO 56 HG2 PRO 56 36.802 10.460 12.299 358 HG3 PRO 56 HG1 PRO 56 37.617 8.939 12.693 359 HD2 PRO 56 HD2 PRO 56 38.219 10.866 10.533 360 HD3 PRO 56 HD1 PRO 56 39.261 9.623 11.259 361 H TYR 57 HN TYR 57 36.229 6.010 8.639 362 HA TYR 57 HA TYR 57 35.103 7.283 6.339 363 HB2 TYR 57 HB2 TYR 57 34.830 5.155 5.532 364 HB3 TYR 57 HB1 TYR 57 35.906 4.767 6.873 365 HD1 TYR 57 HD1 TYR 57 34.556 4.600 9.241 366 HD2 TYR 57 HD2 TYR 57 32.939 3.817 5.339 367 HE1 TYR 57 HE1 TYR 57 32.790 3.185 10.256 368 HE2 TYR 57 HE2 TYR 57 31.173 2.403 6.354 369 HH TYR 57 HH TYR 57 30.566 1.310 8.262 370 HA PRO 58 HA PRO 58 31.124 8.297 8.081 371 HB2 PRO 58 HB2 PRO 58 29.923 9.132 5.787 372 HB3 PRO 58 HB1 PRO 58 31.152 10.094 6.630 373 HG2 PRO 58 HG2 PRO 58 31.414 8.398 4.203 374 HG3 PRO 58 HG1 PRO 58 32.172 9.953 4.584 375 HD2 PRO 58 HD2 PRO 58 33.456 7.515 4.814 376 HD3 PRO 58 HD1 PRO 58 33.911 8.971 5.726 377 H LEU 59 HN LEU 59 30.232 6.254 8.649 378 HA LEU 59 HA LEU 59 29.553 4.059 7.194 379 HB2 LEU 59 HB2 LEU 59 28.919 4.207 9.529 380 HB3 LEU 59 HB1 LEU 59 27.766 5.496 9.177 381 HG LEU 59 HG LEU 59 26.429 3.964 7.810 382 HD11 LEU 59 HD11 LEU 59 28.818 2.238 8.221 383 HD12 LEU 59 HD12 LEU 59 27.759 2.376 6.818 384 HD13 LEU 59 HD13 LEU 59 27.251 1.430 8.217 385 HD21 LEU 59 HD21 LEU 59 26.496 4.005 10.500 386 HD22 LEU 59 HD22 LEU 59 26.925 2.314 10.243 387 HD23 LEU 59 HD23 LEU 59 25.407 2.945 9.604 388 H THR 60 HN THR 60 28.712 3.924 5.171 389 HA THR 60 HA THR 60 26.080 4.837 4.535 390 HB THR 60 HB THR 60 27.558 7.009 4.567 391 HG1 THR 60 HG1 THR 60 25.474 7.009 3.780 392 HG21 THR 60 HG21 THR 60 29.325 5.908 3.131 393 HG22 THR 60 HG22 THR 60 28.744 7.459 2.523 394 HG23 THR 60 HG23 THR 60 28.172 5.957 1.797 395 H ALA 61 HN ALA 61 25.926 4.860 1.914 396 HA ALA 61 HA ALA 61 27.484 2.465 1.028 397 HB1 ALA 61 HB1 ALA 61 25.508 2.220 -0.612 398 HB2 ALA 61 HB2 ALA 61 24.675 3.390 0.412 399 HB3 ALA 61 HB3 ALA 61 25.194 1.843 1.083 Start of MODEL 6 1 H1 SER 8 HT1 SER 8 27.864 -6.965 -2.201 2 H2 SER 8 HT2 SER 8 27.786 -8.591 -2.688 3 H3 SER 8 HT3 SER 8 29.294 -7.838 -2.467 4 HA SER 8 HA SER 8 28.280 -7.454 -0.056 5 HB2 SER 8 HB2 SER 8 27.118 -10.059 -1.086 6 HB3 SER 8 HB1 SER 8 27.134 -9.559 0.602 7 HG SER 8 HG SER 8 26.149 -7.690 -1.171 8 H GLY 9 HN GLY 9 28.616 -10.462 0.674 9 HA2 GLY 9 HA2 GLY 9 30.437 -11.793 1.326 10 HA3 GLY 9 HA1 GLY 9 31.105 -11.413 -0.261 11 HA PRO 10 HA PRO 10 32.651 -7.966 2.796 12 HB2 PRO 10 HB2 PRO 10 32.589 -8.724 5.452 13 HB3 PRO 10 HB1 PRO 10 31.352 -7.726 4.667 14 HG2 PRO 10 HG2 PRO 10 31.311 -10.615 5.333 15 HG3 PRO 10 HG1 PRO 10 29.995 -9.430 5.342 16 HD2 PRO 10 HD2 PRO 10 30.332 -11.282 3.350 17 HD3 PRO 10 HD1 PRO 10 29.550 -9.708 3.093 18 H LEU 11 HN LEU 11 34.589 -8.067 4.597 19 HA LEU 11 HA LEU 11 36.388 -10.160 3.561 20 HB2 LEU 11 HB2 LEU 11 36.656 -7.546 4.974 21 HB3 LEU 11 HB1 LEU 11 37.957 -8.704 5.184 22 HG LEU 11 HG LEU 11 36.876 -8.071 2.445 23 HD11 LEU 11 HD11 LEU 11 38.231 -6.244 4.188 24 HD12 LEU 11 HD12 LEU 11 37.749 -6.005 2.509 25 HD13 LEU 11 HD13 LEU 11 39.328 -6.693 2.883 26 HD21 LEU 11 HD21 LEU 11 39.629 -8.944 3.372 27 HD22 LEU 11 HD22 LEU 11 39.043 -8.875 1.712 28 HD23 LEU 11 HD23 LEU 11 38.375 -10.059 2.834 29 HA PRO 12 HA PRO 12 37.302 -12.923 6.987 30 HB2 PRO 12 HB2 PRO 12 38.500 -10.630 8.514 31 HB3 PRO 12 HB1 PRO 12 39.062 -12.309 8.387 32 HG2 PRO 12 HG2 PRO 12 39.978 -10.188 6.856 33 HG3 PRO 12 HG1 PRO 12 40.173 -11.902 6.465 34 HD2 PRO 12 HD2 PRO 12 38.682 -10.020 4.971 35 HD3 PRO 12 HD1 PRO 12 38.639 -11.779 4.769 36 H ASP 13 HN ASP 13 35.618 -9.935 7.475 37 HA ASP 13 HA ASP 13 33.422 -10.000 8.559 38 HB2 ASP 13 HB2 ASP 13 33.858 -12.395 9.286 39 HB3 ASP 13 HB1 ASP 13 34.738 -11.729 10.665 40 H GLY 14 HN GLY 14 33.313 -7.964 9.285 41 HA2 GLY 14 HA2 GLY 14 33.448 -6.541 11.314 42 HA3 GLY 14 HA1 GLY 14 35.058 -7.209 11.591 43 H TRP 15 HN TRP 15 35.102 -6.930 8.389 44 HA TRP 15 HA TRP 15 35.394 -4.037 8.142 45 HB2 TRP 15 HB2 TRP 15 37.710 -3.896 7.926 46 HB3 TRP 15 HB1 TRP 15 37.511 -5.006 9.276 47 HD1 TRP 15 HD1 TRP 15 37.483 -7.745 8.423 48 HE1 TRP 15 HE1 TRP 15 39.142 -8.829 6.783 49 HE3 TRP 15 HE3 TRP 15 39.215 -3.578 6.033 50 HZ2 TRP 15 HZ2 TRP 15 40.968 -8.039 4.726 51 HZ3 TRP 15 HZ3 TRP 15 40.910 -3.772 4.239 52 HH2 TRP 15 HH2 TRP 15 41.790 -5.996 3.582 53 H GLU 16 HN GLU 16 36.178 -3.442 5.900 54 HA GLU 16 HA GLU 16 36.004 -5.567 3.875 55 HB2 GLU 16 HB2 GLU 16 33.720 -3.826 4.563 56 HB3 GLU 16 HB1 GLU 16 34.095 -3.908 2.841 57 HG2 GLU 16 HG2 GLU 16 34.121 -6.421 3.051 58 HG3 GLU 16 HG1 GLU 16 33.516 -6.231 4.697 59 H GLN 17 HN GLN 17 36.751 -4.849 1.826 60 HA GLN 17 HA GLN 17 38.219 -2.288 1.907 61 HB2 GLN 17 HB2 GLN 17 39.680 -3.840 1.023 62 HB3 GLN 17 HB1 GLN 17 38.385 -4.807 0.319 63 HG2 GLN 17 HG2 GLN 17 38.075 -3.192 -1.470 64 HG3 GLN 17 HG1 GLN 17 39.238 -2.092 -0.726 65 HE21 GLN 17 HE21 GLN 17 41.262 -2.216 -1.699 66 HE22 GLN 17 HE22 GLN 17 41.927 -3.611 -2.400 67 H ALA 18 HN ALA 18 37.438 -0.501 0.851 68 HA ALA 18 HA ALA 18 35.563 -0.896 -1.407 69 HB1 ALA 18 HB1 ALA 18 34.980 0.697 1.097 70 HB2 ALA 18 HB2 ALA 18 34.041 -0.638 0.428 71 HB3 ALA 18 HB3 ALA 18 34.085 0.915 -0.407 72 H MET 19 HN MET 19 34.906 1.679 -1.962 73 HA MET 19 HA MET 19 37.525 3.083 -2.163 74 HB2 MET 19 HB2 MET 19 36.798 3.861 -4.413 75 HB3 MET 19 HB1 MET 19 36.966 2.107 -4.333 76 HG2 MET 19 HG2 MET 19 34.333 3.534 -3.891 77 HG3 MET 19 HG1 MET 19 34.847 2.926 -5.465 78 HE1 MET 19 HE1 MET 19 32.620 0.016 -5.155 79 HE2 MET 19 HE2 MET 19 33.700 0.892 -6.238 80 HE3 MET 19 HE3 MET 19 32.492 1.774 -5.306 81 H THR 20 HN THR 20 37.345 5.436 -2.298 82 HA THR 20 HA THR 20 35.044 6.432 -0.755 83 HB THR 20 HB THR 20 36.488 8.605 -0.943 84 HG1 THR 20 HG1 THR 20 38.573 6.801 -1.344 85 HG21 THR 20 HG21 THR 20 37.004 6.111 0.614 86 HG22 THR 20 HG22 THR 20 36.489 7.700 1.181 87 HG23 THR 20 HG23 THR 20 38.174 7.423 0.742 88 H GLN 21 HN GLN 21 35.037 9.106 -1.791 89 HA GLN 21 HA GLN 21 33.430 8.647 -4.205 90 HB2 GLN 21 HB2 GLN 21 34.140 11.345 -3.050 91 HB3 GLN 21 HB1 GLN 21 32.696 10.882 -3.951 92 HG2 GLN 21 HG2 GLN 21 32.676 9.156 -1.773 93 HG3 GLN 21 HG1 GLN 21 33.235 10.681 -1.084 94 HE21 GLN 21 HE21 GLN 21 30.652 9.663 -0.431 95 HE22 GLN 21 HE22 GLN 21 29.479 10.680 -1.117 96 H ASP 22 HN ASP 22 36.670 9.234 -3.505 97 HA ASP 22 HA ASP 22 37.119 10.404 -6.198 98 HB2 ASP 22 HB2 ASP 22 37.910 11.747 -4.199 99 HB3 ASP 22 HB1 ASP 22 39.040 10.435 -3.861 100 H GLY 23 HN GLY 23 36.818 7.564 -5.095 101 HA2 GLY 23 HA2 GLY 23 37.751 5.463 -5.537 102 HA3 GLY 23 HA1 GLY 23 38.512 6.241 -6.925 103 H GLU 24 HN GLU 24 38.965 6.740 -3.418 104 HA GLU 24 HA GLU 24 41.884 6.545 -3.851 105 HB2 GLU 24 HB2 GLU 24 40.506 7.207 -1.260 106 HB3 GLU 24 HB1 GLU 24 42.127 7.665 -1.785 107 HG2 GLU 24 HG2 GLU 24 40.579 8.743 -3.774 108 HG3 GLU 24 HG1 GLU 24 39.536 8.940 -2.365 109 H ILE 25 HN ILE 25 39.826 4.333 -3.667 110 HA ILE 25 HA ILE 25 39.490 2.296 -2.475 111 HB ILE 25 HB ILE 25 41.263 1.770 -4.062 112 HG12 ILE 25 HG12 ILE 25 42.372 -0.056 -2.790 113 HG13 ILE 25 HG11 ILE 25 41.808 0.674 -1.285 114 HG21 ILE 25 HG21 ILE 25 43.203 2.633 -1.896 115 HG22 ILE 25 HG22 ILE 25 42.823 3.586 -3.330 116 HG23 ILE 25 HG23 ILE 25 43.614 2.022 -3.497 117 HD11 ILE 25 HD11 ILE 25 40.419 -1.215 -2.728 118 HD12 ILE 25 HD12 ILE 25 39.682 0.288 -3.280 119 HD13 ILE 25 HD13 ILE 25 39.698 -0.107 -1.561 120 H TYR 26 HN TYR 26 38.881 2.385 -0.376 121 HA TYR 26 HA TYR 26 41.023 2.774 1.655 122 HB2 TYR 26 HB2 TYR 26 39.625 4.155 2.984 123 HB3 TYR 26 HB1 TYR 26 39.410 4.763 1.342 124 HD1 TYR 26 HD1 TYR 26 37.663 3.964 4.210 125 HD2 TYR 26 HD2 TYR 26 37.552 3.252 -0.020 126 HE1 TYR 26 HE1 TYR 26 35.230 3.487 4.354 127 HE2 TYR 26 HE2 TYR 26 35.123 2.777 0.122 128 HH TYR 26 HH TYR 26 33.226 3.637 2.617 129 H TYR 27 HN TYR 27 40.665 1.602 3.649 130 HA TYR 27 HA TYR 27 38.816 -0.720 3.296 131 HB2 TYR 27 HB2 TYR 27 41.264 -0.395 5.059 132 HB3 TYR 27 HB1 TYR 27 40.242 -1.828 5.017 133 HD1 TYR 27 HD1 TYR 27 42.971 -2.341 4.483 134 HD2 TYR 27 HD2 TYR 27 40.008 -0.823 1.765 135 HE1 TYR 27 HE1 TYR 27 44.272 -3.217 2.565 136 HE2 TYR 27 HE2 TYR 27 41.309 -1.696 -0.143 137 HH TYR 27 HH TYR 27 43.630 -3.958 0.094 138 H ILE 28 HN ILE 28 37.320 -1.182 4.933 139 HA ILE 28 HA ILE 28 37.166 0.846 7.103 140 HB ILE 28 HB ILE 28 35.293 1.491 6.054 141 HG12 ILE 28 HG12 ILE 28 33.276 0.200 6.585 142 HG13 ILE 28 HG11 ILE 28 34.257 -1.227 6.919 143 HG21 ILE 28 HG21 ILE 28 34.241 0.233 4.240 144 HG22 ILE 28 HG22 ILE 28 35.181 -1.197 4.664 145 HG23 ILE 28 HG23 ILE 28 35.992 0.235 4.030 146 HD11 ILE 28 HD11 ILE 28 35.392 0.808 8.475 147 HD12 ILE 28 HD12 ILE 28 34.391 -0.525 9.047 148 HD13 ILE 28 HD13 ILE 28 33.651 1.021 8.644 149 H ASN 29 HN ASN 29 37.062 0.051 9.141 150 HA ASN 29 HA ASN 29 36.671 -2.896 9.438 151 HB2 ASN 29 HB2 ASN 29 38.770 -1.438 10.289 152 HB3 ASN 29 HB1 ASN 29 37.718 -1.265 11.693 153 HD21 ASN 29 HD21 ASN 29 40.253 -2.894 11.398 154 HD22 ASN 29 HD22 ASN 29 39.807 -4.480 11.807 155 H HIS 30 HN HIS 30 34.518 -3.222 9.841 156 HA HIS 30 HA HIS 30 32.852 -1.346 11.260 157 HB2 HIS 30 HB2 HIS 30 32.418 -4.309 10.772 158 HB3 HIS 30 HB1 HIS 30 31.178 -3.145 11.240 159 HD1 HIS 30 HD1 HIS 30 30.840 -1.092 9.468 160 HD2 HIS 30 HD2 HIS 30 32.800 -4.480 8.027 161 HE1 HIS 30 HE1 HIS 30 30.763 -0.946 6.938 162 HE2 HIS 30 HE2 HIS 30 31.950 -3.004 6.053 163 H LYS 31 HN LYS 31 35.323 -3.232 12.386 164 HA LYS 31 HA LYS 31 34.039 -3.956 14.940 165 HB2 LYS 31 HB2 LYS 31 36.518 -4.682 13.518 166 HB3 LYS 31 HB1 LYS 31 36.707 -4.504 15.264 167 HG2 LYS 31 HG2 LYS 31 35.078 -6.162 15.724 168 HG3 LYS 31 HG1 LYS 31 34.435 -6.104 14.082 169 HD2 LYS 31 HD2 LYS 31 36.729 -6.918 13.303 170 HD3 LYS 31 HD1 LYS 31 37.076 -7.256 15.000 171 HE2 LYS 31 HE2 LYS 31 35.529 -8.817 13.131 172 HE3 LYS 31 HE1 LYS 31 36.007 -9.223 14.779 173 HZ1 LYS 31 HZ1 LYS 31 34.126 -7.853 15.563 174 HZ2 LYS 31 HZ2 LYS 31 33.637 -9.199 14.648 175 HZ3 LYS 31 HZ3 LYS 31 33.632 -7.649 13.953 176 H ASN 32 HN ASN 32 36.500 -1.750 13.678 177 HA ASN 32 HA ASN 32 36.626 -0.446 16.347 178 HB2 ASN 32 HB2 ASN 32 38.783 -1.159 15.271 179 HB3 ASN 32 HB1 ASN 32 38.444 -0.030 13.958 180 HD21 ASN 32 HD21 ASN 32 37.244 1.113 16.958 181 HD22 ASN 32 HD22 ASN 32 38.512 2.180 17.322 182 H LYS 33 HN LYS 33 34.800 -0.237 13.705 183 HA LYS 33 HA LYS 33 33.612 1.483 12.642 184 HB2 LYS 33 HB2 LYS 33 33.909 2.178 15.468 185 HB3 LYS 33 HB1 LYS 33 33.705 3.601 14.445 186 HG2 LYS 33 HG2 LYS 33 31.919 1.235 13.999 187 HG3 LYS 33 HG1 LYS 33 31.588 2.309 15.359 188 HD2 LYS 33 HD2 LYS 33 32.074 3.440 12.611 189 HD3 LYS 33 HD1 LYS 33 30.476 2.842 13.063 190 HE2 LYS 33 HE2 LYS 33 32.062 5.045 14.407 191 HE3 LYS 33 HE1 LYS 33 30.512 5.192 13.577 192 HZ1 LYS 33 HZ1 LYS 33 31.046 4.446 16.267 193 HZ2 LYS 33 HZ2 LYS 33 30.144 3.241 15.477 194 HZ3 LYS 33 HZ3 LYS 33 29.566 4.838 15.535 195 H THR 34 HN THR 34 36.405 1.342 12.014 196 HA THR 34 HA THR 34 36.848 4.168 11.263 197 HB THR 34 HB THR 34 39.406 3.187 11.827 198 HG1 THR 34 HG1 THR 34 38.282 1.560 13.063 199 HG21 THR 34 HG21 THR 34 39.407 4.928 13.519 200 HG22 THR 34 HG22 THR 34 37.643 4.934 13.558 201 HG23 THR 34 HG23 THR 34 38.496 5.491 12.117 202 H THR 35 HN THR 35 38.588 4.307 9.538 203 HA THR 35 HA THR 35 38.548 1.841 7.883 204 HB THR 35 HB THR 35 39.061 3.687 6.043 205 HG1 THR 35 HG1 THR 35 38.977 5.252 7.899 206 HG21 THR 35 HG21 THR 35 36.481 2.779 7.254 207 HG22 THR 35 HG22 THR 35 37.153 2.425 5.660 208 HG23 THR 35 HG23 THR 35 36.437 4.001 5.987 209 H SER 36 HN SER 36 40.472 1.766 6.327 210 HA SER 36 HA SER 36 42.884 3.190 7.128 211 HB2 SER 36 HB2 SER 36 42.588 1.456 8.952 212 HB3 SER 36 HB1 SER 36 42.807 0.222 7.715 213 HG SER 36 HG SER 36 44.622 2.107 8.733 214 H TRP 37 HN TRP 37 44.860 1.720 6.117 215 HA TRP 37 HA TRP 37 43.930 0.917 3.388 216 HB2 TRP 37 HB2 TRP 37 46.672 2.047 3.843 217 HB3 TRP 37 HB1 TRP 37 45.679 2.084 2.386 218 HD1 TRP 37 HD1 TRP 37 46.482 4.022 5.492 219 HE1 TRP 37 HE1 TRP 37 45.125 6.215 5.527 220 HE3 TRP 37 HE3 TRP 37 43.264 3.124 1.630 221 HZ2 TRP 37 HZ2 TRP 37 42.956 7.424 4.101 222 HZ3 TRP 37 HZ3 TRP 37 41.566 4.810 0.991 223 HH2 TRP 37 HH2 TRP 37 41.406 6.957 2.220 224 H LEU 38 HN LEU 38 45.906 0.229 6.159 225 HA LEU 38 HA LEU 38 47.882 -1.473 5.436 226 HB2 LEU 38 HB2 LEU 38 45.884 -1.539 7.607 227 HB3 LEU 38 HB1 LEU 38 46.649 -3.093 7.270 228 HG LEU 38 HG LEU 38 47.892 -1.722 8.963 229 HD11 LEU 38 HD11 LEU 38 48.865 -3.205 6.815 230 HD12 LEU 38 HD12 LEU 38 49.786 -2.722 8.240 231 HD13 LEU 38 HD13 LEU 38 49.834 -1.731 6.782 232 HD21 LEU 38 HD21 LEU 38 48.694 0.385 8.496 233 HD22 LEU 38 HD22 LEU 38 47.296 0.404 7.420 234 HD23 LEU 38 HD23 LEU 38 48.898 0.039 6.779 235 H ASP 39 HN ASP 39 48.096 -3.632 4.680 236 HA ASP 39 HA ASP 39 45.644 -4.722 3.388 237 HB2 ASP 39 HB2 ASP 39 47.429 -5.871 1.871 238 HB3 ASP 39 HB1 ASP 39 47.066 -4.165 1.605 239 HA PRO 40 HA PRO 40 46.654 -8.020 6.304 240 HB2 PRO 40 HB2 PRO 40 44.232 -9.268 6.156 241 HB3 PRO 40 HB1 PRO 40 44.515 -7.817 7.132 242 HG2 PRO 40 HG2 PRO 40 43.155 -8.102 4.522 243 HG3 PRO 40 HG1 PRO 40 42.847 -6.968 5.845 244 HD2 PRO 40 HD2 PRO 40 44.225 -6.359 3.490 245 HD3 PRO 40 HD1 PRO 40 44.284 -5.410 4.989 246 H ARG 41 HN ARG 41 44.366 -9.310 3.900 247 HA ARG 41 HA ARG 41 46.541 -11.070 2.888 248 HB2 ARG 41 HB2 ARG 41 44.235 -12.606 2.680 249 HB3 ARG 41 HB1 ARG 41 45.502 -12.814 3.887 250 HG2 ARG 41 HG2 ARG 41 44.164 -12.071 5.547 251 HG3 ARG 41 HG1 ARG 41 43.667 -10.664 4.610 252 HD2 ARG 41 HD2 ARG 41 42.571 -13.330 3.823 253 HD3 ARG 41 HD1 ARG 41 41.914 -12.544 5.259 254 HE ARG 41 HE ARG 41 41.738 -10.508 3.523 255 HH11 ARG 41 HH11 ARG 41 40.177 -10.197 1.918 256 HH12 ARG 41 HH12 ARG 41 39.393 -11.570 1.211 257 HH21 ARG 41 HH21 ARG 41 41.133 -13.880 3.123 258 HH22 ARG 41 HH22 ARG 41 39.934 -13.655 1.894 259 H LEU 42 HN LEU 42 45.365 -8.622 1.794 260 HA LEU 42 HA LEU 42 44.689 -9.681 -0.860 261 HB2 LEU 42 HB2 LEU 42 42.472 -9.569 0.095 262 HB3 LEU 42 HB1 LEU 42 42.780 -7.958 0.741 263 HG LEU 42 HG LEU 42 43.327 -7.970 -2.088 264 HD11 LEU 42 HD11 LEU 42 41.796 -9.790 -2.358 265 HD12 LEU 42 HD12 LEU 42 40.895 -8.330 -2.770 266 HD13 LEU 42 HD13 LEU 42 40.663 -9.097 -1.199 267 HD21 LEU 42 HD21 LEU 42 40.973 -6.657 -0.737 268 HD22 LEU 42 HD22 LEU 42 41.985 -6.037 -2.041 269 HD23 LEU 42 HD23 LEU 42 42.615 -6.110 -0.396 270 H ASP 43 HN ASP 43 46.676 -8.648 -1.453 271 HA ASP 43 HA ASP 43 46.574 -5.658 -1.363 272 HB2 ASP 43 HB2 ASP 43 49.187 -6.228 -1.913 273 HB3 ASP 43 HB1 ASP 43 48.561 -5.962 -0.286 274 HA PRO 44 HA PRO 44 46.297 -6.785 -5.799 275 HB2 PRO 44 HB2 PRO 44 44.504 -4.858 -6.473 276 HB3 PRO 44 HB1 PRO 44 44.020 -6.402 -5.746 277 HG2 PRO 44 HG2 PRO 44 44.244 -3.716 -4.510 278 HG3 PRO 44 HG1 PRO 44 43.095 -5.023 -4.181 279 HD2 PRO 44 HD2 PRO 44 45.332 -4.431 -2.619 280 HD3 PRO 44 HD1 PRO 44 44.458 -5.977 -2.606 281 H ARG 45 HN ARG 45 48.407 -5.166 -4.611 282 HA ARG 45 HA ARG 45 49.746 -3.247 -5.062 283 HB2 ARG 45 HB2 ARG 45 49.298 -4.833 -7.556 284 HB3 ARG 45 HB1 ARG 45 50.145 -3.292 -7.701 285 HG2 ARG 45 HG2 ARG 45 51.911 -3.983 -6.323 286 HG3 ARG 45 HG1 ARG 45 50.954 -5.263 -5.577 287 HD2 ARG 45 HD2 ARG 45 50.872 -6.312 -7.938 288 HD3 ARG 45 HD1 ARG 45 52.194 -5.213 -8.327 289 HE ARG 45 HE ARG 45 52.372 -7.569 -6.605 290 HH11 ARG 45 HH11 ARG 45 54.439 -8.018 -5.809 291 HH12 ARG 45 HH12 ARG 45 55.675 -6.810 -5.919 292 HH21 ARG 45 HH21 ARG 45 53.626 -4.474 -7.459 293 HH22 ARG 45 HH22 ARG 45 55.215 -4.803 -6.853 294 H GLY 46 HN GLY 46 48.380 -2.883 -8.223 295 HA2 GLY 46 HA2 GLY 46 46.807 -1.303 -9.055 296 HA3 GLY 46 HA1 GLY 46 46.509 -0.768 -7.399 297 H GLY 47 HN GLY 47 47.989 0.753 -6.445 298 HA2 GLY 47 HA2 GLY 47 49.826 2.069 -8.406 299 HA3 GLY 47 HA1 GLY 47 48.759 3.019 -7.371 300 H GLY 48 HN GLY 48 49.004 2.336 -4.923 301 HA2 GLY 48 HA2 GLY 48 50.548 1.582 -3.178 302 HA3 GLY 48 HA1 GLY 48 51.876 1.801 -4.318 303 H GLY 49 HN GLY 49 52.572 3.042 -2.208 304 HA2 GLY 49 HA2 GLY 49 53.269 5.525 -2.356 305 HA3 GLY 49 HA1 GLY 49 51.533 5.841 -2.336 306 H ASN 50 HN ASN 50 52.003 7.078 -0.335 307 HA ASN 50 HA ASN 50 52.498 5.321 2.029 308 HB2 ASN 50 HB2 ASN 50 53.707 7.691 1.370 309 HB3 ASN 50 HB1 ASN 50 52.414 8.244 2.437 310 HD21 ASN 50 HD21 ASN 50 55.071 8.465 3.336 311 HD22 ASN 50 HD22 ASN 50 55.346 7.337 4.574 312 H ARG 51 HN ARG 51 50.152 7.335 0.448 313 HA ARG 51 HA ARG 51 47.978 7.986 1.079 314 HB2 ARG 51 HB2 ARG 51 48.293 5.208 1.333 315 HB3 ARG 51 HB1 ARG 51 47.462 5.706 2.808 316 HG2 ARG 51 HG2 ARG 51 45.728 5.302 1.229 317 HG3 ARG 51 HG1 ARG 51 45.899 7.057 1.285 318 HD2 ARG 51 HD2 ARG 51 45.757 6.079 -1.049 319 HD3 ARG 51 HD1 ARG 51 47.178 7.078 -0.751 320 HE ARG 51 HE ARG 51 47.181 4.106 -0.938 321 HH11 ARG 51 HH11 ARG 51 49.216 3.266 -1.444 322 HH12 ARG 51 HH12 ARG 51 50.587 4.322 -1.492 323 HH21 ARG 51 HH21 ARG 51 48.774 7.156 -0.663 324 HH22 ARG 51 HH22 ARG 51 50.337 6.522 -1.050 325 H GLN 52 HN GLN 52 48.274 9.757 2.453 326 HA GLN 52 HA GLN 52 49.332 9.903 4.999 327 HB2 GLN 52 HB2 GLN 52 46.795 11.340 4.908 328 HB3 GLN 52 HB1 GLN 52 48.438 11.978 4.977 329 HG2 GLN 52 HG2 GLN 52 47.057 10.968 2.473 330 HG3 GLN 52 HG1 GLN 52 47.296 12.665 2.891 331 HE21 GLN 52 HE21 GLN 52 49.862 12.922 3.667 332 HE22 GLN 52 HE22 GLN 52 50.948 12.335 2.502 333 HA PRO 53 HA PRO 53 47.016 7.765 8.057 334 HB2 PRO 53 HB2 PRO 53 45.889 10.312 9.126 335 HB3 PRO 53 HB1 PRO 53 46.789 9.037 9.967 336 HG2 PRO 53 HG2 PRO 53 47.914 11.376 9.337 337 HG3 PRO 53 HG1 PRO 53 48.825 9.857 9.322 338 HD2 PRO 53 HD2 PRO 53 47.848 11.484 7.025 339 HD3 PRO 53 HD1 PRO 53 49.260 10.410 7.130 340 HA PRO 54 HA PRO 54 42.928 7.515 6.279 341 HB2 PRO 54 HB2 PRO 54 41.993 5.443 7.768 342 HB3 PRO 54 HB1 PRO 54 43.194 5.233 6.478 343 HG2 PRO 54 HG2 PRO 54 43.579 5.335 9.426 344 HG3 PRO 54 HG1 PRO 54 44.380 4.319 8.216 345 HD2 PRO 54 HD2 PRO 54 45.515 6.586 9.306 346 HD3 PRO 54 HD1 PRO 54 45.949 5.924 7.715 347 HA PRO 55 HA PRO 55 40.932 10.159 9.421 348 HB2 PRO 55 HB2 PRO 55 38.913 10.460 7.280 349 HB3 PRO 55 HB1 PRO 55 39.846 11.704 8.129 350 HG2 PRO 55 HG2 PRO 55 40.319 11.027 5.571 351 HG3 PRO 55 HG1 PRO 55 41.591 11.585 6.670 352 HD2 PRO 55 HD2 PRO 55 41.019 8.816 5.702 353 HD3 PRO 55 HD1 PRO 55 42.573 9.573 6.117 354 HA PRO 56 HA PRO 56 37.767 7.486 10.951 355 HB2 PRO 56 HB2 PRO 56 35.891 9.276 11.881 356 HB3 PRO 56 HB1 PRO 56 37.400 8.888 12.726 357 HG2 PRO 56 HG2 PRO 56 36.718 11.243 11.051 358 HG3 PRO 56 HG1 PRO 56 37.725 11.139 12.506 359 HD2 PRO 56 HD2 PRO 56 38.763 11.329 9.974 360 HD3 PRO 56 HD1 PRO 56 39.612 10.535 11.319 361 H TYR 57 HN TYR 57 36.558 6.328 9.503 362 HA TYR 57 HA TYR 57 34.990 7.610 7.424 363 HB2 TYR 57 HB2 TYR 57 34.984 5.546 6.502 364 HB3 TYR 57 HB1 TYR 57 36.067 5.083 7.815 365 HD1 TYR 57 HD1 TYR 57 32.828 4.611 6.333 366 HD2 TYR 57 HD2 TYR 57 35.013 4.264 10.015 367 HE1 TYR 57 HE1 TYR 57 31.093 3.077 7.218 368 HE2 TYR 57 HE2 TYR 57 33.278 2.731 10.899 369 HH TYR 57 HH TYR 57 31.551 1.188 9.986 370 HA PRO 58 HA PRO 58 31.439 8.115 10.116 371 HB2 PRO 58 HB2 PRO 58 29.849 9.384 8.309 372 HB3 PRO 58 HB1 PRO 58 31.198 10.190 9.131 373 HG2 PRO 58 HG2 PRO 58 31.039 9.109 6.369 374 HG3 PRO 58 HG1 PRO 58 31.857 10.560 6.972 375 HD2 PRO 58 HD2 PRO 58 33.142 8.171 6.403 376 HD3 PRO 58 HD1 PRO 58 33.770 9.410 7.512 377 H LEU 59 HN LEU 59 30.131 6.380 10.533 378 HA LEU 59 HA LEU 59 29.202 4.656 8.347 379 HB2 LEU 59 HB2 LEU 59 29.921 3.615 10.441 380 HB3 LEU 59 HB1 LEU 59 28.725 4.547 11.340 381 HG LEU 59 HG LEU 59 27.474 3.151 9.128 382 HD11 LEU 59 HD11 LEU 59 29.276 1.600 10.970 383 HD12 LEU 59 HD12 LEU 59 29.011 1.390 9.239 384 HD13 LEU 59 HD13 LEU 59 27.778 0.871 10.390 385 HD21 LEU 59 HD21 LEU 59 27.081 2.577 12.059 386 HD22 LEU 59 HD22 LEU 59 25.878 2.629 10.771 387 HD23 LEU 59 HD23 LEU 59 26.578 4.127 11.386 388 H THR 60 HN THR 60 26.966 4.311 7.846 389 HA THR 60 HA THR 60 25.314 6.518 7.573 390 HB THR 60 HB THR 60 23.387 4.850 7.567 391 HG1 THR 60 HG1 THR 60 23.802 2.813 8.069 392 HG21 THR 60 HG21 THR 60 25.602 3.712 5.919 393 HG22 THR 60 HG22 THR 60 25.176 5.405 5.672 394 HG23 THR 60 HG23 THR 60 23.960 4.149 5.445 395 H ALA 61 HN ALA 61 23.018 6.631 8.754 396 HA ALA 61 HA ALA 61 23.374 6.269 11.687 397 HB1 ALA 61 HB1 ALA 61 23.753 8.485 11.927 398 HB2 ALA 61 HB2 ALA 61 22.069 8.722 11.458 399 HB3 ALA 61 HB3 ALA 61 23.344 8.808 10.243 Start of MODEL 7 1 H1 SER 8 HT1 SER 8 29.455 -11.123 -3.592 2 H2 SER 8 HT2 SER 8 30.026 -9.587 -4.043 3 H3 SER 8 HT3 SER 8 29.485 -9.863 -2.457 4 HA SER 8 HA SER 8 31.673 -11.526 -3.458 5 HB2 SER 8 HB2 SER 8 33.159 -9.588 -2.451 6 HB3 SER 8 HB1 SER 8 32.654 -9.530 -4.139 7 HG SER 8 HG SER 8 31.164 -8.378 -2.020 8 H GLY 9 HN GLY 9 30.292 -9.455 -0.900 9 HA2 GLY 9 HA2 GLY 9 29.766 -10.284 1.309 10 HA3 GLY 9 HA1 GLY 9 30.889 -11.619 1.044 11 HA PRO 10 HA PRO 10 32.922 -7.980 3.338 12 HB2 PRO 10 HB2 PRO 10 32.906 -9.007 5.873 13 HB3 PRO 10 HB1 PRO 10 31.609 -7.981 5.231 14 HG2 PRO 10 HG2 PRO 10 31.698 -10.932 5.565 15 HG3 PRO 10 HG1 PRO 10 30.347 -9.808 5.786 16 HD2 PRO 10 HD2 PRO 10 30.668 -11.386 3.549 17 HD3 PRO 10 HD1 PRO 10 29.778 -9.848 3.554 18 H LEU 11 HN LEU 11 35.004 -8.215 4.745 19 HA LEU 11 HA LEU 11 36.611 -10.381 3.576 20 HB2 LEU 11 HB2 LEU 11 37.046 -7.744 4.655 21 HB3 LEU 11 HB1 LEU 11 38.119 -8.882 5.453 22 HG LEU 11 HG LEU 11 38.580 -9.760 3.027 23 HD11 LEU 11 HD11 LEU 11 38.043 -8.384 1.241 24 HD12 LEU 11 HD12 LEU 11 37.960 -6.937 2.246 25 HD13 LEU 11 HD13 LEU 11 36.643 -8.110 2.278 26 HD21 LEU 11 HD21 LEU 11 40.156 -8.475 4.540 27 HD22 LEU 11 HD22 LEU 11 39.589 -6.998 3.759 28 HD23 LEU 11 HD23 LEU 11 40.430 -8.229 2.817 29 HA PRO 12 HA PRO 12 37.705 -13.189 6.947 30 HB2 PRO 12 HB2 PRO 12 38.791 -10.812 8.452 31 HB3 PRO 12 HB1 PRO 12 39.377 -12.490 8.458 32 HG2 PRO 12 HG2 PRO 12 40.405 -10.527 6.855 33 HG3 PRO 12 HG1 PRO 12 40.465 -12.254 6.472 34 HD2 PRO 12 HD2 PRO 12 39.056 -10.227 5.030 35 HD3 PRO 12 HD1 PRO 12 39.008 -11.971 4.731 36 H ASP 13 HN ASP 13 36.578 -10.009 8.126 37 HA ASP 13 HA ASP 13 34.044 -10.373 8.827 38 HB2 ASP 13 HB2 ASP 13 34.155 -12.475 9.842 39 HB3 ASP 13 HB1 ASP 13 35.700 -12.126 10.623 40 H GLY 14 HN GLY 14 33.744 -8.282 9.326 41 HA2 GLY 14 HA2 GLY 14 33.644 -6.636 11.139 42 HA3 GLY 14 HA1 GLY 14 35.225 -7.203 11.676 43 H TRP 15 HN TRP 15 35.434 -7.115 8.370 44 HA TRP 15 HA TRP 15 35.781 -4.241 8.045 45 HB2 TRP 15 HB2 TRP 15 38.039 -4.017 8.262 46 HB3 TRP 15 HB1 TRP 15 37.818 -5.359 9.378 47 HD1 TRP 15 HD1 TRP 15 37.880 -7.889 7.885 48 HE1 TRP 15 HE1 TRP 15 39.777 -8.575 6.283 49 HE3 TRP 15 HE3 TRP 15 39.853 -3.300 6.838 50 HZ2 TRP 15 HZ2 TRP 15 41.871 -7.335 4.758 51 HZ3 TRP 15 HZ3 TRP 15 41.793 -3.083 5.320 52 HH2 TRP 15 HH2 TRP 15 42.803 -5.087 4.275 53 H GLU 16 HN GLU 16 36.787 -3.712 5.868 54 HA GLU 16 HA GLU 16 36.980 -5.845 3.897 55 HB2 GLU 16 HB2 GLU 16 34.396 -5.164 4.514 56 HB3 GLU 16 HB1 GLU 16 34.736 -4.097 3.150 57 HG2 GLU 16 HG2 GLU 16 35.673 -6.170 1.963 58 HG3 GLU 16 HG1 GLU 16 34.900 -7.113 3.238 59 H GLN 17 HN GLN 17 37.103 -4.856 1.622 60 HA GLN 17 HA GLN 17 38.654 -2.347 1.818 61 HB2 GLN 17 HB2 GLN 17 39.869 -3.900 0.558 62 HB3 GLN 17 HB1 GLN 17 38.422 -4.545 -0.218 63 HG2 GLN 17 HG2 GLN 17 38.257 -2.746 -1.707 64 HG3 GLN 17 HG1 GLN 17 39.220 -1.683 -0.680 65 HE21 GLN 17 HE21 GLN 17 41.607 -2.249 -0.505 66 HE22 GLN 17 HE22 GLN 17 42.359 -3.001 -1.828 67 H ALA 18 HN ALA 18 38.088 -0.487 0.593 68 HA ALA 18 HA ALA 18 35.645 -0.570 -1.048 69 HB1 ALA 18 HB1 ALA 18 35.009 1.611 0.421 70 HB2 ALA 18 HB2 ALA 18 35.799 0.638 1.661 71 HB3 ALA 18 HB3 ALA 18 34.403 -0.003 0.794 72 H MET 19 HN MET 19 35.218 2.080 -1.462 73 HA MET 19 HA MET 19 37.869 3.259 -2.100 74 HB2 MET 19 HB2 MET 19 37.352 3.612 -4.361 75 HB3 MET 19 HB1 MET 19 36.697 2.000 -4.069 76 HG2 MET 19 HG2 MET 19 34.515 3.311 -3.416 77 HG3 MET 19 HG1 MET 19 35.238 4.609 -4.367 78 HE1 MET 19 HE1 MET 19 32.691 1.914 -4.670 79 HE2 MET 19 HE2 MET 19 34.123 1.069 -4.088 80 HE3 MET 19 HE3 MET 19 33.452 0.664 -5.665 81 H THR 20 HN THR 20 37.858 5.558 -2.154 82 HA THR 20 HA THR 20 35.655 6.775 -0.649 83 HB THR 20 HB THR 20 37.232 8.861 -1.105 84 HG1 THR 20 HG1 THR 20 38.504 6.756 -2.245 85 HG21 THR 20 HG21 THR 20 38.668 6.963 0.616 86 HG22 THR 20 HG22 THR 20 36.943 7.062 0.962 87 HG23 THR 20 HG23 THR 20 37.938 8.516 1.021 88 H GLN 21 HN GLN 21 35.677 9.371 -1.777 89 HA GLN 21 HA GLN 21 33.978 8.903 -4.122 90 HB2 GLN 21 HB2 GLN 21 34.354 11.652 -3.881 91 HB3 GLN 21 HB1 GLN 21 33.025 10.730 -3.179 92 HG2 GLN 21 HG2 GLN 21 34.159 10.497 -1.092 93 HG3 GLN 21 HG1 GLN 21 35.685 11.053 -1.780 94 HE21 GLN 21 HE21 GLN 21 33.382 12.977 -3.198 95 HE22 GLN 21 HE22 GLN 21 33.383 14.275 -2.104 96 H ASP 22 HN ASP 22 37.251 9.505 -3.488 97 HA ASP 22 HA ASP 22 37.693 10.440 -6.272 98 HB2 ASP 22 HB2 ASP 22 38.498 11.929 -4.380 99 HB3 ASP 22 HB1 ASP 22 39.625 10.641 -3.952 100 H GLY 23 HN GLY 23 37.369 7.706 -4.940 101 HA2 GLY 23 HA2 GLY 23 38.271 5.566 -5.221 102 HA3 GLY 23 HA1 GLY 23 39.070 6.228 -6.647 103 H GLU 24 HN GLU 24 39.489 7.077 -3.208 104 HA GLU 24 HA GLU 24 42.398 6.887 -3.550 105 HB2 GLU 24 HB2 GLU 24 40.892 7.429 -0.993 106 HB3 GLU 24 HB1 GLU 24 42.546 7.893 -1.393 107 HG2 GLU 24 HG2 GLU 24 41.110 9.034 -3.444 108 HG3 GLU 24 HG1 GLU 24 40.016 9.220 -2.075 109 H ILE 25 HN ILE 25 40.386 4.616 -3.469 110 HA ILE 25 HA ILE 25 40.132 2.495 -2.439 111 HB ILE 25 HB ILE 25 41.990 2.072 -3.912 112 HG12 ILE 25 HG12 ILE 25 43.300 0.414 -2.541 113 HG13 ILE 25 HG11 ILE 25 42.505 1.053 -1.102 114 HG21 ILE 25 HG21 ILE 25 43.403 3.968 -3.330 115 HG22 ILE 25 HG22 ILE 25 44.329 2.481 -3.148 116 HG23 ILE 25 HG23 ILE 25 43.693 3.300 -1.726 117 HD11 ILE 25 HD11 ILE 25 40.630 -0.122 -1.523 118 HD12 ILE 25 HD12 ILE 25 41.530 -0.965 -2.783 119 HD13 ILE 25 HD13 ILE 25 40.571 0.460 -3.187 120 H TYR 26 HN TYR 26 39.378 2.510 -0.385 121 HA TYR 26 HA TYR 26 41.377 2.799 1.796 122 HB2 TYR 26 HB2 TYR 26 39.980 4.201 3.067 123 HB3 TYR 26 HB1 TYR 26 39.789 4.831 1.433 124 HD1 TYR 26 HD1 TYR 26 38.281 2.341 3.795 125 HD2 TYR 26 HD2 TYR 26 37.643 5.032 0.511 126 HE1 TYR 26 HE1 TYR 26 35.837 1.911 3.916 127 HE2 TYR 26 HE2 TYR 26 35.203 4.600 0.637 128 HH TYR 26 HH TYR 26 33.879 2.124 2.745 129 H TYR 27 HN TYR 27 40.794 1.599 3.747 130 HA TYR 27 HA TYR 27 38.930 -0.652 3.132 131 HB2 TYR 27 HB2 TYR 27 41.257 -0.570 5.074 132 HB3 TYR 27 HB1 TYR 27 40.213 -1.961 4.771 133 HD1 TYR 27 HD1 TYR 27 40.970 -3.544 3.242 134 HD2 TYR 27 HD2 TYR 27 42.209 0.543 2.808 135 HE1 TYR 27 HE1 TYR 27 42.369 -4.175 1.297 136 HE2 TYR 27 HE2 TYR 27 43.608 -0.085 0.864 137 HH TYR 27 HH TYR 27 44.185 -1.715 -0.535 138 H ILE 28 HN ILE 28 37.578 -1.397 4.898 139 HA ILE 28 HA ILE 28 37.127 0.684 6.970 140 HB ILE 28 HB ILE 28 35.232 1.079 5.859 141 HG12 ILE 28 HG12 ILE 28 33.364 -0.462 6.282 142 HG13 ILE 28 HG11 ILE 28 34.504 -1.738 6.712 143 HG21 ILE 28 HG21 ILE 28 36.216 -0.147 3.900 144 HG22 ILE 28 HG22 ILE 28 34.458 -0.243 3.983 145 HG23 ILE 28 HG23 ILE 28 35.441 -1.615 4.495 146 HD11 ILE 28 HD11 ILE 28 33.463 0.369 8.358 147 HD12 ILE 28 HD12 ILE 28 35.216 0.529 8.243 148 HD13 ILE 28 HD13 ILE 28 34.499 -0.977 8.813 149 H ASN 29 HN ASN 29 36.801 -0.027 9.043 150 HA ASN 29 HA ASN 29 36.776 -2.993 9.450 151 HB2 ASN 29 HB2 ASN 29 38.696 -1.302 10.313 152 HB3 ASN 29 HB1 ASN 29 37.579 -1.192 11.673 153 HD21 ASN 29 HD21 ASN 29 36.572 -3.966 11.359 154 HD22 ASN 29 HD22 ASN 29 37.828 -4.987 11.875 155 H HIS 30 HN HIS 30 34.642 -3.488 9.780 156 HA HIS 30 HA HIS 30 32.749 -1.719 11.021 157 HB2 HIS 30 HB2 HIS 30 32.620 -4.736 10.743 158 HB3 HIS 30 HB1 HIS 30 31.257 -3.660 11.046 159 HD1 HIS 30 HD1 HIS 30 30.978 -1.705 9.093 160 HD2 HIS 30 HD2 HIS 30 33.049 -5.171 8.044 161 HE1 HIS 30 HE1 HIS 30 31.006 -1.786 6.559 162 HE2 HIS 30 HE2 HIS 30 32.262 -3.893 5.912 163 H LYS 31 HN LYS 31 35.354 -3.147 12.395 164 HA LYS 31 HA LYS 31 34.085 -4.007 14.898 165 HB2 LYS 31 HB2 LYS 31 36.723 -4.220 13.663 166 HB3 LYS 31 HB1 LYS 31 36.818 -3.775 15.368 167 HG2 LYS 31 HG2 LYS 31 35.039 -6.026 14.434 168 HG3 LYS 31 HG1 LYS 31 36.742 -6.296 14.805 169 HD2 LYS 31 HD2 LYS 31 36.326 -6.283 17.016 170 HD3 LYS 31 HD1 LYS 31 35.500 -4.729 16.895 171 HE2 LYS 31 HE2 LYS 31 34.129 -7.262 16.016 172 HE3 LYS 31 HE1 LYS 31 34.132 -6.785 17.714 173 HZ1 LYS 31 HZ1 LYS 31 33.475 -4.493 16.460 174 HZ2 LYS 31 HZ2 LYS 31 32.361 -5.575 17.147 175 HZ3 LYS 31 HZ3 LYS 31 32.704 -5.647 15.485 176 H ASN 32 HN ASN 32 36.146 -1.346 13.774 177 HA ASN 32 HA ASN 32 35.424 0.127 16.262 178 HB2 ASN 32 HB2 ASN 32 37.839 -0.296 16.097 179 HB3 ASN 32 HB1 ASN 32 37.868 0.437 14.494 180 HD21 ASN 32 HD21 ASN 32 35.651 1.988 16.615 181 HD22 ASN 32 HD22 ASN 32 36.627 3.313 17.030 182 H LYS 33 HN LYS 33 34.067 -0.096 13.537 183 HA LYS 33 HA LYS 33 33.167 1.336 11.893 184 HB2 LYS 33 HB2 LYS 33 32.074 3.304 12.862 185 HB3 LYS 33 HB1 LYS 33 31.883 1.922 13.940 186 HG2 LYS 33 HG2 LYS 33 33.607 2.715 15.408 187 HG3 LYS 33 HG1 LYS 33 34.111 3.949 14.251 188 HD2 LYS 33 HD2 LYS 33 32.770 5.312 15.488 189 HD3 LYS 33 HD1 LYS 33 31.472 4.575 14.546 190 HE2 LYS 33 HE2 LYS 33 30.658 4.133 16.653 191 HE3 LYS 33 HE1 LYS 33 31.682 2.710 16.462 192 HZ1 LYS 33 HZ1 LYS 33 33.004 5.087 17.468 193 HZ2 LYS 33 HZ2 LYS 33 33.169 3.465 17.945 194 HZ3 LYS 33 HZ3 LYS 33 31.864 4.393 18.514 195 H THR 34 HN THR 34 35.968 1.347 11.812 196 HA THR 34 HA THR 34 36.462 4.162 10.987 197 HB THR 34 HB THR 34 38.951 3.171 11.787 198 HG1 THR 34 HG1 THR 34 38.548 2.471 13.894 199 HG21 THR 34 HG21 THR 34 38.436 4.785 13.785 200 HG22 THR 34 HG22 THR 34 36.946 5.108 12.899 201 HG23 THR 34 HG23 THR 34 38.507 5.432 12.146 202 H THR 35 HN THR 35 38.095 4.342 9.277 203 HA THR 35 HA THR 35 38.354 1.813 7.739 204 HB THR 35 HB THR 35 38.827 3.633 5.857 205 HG1 THR 35 HG1 THR 35 37.908 5.018 8.000 206 HG21 THR 35 HG21 THR 35 36.215 2.650 6.978 207 HG22 THR 35 HG22 THR 35 37.047 2.146 5.511 208 HG23 THR 35 HG23 THR 35 36.237 3.706 5.568 209 H SER 36 HN SER 36 40.366 1.666 6.397 210 HA SER 36 HA SER 36 42.630 3.356 7.140 211 HB2 SER 36 HB2 SER 36 43.104 2.219 9.051 212 HB3 SER 36 HB1 SER 36 42.103 0.844 8.592 213 HG SER 36 HG SER 36 44.765 1.168 8.382 214 H TRP 37 HN TRP 37 44.760 1.909 6.431 215 HA TRP 37 HA TRP 37 44.062 0.859 3.718 216 HB2 TRP 37 HB2 TRP 37 46.813 1.846 4.321 217 HB3 TRP 37 HB1 TRP 37 45.894 1.933 2.819 218 HD1 TRP 37 HD1 TRP 37 46.729 3.872 5.903 219 HE1 TRP 37 HE1 TRP 37 45.520 6.148 5.863 220 HE3 TRP 37 HE3 TRP 37 43.545 3.113 1.981 221 HZ2 TRP 37 HZ2 TRP 37 43.472 7.473 4.368 222 HZ3 TRP 37 HZ3 TRP 37 41.978 4.898 1.272 223 HH2 TRP 37 HH2 TRP 37 41.936 7.073 2.459 224 H LEU 38 HN LEU 38 44.632 -0.368 6.572 225 HA LEU 38 HA LEU 38 47.000 -1.944 6.345 226 HB2 LEU 38 HB2 LEU 38 44.622 -1.874 8.053 227 HB3 LEU 38 HB1 LEU 38 45.218 -3.512 7.788 228 HG LEU 38 HG LEU 38 47.395 -2.954 8.609 229 HD11 LEU 38 HD11 LEU 38 46.510 -0.234 7.930 230 HD12 LEU 38 HD12 LEU 38 48.140 -0.905 7.983 231 HD13 LEU 38 HD13 LEU 38 47.375 -0.331 9.464 232 HD21 LEU 38 HD21 LEU 38 45.187 -1.714 10.273 233 HD22 LEU 38 HD22 LEU 38 46.833 -1.922 10.873 234 HD23 LEU 38 HD23 LEU 38 45.873 -3.332 10.426 235 H ASP 39 HN ASP 39 47.427 -3.709 5.097 236 HA ASP 39 HA ASP 39 45.119 -5.055 3.776 237 HB2 ASP 39 HB2 ASP 39 47.882 -4.888 2.580 238 HB3 ASP 39 HB1 ASP 39 46.360 -5.265 1.772 239 HA PRO 40 HA PRO 40 47.247 -8.366 6.046 240 HB2 PRO 40 HB2 PRO 40 45.015 -9.770 6.674 241 HB3 PRO 40 HB1 PRO 40 45.502 -8.315 7.565 242 HG2 PRO 40 HG2 PRO 40 43.353 -8.676 5.569 243 HG3 PRO 40 HG1 PRO 40 43.444 -7.573 6.949 244 HD2 PRO 40 HD2 PRO 40 43.938 -6.904 4.245 245 HD3 PRO 40 HD1 PRO 40 44.310 -5.899 5.661 246 H ARG 41 HN ARG 41 44.538 -8.966 3.773 247 HA ARG 41 HA ARG 41 46.240 -10.932 2.367 248 HB2 ARG 41 HB2 ARG 41 44.689 -12.724 2.518 249 HB3 ARG 41 HB1 ARG 41 44.798 -12.091 4.161 250 HG2 ARG 41 HG2 ARG 41 42.810 -10.524 3.087 251 HG3 ARG 41 HG1 ARG 41 42.521 -12.074 2.295 252 HD2 ARG 41 HD2 ARG 41 41.320 -11.812 4.494 253 HD3 ARG 41 HD1 ARG 41 42.389 -13.214 4.423 254 HE ARG 41 HE ARG 41 43.544 -10.745 5.562 255 HH11 ARG 41 HH11 ARG 41 44.285 -10.987 7.685 256 HH12 ARG 41 HH12 ARG 41 43.889 -12.423 8.568 257 HH21 ARG 41 HH21 ARG 41 42.079 -13.840 5.972 258 HH22 ARG 41 HH22 ARG 41 42.641 -14.038 7.598 259 H LEU 42 HN LEU 42 45.831 -8.624 1.197 260 HA LEU 42 HA LEU 42 43.717 -9.183 -0.811 261 HB2 LEU 42 HB2 LEU 42 43.190 -7.341 1.026 262 HB3 LEU 42 HB1 LEU 42 44.217 -6.344 -0.004 263 HG LEU 42 HG LEU 42 41.916 -7.964 -1.109 264 HD11 LEU 42 HD11 LEU 42 41.396 -6.111 0.710 265 HD12 LEU 42 HD12 LEU 42 40.435 -6.205 -0.766 266 HD13 LEU 42 HD13 LEU 42 41.724 -5.010 -0.629 267 HD21 LEU 42 HD21 LEU 42 43.450 -7.286 -2.811 268 HD22 LEU 42 HD22 LEU 42 43.648 -5.687 -2.095 269 HD23 LEU 42 HD23 LEU 42 42.129 -6.119 -2.879 270 H ASP 43 HN ASP 43 46.346 -9.827 -1.237 271 HA ASP 43 HA ASP 43 48.302 -9.244 -2.460 272 HB2 ASP 43 HB2 ASP 43 45.847 -8.915 -4.076 273 HB3 ASP 43 HB1 ASP 43 47.287 -8.149 -4.747 274 HA PRO 44 HA PRO 44 48.084 -4.784 -0.961 275 HB2 PRO 44 HB2 PRO 44 50.896 -5.583 -0.365 276 HB3 PRO 44 HB1 PRO 44 49.745 -4.675 0.633 277 HG2 PRO 44 HG2 PRO 44 50.339 -7.231 1.135 278 HG3 PRO 44 HG1 PRO 44 48.722 -6.566 1.416 279 HD2 PRO 44 HD2 PRO 44 49.648 -8.403 -0.738 280 HD3 PRO 44 HD1 PRO 44 48.036 -8.238 -0.008 281 H ARG 45 HN ARG 45 48.210 -3.495 -2.770 282 HA ARG 45 HA ARG 45 49.683 -3.865 -5.091 283 HB2 ARG 45 HB2 ARG 45 48.001 -2.022 -4.624 284 HB3 ARG 45 HB1 ARG 45 49.299 -1.147 -3.812 285 HG2 ARG 45 HG2 ARG 45 50.596 -1.023 -5.825 286 HG3 ARG 45 HG1 ARG 45 49.531 -2.160 -6.653 287 HD2 ARG 45 HD2 ARG 45 48.931 0.682 -5.826 288 HD3 ARG 45 HD1 ARG 45 48.877 -0.014 -7.445 289 HE ARG 45 HE ARG 45 46.749 -0.133 -5.476 290 HH11 ARG 45 HH11 ARG 45 44.909 -1.303 -6.071 291 HH12 ARG 45 HH12 ARG 45 44.993 -2.401 -7.409 292 HH21 ARG 45 HH21 ARG 45 48.332 -1.750 -8.078 293 HH22 ARG 45 HH22 ARG 45 46.930 -2.653 -8.545 294 H GLY 46 HN GLY 46 51.764 -4.736 -4.588 295 HA2 GLY 46 HA2 GLY 46 54.031 -4.665 -3.944 296 HA3 GLY 46 HA1 GLY 46 53.958 -3.036 -4.619 297 H GLY 47 HN GLY 47 53.789 -1.266 -3.204 298 HA2 GLY 47 HA2 GLY 47 53.370 -1.716 -0.334 299 HA3 GLY 47 HA1 GLY 47 55.007 -1.224 -0.765 300 H GLY 48 HN GLY 48 52.689 0.013 -2.913 301 HA2 GLY 48 HA2 GLY 48 52.192 2.281 -3.359 302 HA3 GLY 48 HA1 GLY 48 51.510 2.202 -1.733 303 H GLY 49 HN GLY 49 52.741 3.011 0.024 304 HA2 GLY 49 HA2 GLY 49 55.331 3.697 0.346 305 HA3 GLY 49 HA1 GLY 49 54.808 4.960 -0.770 306 H ASN 50 HN ASN 50 55.022 6.651 0.760 307 HA ASN 50 HA ASN 50 53.975 6.595 3.411 308 HB2 ASN 50 HB2 ASN 50 55.346 8.440 1.814 309 HB3 ASN 50 HB1 ASN 50 53.813 9.231 2.187 310 HD21 ASN 50 HD21 ASN 50 53.181 8.745 4.702 311 HD22 ASN 50 HD22 ASN 50 54.445 9.052 5.793 312 H ARG 51 HN ARG 51 51.864 6.303 3.936 313 HA ARG 51 HA ARG 51 49.788 7.297 2.036 314 HB2 ARG 51 HB2 ARG 51 48.259 5.803 3.411 315 HB3 ARG 51 HB1 ARG 51 49.514 4.954 2.507 316 HG2 ARG 51 HG2 ARG 51 50.445 5.789 5.143 317 HG3 ARG 51 HG1 ARG 51 49.037 4.732 5.244 318 HD2 ARG 51 HD2 ARG 51 51.621 4.159 3.766 319 HD3 ARG 51 HD1 ARG 51 51.043 3.356 5.226 320 HE ARG 51 HE ARG 51 49.239 3.181 2.908 321 HH11 ARG 51 HH11 ARG 51 48.870 1.075 2.177 322 HH12 ARG 51 HH12 ARG 51 49.866 -0.217 2.760 323 HH21 ARG 51 HH21 ARG 51 51.791 1.831 4.791 324 HH22 ARG 51 HH22 ARG 51 51.520 0.210 4.240 325 H GLN 52 HN GLN 52 48.196 8.730 2.763 326 HA GLN 52 HA GLN 52 48.887 10.378 5.047 327 HB2 GLN 52 HB2 GLN 52 46.168 10.775 4.151 328 HB3 GLN 52 HB1 GLN 52 47.555 11.854 3.987 329 HG2 GLN 52 HG2 GLN 52 46.856 9.553 2.140 330 HG3 GLN 52 HG1 GLN 52 46.700 11.270 1.769 331 HE21 GLN 52 HE21 GLN 52 48.316 9.921 0.033 332 HE22 GLN 52 HE22 GLN 52 49.956 10.232 0.341 333 HA PRO 53 HA PRO 53 46.595 8.461 8.266 334 HB2 PRO 53 HB2 PRO 53 45.276 10.587 9.433 335 HB3 PRO 53 HB1 PRO 53 46.996 10.226 9.672 336 HG2 PRO 53 HG2 PRO 53 45.713 12.240 7.908 337 HG3 PRO 53 HG1 PRO 53 47.219 12.341 8.834 338 HD2 PRO 53 HD2 PRO 53 47.164 11.901 6.134 339 HD3 PRO 53 HD1 PRO 53 48.460 11.292 7.187 340 HA PRO 54 HA PRO 54 42.567 7.856 6.367 341 HB2 PRO 54 HB2 PRO 54 41.860 5.661 7.820 342 HB3 PRO 54 HB1 PRO 54 43.015 5.597 6.475 343 HG2 PRO 54 HG2 PRO 54 43.515 5.599 9.402 344 HG3 PRO 54 HG1 PRO 54 44.365 4.739 8.109 345 HD2 PRO 54 HD2 PRO 54 45.292 7.060 9.303 346 HD3 PRO 54 HD1 PRO 54 45.765 6.511 7.680 347 HA PRO 55 HA PRO 55 40.351 9.976 9.705 348 HB2 PRO 55 HB2 PRO 55 38.433 11.080 8.122 349 HB3 PRO 55 HB1 PRO 55 40.073 11.743 8.247 350 HG2 PRO 55 HG2 PRO 55 38.855 10.100 6.099 351 HG3 PRO 55 HG1 PRO 55 40.040 11.411 5.988 352 HD2 PRO 55 HD2 PRO 55 40.660 8.703 5.844 353 HD3 PRO 55 HD1 PRO 55 41.816 9.987 6.259 354 HA PRO 56 HA PRO 56 37.450 6.753 10.747 355 HB2 PRO 56 HB2 PRO 56 35.947 9.087 11.867 356 HB3 PRO 56 HB1 PRO 56 36.346 7.534 12.627 357 HG2 PRO 56 HG2 PRO 56 37.686 9.791 13.183 358 HG3 PRO 56 HG1 PRO 56 38.455 8.195 13.192 359 HD2 PRO 56 HD2 PRO 56 38.801 10.415 11.272 360 HD3 PRO 56 HD1 PRO 56 39.862 9.027 11.593 361 H TYR 57 HN TYR 57 36.170 5.965 9.119 362 HA TYR 57 HA TYR 57 34.650 7.707 7.364 363 HB2 TYR 57 HB2 TYR 57 34.241 5.810 6.111 364 HB3 TYR 57 HB1 TYR 57 35.655 5.256 7.006 365 HD1 TYR 57 HD1 TYR 57 35.405 3.765 8.967 366 HD2 TYR 57 HD2 TYR 57 32.032 4.945 6.582 367 HE1 TYR 57 HE1 TYR 57 34.052 1.952 9.982 368 HE2 TYR 57 HE2 TYR 57 30.680 3.132 7.598 369 HH TYR 57 HH TYR 57 30.684 1.791 9.694 370 HA PRO 58 HA PRO 58 31.140 7.857 10.137 371 HB2 PRO 58 HB2 PRO 58 29.544 9.401 8.563 372 HB3 PRO 58 HB1 PRO 58 30.919 10.055 9.473 373 HG2 PRO 58 HG2 PRO 58 30.703 9.394 6.585 374 HG3 PRO 58 HG1 PRO 58 31.550 10.731 7.381 375 HD2 PRO 58 HD2 PRO 58 32.799 8.443 6.448 376 HD3 PRO 58 HD1 PRO 58 33.451 9.485 7.731 377 H LEU 59 HN LEU 59 29.771 6.131 10.334 378 HA LEU 59 HA LEU 59 28.848 4.658 7.991 379 HB2 LEU 59 HB2 LEU 59 29.378 3.496 10.106 380 HB3 LEU 59 HB1 LEU 59 28.086 4.381 10.916 381 HG LEU 59 HG LEU 59 26.505 3.418 9.158 382 HD11 LEU 59 HD11 LEU 59 29.039 1.891 8.577 383 HD12 LEU 59 HD12 LEU 59 27.933 2.665 7.441 384 HD13 LEU 59 HD13 LEU 59 27.459 1.175 8.257 385 HD21 LEU 59 HD21 LEU 59 26.091 2.269 11.077 386 HD22 LEU 59 HD22 LEU 59 27.806 2.070 11.433 387 HD23 LEU 59 HD23 LEU 59 27.005 0.970 10.311 388 H THR 60 HN THR 60 26.711 4.585 7.201 389 HA THR 60 HA THR 60 25.164 6.990 7.445 390 HB THR 60 HB THR 60 23.752 6.051 5.859 391 HG1 THR 60 HG1 THR 60 22.834 4.388 6.861 392 HG21 THR 60 HG21 THR 60 25.098 4.895 4.295 393 HG22 THR 60 HG22 THR 60 26.036 4.103 5.562 394 HG23 THR 60 HG23 THR 60 26.249 5.827 5.254 395 H ALA 61 HN ALA 61 25.279 6.716 9.973 396 HA ALA 61 HA ALA 61 22.623 5.706 10.802 397 HB1 ALA 61 HB1 ALA 61 24.448 4.957 12.863 398 HB2 ALA 61 HB2 ALA 61 25.059 4.298 11.346 399 HB3 ALA 61 HB3 ALA 61 23.426 3.905 11.885 Start of MODEL 8 1 H1 SER 8 HT1 SER 8 32.539 -13.246 -2.789 2 H2 SER 8 HT2 SER 8 32.455 -12.204 -1.449 3 H3 SER 8 HT3 SER 8 31.415 -11.976 -2.773 4 HA SER 8 HA SER 8 30.015 -13.629 -2.173 5 HB2 SER 8 HB2 SER 8 32.176 -15.176 -2.207 6 HB3 SER 8 HB1 SER 8 32.017 -15.048 -0.457 7 HG SER 8 HG SER 8 29.952 -15.815 -2.254 8 H GLY 9 HN GLY 9 30.939 -11.169 -0.719 9 HA2 GLY 9 HA2 GLY 9 29.406 -10.524 1.223 10 HA3 GLY 9 HA1 GLY 9 30.069 -11.941 2.037 11 HA PRO 10 HA PRO 10 32.449 -7.918 3.031 12 HB2 PRO 10 HB2 PRO 10 32.148 -9.173 5.719 13 HB3 PRO 10 HB1 PRO 10 31.988 -7.472 5.245 14 HG2 PRO 10 HG2 PRO 10 29.860 -8.988 5.797 15 HG3 PRO 10 HG1 PRO 10 29.821 -7.725 4.556 16 HD2 PRO 10 HD2 PRO 10 29.900 -10.686 4.223 17 HD3 PRO 10 HD1 PRO 10 29.190 -9.448 3.164 18 H LEU 11 HN LEU 11 34.509 -8.018 4.671 19 HA LEU 11 HA LEU 11 36.154 -10.216 3.628 20 HB2 LEU 11 HB2 LEU 11 36.590 -7.619 5.024 21 HB3 LEU 11 HB1 LEU 11 37.832 -8.842 5.229 22 HG LEU 11 HG LEU 11 36.749 -8.177 2.498 23 HD11 LEU 11 HD11 LEU 11 38.173 -6.383 4.193 24 HD12 LEU 11 HD12 LEU 11 37.759 -6.174 2.492 25 HD13 LEU 11 HD13 LEU 11 39.287 -6.930 2.941 26 HD21 LEU 11 HD21 LEU 11 39.468 -9.177 3.396 27 HD22 LEU 11 HD22 LEU 11 38.861 -9.099 1.744 28 HD23 LEU 11 HD23 LEU 11 38.153 -10.236 2.889 29 HA PRO 12 HA PRO 12 37.040 -13.023 7.026 30 HB2 PRO 12 HB2 PRO 12 38.246 -10.737 8.563 31 HB3 PRO 12 HB1 PRO 12 38.777 -12.430 8.479 32 HG2 PRO 12 HG2 PRO 12 39.772 -10.361 6.923 33 HG3 PRO 12 HG1 PRO 12 39.927 -12.086 6.562 34 HD2 PRO 12 HD2 PRO 12 38.509 -10.193 5.011 35 HD3 PRO 12 HD1 PRO 12 38.409 -11.955 4.844 36 H ASP 13 HN ASP 13 36.138 -9.789 8.270 37 HA ASP 13 HA ASP 13 33.568 -10.036 8.968 38 HB2 ASP 13 HB2 ASP 13 33.571 -12.124 9.994 39 HB3 ASP 13 HB1 ASP 13 35.165 -11.883 10.712 40 H GLY 14 HN GLY 14 33.379 -7.927 9.464 41 HA2 GLY 14 HA2 GLY 14 33.388 -6.284 11.296 42 HA3 GLY 14 HA1 GLY 14 34.967 -6.908 11.775 43 H TRP 15 HN TRP 15 34.984 -6.825 8.457 44 HA TRP 15 HA TRP 15 35.492 -3.978 8.119 45 HB2 TRP 15 HB2 TRP 15 37.806 -3.966 7.965 46 HB3 TRP 15 HB1 TRP 15 37.538 -5.075 9.305 47 HD1 TRP 15 HD1 TRP 15 37.393 -7.800 8.450 48 HE1 TRP 15 HE1 TRP 15 38.999 -8.960 6.806 49 HE3 TRP 15 HE3 TRP 15 39.307 -3.719 6.057 50 HZ2 TRP 15 HZ2 TRP 15 40.855 -8.253 4.745 51 HZ3 TRP 15 HZ3 TRP 15 40.986 -3.988 4.259 52 HH2 TRP 15 HH2 TRP 15 41.765 -6.248 3.599 53 H GLU 16 HN GLU 16 36.248 -3.474 5.874 54 HA GLU 16 HA GLU 16 36.037 -5.648 3.900 55 HB2 GLU 16 HB2 GLU 16 33.800 -3.817 4.520 56 HB3 GLU 16 HB1 GLU 16 34.185 -3.965 2.805 57 HG2 GLU 16 HG2 GLU 16 33.991 -6.395 2.933 58 HG3 GLU 16 HG1 GLU 16 33.708 -6.304 4.671 59 H GLN 17 HN GLN 17 36.839 -5.003 1.845 60 HA GLN 17 HA GLN 17 38.387 -2.495 1.881 61 HB2 GLN 17 HB2 GLN 17 39.764 -4.142 1.017 62 HB3 GLN 17 HB1 GLN 17 38.423 -5.020 0.281 63 HG2 GLN 17 HG2 GLN 17 38.240 -3.380 -1.491 64 HG3 GLN 17 HG1 GLN 17 39.426 -2.337 -0.707 65 HE21 GLN 17 HE21 GLN 17 41.422 -2.498 -1.728 66 HE22 GLN 17 HE22 GLN 17 42.069 -3.918 -2.396 67 H ALA 18 HN ALA 18 37.825 -0.715 0.645 68 HA ALA 18 HA ALA 18 35.881 -1.032 -1.547 69 HB1 ALA 18 HB1 ALA 18 35.285 0.300 1.063 70 HB2 ALA 18 HB2 ALA 18 34.225 -0.652 0.024 71 HB3 ALA 18 HB3 ALA 18 34.624 1.010 -0.410 72 H MET 19 HN MET 19 35.309 1.578 -2.086 73 HA MET 19 HA MET 19 37.983 2.875 -2.286 74 HB2 MET 19 HB2 MET 19 37.554 3.497 -4.538 75 HB3 MET 19 HB1 MET 19 37.054 1.809 -4.433 76 HG2 MET 19 HG2 MET 19 34.708 2.600 -3.991 77 HG3 MET 19 HG1 MET 19 35.257 4.246 -4.304 78 HE1 MET 19 HE1 MET 19 33.587 4.135 -7.559 79 HE2 MET 19 HE2 MET 19 34.672 5.225 -6.699 80 HE3 MET 19 HE3 MET 19 33.398 4.386 -5.817 81 H THR 20 HN THR 20 37.860 5.257 -2.567 82 HA THR 20 HA THR 20 35.658 6.358 -0.937 83 HB THR 20 HB THR 20 37.198 8.456 -1.153 84 HG1 THR 20 HG1 THR 20 38.780 6.346 -2.152 85 HG21 THR 20 HG21 THR 20 38.661 7.581 0.652 86 HG22 THR 20 HG22 THR 20 38.097 5.950 0.289 87 HG23 THR 20 HG23 THR 20 36.968 7.155 0.907 88 H GLN 21 HN GLN 21 35.749 9.022 -1.981 89 HA GLN 21 HA GLN 21 34.093 8.634 -4.375 90 HB2 GLN 21 HB2 GLN 21 34.826 10.987 -2.640 91 HB3 GLN 21 HB1 GLN 21 34.082 11.247 -4.219 92 HG2 GLN 21 HG2 GLN 21 32.787 9.184 -2.533 93 HG3 GLN 21 HG1 GLN 21 32.656 10.840 -1.939 94 HE21 GLN 21 HE21 GLN 21 31.961 8.775 -4.777 95 HE22 GLN 21 HE22 GLN 21 30.777 9.800 -5.432 96 H ASP 22 HN ASP 22 37.365 9.065 -3.711 97 HA ASP 22 HA ASP 22 37.857 10.179 -6.421 98 HB2 ASP 22 HB2 ASP 22 38.747 11.547 -4.533 99 HB3 ASP 22 HB1 ASP 22 39.713 10.160 -4.026 100 H GLY 23 HN GLY 23 37.369 7.380 -5.349 101 HA2 GLY 23 HA2 GLY 23 38.195 5.221 -5.723 102 HA3 GLY 23 HA1 GLY 23 38.976 5.929 -7.136 103 H GLU 24 HN GLU 24 39.524 6.518 -3.659 104 HA GLU 24 HA GLU 24 42.413 6.158 -4.129 105 HB2 GLU 24 HB2 GLU 24 41.108 6.873 -1.512 106 HB3 GLU 24 HB1 GLU 24 42.743 7.252 -2.055 107 HG2 GLU 24 HG2 GLU 24 41.079 8.368 -4.007 108 HG3 GLU 24 HG1 GLU 24 40.277 8.733 -2.480 109 H ILE 25 HN ILE 25 40.182 4.077 -3.832 110 HA ILE 25 HA ILE 25 39.810 2.044 -2.654 111 HB ILE 25 HB ILE 25 41.434 1.388 -4.312 112 HG12 ILE 25 HG12 ILE 25 42.613 -0.422 -3.075 113 HG13 ILE 25 HG11 ILE 25 42.190 0.367 -1.555 114 HG21 ILE 25 HG21 ILE 25 43.106 3.135 -3.892 115 HG22 ILE 25 HG22 ILE 25 43.861 1.544 -3.851 116 HG23 ILE 25 HG23 ILE 25 43.514 2.391 -2.347 117 HD11 ILE 25 HD11 ILE 25 40.063 -0.402 -1.621 118 HD12 ILE 25 HD12 ILE 25 40.646 -1.528 -2.845 119 HD13 ILE 25 HD13 ILE 25 39.887 -0.014 -3.332 120 H TYR 26 HN TYR 26 39.319 2.122 -0.520 121 HA TYR 26 HA TYR 26 41.586 2.219 1.386 122 HB2 TYR 26 HB2 TYR 26 40.569 3.821 2.801 123 HB3 TYR 26 HB1 TYR 26 40.381 4.479 1.180 124 HD1 TYR 26 HD1 TYR 26 38.690 5.185 3.624 125 HD2 TYR 26 HD2 TYR 26 38.150 2.289 0.501 126 HE1 TYR 26 HE1 TYR 26 36.235 5.290 3.950 127 HE2 TYR 26 HE2 TYR 26 35.699 2.390 0.834 128 HH TYR 26 HH TYR 26 34.025 3.478 1.842 129 H TYR 27 HN TYR 27 40.935 1.327 3.565 130 HA TYR 27 HA TYR 27 38.907 -0.830 3.152 131 HB2 TYR 27 HB2 TYR 27 41.231 -0.720 5.096 132 HB3 TYR 27 HB1 TYR 27 40.121 -2.072 4.897 133 HD1 TYR 27 HD1 TYR 27 43.004 -2.496 4.594 134 HD2 TYR 27 HD2 TYR 27 40.111 -1.205 1.694 135 HE1 TYR 27 HE1 TYR 27 44.419 -3.398 2.772 136 HE2 TYR 27 HE2 TYR 27 41.523 -2.105 -0.120 137 HH TYR 27 HH TYR 27 43.837 -4.270 0.251 138 H ILE 28 HN ILE 28 37.434 -1.285 4.842 139 HA ILE 28 HA ILE 28 37.208 0.864 6.882 140 HB ILE 28 HB ILE 28 35.369 1.445 5.727 141 HG12 ILE 28 HG12 ILE 28 33.340 0.237 6.354 142 HG13 ILE 28 HG11 ILE 28 34.288 -1.188 6.778 143 HG21 ILE 28 HG21 ILE 28 36.090 0.004 3.827 144 HG22 ILE 28 HG22 ILE 28 34.337 0.066 4.002 145 HG23 ILE 28 HG23 ILE 28 35.230 -1.347 4.563 146 HD11 ILE 28 HD11 ILE 28 34.430 -0.360 8.860 147 HD12 ILE 28 HD12 ILE 28 33.733 1.178 8.358 148 HD13 ILE 28 HD13 ILE 28 35.469 0.908 8.212 149 H ASN 29 HN ASN 29 37.125 0.146 8.947 150 HA ASN 29 HA ASN 29 36.780 -2.783 9.370 151 HB2 ASN 29 HB2 ASN 29 38.346 -0.650 10.665 152 HB3 ASN 29 HB1 ASN 29 37.556 -1.753 11.793 153 HD21 ASN 29 HD21 ASN 29 39.388 -3.007 12.410 154 HD22 ASN 29 HD22 ASN 29 40.284 -3.945 11.313 155 H HIS 30 HN HIS 30 34.620 -3.197 9.669 156 HA HIS 30 HA HIS 30 32.771 -1.352 10.863 157 HB2 HIS 30 HB2 HIS 30 32.607 -4.365 10.540 158 HB3 HIS 30 HB1 HIS 30 31.255 -3.324 10.988 159 HD1 HIS 30 HD1 HIS 30 31.142 -1.116 9.138 160 HD2 HIS 30 HD2 HIS 30 32.545 -4.819 7.825 161 HE1 HIS 30 HE1 HIS 30 30.916 -1.115 6.613 162 HE2 HIS 30 HE2 HIS 30 31.766 -3.364 5.804 163 H LYS 31 HN LYS 31 35.297 -2.973 12.265 164 HA LYS 31 HA LYS 31 33.911 -3.473 14.829 165 HB2 LYS 31 HB2 LYS 31 35.681 -4.834 15.399 166 HB3 LYS 31 HB1 LYS 31 35.832 -4.924 13.644 167 HG2 LYS 31 HG2 LYS 31 37.422 -2.977 13.750 168 HG3 LYS 31 HG1 LYS 31 37.365 -3.093 15.509 169 HD2 LYS 31 HD2 LYS 31 39.268 -4.365 14.920 170 HD3 LYS 31 HD1 LYS 31 38.010 -5.574 15.172 171 HE2 LYS 31 HE2 LYS 31 37.853 -4.692 12.457 172 HE3 LYS 31 HE1 LYS 31 39.534 -5.093 12.807 173 HZ1 LYS 31 HZ1 LYS 31 37.208 -6.848 13.380 174 HZ2 LYS 31 HZ2 LYS 31 38.844 -7.232 13.633 175 HZ3 LYS 31 HZ3 LYS 31 38.253 -7.019 12.054 176 H ASN 32 HN ASN 32 36.497 -1.472 13.460 177 HA ASN 32 HA ASN 32 36.587 0.094 15.977 178 HB2 ASN 32 HB2 ASN 32 38.692 -0.742 14.704 179 HB3 ASN 32 HB1 ASN 32 38.335 0.557 13.566 180 HD21 ASN 32 HD21 ASN 32 40.652 0.375 15.453 181 HD22 ASN 32 HD22 ASN 32 40.551 1.753 16.438 182 H LYS 33 HN LYS 33 34.570 0.068 13.557 183 HA LYS 33 HA LYS 33 33.402 1.672 12.285 184 HB2 LYS 33 HB2 LYS 33 33.782 2.708 15.042 185 HB3 LYS 33 HB1 LYS 33 33.257 3.888 13.841 186 HG2 LYS 33 HG2 LYS 33 31.859 1.273 13.771 187 HG3 LYS 33 HG1 LYS 33 31.538 2.278 15.184 188 HD2 LYS 33 HD2 LYS 33 31.036 4.190 13.640 189 HD3 LYS 33 HD1 LYS 33 31.199 3.078 12.281 190 HE2 LYS 33 HE2 LYS 33 29.252 1.943 12.793 191 HE3 LYS 33 HE1 LYS 33 29.378 2.293 14.516 192 HZ1 LYS 33 HZ1 LYS 33 28.969 4.519 12.652 193 HZ2 LYS 33 HZ2 LYS 33 28.463 4.353 14.265 194 HZ3 LYS 33 HZ3 LYS 33 27.646 3.526 13.025 195 H THR 34 HN THR 34 36.241 1.591 11.739 196 HA THR 34 HA THR 34 36.567 4.360 10.753 197 HB THR 34 HB THR 34 39.150 3.575 11.469 198 HG1 THR 34 HG1 THR 34 37.566 2.158 12.891 199 HG21 THR 34 HG21 THR 34 38.506 5.838 11.624 200 HG22 THR 34 HG22 THR 34 38.742 5.346 13.301 201 HG23 THR 34 HG23 THR 34 37.113 5.459 12.636 202 H THR 35 HN THR 35 38.509 4.397 9.159 203 HA THR 35 HA THR 35 38.512 1.840 7.650 204 HB THR 35 HB THR 35 39.192 3.552 5.742 205 HG1 THR 35 HG1 THR 35 38.428 5.087 7.835 206 HG21 THR 35 HG21 THR 35 36.519 2.788 6.840 207 HG22 THR 35 HG22 THR 35 37.268 2.336 5.307 208 HG23 THR 35 HG23 THR 35 36.581 3.943 5.512 209 H SER 36 HN SER 36 40.535 1.687 6.193 210 HA SER 36 HA SER 36 42.929 3.063 7.119 211 HB2 SER 36 HB2 SER 36 42.289 1.222 8.889 212 HB3 SER 36 HB1 SER 36 42.961 0.117 7.693 213 HG SER 36 HG SER 36 44.689 2.003 7.781 214 H TRP 37 HN TRP 37 44.936 1.948 6.108 215 HA TRP 37 HA TRP 37 44.138 0.917 3.419 216 HB2 TRP 37 HB2 TRP 37 46.865 2.016 4.062 217 HB3 TRP 37 HB1 TRP 37 46.041 1.945 2.507 218 HD1 TRP 37 HD1 TRP 37 46.395 4.049 5.622 219 HE1 TRP 37 HE1 TRP 37 45.131 6.273 5.300 220 HE3 TRP 37 HE3 TRP 37 43.906 3.027 1.278 221 HZ2 TRP 37 HZ2 TRP 37 43.312 7.463 3.437 222 HZ3 TRP 37 HZ3 TRP 37 42.414 4.723 0.258 223 HH2 TRP 37 HH2 TRP 37 42.113 6.935 1.331 224 H LEU 38 HN LEU 38 46.155 0.352 6.240 225 HA LEU 38 HA LEU 38 47.991 -1.523 5.546 226 HB2 LEU 38 HB2 LEU 38 47.238 -2.845 7.639 227 HB3 LEU 38 HB1 LEU 38 47.717 -1.164 7.866 228 HG LEU 38 HG LEU 38 45.225 -0.593 7.540 229 HD11 LEU 38 HD11 LEU 38 43.954 -2.769 8.522 230 HD12 LEU 38 HD12 LEU 38 45.204 -3.566 7.567 231 HD13 LEU 38 HD13 LEU 38 44.088 -2.439 6.795 232 HD21 LEU 38 HD21 LEU 38 45.546 -0.266 9.750 233 HD22 LEU 38 HD22 LEU 38 46.699 -1.597 9.836 234 HD23 LEU 38 HD23 LEU 38 44.973 -1.915 10.004 235 H ASP 39 HN ASP 39 47.961 -3.887 5.308 236 HA ASP 39 HA ASP 39 45.435 -4.832 4.040 237 HB2 ASP 39 HB2 ASP 39 47.427 -6.525 3.142 238 HB3 ASP 39 HB1 ASP 39 46.786 -5.145 2.249 239 HA PRO 40 HA PRO 40 45.657 -7.363 7.845 240 HB2 PRO 40 HB2 PRO 40 43.041 -8.239 6.733 241 HB3 PRO 40 HB1 PRO 40 43.439 -7.664 8.362 242 HG2 PRO 40 HG2 PRO 40 42.100 -6.148 6.615 243 HG3 PRO 40 HG1 PRO 40 43.243 -5.459 7.780 244 HD2 PRO 40 HD2 PRO 40 43.572 -5.874 4.840 245 HD3 PRO 40 HD1 PRO 40 44.250 -4.607 5.886 246 H ARG 41 HN ARG 41 44.013 -8.789 4.991 247 HA ARG 41 HA ARG 41 45.850 -11.119 5.264 248 HB2 ARG 41 HB2 ARG 41 43.903 -12.351 4.067 249 HB3 ARG 41 HB1 ARG 41 43.716 -11.977 5.780 250 HG2 ARG 41 HG2 ARG 41 41.682 -11.250 4.846 251 HG3 ARG 41 HG1 ARG 41 42.628 -9.768 4.962 252 HD2 ARG 41 HD2 ARG 41 43.090 -11.214 2.455 253 HD3 ARG 41 HD1 ARG 41 41.410 -10.718 2.663 254 HE ARG 41 HE ARG 41 43.519 -8.682 3.117 255 HH11 ARG 41 HH11 ARG 41 43.214 -6.806 1.891 256 HH12 ARG 41 HH12 ARG 41 41.997 -6.781 0.658 257 HH21 ARG 41 HH21 ARG 41 40.969 -10.042 1.232 258 HH22 ARG 41 HH22 ARG 41 40.727 -8.611 0.286 259 H LEU 42 HN LEU 42 46.106 -8.628 3.663 260 HA LEU 42 HA LEU 42 46.297 -9.913 0.980 261 HB2 LEU 42 HB2 LEU 42 44.517 -8.154 1.086 262 HB3 LEU 42 HB1 LEU 42 45.758 -6.980 1.526 263 HG LEU 42 HG LEU 42 46.911 -8.066 -0.669 264 HD11 LEU 42 HD11 LEU 42 45.364 -8.695 -2.312 265 HD12 LEU 42 HD12 LEU 42 44.019 -7.912 -1.483 266 HD13 LEU 42 HD13 LEU 42 44.679 -9.424 -0.861 267 HD21 LEU 42 HD21 LEU 42 45.732 -6.110 -1.910 268 HD22 LEU 42 HD22 LEU 42 46.718 -5.718 -0.502 269 HD23 LEU 42 HD23 LEU 42 44.962 -5.783 -0.357 270 H ASP 43 HN ASP 43 48.435 -10.225 2.575 271 HA ASP 43 HA ASP 43 50.338 -8.086 1.703 272 HB2 ASP 43 HB2 ASP 43 51.712 -9.215 3.690 273 HB3 ASP 43 HB1 ASP 43 50.522 -7.950 4.003 274 HA PRO 44 HA PRO 44 51.680 -11.875 -0.477 275 HB2 PRO 44 HB2 PRO 44 52.545 -10.611 -2.724 276 HB3 PRO 44 HB1 PRO 44 50.839 -11.004 -2.441 277 HG2 PRO 44 HG2 PRO 44 52.248 -8.408 -2.195 278 HG3 PRO 44 HG1 PRO 44 50.594 -8.753 -2.721 279 HD2 PRO 44 HD2 PRO 44 51.300 -7.829 -0.187 280 HD3 PRO 44 HD1 PRO 44 49.768 -8.635 -0.587 281 H ARG 45 HN ARG 45 53.411 -11.890 1.238 282 HA ARG 45 HA ARG 45 55.654 -11.728 1.934 283 HB2 ARG 45 HB2 ARG 45 55.562 -12.913 -0.516 284 HB3 ARG 45 HB1 ARG 45 56.620 -11.544 -0.862 285 HG2 ARG 45 HG2 ARG 45 57.018 -13.468 1.447 286 HG3 ARG 45 HG1 ARG 45 57.870 -13.572 -0.095 287 HD2 ARG 45 HD2 ARG 45 58.212 -10.918 0.634 288 HD3 ARG 45 HD1 ARG 45 58.338 -11.775 2.171 289 HE ARG 45 HE ARG 45 60.452 -12.476 1.436 290 HH11 ARG 45 HH11 ARG 45 61.984 -13.063 -0.120 291 HH12 ARG 45 HH12 ARG 45 61.546 -13.049 -1.796 292 HH21 ARG 45 HH21 ARG 45 58.293 -12.001 -1.210 293 HH22 ARG 45 HH22 ARG 45 59.456 -12.450 -2.413 294 H GLY 46 HN GLY 46 55.251 -9.480 2.679 295 HA2 GLY 46 HA2 GLY 46 56.858 -7.534 2.701 296 HA3 GLY 46 HA1 GLY 46 56.660 -7.486 0.948 297 H GLY 47 HN GLY 47 54.807 -7.182 3.980 298 HA2 GLY 47 HA2 GLY 47 52.470 -6.058 2.739 299 HA3 GLY 47 HA1 GLY 47 52.877 -5.925 4.450 300 H GLY 48 HN GLY 48 51.786 -3.704 3.465 301 HA2 GLY 48 HA2 GLY 48 53.418 -1.585 4.035 302 HA3 GLY 48 HA1 GLY 48 53.806 -1.899 2.342 303 H GLY 49 HN GLY 49 52.328 0.382 3.697 304 HA2 GLY 49 HA2 GLY 49 50.196 0.569 1.693 305 HA3 GLY 49 HA1 GLY 49 49.618 0.514 3.359 306 H ASN 50 HN ASN 50 52.293 1.916 4.073 307 HA ASN 50 HA ASN 50 52.759 4.151 4.672 308 HB2 ASN 50 HB2 ASN 50 52.111 4.514 1.729 309 HB3 ASN 50 HB1 ASN 50 53.074 5.609 2.721 310 HD21 ASN 50 HD21 ASN 50 55.099 4.569 3.743 311 HD22 ASN 50 HD22 ASN 50 55.910 3.384 2.838 312 H ARG 51 HN ARG 51 51.670 6.544 3.510 313 HA ARG 51 HA ARG 51 49.853 7.989 3.849 314 HB2 ARG 51 HB2 ARG 51 48.873 6.424 2.125 315 HB3 ARG 51 HB1 ARG 51 48.179 5.493 3.453 316 HG2 ARG 51 HG2 ARG 51 46.604 7.082 3.926 317 HG3 ARG 51 HG1 ARG 51 47.685 8.418 3.530 318 HD2 ARG 51 HD2 ARG 51 46.814 6.646 1.291 319 HD3 ARG 51 HD1 ARG 51 45.626 7.772 1.950 320 HE ARG 51 HE ARG 51 48.255 8.923 1.258 321 HH11 ARG 51 HH11 ARG 51 48.150 10.566 -0.292 322 HH12 ARG 51 HH12 ARG 51 46.672 10.828 -1.157 323 HH21 ARG 51 HH21 ARG 51 44.965 8.278 0.458 324 HH22 ARG 51 HH22 ARG 51 44.869 9.533 -0.732 325 H GLN 52 HN GLN 52 49.252 8.786 5.800 326 HA GLN 52 HA GLN 52 49.256 7.158 8.176 327 HB2 GLN 52 HB2 GLN 52 47.861 9.466 8.838 328 HB3 GLN 52 HB1 GLN 52 49.611 9.263 8.934 329 HG2 GLN 52 HG2 GLN 52 48.287 10.063 6.346 330 HG3 GLN 52 HG1 GLN 52 48.695 11.270 7.566 331 HE21 GLN 52 HE21 GLN 52 50.817 8.547 7.557 332 HE22 GLN 52 HE22 GLN 52 52.101 9.273 6.717 333 HA PRO 53 HA PRO 53 45.222 5.526 8.738 334 HB2 PRO 53 HB2 PRO 53 44.760 7.490 10.946 335 HB3 PRO 53 HB1 PRO 53 44.562 5.726 10.945 336 HG2 PRO 53 HG2 PRO 53 46.659 6.914 12.102 337 HG3 PRO 53 HG1 PRO 53 46.789 5.340 11.300 338 HD2 PRO 53 HD2 PRO 53 47.812 7.982 10.413 339 HD3 PRO 53 HD1 PRO 53 48.387 6.353 10.002 340 HA PRO 54 HA PRO 54 42.718 8.516 6.523 341 HB2 PRO 54 HB2 PRO 54 40.676 6.849 5.879 342 HB3 PRO 54 HB1 PRO 54 42.258 6.764 5.086 343 HG2 PRO 54 HG2 PRO 54 41.126 5.049 7.231 344 HG3 PRO 54 HG1 PRO 54 42.129 4.605 5.840 345 HD2 PRO 54 HD2 PRO 54 43.104 4.913 8.412 346 HD3 PRO 54 HD1 PRO 54 44.091 5.082 6.944 347 HA PRO 55 HA PRO 55 39.859 10.198 9.475 348 HB2 PRO 55 HB2 PRO 55 38.007 10.507 7.155 349 HB3 PRO 55 HB1 PRO 55 38.562 11.721 8.323 350 HG2 PRO 55 HG2 PRO 55 39.504 11.602 5.815 351 HG3 PRO 55 HG1 PRO 55 40.491 12.135 7.184 352 HD2 PRO 55 HD2 PRO 55 40.643 9.606 5.642 353 HD3 PRO 55 HD1 PRO 55 41.897 10.427 6.598 354 HA PRO 56 HA PRO 56 36.983 7.009 10.519 355 HB2 PRO 56 HB2 PRO 56 34.870 8.482 11.531 356 HB3 PRO 56 HB1 PRO 56 36.351 8.095 12.426 357 HG2 PRO 56 HG2 PRO 56 35.568 10.607 11.056 358 HG3 PRO 56 HG1 PRO 56 36.500 10.372 12.543 359 HD2 PRO 56 HD2 PRO 56 37.662 11.020 10.155 360 HD3 PRO 56 HD1 PRO 56 38.494 10.076 11.409 361 H TYR 57 HN TYR 57 36.017 5.939 8.842 362 HA TYR 57 HA TYR 57 34.547 7.158 6.736 363 HB2 TYR 57 HB2 TYR 57 34.403 5.044 5.900 364 HB3 TYR 57 HB1 TYR 57 35.535 4.666 7.195 365 HD1 TYR 57 HD1 TYR 57 32.506 3.714 5.740 366 HD2 TYR 57 HD2 TYR 57 34.327 4.295 9.586 367 HE1 TYR 57 HE1 TYR 57 30.836 2.192 6.760 368 HE2 TYR 57 HE2 TYR 57 32.655 2.776 10.605 369 HH TYR 57 HH TYR 57 31.180 0.883 9.835 370 HA PRO 58 HA PRO 58 30.765 7.895 9.013 371 HB2 PRO 58 HB2 PRO 58 29.370 9.039 6.983 372 HB3 PRO 58 HB1 PRO 58 30.674 9.885 7.838 373 HG2 PRO 58 HG2 PRO 58 30.704 8.558 5.179 374 HG3 PRO 58 HG1 PRO 58 31.502 10.047 5.708 375 HD2 PRO 58 HD2 PRO 58 32.781 7.600 5.470 376 HD3 PRO 58 HD1 PRO 58 33.338 8.927 6.514 377 H LEU 59 HN LEU 59 29.916 5.788 9.354 378 HA LEU 59 HA LEU 59 29.065 3.937 7.431 379 HB2 LEU 59 HB2 LEU 59 29.126 3.453 9.855 380 HB3 LEU 59 HB1 LEU 59 27.747 4.525 10.101 381 HG LEU 59 HG LEU 59 26.916 2.825 8.053 382 HD11 LEU 59 HD11 LEU 59 28.683 1.251 8.363 383 HD12 LEU 59 HD12 LEU 59 27.288 0.565 9.196 384 HD13 LEU 59 HD13 LEU 59 28.566 1.355 10.120 385 HD21 LEU 59 HD21 LEU 59 25.381 1.959 9.757 386 HD22 LEU 59 HD22 LEU 59 25.601 3.694 9.985 387 HD23 LEU 59 HD23 LEU 59 26.436 2.553 11.038 388 H THR 60 HN THR 60 27.154 3.651 6.248 389 HA THR 60 HA THR 60 25.784 5.703 5.104 390 HB THR 60 HB THR 60 23.720 4.130 5.112 391 HG1 THR 60 HG1 THR 60 25.154 3.041 7.011 392 HG21 THR 60 HG21 THR 60 25.172 4.181 3.209 393 HG22 THR 60 HG22 THR 60 24.969 2.481 3.633 394 HG23 THR 60 HG23 THR 60 26.448 3.331 4.080 395 H ALA 61 HN ALA 61 24.218 7.192 5.669 396 HA ALA 61 HA ALA 61 23.836 8.005 8.313 397 HB1 ALA 61 HB1 ALA 61 21.413 8.436 6.764 398 HB2 ALA 61 HB2 ALA 61 22.852 8.783 5.805 399 HB3 ALA 61 HB3 ALA 61 22.593 9.616 7.337 Start of MODEL 9 1 H1 SER 8 HT1 SER 8 30.931 -9.293 -3.423 2 H2 SER 8 HT2 SER 8 31.360 -10.081 -4.865 3 H3 SER 8 HT3 SER 8 32.543 -9.275 -3.950 4 HA SER 8 HA SER 8 31.602 -11.944 -3.719 5 HB2 SER 8 HB2 SER 8 33.860 -10.243 -2.723 6 HB3 SER 8 HB1 SER 8 33.589 -11.816 -1.978 7 HG SER 8 HG SER 8 34.344 -12.720 -3.714 8 H GLY 9 HN GLY 9 32.471 -9.767 -1.027 9 HA2 GLY 9 HA2 GLY 9 30.110 -9.544 0.363 10 HA3 GLY 9 HA1 GLY 9 30.629 -11.189 0.741 11 HA PRO 10 HA PRO 10 32.413 -7.977 3.777 12 HB2 PRO 10 HB2 PRO 10 31.796 -10.334 5.502 13 HB3 PRO 10 HB1 PRO 10 31.564 -8.606 5.829 14 HG2 PRO 10 HG2 PRO 10 29.522 -10.211 5.203 15 HG3 PRO 10 HG1 PRO 10 29.581 -8.516 4.692 16 HD2 PRO 10 HD2 PRO 10 29.954 -10.978 3.065 17 HD3 PRO 10 HD1 PRO 10 29.383 -9.370 2.568 18 H LEU 11 HN LEU 11 34.516 -8.121 4.753 19 HA LEU 11 HA LEU 11 36.193 -10.253 3.645 20 HB2 LEU 11 HB2 LEU 11 36.582 -7.646 5.034 21 HB3 LEU 11 HB1 LEU 11 37.875 -8.819 5.201 22 HG LEU 11 HG LEU 11 36.681 -8.155 2.511 23 HD11 LEU 11 HD11 LEU 11 38.237 -6.424 4.193 24 HD12 LEU 11 HD12 LEU 11 37.652 -6.132 2.556 25 HD13 LEU 11 HD13 LEU 11 39.214 -6.908 2.807 26 HD21 LEU 11 HD21 LEU 11 38.126 -10.224 2.876 27 HD22 LEU 11 HD22 LEU 11 39.456 -9.127 3.240 28 HD23 LEU 11 HD23 LEU 11 38.709 -9.107 1.645 29 HA PRO 12 HA PRO 12 37.339 -13.040 6.988 30 HB2 PRO 12 HB2 PRO 12 38.506 -10.728 8.514 31 HB3 PRO 12 HB1 PRO 12 39.105 -12.394 8.376 32 HG2 PRO 12 HG2 PRO 12 39.945 -10.251 6.825 33 HG3 PRO 12 HG1 PRO 12 40.172 -11.960 6.433 34 HD2 PRO 12 HD2 PRO 12 38.614 -10.123 4.956 35 HD3 PRO 12 HD1 PRO 12 38.592 -11.884 4.770 36 H ASP 13 HN ASP 13 36.337 -9.852 8.277 37 HA ASP 13 HA ASP 13 33.809 -10.230 9.066 38 HB2 ASP 13 HB2 ASP 13 33.951 -12.310 10.096 39 HB3 ASP 13 HB1 ASP 13 35.560 -11.992 10.746 40 H GLY 14 HN GLY 14 33.525 -8.136 9.568 41 HA2 GLY 14 HA2 GLY 14 33.504 -6.474 11.369 42 HA3 GLY 14 HA1 GLY 14 35.104 -7.039 11.845 43 H TRP 15 HN TRP 15 35.084 -6.954 8.514 44 HA TRP 15 HA TRP 15 35.529 -4.087 8.215 45 HB2 TRP 15 HB2 TRP 15 37.844 -4.061 7.938 46 HB3 TRP 15 HB1 TRP 15 37.620 -5.130 9.317 47 HD1 TRP 15 HD1 TRP 15 37.431 -7.879 8.533 48 HE1 TRP 15 HE1 TRP 15 38.985 -9.090 6.883 49 HE3 TRP 15 HE3 TRP 15 39.318 -3.873 5.991 50 HZ2 TRP 15 HZ2 TRP 15 40.795 -8.453 4.761 51 HZ3 TRP 15 HZ3 TRP 15 40.949 -4.204 4.161 52 HH2 TRP 15 HH2 TRP 15 41.692 -6.487 3.542 53 H GLU 16 HN GLU 16 36.302 -3.550 5.960 54 HA GLU 16 HA GLU 16 36.029 -5.645 3.931 55 HB2 GLU 16 HB2 GLU 16 33.762 -3.937 4.713 56 HB3 GLU 16 HB1 GLU 16 34.103 -3.927 2.982 57 HG2 GLU 16 HG2 GLU 16 34.189 -6.486 3.143 58 HG3 GLU 16 HG1 GLU 16 33.462 -6.300 4.740 59 H GLN 17 HN GLN 17 36.792 -4.927 1.896 60 HA GLN 17 HA GLN 17 38.358 -2.456 1.951 61 HB2 GLN 17 HB2 GLN 17 39.061 -4.671 0.855 62 HB3 GLN 17 HB1 GLN 17 37.917 -4.273 -0.428 63 HG2 GLN 17 HG2 GLN 17 39.637 -2.013 0.243 64 HG3 GLN 17 HG1 GLN 17 40.564 -3.422 -0.276 65 HE21 GLN 17 HE21 GLN 17 38.703 -0.779 -1.410 66 HE22 GLN 17 HE22 GLN 17 38.535 -1.290 -3.019 67 H ALA 18 HN ALA 18 37.887 -0.585 0.730 68 HA ALA 18 HA ALA 18 35.556 -0.619 -1.071 69 HB1 ALA 18 HB1 ALA 18 34.855 1.578 0.319 70 HB2 ALA 18 HB2 ALA 18 35.570 0.635 1.627 71 HB3 ALA 18 HB3 ALA 18 34.222 -0.024 0.700 72 H MET 19 HN MET 19 35.215 1.974 -1.621 73 HA MET 19 HA MET 19 37.921 3.126 -2.054 74 HB2 MET 19 HB2 MET 19 37.437 3.589 -4.368 75 HB3 MET 19 HB1 MET 19 37.090 1.881 -4.099 76 HG2 MET 19 HG2 MET 19 35.046 4.123 -4.097 77 HG3 MET 19 HG1 MET 19 35.273 2.934 -5.381 78 HE1 MET 19 HE1 MET 19 32.436 2.645 -4.844 79 HE2 MET 19 HE2 MET 19 32.400 0.910 -4.544 80 HE3 MET 19 HE3 MET 19 33.550 1.572 -5.702 81 H THR 20 HN THR 20 37.920 5.442 -2.238 82 HA THR 20 HA THR 20 35.656 6.709 -0.872 83 HB THR 20 HB THR 20 37.206 8.779 -1.254 84 HG1 THR 20 HG1 THR 20 38.405 7.398 -2.847 85 HG21 THR 20 HG21 THR 20 36.973 6.980 0.776 86 HG22 THR 20 HG22 THR 20 38.041 8.381 0.829 87 HG23 THR 20 HG23 THR 20 38.682 6.803 0.375 88 H GLN 21 HN GLN 21 35.747 9.264 -2.122 89 HA GLN 21 HA GLN 21 34.149 8.674 -4.514 90 HB2 GLN 21 HB2 GLN 21 33.255 10.437 -3.206 91 HB3 GLN 21 HB1 GLN 21 34.835 11.191 -2.991 92 HG2 GLN 21 HG2 GLN 21 34.845 12.106 -5.127 93 HG3 GLN 21 HG1 GLN 21 33.752 10.878 -5.768 94 HE21 GLN 21 HE21 GLN 21 33.871 13.863 -3.828 95 HE22 GLN 21 HE22 GLN 21 32.211 14.202 -3.943 96 H ASP 22 HN ASP 22 37.396 9.197 -3.806 97 HA ASP 22 HA ASP 22 37.933 10.132 -6.572 98 HB2 ASP 22 HB2 ASP 22 38.815 11.696 -4.937 99 HB3 ASP 22 HB1 ASP 22 39.596 10.384 -4.057 100 H GLY 23 HN GLY 23 37.529 7.406 -5.189 101 HA2 GLY 23 HA2 GLY 23 38.367 5.238 -5.470 102 HA3 GLY 23 HA1 GLY 23 39.164 5.867 -6.912 103 H GLU 24 HN GLU 24 39.635 6.645 -3.456 104 HA GLU 24 HA GLU 24 42.541 6.327 -3.856 105 HB2 GLU 24 HB2 GLU 24 41.123 7.132 -1.319 106 HB3 GLU 24 HB1 GLU 24 42.795 7.465 -1.778 107 HG2 GLU 24 HG2 GLU 24 41.770 8.726 -3.795 108 HG3 GLU 24 HG1 GLU 24 40.269 8.692 -2.870 109 H ILE 25 HN ILE 25 40.409 4.195 -3.618 110 HA ILE 25 HA ILE 25 40.021 2.173 -2.438 111 HB ILE 25 HB ILE 25 41.811 1.481 -3.864 112 HG12 ILE 25 HG12 ILE 25 43.088 -0.082 -2.370 113 HG13 ILE 25 HG11 ILE 25 42.404 0.757 -0.977 114 HG21 ILE 25 HG21 ILE 25 43.311 3.376 -3.521 115 HG22 ILE 25 HG22 ILE 25 44.185 1.872 -3.234 116 HG23 ILE 25 HG23 ILE 25 43.640 2.848 -1.872 117 HD11 ILE 25 HD11 ILE 25 40.339 0.036 -2.892 118 HD12 ILE 25 HD12 ILE 25 40.449 -0.342 -1.173 119 HD13 ILE 25 HD13 ILE 25 41.244 -1.381 -2.356 120 H TYR 26 HN TYR 26 39.298 2.334 -0.394 121 HA TYR 26 HA TYR 26 41.311 2.717 1.758 122 HB2 TYR 26 HB2 TYR 26 39.892 4.166 2.965 123 HB3 TYR 26 HB1 TYR 26 39.724 4.721 1.299 124 HD1 TYR 26 HD1 TYR 26 38.203 2.295 3.716 125 HD2 TYR 26 HD2 TYR 26 37.583 4.913 0.370 126 HE1 TYR 26 HE1 TYR 26 35.767 1.850 3.820 127 HE2 TYR 26 HE2 TYR 26 35.146 4.468 0.478 128 HH TYR 26 HH TYR 26 33.717 2.298 1.485 129 H TYR 27 HN TYR 27 40.784 1.574 3.747 130 HA TYR 27 HA TYR 27 38.948 -0.737 3.260 131 HB2 TYR 27 HB2 TYR 27 41.295 -0.418 5.157 132 HB3 TYR 27 HB1 TYR 27 40.237 -1.824 5.125 133 HD1 TYR 27 HD1 TYR 27 42.775 -2.702 4.759 134 HD2 TYR 27 HD2 TYR 27 40.384 -0.682 1.820 135 HE1 TYR 27 HE1 TYR 27 44.144 -3.694 2.953 136 HE2 TYR 27 HE2 TYR 27 41.753 -1.668 0.020 137 HH TYR 27 HH TYR 27 43.220 -3.523 -0.366 138 H ILE 28 HN ILE 28 37.443 -1.291 4.924 139 HA ILE 28 HA ILE 28 37.092 0.813 7.002 140 HB ILE 28 HB ILE 28 35.248 1.316 5.807 141 HG12 ILE 28 HG12 ILE 28 33.268 0.108 6.521 142 HG13 ILE 28 HG11 ILE 28 34.233 -1.318 6.908 143 HG21 ILE 28 HG21 ILE 28 35.024 -1.500 4.730 144 HG22 ILE 28 HG22 ILE 28 36.053 -0.279 3.983 145 HG23 ILE 28 HG23 ILE 28 34.310 -0.032 4.067 146 HD11 ILE 28 HD11 ILE 28 33.615 0.858 8.609 147 HD12 ILE 28 HD12 ILE 28 35.339 0.964 8.257 148 HD13 ILE 28 HD13 ILE 28 34.669 -0.510 8.949 149 H ASN 29 HN ASN 29 37.163 0.034 9.033 150 HA ASN 29 HA ASN 29 36.828 -2.902 9.419 151 HB2 ASN 29 HB2 ASN 29 38.692 -1.000 10.416 152 HB3 ASN 29 HB1 ASN 29 37.731 -1.557 11.787 153 HD21 ASN 29 HD21 ASN 29 38.276 -3.582 12.642 154 HD22 ASN 29 HD22 ASN 29 39.288 -4.710 11.878 155 H HIS 30 HN HIS 30 34.682 -3.296 9.830 156 HA HIS 30 HA HIS 30 32.917 -1.457 11.142 157 HB2 HIS 30 HB2 HIS 30 32.701 -4.469 10.841 158 HB3 HIS 30 HB1 HIS 30 31.383 -3.395 11.311 159 HD1 HIS 30 HD1 HIS 30 31.016 -1.325 9.458 160 HD2 HIS 30 HD2 HIS 30 32.793 -4.850 8.107 161 HE1 HIS 30 HE1 HIS 30 30.780 -1.327 6.934 162 HE2 HIS 30 HE2 HIS 30 31.857 -3.468 6.103 163 H LYS 31 HN LYS 31 35.496 -3.134 12.398 164 HA LYS 31 HA LYS 31 34.356 -3.932 14.951 165 HB2 LYS 31 HB2 LYS 31 36.932 -4.077 13.628 166 HB3 LYS 31 HB1 LYS 31 37.119 -3.524 15.292 167 HG2 LYS 31 HG2 LYS 31 35.352 -5.878 14.658 168 HG3 LYS 31 HG1 LYS 31 37.093 -6.090 14.837 169 HD2 LYS 31 HD2 LYS 31 36.859 -4.832 17.061 170 HD3 LYS 31 HD1 LYS 31 35.121 -5.080 16.890 171 HE2 LYS 31 HE2 LYS 31 35.929 -6.913 18.203 172 HE3 LYS 31 HE1 LYS 31 35.627 -7.557 16.589 173 HZ1 LYS 31 HZ1 LYS 31 37.935 -7.400 16.072 174 HZ2 LYS 31 HZ2 LYS 31 37.790 -8.226 17.549 175 HZ3 LYS 31 HZ3 LYS 31 38.274 -6.598 17.527 176 H ASN 32 HN ASN 32 36.328 -1.192 13.840 177 HA ASN 32 HA ASN 32 35.561 0.240 16.339 178 HB2 ASN 32 HB2 ASN 32 37.886 0.964 14.551 179 HB3 ASN 32 HB1 ASN 32 37.601 1.459 16.219 180 HD21 ASN 32 HD21 ASN 32 39.733 -0.354 14.672 181 HD22 ASN 32 HD22 ASN 32 39.908 -1.667 15.735 182 H LYS 33 HN LYS 33 34.388 -0.050 13.439 183 HA LYS 33 HA LYS 33 33.309 1.351 11.898 184 HB2 LYS 33 HB2 LYS 33 32.929 2.465 14.589 185 HB3 LYS 33 HB1 LYS 33 32.747 3.664 13.307 186 HG2 LYS 33 HG2 LYS 33 31.229 1.977 12.132 187 HG3 LYS 33 HG1 LYS 33 31.236 1.065 13.641 188 HD2 LYS 33 HD2 LYS 33 29.477 2.379 14.216 189 HD3 LYS 33 HD1 LYS 33 30.697 3.615 14.521 190 HE2 LYS 33 HE2 LYS 33 30.420 4.543 12.317 191 HE3 LYS 33 HE1 LYS 33 29.402 3.193 11.817 192 HZ1 LYS 33 HZ1 LYS 33 27.751 3.864 13.426 193 HZ2 LYS 33 HZ2 LYS 33 28.101 5.161 12.386 194 HZ3 LYS 33 HZ3 LYS 33 28.736 5.136 13.962 195 H THR 34 HN THR 34 36.074 1.478 11.652 196 HA THR 34 HA THR 34 36.425 4.304 10.830 197 HB THR 34 HB THR 34 38.967 3.490 11.634 198 HG1 THR 34 HG1 THR 34 38.046 3.146 13.991 199 HG21 THR 34 HG21 THR 34 38.527 5.142 13.510 200 HG22 THR 34 HG22 THR 34 36.865 5.227 12.929 201 HG23 THR 34 HG23 THR 34 38.191 5.736 11.883 202 H THR 35 HN THR 35 38.014 4.538 9.090 203 HA THR 35 HA THR 35 38.306 2.014 7.569 204 HB THR 35 HB THR 35 38.977 3.911 5.764 205 HG1 THR 35 HG1 THR 35 37.722 5.722 6.152 206 HG21 THR 35 HG21 THR 35 37.193 2.225 5.518 207 HG22 THR 35 HG22 THR 35 36.630 3.811 5.017 208 HG23 THR 35 HG23 THR 35 36.157 3.163 6.586 209 H SER 36 HN SER 36 40.361 1.660 6.404 210 HA SER 36 HA SER 36 42.693 3.209 7.313 211 HB2 SER 36 HB2 SER 36 42.928 1.854 9.142 212 HB3 SER 36 HB1 SER 36 41.966 0.561 8.433 213 HG SER 36 HG SER 36 44.626 1.275 7.725 214 H TRP 37 HN TRP 37 44.748 1.666 6.538 215 HA TRP 37 HA TRP 37 44.063 0.859 3.737 216 HB2 TRP 37 HB2 TRP 37 46.796 1.858 4.478 217 HB3 TRP 37 HB1 TRP 37 45.978 1.908 2.918 218 HD1 TRP 37 HD1 TRP 37 46.529 3.877 6.053 219 HE1 TRP 37 HE1 TRP 37 45.283 6.130 5.903 220 HE3 TRP 37 HE3 TRP 37 43.699 3.041 1.883 221 HZ2 TRP 37 HZ2 TRP 37 43.342 7.406 4.233 222 HZ3 TRP 37 HZ3 TRP 37 42.162 4.793 1.035 223 HH2 TRP 37 HH2 TRP 37 41.981 6.971 2.204 224 H LEU 38 HN LEU 38 45.902 0.189 6.649 225 HA LEU 38 HA LEU 38 47.752 -1.697 6.037 226 HB2 LEU 38 HB2 LEU 38 45.564 -2.260 8.058 227 HB3 LEU 38 HB1 LEU 38 47.214 -2.882 8.079 228 HG LEU 38 HG LEU 38 46.286 -0.043 8.532 229 HD11 LEU 38 HD11 LEU 38 48.365 -1.195 10.235 230 HD12 LEU 38 HD12 LEU 38 46.885 -2.152 10.244 231 HD13 LEU 38 HD13 LEU 38 46.834 -0.447 10.689 232 HD21 LEU 38 HD21 LEU 38 48.117 0.263 7.054 233 HD22 LEU 38 HD22 LEU 38 49.006 -1.097 7.742 234 HD23 LEU 38 HD23 LEU 38 48.830 0.397 8.662 235 H ASP 39 HN ASP 39 47.726 -4.028 5.658 236 HA ASP 39 HA ASP 39 45.220 -4.951 4.334 237 HB2 ASP 39 HB2 ASP 39 47.919 -5.978 3.517 238 HB3 ASP 39 HB1 ASP 39 46.433 -5.878 2.571 239 HA PRO 40 HA PRO 40 45.884 -7.743 7.935 240 HB2 PRO 40 HB2 PRO 40 43.171 -8.545 6.996 241 HB3 PRO 40 HB1 PRO 40 43.729 -8.160 8.634 242 HG2 PRO 40 HG2 PRO 40 42.223 -6.467 7.220 243 HG3 PRO 40 HG1 PRO 40 43.475 -5.906 8.338 244 HD2 PRO 40 HD2 PRO 40 43.494 -5.940 5.357 245 HD3 PRO 40 HD1 PRO 40 44.311 -4.831 6.480 246 H ARG 41 HN ARG 41 43.767 -9.158 5.439 247 HA ARG 41 HA ARG 41 45.918 -11.055 4.705 248 HB2 ARG 41 HB2 ARG 41 44.212 -12.934 4.899 249 HB3 ARG 41 HB1 ARG 41 44.787 -12.274 6.431 250 HG2 ARG 41 HG2 ARG 41 42.539 -10.724 5.536 251 HG3 ARG 41 HG1 ARG 41 42.104 -12.433 5.509 252 HD2 ARG 41 HD2 ARG 41 41.753 -11.162 7.729 253 HD3 ARG 41 HD1 ARG 41 42.589 -12.713 7.810 254 HE ARG 41 HE ARG 41 44.555 -10.694 7.472 255 HH11 ARG 41 HH11 ARG 41 45.690 -9.949 9.278 256 HH12 ARG 41 HH12 ARG 41 45.018 -10.173 10.859 257 HH21 ARG 41 HH21 ARG 41 42.162 -11.767 9.709 258 HH22 ARG 41 HH22 ARG 41 43.020 -11.202 11.103 259 H LEU 42 HN LEU 42 45.047 -8.986 3.106 260 HA LEU 42 HA LEU 42 43.872 -10.472 0.862 261 HB2 LEU 42 HB2 LEU 42 42.098 -9.149 2.439 262 HB3 LEU 42 HB1 LEU 42 42.548 -7.858 1.326 263 HG LEU 42 HG LEU 42 40.621 -9.111 0.452 264 HD11 LEU 42 HD11 LEU 42 41.630 -9.779 -1.748 265 HD12 LEU 42 HD12 LEU 42 43.227 -9.578 -1.027 266 HD13 LEU 42 HD13 LEU 42 42.152 -8.189 -1.191 267 HD21 LEU 42 HD21 LEU 42 40.514 -11.389 0.408 268 HD22 LEU 42 HD22 LEU 42 41.801 -11.295 1.610 269 HD23 LEU 42 HD23 LEU 42 42.198 -11.552 -0.089 270 H ASP 43 HN ASP 43 46.432 -9.627 0.950 271 HA ASP 43 HA ASP 43 47.025 -6.976 0.187 272 HB2 ASP 43 HB2 ASP 43 48.895 -8.310 -1.213 273 HB3 ASP 43 HB1 ASP 43 48.970 -8.149 0.542 274 HA PRO 44 HA PRO 44 44.958 -6.976 -3.789 275 HB2 PRO 44 HB2 PRO 44 45.555 -4.406 -4.464 276 HB3 PRO 44 HB1 PRO 44 44.310 -4.822 -3.270 277 HG2 PRO 44 HG2 PRO 44 47.087 -3.851 -2.852 278 HG3 PRO 44 HG1 PRO 44 45.610 -3.481 -1.946 279 HD2 PRO 44 HD2 PRO 44 47.533 -5.285 -1.104 280 HD3 PRO 44 HD1 PRO 44 45.835 -5.318 -0.583 281 H ARG 45 HN ARG 45 46.041 -5.261 -5.860 282 HA ARG 45 HA ARG 45 48.086 -7.046 -6.906 283 HB2 ARG 45 HB2 ARG 45 48.134 -5.249 -8.768 284 HB3 ARG 45 HB1 ARG 45 46.634 -6.151 -8.547 285 HG2 ARG 45 HG2 ARG 45 45.669 -4.341 -7.249 286 HG3 ARG 45 HG1 ARG 45 47.197 -3.458 -7.276 287 HD2 ARG 45 HD2 ARG 45 45.581 -2.597 -8.965 288 HD3 ARG 45 HD1 ARG 45 47.055 -3.219 -9.705 289 HE ARG 45 HE ARG 45 45.713 -4.809 -10.794 290 HH11 ARG 45 HH11 ARG 45 43.830 -6.019 -11.099 291 HH12 ARG 45 HH12 ARG 45 42.557 -5.927 -9.927 292 HH21 ARG 45 HH21 ARG 45 44.239 -3.681 -7.889 293 HH22 ARG 45 HH22 ARG 45 42.790 -4.603 -8.109 294 H GLY 46 HN GLY 46 50.294 -6.643 -7.085 295 HA2 GLY 46 HA2 GLY 46 52.341 -5.764 -6.312 296 HA3 GLY 46 HA1 GLY 46 51.684 -4.249 -6.934 297 H GLY 47 HN GLY 47 51.513 -2.651 -5.447 298 HA2 GLY 47 HA2 GLY 47 50.393 -3.005 -2.837 299 HA3 GLY 47 HA1 GLY 47 52.152 -2.957 -2.709 300 H GLY 48 HN GLY 48 52.913 -0.949 -2.297 301 HA2 GLY 48 HA2 GLY 48 52.709 1.338 -3.773 302 HA3 GLY 48 HA1 GLY 48 51.233 1.401 -2.810 303 H GLY 49 HN GLY 49 52.949 3.426 -2.359 304 HA2 GLY 49 HA2 GLY 49 54.912 2.831 -0.300 305 HA3 GLY 49 HA1 GLY 49 54.359 4.441 -0.765 306 H ASN 50 HN ASN 50 53.696 5.373 1.129 307 HA ASN 50 HA ASN 50 52.045 3.749 3.000 308 HB2 ASN 50 HB2 ASN 50 53.903 6.018 3.279 309 HB3 ASN 50 HB1 ASN 50 52.427 6.176 4.231 310 HD21 ASN 50 HD21 ASN 50 53.996 5.858 6.126 311 HD22 ASN 50 HD22 ASN 50 54.389 4.267 6.570 312 H ARG 51 HN ARG 51 50.452 5.522 4.211 313 HA ARG 51 HA ARG 51 49.079 7.148 2.149 314 HB2 ARG 51 HB2 ARG 51 48.165 4.691 2.329 315 HB3 ARG 51 HB1 ARG 51 47.429 5.274 3.822 316 HG2 ARG 51 HG2 ARG 51 45.810 5.610 2.079 317 HG3 ARG 51 HG1 ARG 51 46.467 7.197 2.476 318 HD2 ARG 51 HD2 ARG 51 46.272 6.427 -0.048 319 HD3 ARG 51 HD1 ARG 51 47.675 7.345 0.497 320 HE ARG 51 HE ARG 51 48.996 5.428 0.119 321 HH11 ARG 51 HH11 ARG 51 49.289 3.264 -0.463 322 HH12 ARG 51 HH12 ARG 51 47.916 2.213 -0.560 323 HH21 ARG 51 HH21 ARG 51 45.640 4.669 0.339 324 HH22 ARG 51 HH22 ARG 51 45.850 3.008 -0.107 325 H GLN 52 HN GLN 52 48.048 8.936 3.047 326 HA GLN 52 HA GLN 52 48.797 9.817 5.634 327 HB2 GLN 52 HB2 GLN 52 47.019 10.734 3.496 328 HB3 GLN 52 HB1 GLN 52 46.431 11.168 5.101 329 HG2 GLN 52 HG2 GLN 52 48.733 12.057 5.620 330 HG3 GLN 52 HG1 GLN 52 49.153 11.794 3.927 331 HE21 GLN 52 HE21 GLN 52 49.410 14.174 3.681 332 HE22 GLN 52 HE22 GLN 52 48.039 15.166 3.545 333 HA PRO 53 HA PRO 53 46.200 8.064 8.702 334 HB2 PRO 53 HB2 PRO 53 44.882 10.723 9.058 335 HB3 PRO 53 HB1 PRO 53 45.618 9.657 10.271 336 HG2 PRO 53 HG2 PRO 53 46.849 11.859 9.388 337 HG3 PRO 53 HG1 PRO 53 47.738 10.393 9.830 338 HD2 PRO 53 HD2 PRO 53 47.230 11.531 7.135 339 HD3 PRO 53 HD1 PRO 53 48.542 10.465 7.683 340 HA PRO 54 HA PRO 54 42.268 7.595 6.536 341 HB2 PRO 54 HB2 PRO 54 41.754 5.113 7.326 342 HB3 PRO 54 HB1 PRO 54 43.162 5.451 6.301 343 HG2 PRO 54 HG2 PRO 54 43.047 4.818 9.192 344 HG3 PRO 54 HG1 PRO 54 44.313 4.463 8.006 345 HD2 PRO 54 HD2 PRO 54 44.233 6.666 9.855 346 HD3 PRO 54 HD1 PRO 54 45.452 6.340 8.601 347 HA PRO 55 HA PRO 55 40.405 7.969 11.112 348 HB2 PRO 55 HB2 PRO 55 39.944 10.770 10.228 349 HB3 PRO 55 HB1 PRO 55 40.412 10.149 11.818 350 HG2 PRO 55 HG2 PRO 55 42.131 11.377 10.129 351 HG3 PRO 55 HG1 PRO 55 42.619 10.169 11.325 352 HD2 PRO 55 HD2 PRO 55 42.497 9.931 8.389 353 HD3 PRO 55 HD1 PRO 55 43.390 8.948 9.569 354 HA PRO 56 HA PRO 56 36.758 9.769 8.182 355 HB2 PRO 56 HB2 PRO 56 37.953 8.490 5.752 356 HB3 PRO 56 HB1 PRO 56 36.958 9.954 5.883 357 HG2 PRO 56 HG2 PRO 56 39.583 10.109 5.533 358 HG3 PRO 56 HG1 PRO 56 38.723 11.255 6.575 359 HD2 PRO 56 HD2 PRO 56 40.518 9.008 7.334 360 HD3 PRO 56 HD1 PRO 56 40.203 10.533 8.185 361 H TYR 57 HN TYR 57 35.866 7.951 6.079 362 HA TYR 57 HA TYR 57 35.770 5.343 6.109 363 HB2 TYR 57 HB2 TYR 57 36.080 4.902 8.398 364 HB3 TYR 57 HB1 TYR 57 34.968 6.183 8.887 365 HD1 TYR 57 HD1 TYR 57 33.576 4.748 10.275 366 HD2 TYR 57 HD2 TYR 57 34.205 3.860 6.119 367 HE1 TYR 57 HE1 TYR 57 31.706 3.122 10.339 368 HE2 TYR 57 HE2 TYR 57 32.337 2.234 6.185 369 HH TYR 57 HH TYR 57 30.178 2.024 8.876 370 HA PRO 58 HA PRO 58 31.813 7.217 4.759 371 HB2 PRO 58 HB2 PRO 58 31.930 6.351 2.191 372 HB3 PRO 58 HB1 PRO 58 32.787 7.800 2.749 373 HG2 PRO 58 HG2 PRO 58 33.834 5.094 2.157 374 HG3 PRO 58 HG1 PRO 58 34.601 6.675 1.952 375 HD2 PRO 58 HD2 PRO 58 35.080 4.903 4.070 376 HD3 PRO 58 HD1 PRO 58 35.503 6.627 4.053 377 H LEU 59 HN LEU 59 30.110 6.008 5.514 378 HA LEU 59 HA LEU 59 30.045 3.136 5.474 379 HB2 LEU 59 HB2 LEU 59 28.226 5.328 6.259 380 HB3 LEU 59 HB1 LEU 59 27.418 3.845 5.749 381 HG LEU 59 HG LEU 59 29.718 3.759 7.695 382 HD11 LEU 59 HD11 LEU 59 28.258 4.039 9.538 383 HD12 LEU 59 HD12 LEU 59 26.820 3.870 8.532 384 HD13 LEU 59 HD13 LEU 59 27.802 5.331 8.428 385 HD21 LEU 59 HD21 LEU 59 28.325 1.713 8.411 386 HD22 LEU 59 HD22 LEU 59 29.132 1.614 6.847 387 HD23 LEU 59 HD23 LEU 59 27.407 1.967 6.927 388 H THR 60 HN THR 60 28.764 1.742 4.145 389 HA THR 60 HA THR 60 27.987 2.966 1.527 390 HB THR 60 HB THR 60 28.707 0.064 1.969 391 HG1 THR 60 HG1 THR 60 30.747 0.569 1.812 392 HG21 THR 60 HG21 THR 60 27.453 0.742 -0.089 393 HG22 THR 60 HG22 THR 60 29.051 0.080 -0.435 394 HG23 THR 60 HG23 THR 60 28.785 1.822 -0.496 395 H ALA 61 HN ALA 61 26.141 3.000 3.627 396 HA ALA 61 HA ALA 61 24.142 1.031 2.615 397 HB1 ALA 61 HB1 ALA 61 24.016 1.741 5.502 398 HB2 ALA 61 HB2 ALA 61 25.304 0.638 5.018 399 HB3 ALA 61 HB3 ALA 61 23.620 0.221 4.700 Start of MODEL 10 1 H1 SER 8 HT1 SER 8 35.467 -9.495 -3.648 2 H2 SER 8 HT2 SER 8 35.484 -11.094 -4.225 3 H3 SER 8 HT3 SER 8 36.730 -10.540 -3.212 4 HA SER 8 HA SER 8 34.017 -11.386 -2.544 5 HB2 SER 8 HB2 SER 8 35.375 -11.990 -0.417 6 HB3 SER 8 HB1 SER 8 35.713 -12.892 -1.892 7 HG SER 8 HG SER 8 37.195 -10.701 -1.923 8 H GLY 9 HN GLY 9 32.686 -9.784 -1.818 9 HA2 GLY 9 HA2 GLY 9 33.490 -7.249 -0.851 10 HA3 GLY 9 HA1 GLY 9 31.927 -7.990 -0.508 11 HA PRO 10 HA PRO 10 32.683 -8.318 3.809 12 HB2 PRO 10 HB2 PRO 10 32.143 -11.236 3.409 13 HB3 PRO 10 HB1 PRO 10 31.455 -10.118 4.600 14 HG2 PRO 10 HG2 PRO 10 30.115 -10.891 2.405 15 HG3 PRO 10 HG1 PRO 10 29.912 -9.292 3.140 16 HD2 PRO 10 HD2 PRO 10 31.193 -10.005 0.580 17 HD3 PRO 10 HD1 PRO 10 30.597 -8.428 1.140 18 H LEU 11 HN LEU 11 34.785 -8.221 4.537 19 HA LEU 11 HA LEU 11 36.755 -10.175 3.543 20 HB2 LEU 11 HB2 LEU 11 36.892 -7.652 5.202 21 HB3 LEU 11 HB1 LEU 11 38.293 -8.687 4.987 22 HG LEU 11 HG LEU 11 36.673 -7.533 2.708 23 HD11 LEU 11 HD11 LEU 11 39.466 -6.669 3.151 24 HD12 LEU 11 HD12 LEU 11 38.303 -6.087 4.343 25 HD13 LEU 11 HD13 LEU 11 38.066 -5.731 2.633 26 HD21 LEU 11 HD21 LEU 11 39.034 -9.353 2.937 27 HD22 LEU 11 HD22 LEU 11 39.022 -8.187 1.615 28 HD23 LEU 11 HD23 LEU 11 37.718 -9.366 1.763 29 HA PRO 12 HA PRO 12 37.733 -12.927 6.939 30 HB2 PRO 12 HB2 PRO 12 38.693 -10.579 8.546 31 HB3 PRO 12 HB1 PRO 12 39.377 -12.214 8.433 32 HG2 PRO 12 HG2 PRO 12 40.197 -10.010 6.945 33 HG3 PRO 12 HG1 PRO 12 40.551 -11.703 6.573 34 HD2 PRO 12 HD2 PRO 12 38.999 -9.965 4.982 35 HD3 PRO 12 HD1 PRO 12 39.067 -11.728 4.818 36 H ASP 13 HN ASP 13 36.539 -9.809 8.256 37 HA ASP 13 HA ASP 13 33.971 -10.353 8.874 38 HB2 ASP 13 HB2 ASP 13 34.168 -12.411 9.917 39 HB3 ASP 13 HB1 ASP 13 35.749 -12.030 10.601 40 H GLY 14 HN GLY 14 33.529 -8.282 9.363 41 HA2 GLY 14 HA2 GLY 14 33.305 -6.618 11.146 42 HA3 GLY 14 HA1 GLY 14 34.900 -7.093 11.728 43 H TRP 15 HN TRP 15 35.045 -7.017 8.400 44 HA TRP 15 HA TRP 15 35.390 -4.138 8.096 45 HB2 TRP 15 HB2 TRP 15 37.710 -4.021 7.950 46 HB3 TRP 15 HB1 TRP 15 37.467 -5.115 9.307 47 HD1 TRP 15 HD1 TRP 15 37.321 -7.870 8.365 48 HE1 TRP 15 HE1 TRP 15 39.039 -8.981 6.804 49 HE3 TRP 15 HE3 TRP 15 39.405 -3.721 6.267 50 HZ2 TRP 15 HZ2 TRP 15 41.044 -8.208 4.908 51 HZ3 TRP 15 HZ3 TRP 15 41.210 -3.929 4.595 52 HH2 TRP 15 HH2 TRP 15 42.036 -6.163 3.907 53 H GLU 16 HN GLU 16 36.300 -3.633 5.837 54 HA GLU 16 HA GLU 16 36.162 -5.784 3.861 55 HB2 GLU 16 HB2 GLU 16 33.791 -4.154 4.512 56 HB3 GLU 16 HB1 GLU 16 34.181 -4.219 2.793 57 HG2 GLU 16 HG2 GLU 16 34.386 -6.764 3.106 58 HG3 GLU 16 HG1 GLU 16 33.585 -6.518 4.658 59 H GLN 17 HN GLN 17 36.408 -4.870 1.608 60 HA GLN 17 HA GLN 17 38.146 -2.484 1.704 61 HB2 GLN 17 HB2 GLN 17 38.938 -4.493 0.494 62 HB3 GLN 17 HB1 GLN 17 37.539 -4.391 -0.576 63 HG2 GLN 17 HG2 GLN 17 38.270 -2.152 -1.319 64 HG3 GLN 17 HG1 GLN 17 39.676 -2.261 -0.260 65 HE21 GLN 17 HE21 GLN 17 41.354 -2.430 -1.816 66 HE22 GLN 17 HE22 GLN 17 41.446 -3.677 -2.965 67 H ALA 18 HN ALA 18 37.629 -0.552 0.638 68 HA ALA 18 HA ALA 18 35.225 -0.454 -1.057 69 HB1 ALA 18 HB1 ALA 18 34.088 -0.087 0.968 70 HB2 ALA 18 HB2 ALA 18 34.413 1.548 0.393 71 HB3 ALA 18 HB3 ALA 18 35.422 0.837 1.655 72 H MET 19 HN MET 19 34.902 2.238 -1.319 73 HA MET 19 HA MET 19 37.616 3.306 -1.892 74 HB2 MET 19 HB2 MET 19 36.656 4.232 -4.046 75 HB3 MET 19 HB1 MET 19 36.839 2.478 -4.014 76 HG2 MET 19 HG2 MET 19 34.503 2.154 -3.578 77 HG3 MET 19 HG1 MET 19 34.259 3.871 -3.262 78 HE1 MET 19 HE1 MET 19 32.925 5.120 -4.909 79 HE2 MET 19 HE2 MET 19 32.208 3.512 -4.819 80 HE3 MET 19 HE3 MET 19 32.380 4.308 -6.382 81 H THR 20 HN THR 20 37.605 5.695 -2.177 82 HA THR 20 HA THR 20 35.583 6.913 -0.385 83 HB THR 20 HB THR 20 37.363 8.903 -0.822 84 HG1 THR 20 HG1 THR 20 38.982 6.609 -0.847 85 HG21 THR 20 HG21 THR 20 38.645 7.799 1.176 86 HG22 THR 20 HG22 THR 20 37.365 6.589 1.094 87 HG23 THR 20 HG23 THR 20 36.963 8.279 1.396 88 H GLN 21 HN GLN 21 35.814 9.584 -1.334 89 HA GLN 21 HA GLN 21 34.076 9.396 -3.696 90 HB2 GLN 21 HB2 GLN 21 35.065 11.756 -2.065 91 HB3 GLN 21 HB1 GLN 21 33.956 11.897 -3.429 92 HG2 GLN 21 HG2 GLN 21 33.148 9.861 -1.470 93 HG3 GLN 21 HG1 GLN 21 33.191 11.496 -0.809 94 HE21 GLN 21 HE21 GLN 21 31.328 9.333 -2.719 95 HE22 GLN 21 HE22 GLN 21 30.207 10.462 -3.312 96 H ASP 22 HN ASP 22 37.382 9.640 -3.098 97 HA ASP 22 HA ASP 22 37.855 10.864 -5.764 98 HB2 ASP 22 HB2 ASP 22 38.847 12.064 -3.782 99 HB3 ASP 22 HB1 ASP 22 39.818 10.626 -3.471 100 H GLY 23 HN GLY 23 37.274 8.039 -4.800 101 HA2 GLY 23 HA2 GLY 23 37.964 5.872 -5.349 102 HA3 GLY 23 HA1 GLY 23 38.811 6.626 -6.699 103 H GLU 24 HN GLU 24 39.384 7.126 -3.228 104 HA GLU 24 HA GLU 24 42.238 6.607 -3.648 105 HB2 GLU 24 HB2 GLU 24 40.886 7.099 -1.003 106 HB3 GLU 24 HB1 GLU 24 42.550 7.464 -1.462 107 HG2 GLU 24 HG2 GLU 24 41.308 8.945 -3.310 108 HG3 GLU 24 HG1 GLU 24 40.040 8.952 -2.083 109 H ILE 25 HN ILE 25 39.978 4.571 -3.668 110 HA ILE 25 HA ILE 25 39.446 2.497 -2.559 111 HB ILE 25 HB ILE 25 40.814 1.884 -4.444 112 HG12 ILE 25 HG12 ILE 25 41.902 -0.146 -3.552 113 HG13 ILE 25 HG11 ILE 25 41.825 0.526 -1.922 114 HG21 ILE 25 HG21 ILE 25 43.214 1.945 -4.419 115 HG22 ILE 25 HG22 ILE 25 43.248 2.306 -2.694 116 HG23 ILE 25 HG23 ILE 25 42.667 3.516 -3.837 117 HD11 ILE 25 HD11 ILE 25 39.910 -1.099 -2.959 118 HD12 ILE 25 HD12 ILE 25 39.257 0.481 -3.394 119 HD13 ILE 25 HD13 ILE 25 39.597 0.102 -1.705 120 H TYR 26 HN TYR 26 39.202 2.323 -0.398 121 HA TYR 26 HA TYR 26 41.652 1.983 1.223 122 HB2 TYR 26 HB2 TYR 26 40.944 3.473 2.947 123 HB3 TYR 26 HB1 TYR 26 40.793 4.360 1.436 124 HD1 TYR 26 HD1 TYR 26 39.355 5.152 3.916 125 HD2 TYR 26 HD2 TYR 26 38.206 2.468 0.765 126 HE1 TYR 26 HE1 TYR 26 36.967 5.587 4.415 127 HE2 TYR 26 HE2 TYR 26 35.822 2.904 1.267 128 HH TYR 26 HH TYR 26 34.725 5.432 2.933 129 H TYR 27 HN TYR 27 40.854 1.229 3.565 130 HA TYR 27 HA TYR 27 38.811 -0.885 3.037 131 HB2 TYR 27 HB2 TYR 27 41.123 -0.862 4.999 132 HB3 TYR 27 HB1 TYR 27 39.945 -2.166 4.837 133 HD1 TYR 27 HD1 TYR 27 39.781 -3.448 2.699 134 HD2 TYR 27 HD2 TYR 27 42.900 -0.586 3.413 135 HE1 TYR 27 HE1 TYR 27 41.083 -4.400 0.821 136 HE2 TYR 27 HE2 TYR 27 44.204 -1.536 1.537 137 HH TYR 27 HH TYR 27 44.385 -3.371 0.166 138 H ILE 28 HN ILE 28 37.400 -1.450 4.824 139 HA ILE 28 HA ILE 28 37.056 0.741 6.798 140 HB ILE 28 HB ILE 28 35.209 1.212 5.597 141 HG12 ILE 28 HG12 ILE 28 33.224 -0.019 6.274 142 HG13 ILE 28 HG11 ILE 28 34.200 -1.420 6.713 143 HG21 ILE 28 HG21 ILE 28 34.227 -0.308 3.937 144 HG22 ILE 28 HG22 ILE 28 35.239 -1.624 4.533 145 HG23 ILE 28 HG23 ILE 28 35.978 -0.231 3.741 146 HD11 ILE 28 HD11 ILE 28 34.380 -0.568 8.779 147 HD12 ILE 28 HD12 ILE 28 33.578 0.919 8.284 148 HD13 ILE 28 HD13 ILE 28 35.323 0.758 8.104 149 H ASN 29 HN ASN 29 36.988 0.051 8.879 150 HA ASN 29 HA ASN 29 36.679 -2.881 9.346 151 HB2 ASN 29 HB2 ASN 29 38.599 -1.073 10.250 152 HB3 ASN 29 HB1 ASN 29 37.539 -1.299 11.641 153 HD21 ASN 29 HD21 ASN 29 36.881 -3.833 11.847 154 HD22 ASN 29 HD22 ASN 29 38.199 -4.898 11.743 155 H HIS 30 HN HIS 30 34.529 -3.265 9.711 156 HA HIS 30 HA HIS 30 32.745 -1.376 10.944 157 HB2 HIS 30 HB2 HIS 30 32.511 -4.378 10.575 158 HB3 HIS 30 HB1 HIS 30 31.192 -3.328 11.097 159 HD1 HIS 30 HD1 HIS 30 31.008 -1.086 9.323 160 HD2 HIS 30 HD2 HIS 30 32.393 -4.731 7.840 161 HE1 HIS 30 HE1 HIS 30 30.717 -0.996 6.807 162 HE2 HIS 30 HE2 HIS 30 31.552 -3.210 5.896 163 H LYS 31 HN LYS 31 35.287 -2.931 12.300 164 HA LYS 31 HA LYS 31 33.992 -3.649 14.842 165 HB2 LYS 31 HB2 LYS 31 36.620 -4.073 13.584 166 HB3 LYS 31 HB1 LYS 31 36.701 -3.734 15.313 167 HG2 LYS 31 HG2 LYS 31 34.757 -5.757 14.200 168 HG3 LYS 31 HG1 LYS 31 36.415 -6.202 14.605 169 HD2 LYS 31 HD2 LYS 31 35.120 -4.632 16.712 170 HD3 LYS 31 HD1 LYS 31 34.286 -6.152 16.381 171 HE2 LYS 31 HE2 LYS 31 36.551 -7.295 16.515 172 HE3 LYS 31 HE1 LYS 31 37.193 -5.773 17.133 173 HZ1 LYS 31 HZ1 LYS 31 36.624 -6.839 19.059 174 HZ2 LYS 31 HZ2 LYS 31 35.284 -7.626 18.374 175 HZ3 LYS 31 HZ3 LYS 31 35.196 -5.974 18.760 176 H ASN 32 HN ASN 32 36.151 -1.168 13.545 177 HA ASN 32 HA ASN 32 35.752 0.375 16.064 178 HB2 ASN 32 HB2 ASN 32 38.131 -0.295 15.512 179 HB3 ASN 32 HB1 ASN 32 38.007 0.714 14.070 180 HD21 ASN 32 HD21 ASN 32 38.939 2.724 14.439 181 HD22 ASN 32 HD22 ASN 32 38.861 3.587 15.900 182 H LYS 33 HN LYS 33 34.238 0.166 13.371 183 HA LYS 33 HA LYS 33 33.259 1.627 11.811 184 HB2 LYS 33 HB2 LYS 33 33.340 3.148 14.415 185 HB3 LYS 33 HB1 LYS 33 32.592 3.839 12.975 186 HG2 LYS 33 HG2 LYS 33 30.736 2.761 13.769 187 HG3 LYS 33 HG1 LYS 33 31.459 1.378 12.949 188 HD2 LYS 33 HD2 LYS 33 32.766 1.167 15.273 189 HD3 LYS 33 HD1 LYS 33 31.326 1.996 15.867 190 HE2 LYS 33 HE2 LYS 33 31.302 -0.539 14.202 191 HE3 LYS 33 HE1 LYS 33 31.081 -0.478 15.951 192 HZ1 LYS 33 HZ1 LYS 33 29.362 1.370 14.673 193 HZ2 LYS 33 HZ2 LYS 33 28.965 0.059 15.679 194 HZ3 LYS 33 HZ3 LYS 33 29.141 -0.172 14.005 195 H THR 34 HN THR 34 36.091 1.559 11.599 196 HA THR 34 HA THR 34 36.571 4.327 10.636 197 HB THR 34 HB THR 34 39.078 3.397 11.442 198 HG1 THR 34 HG1 THR 34 37.685 1.869 12.684 199 HG21 THR 34 HG21 THR 34 38.599 5.116 13.355 200 HG22 THR 34 HG22 THR 34 37.083 5.376 12.493 201 HG23 THR 34 HG23 THR 34 38.621 5.672 11.682 202 H THR 35 HN THR 35 38.157 4.410 8.876 203 HA THR 35 HA THR 35 38.366 1.804 7.475 204 HB THR 35 HB THR 35 38.877 3.484 5.497 205 HG1 THR 35 HG1 THR 35 37.620 5.007 7.503 206 HG21 THR 35 HG21 THR 35 36.286 2.630 6.720 207 HG22 THR 35 HG22 THR 35 37.000 2.167 5.174 208 HG23 THR 35 HG23 THR 35 36.239 3.742 5.356 209 H SER 36 HN SER 36 40.367 1.535 6.132 210 HA SER 36 HA SER 36 42.688 3.167 6.918 211 HB2 SER 36 HB2 SER 36 42.672 1.726 8.833 212 HB3 SER 36 HB1 SER 36 42.358 0.304 7.842 213 HG SER 36 HG SER 36 44.713 1.697 8.304 214 H TRP 37 HN TRP 37 44.654 2.494 5.720 215 HA TRP 37 HA TRP 37 43.900 1.332 3.098 216 HB2 TRP 37 HB2 TRP 37 46.651 2.360 3.679 217 HB3 TRP 37 HB1 TRP 37 45.696 2.489 2.202 218 HD1 TRP 37 HD1 TRP 37 46.244 4.139 5.582 219 HE1 TRP 37 HE1 TRP 37 45.053 6.425 5.604 220 HE3 TRP 37 HE3 TRP 37 43.682 3.843 1.175 221 HZ2 TRP 37 HZ2 TRP 37 43.251 7.929 3.970 222 HZ3 TRP 37 HZ3 TRP 37 42.237 5.713 0.432 223 HH2 TRP 37 HH2 TRP 37 42.017 7.755 1.822 224 H LEU 38 HN LEU 38 45.080 0.220 5.994 225 HA LEU 38 HA LEU 38 47.288 -1.378 5.532 226 HB2 LEU 38 HB2 LEU 38 44.742 -2.100 7.010 227 HB3 LEU 38 HB1 LEU 38 46.228 -3.047 7.096 228 HG LEU 38 HG LEU 38 46.403 -0.106 7.615 229 HD11 LEU 38 HD11 LEU 38 45.758 -0.379 9.935 230 HD12 LEU 38 HD12 LEU 38 45.512 -2.111 9.708 231 HD13 LEU 38 HD13 LEU 38 44.430 -0.956 8.927 232 HD21 LEU 38 HD21 LEU 38 48.226 -2.100 7.601 233 HD22 LEU 38 HD22 LEU 38 47.709 -2.196 9.285 234 HD23 LEU 38 HD23 LEU 38 48.370 -0.690 8.650 235 H ASP 39 HN ASP 39 47.720 -3.266 4.401 236 HA ASP 39 HA ASP 39 45.469 -4.399 2.811 237 HB2 ASP 39 HB2 ASP 39 47.899 -4.979 1.491 238 HB3 ASP 39 HB1 ASP 39 46.639 -3.863 0.963 239 HA PRO 40 HA PRO 40 47.114 -7.868 5.272 240 HB2 PRO 40 HB2 PRO 40 44.741 -9.154 5.573 241 HB3 PRO 40 HB1 PRO 40 45.210 -7.768 6.576 242 HG2 PRO 40 HG2 PRO 40 43.328 -7.898 4.290 243 HG3 PRO 40 HG1 PRO 40 43.266 -6.906 5.755 244 HD2 PRO 40 HD2 PRO 40 44.111 -6.011 3.246 245 HD3 PRO 40 HD1 PRO 40 44.468 -5.211 4.792 246 H ARG 41 HN ARG 41 44.378 -8.759 3.138 247 HA ARG 41 HA ARG 41 46.249 -10.555 1.672 248 HB2 ARG 41 HB2 ARG 41 44.603 -12.309 1.646 249 HB3 ARG 41 HB1 ARG 41 44.757 -11.776 3.321 250 HG2 ARG 41 HG2 ARG 41 42.819 -10.077 2.277 251 HG3 ARG 41 HG1 ARG 41 42.445 -11.635 1.539 252 HD2 ARG 41 HD2 ARG 41 41.261 -11.636 3.601 253 HD3 ARG 41 HD1 ARG 41 42.688 -12.629 3.894 254 HE ARG 41 HE ARG 41 42.916 -9.767 4.593 255 HH11 ARG 41 HH11 ARG 41 43.413 -9.401 6.768 256 HH12 ARG 41 HH12 ARG 41 43.348 -10.719 7.890 257 HH21 ARG 41 HH21 ARG 41 42.388 -13.048 5.508 258 HH22 ARG 41 HH22 ARG 41 42.767 -12.783 7.177 259 H LEU 42 HN LEU 42 45.628 -8.014 0.738 260 HA LEU 42 HA LEU 42 44.058 -8.695 -1.674 261 HB2 LEU 42 HB2 LEU 42 42.956 -7.178 0.384 262 HB3 LEU 42 HB1 LEU 42 43.518 -5.972 -0.774 263 HG LEU 42 HG LEU 42 41.782 -8.361 -1.464 264 HD11 LEU 42 HD11 LEU 42 40.526 -6.752 -0.136 265 HD12 LEU 42 HD12 LEU 42 40.030 -6.609 -1.823 266 HD13 LEU 42 HD13 LEU 42 41.128 -5.420 -1.122 267 HD21 LEU 42 HD21 LEU 42 41.828 -7.622 -3.665 268 HD22 LEU 42 HD22 LEU 42 43.458 -7.181 -3.156 269 HD23 LEU 42 HD23 LEU 42 42.189 -5.957 -3.207 270 H ASP 43 HN ASP 43 46.825 -8.534 -1.534 271 HA ASP 43 HA ASP 43 47.326 -6.309 -3.377 272 HB2 ASP 43 HB2 ASP 43 47.687 -5.228 -1.195 273 HB3 ASP 43 HB1 ASP 43 48.820 -6.503 -0.745 274 HA PRO 44 HA PRO 44 49.871 -9.743 -4.733 275 HB2 PRO 44 HB2 PRO 44 50.647 -8.646 -7.103 276 HB3 PRO 44 HB1 PRO 44 49.031 -9.332 -6.843 277 HG2 PRO 44 HG2 PRO 44 49.900 -6.493 -6.885 278 HG3 PRO 44 HG1 PRO 44 48.400 -7.227 -7.474 279 HD2 PRO 44 HD2 PRO 44 48.624 -5.866 -5.072 280 HD3 PRO 44 HD1 PRO 44 47.374 -7.079 -5.424 281 H ARG 45 HN ARG 45 52.195 -9.515 -6.149 282 HA ARG 45 HA ARG 45 54.108 -8.709 -4.188 283 HB2 ARG 45 HB2 ARG 45 55.774 -9.009 -6.022 284 HB3 ARG 45 HB1 ARG 45 54.657 -10.368 -5.896 285 HG2 ARG 45 HG2 ARG 45 53.246 -9.247 -7.677 286 HG3 ARG 45 HG1 ARG 45 54.569 -8.103 -7.901 287 HD2 ARG 45 HD2 ARG 45 54.696 -9.982 -9.517 288 HD3 ARG 45 HD1 ARG 45 56.099 -9.939 -8.451 289 HE ARG 45 HE ARG 45 53.894 -11.928 -8.320 290 HH11 ARG 45 HH11 ARG 45 54.454 -13.791 -7.173 291 HH12 ARG 45 HH12 ARG 45 55.952 -13.842 -6.307 292 HH21 ARG 45 HH21 ARG 45 56.893 -10.630 -7.209 293 HH22 ARG 45 HH22 ARG 45 57.332 -12.054 -6.327 294 H GLY 46 HN GLY 46 55.429 -6.850 -4.077 295 HA2 GLY 46 HA2 GLY 46 55.859 -4.548 -4.252 296 HA3 GLY 46 HA1 GLY 46 55.600 -4.776 -5.982 297 H GLY 47 HN GLY 47 54.739 -2.420 -5.267 298 HA2 GLY 47 HA2 GLY 47 52.675 -1.256 -5.715 299 HA3 GLY 47 HA1 GLY 47 51.786 -2.702 -5.237 300 H GLY 48 HN GLY 48 53.753 -0.037 -3.947 301 HA2 GLY 48 HA2 GLY 48 51.999 0.277 -1.672 302 HA3 GLY 48 HA1 GLY 48 53.509 -0.506 -1.202 303 H GLY 49 HN GLY 49 52.624 2.143 -0.384 304 HA2 GLY 49 HA2 GLY 49 55.058 3.595 -0.804 305 HA3 GLY 49 HA1 GLY 49 53.794 4.262 -1.838 306 H ASN 50 HN ASN 50 52.414 2.907 0.906 307 HA ASN 50 HA ASN 50 51.646 3.821 2.941 308 HB2 ASN 50 HB2 ASN 50 54.095 4.969 2.706 309 HB3 ASN 50 HB1 ASN 50 53.070 6.401 2.597 310 HD21 ASN 50 HD21 ASN 50 51.783 6.980 4.475 311 HD22 ASN 50 HD22 ASN 50 52.035 6.254 5.989 312 H ARG 51 HN ARG 51 50.045 5.439 3.569 313 HA ARG 51 HA ARG 51 49.131 7.216 1.360 314 HB2 ARG 51 HB2 ARG 51 47.870 4.973 1.437 315 HB3 ARG 51 HB1 ARG 51 47.192 5.542 2.963 316 HG2 ARG 51 HG2 ARG 51 45.596 6.483 1.642 317 HG3 ARG 51 HG1 ARG 51 46.812 7.732 1.371 318 HD2 ARG 51 HD2 ARG 51 46.376 7.189 -0.825 319 HD3 ARG 51 HD1 ARG 51 47.625 5.989 -0.493 320 HE ARG 51 HE ARG 51 44.709 5.445 -0.663 321 HH11 ARG 51 HH11 ARG 51 44.231 3.256 -0.947 322 HH12 ARG 51 HH12 ARG 51 45.497 2.083 -0.819 323 HH21 ARG 51 HH21 ARG 51 47.966 4.424 -0.157 324 HH22 ARG 51 HH22 ARG 51 47.610 2.742 -0.371 325 H GLN 52 HN GLN 52 47.744 8.973 2.137 326 HA GLN 52 HA GLN 52 48.642 10.175 4.541 327 HB2 GLN 52 HB2 GLN 52 47.114 11.883 4.090 328 HB3 GLN 52 HB1 GLN 52 47.319 11.166 2.491 329 HG2 GLN 52 HG2 GLN 52 45.323 9.684 3.024 330 HG3 GLN 52 HG1 GLN 52 45.054 10.698 4.442 331 HE21 GLN 52 HE21 GLN 52 43.404 10.404 1.892 332 HE22 GLN 52 HE22 GLN 52 43.243 11.989 1.303 333 HA PRO 53 HA PRO 53 46.654 8.304 7.980 334 HB2 PRO 53 HB2 PRO 53 45.414 10.981 8.478 335 HB3 PRO 53 HB1 PRO 53 46.298 9.925 9.595 336 HG2 PRO 53 HG2 PRO 53 47.414 12.097 8.489 337 HG3 PRO 53 HG1 PRO 53 48.341 10.637 8.869 338 HD2 PRO 53 HD2 PRO 53 47.565 11.711 6.227 339 HD3 PRO 53 HD1 PRO 53 48.858 10.567 6.643 340 HA PRO 54 HA PRO 54 42.598 7.536 6.204 341 HB2 PRO 54 HB2 PRO 54 41.928 5.445 7.821 342 HB3 PRO 54 HB1 PRO 54 43.064 5.294 6.467 343 HG2 PRO 54 HG2 PRO 54 43.604 5.510 9.380 344 HG3 PRO 54 HG1 PRO 54 44.443 4.565 8.140 345 HD2 PRO 54 HD2 PRO 54 45.373 6.969 9.148 346 HD3 PRO 54 HD1 PRO 54 45.821 6.312 7.560 347 HA PRO 55 HA PRO 55 40.432 9.857 9.450 348 HB2 PRO 55 HB2 PRO 55 38.585 10.993 7.811 349 HB3 PRO 55 HB1 PRO 55 40.250 11.591 7.937 350 HG2 PRO 55 HG2 PRO 55 38.985 9.943 5.820 351 HG3 PRO 55 HG1 PRO 55 40.230 11.195 5.689 352 HD2 PRO 55 HD2 PRO 55 40.719 8.450 5.639 353 HD3 PRO 55 HD1 PRO 55 41.934 9.694 6.002 354 HA PRO 56 HA PRO 56 37.250 7.007 10.619 355 HB2 PRO 56 HB2 PRO 56 35.644 9.470 11.149 356 HB3 PRO 56 HB1 PRO 56 35.957 8.079 12.203 357 HG2 PRO 56 HG2 PRO 56 37.215 10.438 12.500 358 HG3 PRO 56 HG1 PRO 56 37.970 8.887 12.899 359 HD2 PRO 56 HD2 PRO 56 38.569 10.724 10.665 360 HD3 PRO 56 HD1 PRO 56 39.570 9.433 11.362 361 H TYR 57 HN TYR 57 36.207 5.970 8.958 362 HA TYR 57 HA TYR 57 34.937 7.376 6.776 363 HB2 TYR 57 HB2 TYR 57 34.805 5.318 5.818 364 HB3 TYR 57 HB1 TYR 57 35.847 4.823 7.150 365 HD1 TYR 57 HD1 TYR 57 34.168 4.750 9.478 366 HD2 TYR 57 HD2 TYR 57 33.194 3.678 5.433 367 HE1 TYR 57 HE1 TYR 57 32.400 3.218 10.308 368 HE2 TYR 57 HE2 TYR 57 31.427 2.150 6.263 369 HH TYR 57 HH TYR 57 30.991 0.858 8.422 370 HA PRO 58 HA PRO 58 30.804 8.204 7.978 371 HB2 PRO 58 HB2 PRO 58 29.847 6.020 6.175 372 HB3 PRO 58 HB1 PRO 58 29.337 7.717 6.261 373 HG2 PRO 58 HG2 PRO 58 30.937 6.827 4.319 374 HG3 PRO 58 HG1 PRO 58 31.100 8.454 5.000 375 HD2 PRO 58 HD2 PRO 58 32.858 6.085 5.366 376 HD3 PRO 58 HD1 PRO 58 33.255 7.813 5.476 377 H LEU 59 HN LEU 59 28.597 6.317 8.003 378 HA LEU 59 HA LEU 59 27.602 4.810 9.498 379 HB2 LEU 59 HB2 LEU 59 29.565 3.444 8.315 380 HB3 LEU 59 HB1 LEU 59 30.210 3.442 9.958 381 HG LEU 59 HG LEU 59 28.836 1.466 9.699 382 HD11 LEU 59 HD11 LEU 59 27.089 3.446 11.165 383 HD12 LEU 59 HD12 LEU 59 28.655 2.947 11.804 384 HD13 LEU 59 HD13 LEU 59 27.383 1.751 11.551 385 HD21 LEU 59 HD21 LEU 59 26.287 2.854 9.269 386 HD22 LEU 59 HD22 LEU 59 26.931 1.418 8.471 387 HD23 LEU 59 HD23 LEU 59 27.399 3.023 7.911 388 H THR 60 HN THR 60 27.628 6.791 10.966 389 HA THR 60 HA THR 60 29.636 6.738 13.120 390 HB THR 60 HB THR 60 28.395 8.692 13.990 391 HG1 THR 60 HG1 THR 60 26.598 9.413 12.800 392 HG21 THR 60 HG21 THR 60 28.635 9.029 11.005 393 HG22 THR 60 HG22 THR 60 30.063 8.785 12.013 394 HG23 THR 60 HG23 THR 60 29.025 10.187 12.278 395 H ALA 61 HN ALA 61 28.653 6.907 15.446 396 HA ALA 61 HA ALA 61 26.291 5.122 15.744 397 HB1 ALA 61 HB1 ALA 61 28.588 3.892 15.890 398 HB2 ALA 61 HB2 ALA 61 27.391 3.591 17.149 399 HB3 ALA 61 HB3 ALA 61 28.733 4.694 17.454 Start of MODEL 11 1 H1 SER 8 HT1 SER 8 33.329 -11.464 -2.622 2 H2 SER 8 HT2 SER 8 33.801 -12.862 -3.464 3 H3 SER 8 HT3 SER 8 34.378 -12.579 -1.891 4 HA SER 8 HA SER 8 31.543 -13.078 -2.619 5 HB2 SER 8 HB2 SER 8 33.653 -14.896 -2.378 6 HB3 SER 8 HB1 SER 8 32.843 -14.961 -0.816 7 HG SER 8 HG SER 8 30.922 -14.887 -2.544 8 H GLY 9 HN GLY 9 30.396 -11.798 -1.235 9 HA2 GLY 9 HA2 GLY 9 29.639 -10.886 0.790 10 HA3 GLY 9 HA1 GLY 9 30.515 -12.190 1.594 11 HA PRO 10 HA PRO 10 32.642 -8.124 2.483 12 HB2 PRO 10 HB2 PRO 10 32.628 -8.409 5.211 13 HB3 PRO 10 HB1 PRO 10 31.323 -7.625 4.301 14 HG2 PRO 10 HG2 PRO 10 31.453 -10.357 5.454 15 HG3 PRO 10 HG1 PRO 10 30.079 -9.248 5.319 16 HD2 PRO 10 HD2 PRO 10 30.479 -11.395 3.638 17 HD3 PRO 10 HD1 PRO 10 29.559 -9.943 3.186 18 H LEU 11 HN LEU 11 34.510 -8.069 4.500 19 HA LEU 11 HA LEU 11 36.419 -10.100 3.575 20 HB2 LEU 11 HB2 LEU 11 36.518 -7.553 5.135 21 HB3 LEU 11 HB1 LEU 11 37.829 -8.697 5.365 22 HG LEU 11 HG LEU 11 36.920 -7.905 2.602 23 HD11 LEU 11 HD11 LEU 11 38.068 -6.155 4.518 24 HD12 LEU 11 HD12 LEU 11 37.842 -5.867 2.793 25 HD13 LEU 11 HD13 LEU 11 39.347 -6.572 3.378 26 HD21 LEU 11 HD21 LEU 11 39.615 -8.825 3.646 27 HD22 LEU 11 HD22 LEU 11 39.133 -8.654 1.960 28 HD23 LEU 11 HD23 LEU 11 38.408 -9.911 2.960 29 HA PRO 12 HA PRO 12 37.106 -13.014 6.905 30 HB2 PRO 12 HB2 PRO 12 38.117 -10.762 8.618 31 HB3 PRO 12 HB1 PRO 12 38.722 -12.426 8.487 32 HG2 PRO 12 HG2 PRO 12 39.724 -10.238 7.102 33 HG3 PRO 12 HG1 PRO 12 39.986 -11.935 6.682 34 HD2 PRO 12 HD2 PRO 12 38.594 -10.046 5.106 35 HD3 PRO 12 HD1 PRO 12 38.583 -11.803 4.871 36 H ASP 13 HN ASP 13 36.047 -9.878 8.275 37 HA ASP 13 HA ASP 13 33.430 -10.273 8.789 38 HB2 ASP 13 HB2 ASP 13 33.462 -12.370 9.775 39 HB3 ASP 13 HB1 ASP 13 35.036 -12.106 10.527 40 H GLY 14 HN GLY 14 33.128 -8.179 9.308 41 HA2 GLY 14 HA2 GLY 14 32.966 -6.585 11.184 42 HA3 GLY 14 HA1 GLY 14 34.556 -7.139 11.716 43 H TRP 15 HN TRP 15 34.879 -7.061 8.474 44 HA TRP 15 HA TRP 15 35.195 -4.164 8.179 45 HB2 TRP 15 HB2 TRP 15 37.532 -4.093 7.975 46 HB3 TRP 15 HB1 TRP 15 37.249 -5.091 9.395 47 HD1 TRP 15 HD1 TRP 15 37.027 -7.909 8.584 48 HE1 TRP 15 HE1 TRP 15 38.778 -9.139 7.159 49 HE3 TRP 15 HE3 TRP 15 39.305 -3.925 6.364 50 HZ2 TRP 15 HZ2 TRP 15 40.882 -8.516 5.315 51 HZ3 TRP 15 HZ3 TRP 15 41.170 -4.265 4.784 52 HH2 TRP 15 HH2 TRP 15 41.967 -6.553 4.250 53 H GLU 16 HN GLU 16 36.255 -3.688 5.927 54 HA GLU 16 HA GLU 16 35.983 -5.796 3.925 55 HB2 GLU 16 HB2 GLU 16 33.680 -4.158 4.652 56 HB3 GLU 16 HB1 GLU 16 34.086 -4.009 2.942 57 HG2 GLU 16 HG2 GLU 16 34.199 -6.553 2.875 58 HG3 GLU 16 HG1 GLU 16 33.469 -6.538 4.481 59 H GLN 17 HN GLN 17 36.354 -4.925 1.710 60 HA GLN 17 HA GLN 17 38.181 -2.613 1.796 61 HB2 GLN 17 HB2 GLN 17 38.905 -4.638 0.603 62 HB3 GLN 17 HB1 GLN 17 37.485 -4.548 -0.436 63 HG2 GLN 17 HG2 GLN 17 38.238 -2.549 -1.478 64 HG3 GLN 17 HG1 GLN 17 39.457 -2.269 -0.233 65 HE21 GLN 17 HE21 GLN 17 39.380 -3.055 -3.369 66 HE22 GLN 17 HE22 GLN 17 40.662 -4.164 -3.460 67 H ALA 18 HN ALA 18 37.622 -0.615 0.977 68 HA ALA 18 HA ALA 18 35.244 -0.432 -0.788 69 HB1 ALA 18 HB1 ALA 18 34.916 1.798 0.747 70 HB2 ALA 18 HB2 ALA 18 35.527 0.659 1.946 71 HB3 ALA 18 HB3 ALA 18 34.067 0.280 1.031 72 H MET 19 HN MET 19 35.103 2.249 -1.181 73 HA MET 19 HA MET 19 37.861 3.146 -1.819 74 HB2 MET 19 HB2 MET 19 37.534 2.864 -4.027 75 HB3 MET 19 HB1 MET 19 35.917 2.237 -3.719 76 HG2 MET 19 HG2 MET 19 35.028 4.536 -3.659 77 HG3 MET 19 HG1 MET 19 36.647 5.171 -3.955 78 HE1 MET 19 HE1 MET 19 35.643 6.489 -6.329 79 HE2 MET 19 HE2 MET 19 34.261 5.944 -5.382 80 HE3 MET 19 HE3 MET 19 34.309 5.634 -7.115 81 H THR 20 HN THR 20 37.965 5.506 -2.226 82 HA THR 20 HA THR 20 35.926 6.919 -0.606 83 HB THR 20 HB THR 20 37.805 8.804 -1.095 84 HG1 THR 20 HG1 THR 20 39.209 7.649 -2.260 85 HG21 THR 20 HG21 THR 20 38.980 7.500 0.994 86 HG22 THR 20 HG22 THR 20 37.379 6.760 0.994 87 HG23 THR 20 HG23 THR 20 37.542 8.510 1.146 88 H GLN 21 HN GLN 21 36.290 9.507 -1.690 89 HA GLN 21 HA GLN 21 34.656 9.250 -4.118 90 HB2 GLN 21 HB2 GLN 21 35.424 11.443 -2.249 91 HB3 GLN 21 HB1 GLN 21 35.041 11.905 -3.908 92 HG2 GLN 21 HG2 GLN 21 32.833 11.365 -3.689 93 HG3 GLN 21 HG1 GLN 21 33.172 9.975 -2.658 94 HE21 GLN 21 HE21 GLN 21 34.427 13.230 -1.976 95 HE22 GLN 21 HE22 GLN 21 33.500 13.479 -0.577 96 H ASP 22 HN ASP 22 37.933 9.348 -3.404 97 HA ASP 22 HA ASP 22 38.576 10.462 -6.081 98 HB2 ASP 22 HB2 ASP 22 39.557 11.630 -4.048 99 HB3 ASP 22 HB1 ASP 22 40.476 10.155 -3.747 100 H GLY 23 HN GLY 23 37.817 7.697 -5.013 101 HA2 GLY 23 HA2 GLY 23 38.410 5.475 -5.456 102 HA3 GLY 23 HA1 GLY 23 39.275 6.130 -6.846 103 H GLU 24 HN GLU 24 39.800 6.459 -3.324 104 HA GLU 24 HA GLU 24 42.660 5.867 -3.784 105 HB2 GLU 24 HB2 GLU 24 41.380 6.650 -1.172 106 HB3 GLU 24 HB1 GLU 24 43.065 6.844 -1.659 107 HG2 GLU 24 HG2 GLU 24 41.875 8.262 -3.621 108 HG3 GLU 24 HG1 GLU 24 40.697 8.507 -2.331 109 H ILE 25 HN ILE 25 40.248 4.010 -3.612 110 HA ILE 25 HA ILE 25 39.605 2.043 -2.402 111 HB ILE 25 HB ILE 25 40.989 1.229 -4.206 112 HG12 ILE 25 HG12 ILE 25 41.897 -0.806 -3.165 113 HG13 ILE 25 HG11 ILE 25 41.849 -0.029 -1.582 114 HG21 ILE 25 HG21 ILE 25 43.371 1.675 -2.385 115 HG22 ILE 25 HG22 ILE 25 42.927 2.749 -3.711 116 HG23 ILE 25 HG23 ILE 25 43.403 1.085 -4.046 117 HD11 ILE 25 HD11 ILE 25 39.601 -0.306 -1.369 118 HD12 ILE 25 HD12 ILE 25 39.828 -1.563 -2.581 119 HD13 ILE 25 HD13 ILE 25 39.299 0.042 -3.071 120 H TYR 26 HN TYR 26 39.295 1.993 -0.247 121 HA TYR 26 HA TYR 26 41.704 1.884 1.493 122 HB2 TYR 26 HB2 TYR 26 40.610 3.263 3.156 123 HB3 TYR 26 HB1 TYR 26 40.570 4.125 1.620 124 HD1 TYR 26 HD1 TYR 26 38.526 4.912 0.781 125 HD2 TYR 26 HD2 TYR 26 38.532 1.767 3.703 126 HE1 TYR 26 HE1 TYR 26 36.052 5.030 0.920 127 HE2 TYR 26 HE2 TYR 26 36.059 1.882 3.835 128 HH TYR 26 HH TYR 26 34.173 3.507 1.564 129 H TYR 27 HN TYR 27 40.892 1.104 3.805 130 HA TYR 27 HA TYR 27 39.031 -1.191 3.334 131 HB2 TYR 27 HB2 TYR 27 41.433 -0.975 5.172 132 HB3 TYR 27 HB1 TYR 27 40.284 -2.311 5.212 133 HD1 TYR 27 HD1 TYR 27 43.252 -1.054 3.697 134 HD2 TYR 27 HD2 TYR 27 39.814 -3.513 2.952 135 HE1 TYR 27 HE1 TYR 27 44.435 -2.134 1.809 136 HE2 TYR 27 HE2 TYR 27 40.995 -4.597 1.067 137 HH TYR 27 HH TYR 27 43.943 -4.788 0.608 138 H ILE 28 HN ILE 28 37.467 -1.575 4.968 139 HA ILE 28 HA ILE 28 37.285 0.569 7.022 140 HB ILE 28 HB ILE 28 35.501 1.223 5.812 141 HG12 ILE 28 HG12 ILE 28 33.408 0.125 6.405 142 HG13 ILE 28 HG11 ILE 28 34.268 -1.355 6.828 143 HG21 ILE 28 HG21 ILE 28 36.214 -0.272 3.941 144 HG22 ILE 28 HG22 ILE 28 34.462 -0.113 4.060 145 HG23 ILE 28 HG23 ILE 28 35.258 -1.568 4.659 146 HD11 ILE 28 HD11 ILE 28 34.472 -0.570 8.916 147 HD12 ILE 28 HD12 ILE 28 33.780 0.980 8.447 148 HD13 ILE 28 HD13 ILE 28 35.514 0.706 8.293 149 H ASN 29 HN ASN 29 37.086 -0.145 9.084 150 HA ASN 29 HA ASN 29 36.485 -3.044 9.483 151 HB2 ASN 29 HB2 ASN 29 38.530 -1.338 10.518 152 HB3 ASN 29 HB1 ASN 29 37.501 -1.832 11.861 153 HD21 ASN 29 HD21 ASN 29 37.869 -3.906 12.687 154 HD22 ASN 29 HD22 ASN 29 38.770 -5.112 11.902 155 H HIS 30 HN HIS 30 34.309 -3.179 9.854 156 HA HIS 30 HA HIS 30 32.763 -1.127 11.145 157 HB2 HIS 30 HB2 HIS 30 32.117 -4.077 10.849 158 HB3 HIS 30 HB1 HIS 30 30.963 -2.781 11.170 159 HD1 HIS 30 HD1 HIS 30 30.725 -0.931 9.227 160 HD2 HIS 30 HD2 HIS 30 32.718 -4.433 8.143 161 HE1 HIS 30 HE1 HIS 30 30.785 -0.969 6.693 162 HE2 HIS 30 HE2 HIS 30 31.994 -3.096 6.024 163 H LYS 31 HN LYS 31 35.096 -3.064 12.434 164 HA LYS 31 HA LYS 31 33.774 -3.753 14.948 165 HB2 LYS 31 HB2 LYS 31 36.653 -3.844 14.020 166 HB3 LYS 31 HB1 LYS 31 36.164 -4.294 15.655 167 HG2 LYS 31 HG2 LYS 31 34.377 -5.634 13.932 168 HG3 LYS 31 HG1 LYS 31 35.975 -5.837 13.215 169 HD2 LYS 31 HD2 LYS 31 35.425 -6.328 16.150 170 HD3 LYS 31 HD1 LYS 31 35.321 -7.601 14.931 171 HE2 LYS 31 HE2 LYS 31 37.567 -7.797 14.807 172 HE3 LYS 31 HE1 LYS 31 37.784 -6.050 14.697 173 HZ1 LYS 31 HZ1 LYS 31 38.655 -6.299 16.733 174 HZ2 LYS 31 HZ2 LYS 31 37.880 -7.785 17.013 175 HZ3 LYS 31 HZ3 LYS 31 37.038 -6.328 17.245 176 H ASN 32 HN ASN 32 36.133 -1.338 13.858 177 HA ASN 32 HA ASN 32 35.628 0.150 16.391 178 HB2 ASN 32 HB2 ASN 32 38.083 -0.510 14.971 179 HB3 ASN 32 HB1 ASN 32 37.922 1.231 15.212 180 HD21 ASN 32 HD21 ASN 32 39.069 1.764 17.079 181 HD22 ASN 32 HD22 ASN 32 39.008 0.897 18.537 182 H LYS 33 HN LYS 33 34.430 0.105 13.478 183 HA LYS 33 HA LYS 33 33.599 1.696 11.964 184 HB2 LYS 33 HB2 LYS 33 33.408 2.818 14.681 185 HB3 LYS 33 HB1 LYS 33 33.370 4.030 13.400 186 HG2 LYS 33 HG2 LYS 33 31.411 3.195 12.476 187 HG3 LYS 33 HG1 LYS 33 31.695 1.566 13.091 188 HD2 LYS 33 HD2 LYS 33 31.413 3.581 15.211 189 HD3 LYS 33 HD1 LYS 33 29.968 3.399 14.216 190 HE2 LYS 33 HE2 LYS 33 30.081 1.843 16.214 191 HE3 LYS 33 HE1 LYS 33 29.860 1.037 14.660 192 HZ1 LYS 33 HZ1 LYS 33 32.581 1.294 14.990 193 HZ2 LYS 33 HZ2 LYS 33 31.665 -0.131 15.132 194 HZ3 LYS 33 HZ3 LYS 33 32.002 0.807 16.508 195 H THR 34 HN THR 34 36.329 1.389 11.694 196 HA THR 34 HA THR 34 37.154 4.155 11.009 197 HB THR 34 HB THR 34 39.525 2.861 11.705 198 HG1 THR 34 HG1 THR 34 38.240 1.306 12.795 199 HG21 THR 34 HG21 THR 34 39.043 5.216 12.077 200 HG22 THR 34 HG22 THR 34 39.497 4.471 13.610 201 HG23 THR 34 HG23 THR 34 37.800 4.805 13.260 202 H THR 35 HN THR 35 38.746 4.206 9.251 203 HA THR 35 HA THR 35 38.728 1.690 7.669 204 HB THR 35 HB THR 35 39.241 3.548 5.794 205 HG1 THR 35 HG1 THR 35 38.791 5.014 7.819 206 HG21 THR 35 HG21 THR 35 36.680 3.620 5.485 207 HG22 THR 35 HG22 THR 35 36.613 2.603 6.924 208 HG23 THR 35 HG23 THR 35 37.450 2.037 5.483 209 H SER 36 HN SER 36 40.662 1.376 6.271 210 HA SER 36 HA SER 36 43.053 2.954 6.928 211 HB2 SER 36 HB2 SER 36 42.884 1.432 8.880 212 HB3 SER 36 HB1 SER 36 42.893 0.050 7.789 213 HG SER 36 HG SER 36 44.921 1.743 7.235 214 H TRP 37 HN TRP 37 45.025 1.965 5.789 215 HA TRP 37 HA TRP 37 44.111 0.876 3.173 216 HB2 TRP 37 HB2 TRP 37 46.920 1.797 3.663 217 HB3 TRP 37 HB1 TRP 37 45.947 1.909 2.196 218 HD1 TRP 37 HD1 TRP 37 46.776 3.736 5.388 219 HE1 TRP 37 HE1 TRP 37 45.624 6.042 5.381 220 HE3 TRP 37 HE3 TRP 37 43.752 3.201 1.305 221 HZ2 TRP 37 HZ2 TRP 37 43.677 7.470 3.849 222 HZ3 TRP 37 HZ3 TRP 37 42.261 5.050 0.597 223 HH2 TRP 37 HH2 TRP 37 42.220 7.181 1.861 224 H LEU 38 HN LEU 38 45.658 -0.062 6.059 225 HA LEU 38 HA LEU 38 47.500 -2.020 5.064 226 HB2 LEU 38 HB2 LEU 38 47.008 -1.051 7.517 227 HB3 LEU 38 HB1 LEU 38 46.059 -2.535 7.624 228 HG LEU 38 HG LEU 38 48.291 -3.548 6.518 229 HD11 LEU 38 HD11 LEU 38 49.399 -1.322 6.487 230 HD12 LEU 38 HD12 LEU 38 50.266 -2.478 7.498 231 HD13 LEU 38 HD13 LEU 38 49.250 -1.243 8.242 232 HD21 LEU 38 HD21 LEU 38 49.007 -4.091 8.872 233 HD22 LEU 38 HD22 LEU 38 47.296 -4.388 8.565 234 HD23 LEU 38 HD23 LEU 38 47.796 -2.946 9.449 235 H ASP 39 HN ASP 39 47.135 -4.058 4.274 236 HA ASP 39 HA ASP 39 44.360 -5.125 4.486 237 HB2 ASP 39 HB2 ASP 39 45.624 -6.279 2.233 238 HB3 ASP 39 HB1 ASP 39 44.288 -5.129 2.238 239 HA PRO 40 HA PRO 40 46.848 -8.136 6.865 240 HB2 PRO 40 HB2 PRO 40 44.119 -9.359 6.876 241 HB3 PRO 40 HB1 PRO 40 45.257 -9.130 8.217 242 HG2 PRO 40 HG2 PRO 40 43.122 -7.561 7.909 243 HG3 PRO 40 HG1 PRO 40 44.660 -6.940 8.530 244 HD2 PRO 40 HD2 PRO 40 43.399 -6.508 5.872 245 HD3 PRO 40 HD1 PRO 40 44.531 -5.471 6.766 246 H ARG 41 HN ARG 41 44.307 -9.143 4.535 247 HA ARG 41 HA ARG 41 46.302 -10.955 3.297 248 HB2 ARG 41 HB2 ARG 41 44.824 -12.840 3.316 249 HB3 ARG 41 HB1 ARG 41 44.846 -12.214 4.966 250 HG2 ARG 41 HG2 ARG 41 42.816 -10.742 3.935 251 HG3 ARG 41 HG1 ARG 41 42.649 -12.212 2.973 252 HD2 ARG 41 HD2 ARG 41 41.311 -12.371 5.031 253 HD3 ARG 41 HD1 ARG 41 42.612 -13.560 5.043 254 HE ARG 41 HE ARG 41 43.247 -11.012 6.367 255 HH11 ARG 41 HH11 ARG 41 43.698 -11.202 8.575 256 HH12 ARG 41 HH12 ARG 41 43.332 -12.683 9.395 257 HH21 ARG 41 HH21 ARG 41 42.072 -14.247 6.568 258 HH22 ARG 41 HH22 ARG 41 42.411 -14.406 8.259 259 H LEU 42 HN LEU 42 45.771 -8.661 2.075 260 HA LEU 42 HA LEU 42 44.041 -9.478 -0.187 261 HB2 LEU 42 HB2 LEU 42 43.219 -7.589 1.714 262 HB3 LEU 42 HB1 LEU 42 43.775 -6.632 0.341 263 HG LEU 42 HG LEU 42 41.391 -7.188 0.093 264 HD11 LEU 42 HD11 LEU 42 41.958 -7.139 -2.090 265 HD12 LEU 42 HD12 LEU 42 42.039 -8.900 -2.026 266 HD13 LEU 42 HD13 LEU 42 43.497 -7.940 -1.771 267 HD21 LEU 42 HD21 LEU 42 40.545 -9.286 0.407 268 HD22 LEU 42 HD22 LEU 42 42.032 -9.541 1.321 269 HD23 LEU 42 HD23 LEU 42 41.930 -10.064 -0.360 270 H ASP 43 HN ASP 43 46.277 -9.821 -1.048 271 HA ASP 43 HA ASP 43 48.287 -9.051 -2.058 272 HB2 ASP 43 HB2 ASP 43 47.794 -7.838 -4.045 273 HB3 ASP 43 HB1 ASP 43 46.334 -8.772 -3.710 274 HA PRO 44 HA PRO 44 48.373 -5.414 1.043 275 HB2 PRO 44 HB2 PRO 44 50.945 -6.863 1.512 276 HB3 PRO 44 HB1 PRO 44 49.841 -6.116 2.682 277 HG2 PRO 44 HG2 PRO 44 49.947 -8.764 2.321 278 HG3 PRO 44 HG1 PRO 44 48.442 -7.923 2.723 279 HD2 PRO 44 HD2 PRO 44 49.269 -9.151 0.149 280 HD3 PRO 44 HD1 PRO 44 47.637 -8.836 0.777 281 H ARG 45 HN ARG 45 48.703 -3.868 -0.627 282 HA ARG 45 HA ARG 45 51.068 -3.894 -2.304 283 HB2 ARG 45 HB2 ARG 45 48.657 -2.285 -2.015 284 HB3 ARG 45 HB1 ARG 45 50.081 -1.278 -2.282 285 HG2 ARG 45 HG2 ARG 45 49.617 -3.727 -3.971 286 HG3 ARG 45 HG1 ARG 45 48.803 -2.211 -4.359 287 HD2 ARG 45 HD2 ARG 45 50.686 -1.355 -5.248 288 HD3 ARG 45 HD1 ARG 45 51.604 -1.738 -3.792 289 HE ARG 45 HE ARG 45 51.328 -3.493 -6.169 290 HH11 ARG 45 HH11 ARG 45 52.876 -5.137 -6.242 291 HH12 ARG 45 HH12 ARG 45 53.906 -5.400 -4.876 292 HH21 ARG 45 HH21 ARG 45 52.510 -2.847 -2.993 293 HH22 ARG 45 HH22 ARG 45 53.701 -4.105 -3.038 294 H GLY 46 HN GLY 46 51.912 -1.200 -2.155 295 HA2 GLY 46 HA2 GLY 46 52.570 -0.286 0.454 296 HA3 GLY 46 HA1 GLY 46 53.878 -1.336 -0.096 297 H GLY 47 HN GLY 47 55.331 0.483 -0.200 298 HA2 GLY 47 HA2 GLY 47 56.314 2.377 -1.195 299 HA3 GLY 47 HA1 GLY 47 55.753 1.637 -2.695 300 H GLY 48 HN GLY 48 53.877 3.026 0.003 301 HA2 GLY 48 HA2 GLY 48 52.242 4.515 -1.932 302 HA3 GLY 48 HA1 GLY 48 51.981 4.449 -0.188 303 H GLY 49 HN GLY 49 54.797 5.162 0.397 304 HA2 GLY 49 HA2 GLY 49 56.176 7.075 0.539 305 HA3 GLY 49 HA1 GLY 49 55.267 7.780 -0.798 306 H ASN 50 HN ASN 50 54.589 6.800 2.585 307 HA ASN 50 HA ASN 50 53.486 7.971 4.294 308 HB2 ASN 50 HB2 ASN 50 55.210 9.752 3.380 309 HB3 ASN 50 HB1 ASN 50 53.758 10.524 2.739 310 HD21 ASN 50 HD21 ASN 50 51.900 9.950 4.794 311 HD22 ASN 50 HD22 ASN 50 52.395 10.718 6.224 312 H ARG 51 HN ARG 51 51.681 6.711 2.945 313 HA ARG 51 HA ARG 51 49.866 7.948 1.236 314 HB2 ARG 51 HB2 ARG 51 48.098 6.549 2.555 315 HB3 ARG 51 HB1 ARG 51 49.390 5.698 1.711 316 HG2 ARG 51 HG2 ARG 51 48.977 4.937 4.100 317 HG3 ARG 51 HG1 ARG 51 50.639 5.405 3.740 318 HD2 ARG 51 HD2 ARG 51 50.357 7.540 4.797 319 HD3 ARG 51 HD1 ARG 51 48.612 7.318 4.921 320 HE ARG 51 HE ARG 51 48.972 5.792 6.745 321 HH11 ARG 51 HH11 ARG 51 50.299 5.120 8.446 322 HH12 ARG 51 HH12 ARG 51 52.001 5.429 8.373 323 HH21 ARG 51 HH21 ARG 51 51.854 7.004 5.288 324 HH22 ARG 51 HH22 ARG 51 52.881 6.495 6.586 325 H GLN 52 HN GLN 52 47.457 8.471 2.161 326 HA GLN 52 HA GLN 52 47.876 10.808 3.942 327 HB2 GLN 52 HB2 GLN 52 45.449 10.018 2.301 328 HB3 GLN 52 HB1 GLN 52 45.673 11.546 3.154 329 HG2 GLN 52 HG2 GLN 52 47.624 10.587 1.056 330 HG3 GLN 52 HG1 GLN 52 46.206 11.550 0.642 331 HE21 GLN 52 HE21 GLN 52 46.074 13.402 2.709 332 HE22 GLN 52 HE22 GLN 52 47.486 14.341 2.751 333 HA PRO 53 HA PRO 53 46.462 8.654 7.559 334 HB2 PRO 53 HB2 PRO 53 45.020 11.245 7.983 335 HB3 PRO 53 HB1 PRO 53 46.024 10.317 9.114 336 HG2 PRO 53 HG2 PRO 53 46.925 12.511 7.854 337 HG3 PRO 53 HG1 PRO 53 47.976 11.151 8.280 338 HD2 PRO 53 HD2 PRO 53 47.057 12.021 5.613 339 HD3 PRO 53 HD1 PRO 53 48.423 10.971 6.046 340 HA PRO 54 HA PRO 54 42.439 7.367 6.067 341 HB2 PRO 54 HB2 PRO 54 41.916 5.542 8.038 342 HB3 PRO 54 HB1 PRO 54 43.018 5.229 6.684 343 HG2 PRO 54 HG2 PRO 54 43.633 5.955 9.497 344 HG3 PRO 54 HG1 PRO 54 44.486 4.859 8.398 345 HD2 PRO 54 HD2 PRO 54 45.331 7.422 8.956 346 HD3 PRO 54 HD1 PRO 54 45.723 6.558 7.454 347 HA PRO 55 HA PRO 55 40.124 10.022 8.940 348 HB2 PRO 55 HB2 PRO 55 38.299 10.892 7.139 349 HB3 PRO 55 HB1 PRO 55 39.956 11.526 7.188 350 HG2 PRO 55 HG2 PRO 55 38.731 9.575 5.318 351 HG3 PRO 55 HG1 PRO 55 39.956 10.818 5.016 352 HD2 PRO 55 HD2 PRO 55 40.483 8.094 5.377 353 HD3 PRO 55 HD1 PRO 55 41.678 9.398 5.526 354 HA PRO 56 HA PRO 56 36.930 7.318 10.379 355 HB2 PRO 56 HB2 PRO 56 35.215 9.763 10.405 356 HB3 PRO 56 HB1 PRO 56 35.516 8.582 11.694 357 HG2 PRO 56 HG2 PRO 56 36.669 11.010 11.658 358 HG3 PRO 56 HG1 PRO 56 37.457 9.583 12.345 359 HD2 PRO 56 HD2 PRO 56 38.104 11.050 9.861 360 HD3 PRO 56 HD1 PRO 56 39.121 9.956 10.822 361 H TYR 57 HN TYR 57 36.059 5.991 8.832 362 HA TYR 57 HA TYR 57 34.896 6.952 6.378 363 HB2 TYR 57 HB2 TYR 57 34.821 4.747 5.795 364 HB3 TYR 57 HB1 TYR 57 35.840 4.549 7.220 365 HD1 TYR 57 HD1 TYR 57 32.986 3.329 5.646 366 HD2 TYR 57 HD2 TYR 57 34.395 4.517 9.526 367 HE1 TYR 57 HE1 TYR 57 31.235 1.932 6.710 368 HE2 TYR 57 HE2 TYR 57 32.643 3.120 10.589 369 HH TYR 57 HH TYR 57 31.259 0.838 9.593 370 HA PRO 58 HA PRO 58 30.865 7.929 7.972 371 HB2 PRO 58 HB2 PRO 58 29.556 8.161 5.589 372 HB3 PRO 58 HB1 PRO 58 30.687 9.386 6.196 373 HG2 PRO 58 HG2 PRO 58 31.103 7.275 4.146 374 HG3 PRO 58 HG1 PRO 58 31.705 8.940 4.193 375 HD2 PRO 58 HD2 PRO 58 33.238 6.746 4.855 376 HD3 PRO 58 HD1 PRO 58 33.530 8.382 5.484 377 H LEU 59 HN LEU 59 29.459 6.463 8.846 378 HA LEU 59 HA LEU 59 29.007 3.894 7.472 379 HB2 LEU 59 HB2 LEU 59 29.360 3.542 9.763 380 HB3 LEU 59 HB1 LEU 59 28.423 4.965 10.222 381 HG LEU 59 HG LEU 59 26.350 3.883 9.615 382 HD11 LEU 59 HD11 LEU 59 28.219 1.951 8.307 383 HD12 LEU 59 HD12 LEU 59 26.685 2.597 7.724 384 HD13 LEU 59 HD13 LEU 59 26.699 1.323 8.943 385 HD21 LEU 59 HD21 LEU 59 26.294 2.683 11.533 386 HD22 LEU 59 HD22 LEU 59 28.020 3.018 11.673 387 HD23 LEU 59 HD23 LEU 59 27.471 1.521 10.923 388 H THR 60 HN THR 60 27.458 4.009 5.897 389 HA THR 60 HA THR 60 25.014 5.630 6.458 390 HB THR 60 HB THR 60 26.212 6.190 4.371 391 HG1 THR 60 HG1 THR 60 24.361 6.415 3.412 392 HG21 THR 60 HG21 THR 60 26.249 3.275 4.151 393 HG22 THR 60 HG22 THR 60 27.267 4.473 3.353 394 HG23 THR 60 HG23 THR 60 25.694 4.059 2.672 395 H ALA 61 HN ALA 61 22.930 4.655 6.012 396 HA ALA 61 HA ALA 61 22.987 1.667 5.902 397 HB1 ALA 61 HB1 ALA 61 21.356 1.507 7.613 398 HB2 ALA 61 HB2 ALA 61 20.958 3.223 7.509 399 HB3 ALA 61 HB3 ALA 61 22.494 2.715 8.212 Start of MODEL 12 1 H1 SER 8 HT1 SER 8 28.873 -6.004 -2.510 2 H2 SER 8 HT2 SER 8 30.448 -6.608 -2.309 3 H3 SER 8 HT3 SER 8 29.570 -6.052 -0.966 4 HA SER 8 HA SER 8 28.135 -7.867 -0.969 5 HB2 SER 8 HB2 SER 8 28.197 -9.505 -2.896 6 HB3 SER 8 HB1 SER 8 27.565 -7.914 -3.312 7 HG SER 8 HG SER 8 29.511 -9.148 -4.485 8 H GLY 9 HN GLY 9 28.874 -9.496 0.325 9 HA2 GLY 9 HA2 GLY 9 30.312 -11.202 1.114 10 HA3 GLY 9 HA1 GLY 9 31.332 -10.946 -0.301 11 HA PRO 10 HA PRO 10 32.649 -7.933 3.240 12 HB2 PRO 10 HB2 PRO 10 32.458 -9.033 5.724 13 HB3 PRO 10 HB1 PRO 10 31.154 -8.085 4.988 14 HG2 PRO 10 HG2 PRO 10 31.416 -11.021 5.297 15 HG3 PRO 10 HG1 PRO 10 29.970 -10.000 5.354 16 HD2 PRO 10 HD2 PRO 10 30.740 -11.533 3.163 17 HD3 PRO 10 HD1 PRO 10 29.635 -10.144 3.090 18 H LEU 11 HN LEU 11 34.655 -8.050 4.699 19 HA LEU 11 HA LEU 11 36.417 -10.163 3.670 20 HB2 LEU 11 HB2 LEU 11 36.722 -7.567 5.115 21 HB3 LEU 11 HB1 LEU 11 38.022 -8.735 5.274 22 HG LEU 11 HG LEU 11 36.882 -8.051 2.572 23 HD11 LEU 11 HD11 LEU 11 39.364 -6.696 3.041 24 HD12 LEU 11 HD12 LEU 11 38.222 -6.229 4.299 25 HD13 LEU 11 HD13 LEU 11 37.804 -6.006 2.602 26 HD21 LEU 11 HD21 LEU 11 39.646 -8.954 3.436 27 HD22 LEU 11 HD22 LEU 11 39.042 -8.839 1.785 28 HD23 LEU 11 HD23 LEU 11 38.379 -10.048 2.882 29 HA PRO 12 HA PRO 12 37.389 -12.961 7.041 30 HB2 PRO 12 HB2 PRO 12 38.508 -10.632 8.581 31 HB3 PRO 12 HB1 PRO 12 39.106 -12.301 8.490 32 HG2 PRO 12 HG2 PRO 12 40.003 -10.186 6.929 33 HG3 PRO 12 HG1 PRO 12 40.238 -11.903 6.572 34 HD2 PRO 12 HD2 PRO 12 38.733 -10.091 5.011 35 HD3 PRO 12 HD1 PRO 12 38.696 -11.857 4.870 36 H ASP 13 HN ASP 13 36.318 -9.770 8.254 37 HA ASP 13 HA ASP 13 33.778 -10.128 8.974 38 HB2 ASP 13 HB2 ASP 13 33.890 -12.227 9.988 39 HB3 ASP 13 HB1 ASP 13 35.454 -11.893 10.735 40 H GLY 14 HN GLY 14 33.492 -8.035 9.483 41 HA2 GLY 14 HA2 GLY 14 33.436 -6.403 11.325 42 HA3 GLY 14 HA1 GLY 14 35.045 -6.955 11.790 43 H TRP 15 HN TRP 15 35.159 -6.885 8.504 44 HA TRP 15 HA TRP 15 35.487 -3.995 8.188 45 HB2 TRP 15 HB2 TRP 15 37.797 -3.881 7.989 46 HB3 TRP 15 HB1 TRP 15 37.590 -4.990 9.338 47 HD1 TRP 15 HD1 TRP 15 37.522 -7.731 8.464 48 HE1 TRP 15 HE1 TRP 15 39.181 -8.825 6.829 49 HE3 TRP 15 HE3 TRP 15 39.330 -3.570 6.116 50 HZ2 TRP 15 HZ2 TRP 15 41.034 -8.045 4.793 51 HZ3 TRP 15 HZ3 TRP 15 41.036 -3.776 4.335 52 HH2 TRP 15 HH2 TRP 15 41.892 -6.005 3.669 53 H GLU 16 HN GLU 16 36.279 -3.443 5.945 54 HA GLU 16 HA GLU 16 36.073 -5.579 3.937 55 HB2 GLU 16 HB2 GLU 16 33.813 -3.808 4.617 56 HB3 GLU 16 HB1 GLU 16 34.197 -3.874 2.896 57 HG2 GLU 16 HG2 GLU 16 34.183 -6.393 3.080 58 HG3 GLU 16 HG1 GLU 16 33.564 -6.206 4.722 59 H GLN 17 HN GLN 17 36.831 -4.875 1.877 60 HA GLN 17 HA GLN 17 38.344 -2.340 1.965 61 HB2 GLN 17 HB2 GLN 17 39.836 -3.763 1.004 62 HB3 GLN 17 HB1 GLN 17 38.576 -4.908 0.544 63 HG2 GLN 17 HG2 GLN 17 38.018 -3.639 -1.416 64 HG3 GLN 17 HG1 GLN 17 39.021 -2.284 -0.898 65 HE21 GLN 17 HE21 GLN 17 41.146 -2.272 -1.663 66 HE22 GLN 17 HE22 GLN 17 41.935 -3.606 -2.355 67 H ALA 18 HN ALA 18 37.777 -0.575 0.709 68 HA ALA 18 HA ALA 18 35.849 -0.925 -1.492 69 HB1 ALA 18 HB1 ALA 18 34.401 0.922 -0.520 70 HB2 ALA 18 HB2 ALA 18 35.275 0.698 0.996 71 HB3 ALA 18 HB3 ALA 18 34.315 -0.622 0.328 72 H MET 19 HN MET 19 35.265 1.665 -2.067 73 HA MET 19 HA MET 19 37.931 2.979 -2.272 74 HB2 MET 19 HB2 MET 19 37.275 3.767 -4.508 75 HB3 MET 19 HB1 MET 19 37.226 2.005 -4.434 76 HG2 MET 19 HG2 MET 19 35.021 1.981 -4.889 77 HG3 MET 19 HG1 MET 19 34.690 3.137 -3.598 78 HE1 MET 19 HE1 MET 19 32.908 3.208 -5.227 79 HE2 MET 19 HE2 MET 19 32.997 3.762 -6.896 80 HE3 MET 19 HE3 MET 19 32.728 4.927 -5.602 81 H THR 20 HN THR 20 37.853 5.336 -2.370 82 HA THR 20 HA THR 20 35.621 6.413 -0.787 83 HB THR 20 HB THR 20 37.140 8.521 -0.953 84 HG1 THR 20 HG1 THR 20 38.352 6.940 -2.628 85 HG21 THR 20 HG21 THR 20 38.880 6.903 0.509 86 HG22 THR 20 HG22 THR 20 37.322 6.082 0.619 87 HG23 THR 20 HG23 THR 20 37.475 7.761 1.140 88 H GLN 21 HN GLN 21 35.739 9.102 -1.821 89 HA GLN 21 HA GLN 21 34.050 8.728 -4.195 90 HB2 GLN 21 HB2 GLN 21 34.904 11.400 -3.095 91 HB3 GLN 21 HB1 GLN 21 33.392 10.966 -3.892 92 HG2 GLN 21 HG2 GLN 21 34.239 9.874 -1.196 93 HG3 GLN 21 HG1 GLN 21 33.188 11.275 -1.396 94 HE21 GLN 21 HE21 GLN 21 31.846 9.410 -0.095 95 HE22 GLN 21 HE22 GLN 21 30.830 8.484 -1.091 96 H ASP 22 HN ASP 22 37.330 9.198 -3.552 97 HA ASP 22 HA ASP 22 37.771 10.328 -6.264 98 HB2 ASP 22 HB2 ASP 22 38.637 11.634 -4.247 99 HB3 ASP 22 HB1 ASP 22 39.768 10.305 -3.996 100 H GLY 23 HN GLY 23 37.387 7.510 -5.140 101 HA2 GLY 23 HA2 GLY 23 38.239 5.375 -5.585 102 HA3 GLY 23 HA1 GLY 23 39.031 6.122 -6.973 103 H GLU 24 HN GLU 24 39.507 6.690 -3.487 104 HA GLU 24 HA GLU 24 42.410 6.374 -3.902 105 HB2 GLU 24 HB2 GLU 24 41.036 7.073 -1.317 106 HB3 GLU 24 HB1 GLU 24 42.678 7.475 -1.825 107 HG2 GLU 24 HG2 GLU 24 41.164 8.600 -3.828 108 HG3 GLU 24 HG1 GLU 24 40.149 8.853 -2.407 109 H ILE 25 HN ILE 25 40.249 4.233 -3.686 110 HA ILE 25 HA ILE 25 39.887 2.187 -2.539 111 HB ILE 25 HB ILE 25 41.659 1.573 -4.053 112 HG12 ILE 25 HG12 ILE 25 42.917 -0.101 -2.647 113 HG13 ILE 25 HG11 ILE 25 42.202 0.644 -1.217 114 HG21 ILE 25 HG21 ILE 25 43.516 2.776 -1.982 115 HG22 ILE 25 HG22 ILE 25 43.213 3.393 -3.605 116 HG23 ILE 25 HG23 ILE 25 44.046 1.855 -3.387 117 HD11 ILE 25 HD11 ILE 25 40.087 0.173 -3.058 118 HD12 ILE 25 HD12 ILE 25 40.362 -0.614 -1.506 119 HD13 ILE 25 HD13 ILE 25 41.045 -1.302 -2.979 120 H TYR 26 HN TYR 26 39.216 2.316 -0.460 121 HA TYR 26 HA TYR 26 41.302 2.666 1.633 122 HB2 TYR 26 HB2 TYR 26 39.911 4.100 2.902 123 HB3 TYR 26 HB1 TYR 26 39.732 4.685 1.247 124 HD1 TYR 26 HD1 TYR 26 37.864 3.218 -0.128 125 HD2 TYR 26 HD2 TYR 26 37.933 3.923 4.104 126 HE1 TYR 26 HE1 TYR 26 35.428 2.780 -0.016 127 HE2 TYR 26 HE2 TYR 26 35.490 3.484 4.217 128 HH TYR 26 HH TYR 26 33.716 2.690 3.086 129 H TYR 27 HN TYR 27 40.806 1.570 3.652 130 HA TYR 27 HA TYR 27 38.929 -0.725 3.266 131 HB2 TYR 27 HB2 TYR 27 41.337 -0.450 5.090 132 HB3 TYR 27 HB1 TYR 27 40.282 -1.857 5.020 133 HD1 TYR 27 HD1 TYR 27 43.103 -2.274 4.549 134 HD2 TYR 27 HD2 TYR 27 40.071 -1.008 1.779 135 HE1 TYR 27 HE1 TYR 27 44.433 -3.180 2.667 136 HE2 TYR 27 HE2 TYR 27 41.401 -1.914 -0.092 137 HH TYR 27 HH TYR 27 43.140 -3.490 -0.522 138 H ILE 28 HN ILE 28 37.421 -1.167 4.894 139 HA ILE 28 HA ILE 28 37.210 0.909 7.008 140 HB ILE 28 HB ILE 28 35.341 1.496 5.929 141 HG12 ILE 28 HG12 ILE 28 33.340 0.167 6.449 142 HG13 ILE 28 HG11 ILE 28 34.351 -1.221 6.851 143 HG21 ILE 28 HG21 ILE 28 36.105 0.188 3.945 144 HG22 ILE 28 HG22 ILE 28 34.350 0.210 4.114 145 HG23 ILE 28 HG23 ILE 28 35.262 -1.221 4.593 146 HD11 ILE 28 HD11 ILE 28 34.384 -0.438 8.959 147 HD12 ILE 28 HD12 ILE 28 33.678 1.102 8.470 148 HD13 ILE 28 HD13 ILE 28 35.422 0.858 8.367 149 H ASN 29 HN ASN 29 37.194 0.152 9.044 150 HA ASN 29 HA ASN 29 36.760 -2.774 9.443 151 HB2 ASN 29 HB2 ASN 29 38.948 -1.832 10.183 152 HB3 ASN 29 HB1 ASN 29 38.083 -0.760 11.284 153 HD21 ASN 29 HD21 ASN 29 36.388 -3.680 11.050 154 HD22 ASN 29 HD22 ASN 29 37.013 -4.445 12.430 155 H HIS 30 HN HIS 30 34.603 -3.049 9.878 156 HA HIS 30 HA HIS 30 32.983 -1.091 11.237 157 HB2 HIS 30 HB2 HIS 30 32.480 -4.060 10.864 158 HB3 HIS 30 HB1 HIS 30 31.268 -2.843 11.273 159 HD1 HIS 30 HD1 HIS 30 30.880 -0.928 9.412 160 HD2 HIS 30 HD2 HIS 30 32.992 -4.289 8.129 161 HE1 HIS 30 HE1 HIS 30 30.860 -0.867 6.878 162 HE2 HIS 30 HE2 HIS 30 32.137 -2.909 6.088 163 H LYS 31 HN LYS 31 35.469 -2.793 12.464 164 HA LYS 31 HA LYS 31 34.210 -3.653 14.972 165 HB2 LYS 31 HB2 LYS 31 37.117 -3.556 14.120 166 HB3 LYS 31 HB1 LYS 31 36.529 -4.267 15.625 167 HG2 LYS 31 HG2 LYS 31 35.542 -5.137 12.899 168 HG3 LYS 31 HG1 LYS 31 36.893 -5.916 13.725 169 HD2 LYS 31 HD2 LYS 31 34.864 -5.735 15.659 170 HD3 LYS 31 HD1 LYS 31 34.045 -6.236 14.180 171 HE2 LYS 31 HE2 LYS 31 36.584 -7.560 15.153 172 HE3 LYS 31 HE1 LYS 31 34.980 -8.123 15.626 173 HZ1 LYS 31 HZ1 LYS 31 36.276 -8.186 13.000 174 HZ2 LYS 31 HZ2 LYS 31 34.587 -8.009 13.056 175 HZ3 LYS 31 HZ3 LYS 31 35.327 -9.366 13.764 176 H ASN 32 HN ASN 32 36.626 -1.227 13.990 177 HA ASN 32 HA ASN 32 36.128 0.179 16.562 178 HB2 ASN 32 HB2 ASN 32 38.499 -0.474 15.911 179 HB3 ASN 32 HB1 ASN 32 38.373 0.701 14.602 180 HD21 ASN 32 HD21 ASN 32 36.533 2.334 16.548 181 HD22 ASN 32 HD22 ASN 32 37.650 3.145 17.536 182 H LYS 33 HN LYS 33 34.567 0.217 13.898 183 HA LYS 33 HA LYS 33 33.542 1.822 12.521 184 HB2 LYS 33 HB2 LYS 33 33.755 2.971 15.256 185 HB3 LYS 33 HB1 LYS 33 33.335 4.093 13.960 186 HG2 LYS 33 HG2 LYS 33 31.406 2.822 13.353 187 HG3 LYS 33 HG1 LYS 33 31.914 1.451 14.341 188 HD2 LYS 33 HD2 LYS 33 31.834 3.263 16.284 189 HD3 LYS 33 HD1 LYS 33 30.697 4.049 15.188 190 HE2 LYS 33 HE2 LYS 33 30.427 1.492 16.684 191 HE3 LYS 33 HE1 LYS 33 29.198 2.687 16.267 192 HZ1 LYS 33 HZ1 LYS 33 29.508 1.908 13.902 193 HZ2 LYS 33 HZ2 LYS 33 28.739 0.818 14.955 194 HZ3 LYS 33 HZ3 LYS 33 30.370 0.592 14.536 195 H THR 34 HN THR 34 36.233 1.586 11.928 196 HA THR 34 HA THR 34 36.888 4.367 11.158 197 HB THR 34 HB THR 34 39.366 3.205 11.714 198 HG1 THR 34 HG1 THR 34 38.650 2.914 14.132 199 HG21 THR 34 HG21 THR 34 37.668 5.123 13.325 200 HG22 THR 34 HG22 THR 34 38.797 5.547 12.038 201 HG23 THR 34 HG23 THR 34 39.400 4.882 13.556 202 H THR 35 HN THR 35 38.865 4.249 9.554 203 HA THR 35 HA THR 35 38.530 1.834 7.855 204 HB THR 35 HB THR 35 39.238 3.686 6.041 205 HG1 THR 35 HG1 THR 35 38.797 5.091 8.176 206 HG21 THR 35 HG21 THR 35 36.565 2.848 7.109 207 HG22 THR 35 HG22 THR 35 37.315 2.457 5.561 208 HG23 THR 35 HG23 THR 35 36.643 4.061 5.835 209 H SER 36 HN SER 36 40.418 1.133 6.723 210 HA SER 36 HA SER 36 42.962 2.414 7.645 211 HB2 SER 36 HB2 SER 36 42.075 -0.427 7.869 212 HB3 SER 36 HB1 SER 36 43.770 -0.127 7.495 213 HG SER 36 HG SER 36 42.616 1.408 9.508 214 H TRP 37 HN TRP 37 44.845 1.231 6.270 215 HA TRP 37 HA TRP 37 43.923 1.248 3.423 216 HB2 TRP 37 HB2 TRP 37 46.629 2.119 4.473 217 HB3 TRP 37 HB1 TRP 37 46.055 2.241 2.811 218 HD1 TRP 37 HD1 TRP 37 46.131 4.077 6.031 219 HE1 TRP 37 HE1 TRP 37 44.723 6.230 5.869 220 HE3 TRP 37 HE3 TRP 37 43.692 3.202 1.628 221 HZ2 TRP 37 HZ2 TRP 37 42.813 7.423 4.098 222 HZ3 TRP 37 HZ3 TRP 37 42.088 4.862 0.729 223 HH2 TRP 37 HH2 TRP 37 41.645 6.968 1.958 224 H LEU 38 HN LEU 38 46.613 0.138 5.485 225 HA LEU 38 HA LEU 38 47.667 -1.817 3.765 226 HB2 LEU 38 HB2 LEU 38 47.737 -1.266 6.645 227 HB3 LEU 38 HB1 LEU 38 47.904 -2.982 6.266 228 HG LEU 38 HG LEU 38 49.730 -2.477 4.703 229 HD11 LEU 38 HD11 LEU 38 50.596 0.026 5.048 230 HD12 LEU 38 HD12 LEU 38 48.881 0.318 5.336 231 HD13 LEU 38 HD13 LEU 38 49.413 -0.372 3.802 232 HD21 LEU 38 HD21 LEU 38 50.235 -1.040 7.322 233 HD22 LEU 38 HD22 LEU 38 51.402 -1.925 6.338 234 HD23 LEU 38 HD23 LEU 38 50.132 -2.796 7.197 235 H ASP 39 HN ASP 39 47.135 -3.963 3.320 236 HA ASP 39 HA ASP 39 44.412 -4.791 4.161 237 HB2 ASP 39 HB2 ASP 39 45.449 -6.597 2.246 238 HB3 ASP 39 HB1 ASP 39 44.214 -5.363 1.993 239 HA PRO 40 HA PRO 40 46.645 -7.326 7.193 240 HB2 PRO 40 HB2 PRO 40 43.889 -8.477 7.331 241 HB3 PRO 40 HB1 PRO 40 44.965 -7.964 8.645 242 HG2 PRO 40 HG2 PRO 40 42.880 -6.485 7.869 243 HG3 PRO 40 HG1 PRO 40 44.391 -5.759 8.439 244 HD2 PRO 40 HD2 PRO 40 43.300 -5.887 5.679 245 HD3 PRO 40 HD1 PRO 40 44.421 -4.710 6.396 246 H ARG 41 HN ARG 41 44.118 -8.875 5.165 247 HA ARG 41 HA ARG 41 46.138 -10.840 4.268 248 HB2 ARG 41 HB2 ARG 41 44.438 -12.682 4.689 249 HB3 ARG 41 HB1 ARG 41 45.165 -11.988 6.139 250 HG2 ARG 41 HG2 ARG 41 42.865 -10.427 5.425 251 HG3 ARG 41 HG1 ARG 41 42.403 -12.129 5.475 252 HD2 ARG 41 HD2 ARG 41 42.267 -10.830 7.691 253 HD3 ARG 41 HD1 ARG 41 43.123 -12.371 7.725 254 HE ARG 41 HE ARG 41 44.781 -9.971 7.258 255 HH11 ARG 41 HH11 ARG 41 46.401 -9.673 8.806 256 HH12 ARG 41 HH12 ARG 41 46.387 -10.630 10.249 257 HH21 ARG 41 HH21 ARG 41 43.525 -12.382 9.379 258 HH22 ARG 41 HH22 ARG 41 44.759 -12.164 10.574 259 H LEU 42 HN LEU 42 45.070 -8.753 2.752 260 HA LEU 42 HA LEU 42 43.500 -10.294 0.766 261 HB2 LEU 42 HB2 LEU 42 42.045 -8.737 2.247 262 HB3 LEU 42 HB1 LEU 42 42.810 -7.421 1.355 263 HG LEU 42 HG LEU 42 42.124 -8.666 -0.776 264 HD11 LEU 42 HD11 LEU 42 40.699 -10.245 1.350 265 HD12 LEU 42 HD12 LEU 42 41.556 -10.827 -0.077 266 HD13 LEU 42 HD13 LEU 42 39.973 -10.067 -0.247 267 HD21 LEU 42 HD21 LEU 42 40.398 -7.193 1.144 268 HD22 LEU 42 HD22 LEU 42 39.562 -8.015 -0.174 269 HD23 LEU 42 HD23 LEU 42 40.799 -6.810 -0.531 270 H ASP 43 HN ASP 43 46.312 -9.520 0.900 271 HA ASP 43 HA ASP 43 46.921 -8.836 -1.687 272 HB2 ASP 43 HB2 ASP 43 45.887 -6.507 -0.211 273 HB3 ASP 43 HB1 ASP 43 47.436 -6.221 -1.005 274 HA PRO 44 HA PRO 44 50.900 -9.268 0.184 275 HB2 PRO 44 HB2 PRO 44 52.480 -8.463 -1.897 276 HB3 PRO 44 HB1 PRO 44 51.637 -10.023 -1.864 277 HG2 PRO 44 HG2 PRO 44 50.925 -7.518 -3.293 278 HG3 PRO 44 HG1 PRO 44 50.754 -9.203 -3.810 279 HD2 PRO 44 HD2 PRO 44 48.663 -7.684 -2.853 280 HD3 PRO 44 HD1 PRO 44 48.721 -9.458 -2.755 281 H ARG 45 HN ARG 45 53.033 -7.938 0.454 282 HA ARG 45 HA ARG 45 52.311 -5.325 1.496 283 HB2 ARG 45 HB2 ARG 45 54.895 -5.205 1.801 284 HB3 ARG 45 HB1 ARG 45 53.997 -6.400 2.737 285 HG2 ARG 45 HG2 ARG 45 54.959 -8.142 1.652 286 HG3 ARG 45 HG1 ARG 45 54.803 -7.359 0.078 287 HD2 ARG 45 HD2 ARG 45 56.832 -6.223 0.291 288 HD3 ARG 45 HD1 ARG 45 56.820 -6.328 2.053 289 HE ARG 45 HE ARG 45 57.037 -8.956 1.343 290 HH11 ARG 45 HH11 ARG 45 58.983 -10.004 0.861 291 HH12 ARG 45 HH12 ARG 45 60.319 -9.083 0.255 292 HH21 ARG 45 HH21 ARG 45 58.614 -6.064 0.322 293 HH22 ARG 45 HH22 ARG 45 60.110 -6.854 -0.050 294 H GLY 46 HN GLY 46 55.360 -5.375 -0.096 295 HA2 GLY 46 HA2 GLY 46 56.204 -3.985 -1.791 296 HA3 GLY 46 HA1 GLY 46 54.766 -4.474 -2.687 297 H GLY 47 HN GLY 47 56.106 -2.019 -0.552 298 HA2 GLY 47 HA2 GLY 47 53.925 -0.193 -1.456 299 HA3 GLY 47 HA1 GLY 47 54.377 -0.247 0.249 300 H GLY 48 HN GLY 48 54.598 1.994 -1.713 301 HA2 GLY 48 HA2 GLY 48 57.539 2.454 -1.415 302 HA3 GLY 48 HA1 GLY 48 56.670 2.963 -2.863 303 H GLY 49 HN GLY 49 54.559 4.298 -2.192 304 HA2 GLY 49 HA2 GLY 49 55.559 6.645 -0.781 305 HA3 GLY 49 HA1 GLY 49 53.953 6.471 -1.489 306 H ASN 50 HN ASN 50 53.320 7.541 0.618 307 HA ASN 50 HA ASN 50 52.870 5.433 2.684 308 HB2 ASN 50 HB2 ASN 50 54.568 6.771 3.672 309 HB3 ASN 50 HB1 ASN 50 53.843 8.266 3.079 310 HD21 ASN 50 HD21 ASN 50 53.024 9.372 4.864 311 HD22 ASN 50 HD22 ASN 50 52.121 8.665 6.116 312 H ARG 51 HN ARG 51 50.747 5.280 3.261 313 HA ARG 51 HA ARG 51 48.828 7.137 2.041 314 HB2 ARG 51 HB2 ARG 51 48.773 4.440 2.837 315 HB3 ARG 51 HB1 ARG 51 47.668 5.267 3.936 316 HG2 ARG 51 HG2 ARG 51 46.257 4.795 2.140 317 HG3 ARG 51 HG1 ARG 51 46.803 6.423 1.733 318 HD2 ARG 51 HD2 ARG 51 48.482 5.546 0.221 319 HD3 ARG 51 HD1 ARG 51 48.136 3.893 0.728 320 HE ARG 51 HE ARG 51 46.179 3.928 -0.624 321 HH11 ARG 51 HH11 ARG 51 44.906 4.883 -2.229 322 HH12 ARG 51 HH12 ARG 51 45.129 6.558 -2.611 323 HH21 ARG 51 HH21 ARG 51 47.655 7.026 -0.282 324 HH22 ARG 51 HH22 ARG 51 46.687 7.770 -1.509 325 H GLN 52 HN GLN 52 48.218 8.977 3.064 326 HA GLN 52 HA GLN 52 48.987 9.674 5.708 327 HB2 GLN 52 HB2 GLN 52 47.236 10.788 3.621 328 HB3 GLN 52 HB1 GLN 52 46.735 11.198 5.263 329 HG2 GLN 52 HG2 GLN 52 48.717 12.330 5.731 330 HG3 GLN 52 HG1 GLN 52 49.630 11.446 4.508 331 HE21 GLN 52 HE21 GLN 52 46.567 12.451 3.338 332 HE22 GLN 52 HE22 GLN 52 47.087 13.824 2.486 333 HA PRO 53 HA PRO 53 46.287 7.802 8.612 334 HB2 PRO 53 HB2 PRO 53 45.159 10.508 9.208 335 HB3 PRO 53 HB1 PRO 53 45.813 9.290 10.320 336 HG2 PRO 53 HG2 PRO 53 47.198 11.472 9.620 337 HG3 PRO 53 HG1 PRO 53 47.978 9.919 9.950 338 HD2 PRO 53 HD2 PRO 53 47.595 11.304 7.356 339 HD3 PRO 53 HD1 PRO 53 48.803 10.085 7.818 340 HA PRO 54 HA PRO 54 42.513 7.496 6.216 341 HB2 PRO 54 HB2 PRO 54 41.407 5.425 7.599 342 HB3 PRO 54 HB1 PRO 54 42.741 5.214 6.448 343 HG2 PRO 54 HG2 PRO 54 42.801 5.306 9.419 344 HG3 PRO 54 HG1 PRO 54 43.741 4.308 8.297 345 HD2 PRO 54 HD2 PRO 54 44.723 6.574 9.529 346 HD3 PRO 54 HD1 PRO 54 45.343 5.929 7.994 347 HA PRO 55 HA PRO 55 40.142 10.232 8.982 348 HB2 PRO 55 HB2 PRO 55 38.311 10.159 6.637 349 HB3 PRO 55 HB1 PRO 55 38.985 11.554 7.498 350 HG2 PRO 55 HG2 PRO 55 39.857 10.818 5.079 351 HG3 PRO 55 HG1 PRO 55 40.927 11.532 6.296 352 HD2 PRO 55 HD2 PRO 55 40.738 8.697 5.388 353 HD3 PRO 55 HD1 PRO 55 42.142 9.599 5.999 354 HA PRO 56 HA PRO 56 37.073 7.470 10.547 355 HB2 PRO 56 HB2 PRO 56 35.061 9.197 11.276 356 HB3 PRO 56 HB1 PRO 56 36.553 8.962 12.203 357 HG2 PRO 56 HG2 PRO 56 35.803 11.152 10.344 358 HG3 PRO 56 HG1 PRO 56 36.749 11.211 11.840 359 HD2 PRO 56 HD2 PRO 56 37.881 11.292 9.340 360 HD3 PRO 56 HD1 PRO 56 38.720 10.656 10.772 361 H TYR 57 HN TYR 57 36.064 6.171 9.072 362 HA TYR 57 HA TYR 57 34.529 7.173 6.846 363 HB2 TYR 57 HB2 TYR 57 34.639 5.026 6.149 364 HB3 TYR 57 HB1 TYR 57 35.650 4.740 7.564 365 HD1 TYR 57 HD1 TYR 57 32.573 3.927 5.936 366 HD2 TYR 57 HD2 TYR 57 34.443 4.193 9.793 367 HE1 TYR 57 HE1 TYR 57 30.840 2.426 6.880 368 HE2 TYR 57 HE2 TYR 57 32.709 2.694 10.736 369 HH TYR 57 HH TYR 57 29.914 2.156 9.574 370 HA PRO 58 HA PRO 58 30.805 7.831 9.247 371 HB2 PRO 58 HB2 PRO 58 29.262 8.761 7.208 372 HB3 PRO 58 HB1 PRO 58 30.530 9.739 7.973 373 HG2 PRO 58 HG2 PRO 58 30.567 8.279 5.385 374 HG3 PRO 58 HG1 PRO 58 31.283 9.842 5.813 375 HD2 PRO 58 HD2 PRO 58 32.710 7.473 5.649 376 HD3 PRO 58 HD1 PRO 58 33.213 8.882 6.609 377 H LEU 59 HN LEU 59 29.640 6.033 9.835 378 HA LEU 59 HA LEU 59 29.087 3.789 8.221 379 HB2 LEU 59 HB2 LEU 59 28.791 3.571 10.582 380 HB3 LEU 59 HB1 LEU 59 27.649 4.914 10.634 381 HG LEU 59 HG LEU 59 26.018 3.630 9.350 382 HD11 LEU 59 HD11 LEU 59 28.240 1.575 9.257 383 HD12 LEU 59 HD12 LEU 59 27.435 2.352 7.894 384 HD13 LEU 59 HD13 LEU 59 26.559 1.189 8.888 385 HD21 LEU 59 HD21 LEU 59 25.881 3.284 11.726 386 HD22 LEU 59 HD22 LEU 59 27.247 2.169 11.703 387 HD23 LEU 59 HD23 LEU 59 25.711 1.697 10.976 388 H THR 60 HN THR 60 27.837 3.651 6.426 389 HA THR 60 HA THR 60 25.321 5.242 6.327 390 HB THR 60 HB THR 60 27.353 5.072 4.078 391 HG1 THR 60 HG1 THR 60 26.496 7.203 5.740 392 HG21 THR 60 HG21 THR 60 24.509 5.879 4.238 393 HG22 THR 60 HG22 THR 60 25.444 5.311 2.855 394 HG23 THR 60 HG23 THR 60 25.567 6.993 3.371 395 H ALA 61 HN ALA 61 23.810 4.372 4.653 396 HA ALA 61 HA ALA 61 24.300 1.454 4.197 397 HB1 ALA 61 HB1 ALA 61 21.760 2.967 4.839 398 HB2 ALA 61 HB2 ALA 61 22.493 1.645 5.747 399 HB3 ALA 61 HB3 ALA 61 21.742 1.329 4.183 Start of MODEL 13 1 H1 SER 8 HT1 SER 8 30.965 -15.155 1.649 2 H2 SER 8 HT2 SER 8 29.779 -15.668 0.546 3 H3 SER 8 HT3 SER 8 29.841 -16.340 2.105 4 HA SER 8 HA SER 8 28.037 -14.723 1.891 5 HB2 SER 8 HB2 SER 8 30.228 -13.636 3.667 6 HB3 SER 8 HB1 SER 8 28.489 -13.596 3.944 7 HG SER 8 HG SER 8 29.644 -16.092 3.547 8 H GLY 9 HN GLY 9 30.833 -12.622 2.454 9 HA2 GLY 9 HA2 GLY 9 30.941 -11.300 -0.033 10 HA3 GLY 9 HA1 GLY 9 29.703 -10.478 0.916 11 HA PRO 10 HA PRO 10 32.446 -8.051 3.327 12 HB2 PRO 10 HB2 PRO 10 31.903 -9.731 5.736 13 HB3 PRO 10 HB1 PRO 10 31.774 -7.974 5.534 14 HG2 PRO 10 HG2 PRO 10 29.617 -9.552 5.594 15 HG3 PRO 10 HG1 PRO 10 29.695 -8.096 4.587 16 HD2 PRO 10 HD2 PRO 10 29.808 -10.953 3.765 17 HD3 PRO 10 HD1 PRO 10 29.262 -9.533 2.847 18 H LEU 11 HN LEU 11 34.452 -8.201 4.845 19 HA LEU 11 HA LEU 11 36.115 -10.425 3.865 20 HB2 LEU 11 HB2 LEU 11 36.539 -7.745 5.097 21 HB3 LEU 11 HB1 LEU 11 37.796 -8.939 5.361 22 HG LEU 11 HG LEU 11 36.672 -8.438 2.610 23 HD11 LEU 11 HD11 LEU 11 38.210 -6.602 4.207 24 HD12 LEU 11 HD12 LEU 11 37.630 -6.409 2.554 25 HD13 LEU 11 HD13 LEU 11 39.192 -7.167 2.855 26 HD21 LEU 11 HD21 LEU 11 38.745 -9.428 1.869 27 HD22 LEU 11 HD22 LEU 11 38.089 -10.477 3.124 28 HD23 LEU 11 HD23 LEU 11 39.415 -9.377 3.498 29 HA PRO 12 HA PRO 12 37.068 -13.012 7.430 30 HB2 PRO 12 HB2 PRO 12 38.361 -10.673 8.804 31 HB3 PRO 12 HB1 PRO 12 38.877 -12.371 8.755 32 HG2 PRO 12 HG2 PRO 12 39.814 -10.357 7.095 33 HG3 PRO 12 HG1 PRO 12 39.958 -12.094 6.795 34 HD2 PRO 12 HD2 PRO 12 38.487 -10.259 5.229 35 HD3 PRO 12 HD1 PRO 12 38.396 -12.024 5.122 36 H ASP 13 HN ASP 13 35.512 -9.933 7.786 37 HA ASP 13 HA ASP 13 33.326 -9.864 8.898 38 HB2 ASP 13 HB2 ASP 13 33.670 -12.218 9.761 39 HB3 ASP 13 HB1 ASP 13 34.633 -11.522 11.068 40 H GLY 14 HN GLY 14 33.315 -7.777 9.486 41 HA2 GLY 14 HA2 GLY 14 33.527 -6.237 11.419 42 HA3 GLY 14 HA1 GLY 14 35.108 -6.957 11.731 43 H TRP 15 HN TRP 15 35.058 -6.840 8.486 44 HA TRP 15 HA TRP 15 35.517 -3.992 8.091 45 HB2 TRP 15 HB2 TRP 15 37.837 -3.992 7.822 46 HB3 TRP 15 HB1 TRP 15 37.596 -4.988 9.253 47 HD1 TRP 15 HD1 TRP 15 37.414 -7.771 8.624 48 HE1 TRP 15 HE1 TRP 15 38.964 -9.075 7.042 49 HE3 TRP 15 HE3 TRP 15 39.293 -3.917 5.849 50 HZ2 TRP 15 HZ2 TRP 15 40.767 -8.562 4.883 51 HZ3 TRP 15 HZ3 TRP 15 40.919 -4.357 4.036 52 HH2 TRP 15 HH2 TRP 15 41.659 -6.671 3.547 53 H GLU 16 HN GLU 16 36.304 -3.550 5.820 54 HA GLU 16 HA GLU 16 36.022 -5.754 3.897 55 HB2 GLU 16 HB2 GLU 16 33.828 -3.861 4.499 56 HB3 GLU 16 HB1 GLU 16 34.177 -4.095 2.786 57 HG2 GLU 16 HG2 GLU 16 34.062 -6.573 3.163 58 HG3 GLU 16 HG1 GLU 16 33.537 -6.250 4.816 59 H GLN 17 HN GLN 17 36.855 -5.187 1.851 60 HA GLN 17 HA GLN 17 38.525 -2.789 1.790 61 HB2 GLN 17 HB2 GLN 17 38.898 -5.214 0.725 62 HB3 GLN 17 HB1 GLN 17 38.077 -4.465 -0.645 63 HG2 GLN 17 HG2 GLN 17 39.858 -2.505 0.077 64 HG3 GLN 17 HG1 GLN 17 40.776 -3.972 0.422 65 HE21 GLN 17 HE21 GLN 17 41.790 -2.529 -1.652 66 HE22 GLN 17 HE22 GLN 17 41.398 -3.226 -3.150 67 H ALA 18 HN ALA 18 37.986 -0.875 0.756 68 HA ALA 18 HA ALA 18 35.821 -0.883 -1.243 69 HB1 ALA 18 HB1 ALA 18 34.610 -0.636 0.872 70 HB2 ALA 18 HB2 ALA 18 34.549 0.872 -0.038 71 HB3 ALA 18 HB3 ALA 18 35.652 0.711 1.330 72 H MET 19 HN MET 19 35.407 1.780 -1.566 73 HA MET 19 HA MET 19 38.111 2.985 -1.828 74 HB2 MET 19 HB2 MET 19 37.833 3.471 -4.088 75 HB3 MET 19 HB1 MET 19 37.028 1.905 -3.980 76 HG2 MET 19 HG2 MET 19 34.914 3.386 -3.397 77 HG3 MET 19 HG1 MET 19 35.825 4.638 -4.241 78 HE1 MET 19 HE1 MET 19 34.537 0.553 -5.634 79 HE2 MET 19 HE2 MET 19 33.232 1.622 -5.124 80 HE3 MET 19 HE3 MET 19 34.565 1.283 -4.023 81 H THR 20 HN THR 20 38.004 5.379 -2.116 82 HA THR 20 HA THR 20 35.822 6.483 -0.469 83 HB THR 20 HB THR 20 37.338 8.606 -0.817 84 HG1 THR 20 HG1 THR 20 38.678 7.876 -2.384 85 HG21 THR 20 HG21 THR 20 38.939 7.621 0.948 86 HG22 THR 20 HG22 THR 20 37.979 6.149 0.803 87 HG23 THR 20 HG23 THR 20 37.219 7.648 1.339 88 H GLN 21 HN GLN 21 35.847 9.135 -1.569 89 HA GLN 21 HA GLN 21 34.110 8.668 -3.893 90 HB2 GLN 21 HB2 GLN 21 34.910 11.176 -2.384 91 HB3 GLN 21 HB1 GLN 21 33.822 11.179 -3.774 92 HG2 GLN 21 HG2 GLN 21 32.341 9.570 -2.570 93 HG3 GLN 21 HG1 GLN 21 33.394 9.702 -1.160 94 HE21 GLN 21 HE21 GLN 21 31.655 11.921 -3.427 95 HE22 GLN 21 HE22 GLN 21 31.176 13.011 -2.217 96 H ASP 22 HN ASP 22 37.390 9.208 -3.344 97 HA ASP 22 HA ASP 22 37.745 10.305 -6.081 98 HB2 ASP 22 HB2 ASP 22 38.718 11.825 -4.504 99 HB3 ASP 22 HB1 ASP 22 39.473 10.505 -3.610 100 H GLY 23 HN GLY 23 37.431 7.506 -4.891 101 HA2 GLY 23 HA2 GLY 23 38.256 5.371 -5.374 102 HA3 GLY 23 HA1 GLY 23 39.070 6.120 -6.747 103 H GLU 24 HN GLU 24 39.668 7.110 -3.424 104 HA GLU 24 HA GLU 24 42.515 6.608 -3.759 105 HB2 GLU 24 HB2 GLU 24 41.143 7.203 -1.146 106 HB3 GLU 24 HB1 GLU 24 42.778 7.638 -1.646 107 HG2 GLU 24 HG2 GLU 24 41.446 8.920 -3.572 108 HG3 GLU 24 HG1 GLU 24 40.176 8.918 -2.347 109 H ILE 25 HN ILE 25 40.354 4.463 -3.632 110 HA ILE 25 HA ILE 25 39.982 2.377 -2.558 111 HB ILE 25 HB ILE 25 41.737 1.827 -4.116 112 HG12 ILE 25 HG12 ILE 25 43.023 0.102 -2.759 113 HG13 ILE 25 HG11 ILE 25 42.238 0.759 -1.324 114 HG21 ILE 25 HG21 ILE 25 43.306 3.612 -3.603 115 HG22 ILE 25 HG22 ILE 25 44.132 2.063 -3.449 116 HG23 ILE 25 HG23 ILE 25 43.613 2.931 -2.007 117 HD11 ILE 25 HD11 ILE 25 41.189 -1.118 -3.218 118 HD12 ILE 25 HD12 ILE 25 40.212 0.349 -3.283 119 HD13 ILE 25 HD13 ILE 25 40.427 -0.500 -1.752 120 H TYR 26 HN TYR 26 39.319 2.504 -0.460 121 HA TYR 26 HA TYR 26 41.453 2.618 1.601 122 HB2 TYR 26 HB2 TYR 26 40.239 4.120 2.973 123 HB3 TYR 26 HB1 TYR 26 40.148 4.809 1.356 124 HD1 TYR 26 HD1 TYR 26 38.086 2.669 0.333 125 HD2 TYR 26 HD2 TYR 26 38.240 5.220 3.785 126 HE1 TYR 26 HE1 TYR 26 35.615 2.644 0.465 127 HE2 TYR 26 HE2 TYR 26 35.764 5.190 3.915 128 HH TYR 26 HH TYR 26 33.854 4.793 2.447 129 H TYR 27 HN TYR 27 41.023 1.389 3.487 130 HA TYR 27 HA TYR 27 39.031 -0.773 3.051 131 HB2 TYR 27 HB2 TYR 27 41.355 -0.502 4.982 132 HB3 TYR 27 HB1 TYR 27 40.256 -1.877 4.953 133 HD1 TYR 27 HD1 TYR 27 42.692 -2.923 4.615 134 HD2 TYR 27 HD2 TYR 27 40.545 -0.682 1.646 135 HE1 TYR 27 HE1 TYR 27 44.045 -3.981 2.831 136 HE2 TYR 27 HE2 TYR 27 41.896 -1.738 -0.133 137 HH TYR 27 HH TYR 27 44.475 -4.076 0.660 138 H ILE 28 HN ILE 28 37.500 -1.302 4.705 139 HA ILE 28 HA ILE 28 37.148 0.845 6.732 140 HB ILE 28 HB ILE 28 35.339 1.345 5.482 141 HG12 ILE 28 HG12 ILE 28 33.326 0.226 6.226 142 HG13 ILE 28 HG11 ILE 28 34.237 -1.223 6.654 143 HG21 ILE 28 HG21 ILE 28 36.079 -0.226 3.686 144 HG22 ILE 28 HG22 ILE 28 34.325 -0.142 3.844 145 HG23 ILE 28 HG23 ILE 28 35.203 -1.519 4.508 146 HD11 ILE 28 HD11 ILE 28 33.672 0.993 8.306 147 HD12 ILE 28 HD12 ILE 28 35.397 1.069 7.956 148 HD13 ILE 28 HD13 ILE 28 34.706 -0.383 8.676 149 H ASN 29 HN ASN 29 37.198 0.122 8.779 150 HA ASN 29 HA ASN 29 36.815 -2.797 9.245 151 HB2 ASN 29 HB2 ASN 29 38.941 -1.772 10.022 152 HB3 ASN 29 HB1 ASN 29 38.017 -0.684 11.058 153 HD21 ASN 29 HD21 ASN 29 38.793 -1.577 13.071 154 HD22 ASN 29 HD22 ASN 29 38.396 -3.146 13.579 155 H HIS 30 HN HIS 30 34.656 -3.152 9.633 156 HA HIS 30 HA HIS 30 32.901 -1.252 10.878 157 HB2 HIS 30 HB2 HIS 30 32.635 -4.265 10.635 158 HB3 HIS 30 HB1 HIS 30 31.330 -3.156 11.062 159 HD1 HIS 30 HD1 HIS 30 31.024 -1.123 9.159 160 HD2 HIS 30 HD2 HIS 30 32.765 -4.704 7.912 161 HE1 HIS 30 HE1 HIS 30 30.828 -1.176 6.632 162 HE2 HIS 30 HE2 HIS 30 31.883 -3.351 5.864 163 H LYS 31 HN LYS 31 35.402 -3.051 12.183 164 HA LYS 31 HA LYS 31 34.168 -3.605 14.776 165 HB2 LYS 31 HB2 LYS 31 36.866 -3.958 13.550 166 HB3 LYS 31 HB1 LYS 31 36.779 -3.863 15.309 167 HG2 LYS 31 HG2 LYS 31 34.753 -5.608 14.038 168 HG3 LYS 31 HG1 LYS 31 36.421 -6.169 13.910 169 HD2 LYS 31 HD2 LYS 31 36.705 -6.207 16.268 170 HD3 LYS 31 HD1 LYS 31 35.255 -5.239 16.536 171 HE2 LYS 31 HE2 LYS 31 35.297 -8.050 15.399 172 HE3 LYS 31 HE1 LYS 31 34.851 -7.626 17.052 173 HZ1 LYS 31 HZ1 LYS 31 33.466 -6.813 14.557 174 HZ2 LYS 31 HZ2 LYS 31 33.103 -6.176 16.090 175 HZ3 LYS 31 HZ3 LYS 31 32.870 -7.829 15.776 176 H ASN 32 HN ASN 32 36.653 -1.353 13.577 177 HA ASN 32 HA ASN 32 36.333 0.245 16.052 178 HB2 ASN 32 HB2 ASN 32 38.382 0.248 13.829 179 HB3 ASN 32 HB1 ASN 32 38.306 1.534 15.035 180 HD21 ASN 32 HD21 ASN 32 40.637 0.293 15.247 181 HD22 ASN 32 HD22 ASN 32 40.669 -0.872 16.483 182 H LYS 33 HN LYS 33 34.530 0.045 13.514 183 HA LYS 33 HA LYS 33 33.352 1.529 12.115 184 HB2 LYS 33 HB2 LYS 33 33.563 2.753 14.824 185 HB3 LYS 33 HB1 LYS 33 32.976 3.790 13.524 186 HG2 LYS 33 HG2 LYS 33 31.793 1.084 13.570 187 HG3 LYS 33 HG1 LYS 33 31.385 2.092 14.959 188 HD2 LYS 33 HD2 LYS 33 30.792 3.931 13.309 189 HD3 LYS 33 HD1 LYS 33 30.943 2.724 12.032 190 HE2 LYS 33 HE2 LYS 33 29.289 1.872 14.321 191 HE3 LYS 33 HE1 LYS 33 28.629 3.229 13.410 192 HZ1 LYS 33 HZ1 LYS 33 29.288 0.515 12.458 193 HZ2 LYS 33 HZ2 LYS 33 29.179 1.818 11.372 194 HZ3 LYS 33 HZ3 LYS 33 27.832 1.370 12.304 195 H THR 34 HN THR 34 36.174 1.548 11.653 196 HA THR 34 HA THR 34 36.465 4.316 10.644 197 HB THR 34 HB THR 34 39.052 3.568 11.379 198 HG1 THR 34 HG1 THR 34 37.116 2.611 13.130 199 HG21 THR 34 HG21 THR 34 38.682 5.350 13.152 200 HG22 THR 34 HG22 THR 34 36.997 5.391 12.631 201 HG23 THR 34 HG23 THR 34 38.280 5.823 11.502 202 H THR 35 HN THR 35 38.392 4.378 9.048 203 HA THR 35 HA THR 35 38.429 1.815 7.548 204 HB THR 35 HB THR 35 39.146 3.547 5.657 205 HG1 THR 35 HG1 THR 35 38.309 5.530 5.990 206 HG21 THR 35 HG21 THR 35 36.466 2.717 6.677 207 HG22 THR 35 HG22 THR 35 37.249 2.324 5.147 208 HG23 THR 35 HG23 THR 35 36.529 3.909 5.386 209 H SER 36 HN SER 36 40.453 1.408 6.320 210 HA SER 36 HA SER 36 42.849 2.866 7.237 211 HB2 SER 36 HB2 SER 36 42.026 0.726 8.765 212 HB3 SER 36 HB1 SER 36 43.164 -0.029 7.654 213 HG SER 36 HG SER 36 44.756 1.188 8.437 214 H TRP 37 HN TRP 37 44.778 1.015 6.443 215 HA TRP 37 HA TRP 37 44.033 0.382 3.620 216 HB2 TRP 37 HB2 TRP 37 46.796 1.358 4.232 217 HB3 TRP 37 HB1 TRP 37 45.873 1.484 2.736 218 HD1 TRP 37 HD1 TRP 37 46.454 3.199 6.066 219 HE1 TRP 37 HE1 TRP 37 45.312 5.510 6.040 220 HE3 TRP 37 HE3 TRP 37 43.830 2.839 1.696 221 HZ2 TRP 37 HZ2 TRP 37 43.525 7.007 4.385 222 HZ3 TRP 37 HZ3 TRP 37 42.418 4.724 0.923 223 HH2 TRP 37 HH2 TRP 37 42.262 6.803 2.260 224 H LEU 38 HN LEU 38 45.295 -0.691 6.544 225 HA LEU 38 HA LEU 38 47.342 -2.495 5.646 226 HB2 LEU 38 HB2 LEU 38 45.820 -2.012 8.114 227 HB3 LEU 38 HB1 LEU 38 46.260 -3.704 7.877 228 HG LEU 38 HG LEU 38 48.612 -3.041 7.520 229 HD11 LEU 38 HD11 LEU 38 48.657 -0.891 6.659 230 HD12 LEU 38 HD12 LEU 38 49.017 -0.549 8.351 231 HD13 LEU 38 HD13 LEU 38 47.380 -0.322 7.735 232 HD21 LEU 38 HD21 LEU 38 47.655 -3.517 9.829 233 HD22 LEU 38 HD22 LEU 38 47.544 -1.773 10.056 234 HD23 LEU 38 HD23 LEU 38 49.118 -2.533 9.818 235 H ASP 39 HN ASP 39 47.156 -4.465 4.662 236 HA ASP 39 HA ASP 39 44.407 -5.549 4.313 237 HB2 ASP 39 HB2 ASP 39 46.397 -6.750 2.585 238 HB3 ASP 39 HB1 ASP 39 44.929 -5.875 2.146 239 HA PRO 40 HA PRO 40 46.056 -8.489 7.408 240 HB2 PRO 40 HB2 PRO 40 43.360 -9.617 6.780 241 HB3 PRO 40 HB1 PRO 40 44.124 -9.333 8.355 242 HG2 PRO 40 HG2 PRO 40 42.214 -7.728 7.409 243 HG3 PRO 40 HG1 PRO 40 43.560 -7.114 8.382 244 HD2 PRO 40 HD2 PRO 40 43.063 -6.810 5.466 245 HD3 PRO 40 HD1 PRO 40 43.967 -5.756 6.573 246 H ARG 41 HN ARG 41 43.879 -9.919 4.943 247 HA ARG 41 HA ARG 41 46.154 -11.627 4.072 248 HB2 ARG 41 HB2 ARG 41 44.515 -13.533 3.888 249 HB3 ARG 41 HB1 ARG 41 44.838 -13.023 5.545 250 HG2 ARG 41 HG2 ARG 41 42.760 -11.391 4.968 251 HG3 ARG 41 HG1 ARG 41 42.355 -12.765 3.938 252 HD2 ARG 41 HD2 ARG 41 41.378 -13.518 5.876 253 HD3 ARG 41 HD1 ARG 41 43.015 -14.103 6.177 254 HE ARG 41 HE ARG 41 42.678 -11.396 7.141 255 HH11 ARG 41 HH11 ARG 41 42.591 -11.130 9.385 256 HH12 ARG 41 HH12 ARG 41 42.276 -12.501 10.395 257 HH21 ARG 41 HH21 ARG 41 42.024 -14.727 7.748 258 HH22 ARG 41 HH22 ARG 41 41.955 -14.538 9.468 259 H LEU 42 HN LEU 42 45.482 -9.397 2.651 260 HA LEU 42 HA LEU 42 44.471 -10.577 0.158 261 HB2 LEU 42 HB2 LEU 42 42.656 -9.258 1.756 262 HB3 LEU 42 HB1 LEU 42 43.210 -7.972 0.684 263 HG LEU 42 HG LEU 42 42.887 -9.857 -1.167 264 HD11 LEU 42 HD11 LEU 42 41.251 -11.468 -0.683 265 HD12 LEU 42 HD12 LEU 42 40.653 -10.578 0.718 266 HD13 LEU 42 HD13 LEU 42 42.195 -11.429 0.806 267 HD21 LEU 42 HD21 LEU 42 41.718 -7.777 -1.309 268 HD22 LEU 42 HD22 LEU 42 40.761 -8.136 0.128 269 HD23 LEU 42 HD23 LEU 42 40.473 -9.025 -1.367 270 H ASP 43 HN ASP 43 47.009 -9.979 0.353 271 HA ASP 43 HA ASP 43 47.391 -7.166 -0.549 272 HB2 ASP 43 HB2 ASP 43 49.834 -8.705 -0.271 273 HB3 ASP 43 HB1 ASP 43 49.344 -7.236 0.573 274 HA PRO 44 HA PRO 44 47.704 -9.251 -4.566 275 HB2 PRO 44 HB2 PRO 44 47.116 -7.064 -6.067 276 HB3 PRO 44 HB1 PRO 44 45.871 -8.013 -5.231 277 HG2 PRO 44 HG2 PRO 44 47.061 -5.395 -4.506 278 HG3 PRO 44 HG1 PRO 44 45.409 -5.989 -4.281 279 HD2 PRO 44 HD2 PRO 44 47.357 -5.894 -2.285 280 HD3 PRO 44 HD1 PRO 44 45.893 -6.899 -2.236 281 H ARG 45 HN ARG 45 49.604 -9.526 -5.676 282 HA ARG 45 HA ARG 45 51.915 -9.146 -6.099 283 HB2 ARG 45 HB2 ARG 45 50.267 -7.008 -7.397 284 HB3 ARG 45 HB1 ARG 45 52.024 -6.881 -7.485 285 HG2 ARG 45 HG2 ARG 45 52.189 -9.085 -8.494 286 HG3 ARG 45 HG1 ARG 45 50.459 -9.351 -8.280 287 HD2 ARG 45 HD2 ARG 45 50.698 -8.682 -10.549 288 HD3 ARG 45 HD1 ARG 45 50.120 -7.244 -9.708 289 HE ARG 45 HE ARG 45 52.952 -7.160 -9.674 290 HH11 ARG 45 HH11 ARG 45 54.043 -5.896 -11.197 291 HH12 ARG 45 HH12 ARG 45 53.242 -5.455 -12.669 292 HH21 ARG 45 HH21 ARG 45 50.300 -7.111 -11.877 293 HH22 ARG 45 HH22 ARG 45 51.124 -6.143 -13.054 294 H GLY 46 HN GLY 46 51.689 -5.735 -6.172 295 HA2 GLY 46 HA2 GLY 46 52.125 -5.049 -3.453 296 HA3 GLY 46 HA1 GLY 46 53.700 -5.376 -4.178 297 H GLY 47 HN GLY 47 52.958 -2.800 -3.251 298 HA2 GLY 47 HA2 GLY 47 53.867 -1.012 -5.056 299 HA3 GLY 47 HA1 GLY 47 52.215 -1.229 -5.635 300 H GLY 48 HN GLY 48 53.453 1.187 -4.447 301 HA2 GLY 48 HA2 GLY 48 51.657 2.612 -3.212 302 HA3 GLY 48 HA1 GLY 48 51.875 1.422 -1.926 303 H GLY 49 HN GLY 49 52.437 3.738 -0.950 304 HA2 GLY 49 HA2 GLY 49 55.311 3.730 -0.528 305 HA3 GLY 49 HA1 GLY 49 54.780 5.137 -1.451 306 H ASN 50 HN ASN 50 52.581 6.055 -0.370 307 HA ASN 50 HA ASN 50 52.946 6.104 2.589 308 HB2 ASN 50 HB2 ASN 50 54.031 8.108 2.081 309 HB3 ASN 50 HB1 ASN 50 53.015 8.417 0.674 310 HD21 ASN 50 HD21 ASN 50 51.465 10.007 1.017 311 HD22 ASN 50 HD22 ASN 50 50.792 10.408 2.524 312 H ARG 51 HN ARG 51 51.016 5.079 3.077 313 HA ARG 51 HA ARG 51 48.560 5.554 1.635 314 HB2 ARG 51 HB2 ARG 51 47.518 4.176 3.301 315 HB3 ARG 51 HB1 ARG 51 49.124 3.498 3.027 316 HG2 ARG 51 HG2 ARG 51 49.784 5.175 4.982 317 HG3 ARG 51 HG1 ARG 51 48.078 5.000 5.393 318 HD2 ARG 51 HD2 ARG 51 48.736 3.131 6.501 319 HD3 ARG 51 HD1 ARG 51 48.812 2.395 4.901 320 HE ARG 51 HE ARG 51 51.165 2.415 5.070 321 HH11 ARG 51 HH11 ARG 51 53.104 2.887 6.133 322 HH12 ARG 51 HH12 ARG 51 53.094 3.978 7.478 323 HH21 ARG 51 HH21 ARG 51 49.677 4.546 7.333 324 HH22 ARG 51 HH22 ARG 51 51.154 4.919 8.157 325 H GLN 52 HN GLN 52 47.739 7.613 1.657 326 HA GLN 52 HA GLN 52 48.089 9.661 3.470 327 HB2 GLN 52 HB2 GLN 52 45.384 9.893 2.887 328 HB3 GLN 52 HB1 GLN 52 46.704 10.519 1.898 329 HG2 GLN 52 HG2 GLN 52 45.822 7.654 1.615 330 HG3 GLN 52 HG1 GLN 52 44.949 8.941 0.782 331 HE21 GLN 52 HE21 GLN 52 46.180 10.241 -0.817 332 HE22 GLN 52 HE22 GLN 52 47.597 9.619 -1.514 333 HA PRO 53 HA PRO 53 46.257 8.637 7.328 334 HB2 PRO 53 HB2 PRO 53 44.761 10.898 7.901 335 HB3 PRO 53 HB1 PRO 53 46.515 10.769 8.122 336 HG2 PRO 53 HG2 PRO 53 44.972 12.044 5.932 337 HG3 PRO 53 HG1 PRO 53 46.505 12.533 6.671 338 HD2 PRO 53 HD2 PRO 53 46.372 11.304 4.237 339 HD3 PRO 53 HD1 PRO 53 47.760 11.120 5.335 340 HA PRO 54 HA PRO 54 42.221 7.097 6.092 341 HB2 PRO 54 HB2 PRO 54 41.850 5.434 8.215 342 HB3 PRO 54 HB1 PRO 54 42.933 5.047 6.865 343 HG2 PRO 54 HG2 PRO 54 43.581 6.037 9.588 344 HG3 PRO 54 HG1 PRO 54 44.458 4.890 8.561 345 HD2 PRO 54 HD2 PRO 54 45.169 7.549 8.883 346 HD3 PRO 54 HD1 PRO 54 45.620 6.552 7.483 347 HA PRO 55 HA PRO 55 39.947 9.898 8.853 348 HB2 PRO 55 HB2 PRO 55 38.045 10.598 7.058 349 HB3 PRO 55 HB1 PRO 55 39.685 11.274 7.004 350 HG2 PRO 55 HG2 PRO 55 38.444 9.184 5.308 351 HG3 PRO 55 HG1 PRO 55 39.646 10.415 4.891 352 HD2 PRO 55 HD2 PRO 55 40.200 7.717 5.437 353 HD3 PRO 55 HD1 PRO 55 41.390 9.034 5.417 354 HA PRO 56 HA PRO 56 36.689 7.285 10.277 355 HB2 PRO 56 HB2 PRO 56 34.666 9.115 10.764 356 HB3 PRO 56 HB1 PRO 56 36.014 8.771 11.861 357 HG2 PRO 56 HG2 PRO 56 35.629 11.037 9.989 358 HG3 PRO 56 HG1 PRO 56 36.431 10.995 11.567 359 HD2 PRO 56 HD2 PRO 56 37.807 11.058 9.203 360 HD3 PRO 56 HD1 PRO 56 38.447 10.297 10.676 361 H TYR 57 HN TYR 57 35.880 6.004 8.662 362 HA TYR 57 HA TYR 57 34.517 6.965 6.334 363 HB2 TYR 57 HB2 TYR 57 34.540 4.782 5.706 364 HB3 TYR 57 HB1 TYR 57 35.568 4.571 7.121 365 HD1 TYR 57 HD1 TYR 57 32.556 3.555 5.544 366 HD2 TYR 57 HD2 TYR 57 34.324 4.199 9.405 367 HE1 TYR 57 HE1 TYR 57 30.854 2.073 6.570 368 HE2 TYR 57 HE2 TYR 57 32.620 2.719 10.431 369 HH TYR 57 HH TYR 57 30.151 1.096 8.433 370 HA PRO 58 HA PRO 58 30.627 7.740 8.434 371 HB2 PRO 58 HB2 PRO 58 29.337 8.842 6.312 372 HB3 PRO 58 HB1 PRO 58 30.576 9.715 7.233 373 HG2 PRO 58 HG2 PRO 58 30.776 8.372 4.591 374 HG3 PRO 58 HG1 PRO 58 31.534 9.868 5.161 375 HD2 PRO 58 HD2 PRO 58 32.827 7.416 5.011 376 HD3 PRO 58 HD1 PRO 58 33.333 8.760 6.057 377 H LEU 59 HN LEU 59 29.917 5.542 8.708 378 HA LEU 59 HA LEU 59 29.185 3.635 6.878 379 HB2 LEU 59 HB2 LEU 59 28.892 3.262 9.266 380 HB3 LEU 59 HB1 LEU 59 27.608 4.470 9.330 381 HG LEU 59 HG LEU 59 26.203 3.117 7.867 382 HD11 LEU 59 HD11 LEU 59 27.516 1.964 6.362 383 HD12 LEU 59 HD12 LEU 59 27.243 0.671 7.530 384 HD13 LEU 59 HD13 LEU 59 28.749 1.589 7.565 385 HD21 LEU 59 HD21 LEU 59 27.351 1.212 9.911 386 HD22 LEU 59 HD22 LEU 59 25.672 1.395 9.407 387 HD23 LEU 59 HD23 LEU 59 26.434 2.637 10.400 388 H THR 60 HN THR 60 27.581 3.350 5.348 389 HA THR 60 HA THR 60 25.806 5.692 4.865 390 HB THR 60 HB THR 60 25.766 5.082 2.606 391 HG1 THR 60 HG1 THR 60 26.814 2.531 3.079 392 HG21 THR 60 HG21 THR 60 28.096 4.454 1.991 393 HG22 THR 60 HG22 THR 60 28.410 4.062 3.681 394 HG23 THR 60 HG23 THR 60 28.041 5.722 3.216 395 H ALA 61 HN ALA 61 24.319 5.023 6.593 396 HA ALA 61 HA ALA 61 23.035 2.494 6.718 397 HB1 ALA 61 HB1 ALA 61 21.086 3.999 7.678 398 HB2 ALA 61 HB2 ALA 61 22.310 5.267 7.605 399 HB3 ALA 61 HB3 ALA 61 22.593 3.823 8.578 Start of MODEL 14 1 H1 SER 8 HT1 SER 8 28.548 -6.100 -2.711 2 H2 SER 8 HT2 SER 8 30.067 -6.373 -2.001 3 H3 SER 8 HT3 SER 8 28.830 -5.633 -1.104 4 HA SER 8 HA SER 8 28.146 -7.592 -0.376 5 HB2 SER 8 HB2 SER 8 27.082 -9.118 -1.910 6 HB3 SER 8 HB1 SER 8 26.779 -7.489 -2.506 7 HG SER 8 HG SER 8 29.107 -8.368 -3.476 8 H GLY 9 HN GLY 9 29.888 -8.494 0.680 9 HA2 GLY 9 HA2 GLY 9 31.085 -10.836 0.152 10 HA3 GLY 9 HA1 GLY 9 32.036 -9.781 -0.895 11 HA PRO 10 HA PRO 10 32.525 -8.082 3.739 12 HB2 PRO 10 HB2 PRO 10 31.958 -10.715 5.029 13 HB3 PRO 10 HB1 PRO 10 31.590 -9.076 5.600 14 HG2 PRO 10 HG2 PRO 10 29.705 -10.674 4.585 15 HG3 PRO 10 HG1 PRO 10 29.683 -8.918 4.347 16 HD2 PRO 10 HD2 PRO 10 30.324 -11.068 2.394 17 HD3 PRO 10 HD1 PRO 10 29.678 -9.438 2.108 18 H LEU 11 HN LEU 11 34.645 -8.118 4.542 19 HA LEU 11 HA LEU 11 36.426 -10.163 3.428 20 HB2 LEU 11 HB2 LEU 11 36.691 -7.532 4.806 21 HB3 LEU 11 HB1 LEU 11 38.051 -8.633 4.941 22 HG LEU 11 HG LEU 11 36.764 -8.062 2.276 23 HD11 LEU 11 HD11 LEU 11 37.565 -5.966 2.298 24 HD12 LEU 11 HD12 LEU 11 39.190 -6.612 2.510 25 HD13 LEU 11 HD13 LEU 11 38.212 -6.202 3.920 26 HD21 LEU 11 HD21 LEU 11 38.872 -8.834 1.390 27 HD22 LEU 11 HD22 LEU 11 38.356 -10.008 2.599 28 HD23 LEU 11 HD23 LEU 11 39.608 -8.831 2.990 29 HA PRO 12 HA PRO 12 37.744 -12.862 6.776 30 HB2 PRO 12 HB2 PRO 12 38.801 -10.476 8.268 31 HB3 PRO 12 HB1 PRO 12 39.486 -12.110 8.141 32 HG2 PRO 12 HG2 PRO 12 40.194 -9.941 6.556 33 HG3 PRO 12 HG1 PRO 12 40.514 -11.640 6.184 34 HD2 PRO 12 HD2 PRO 12 38.844 -9.914 4.693 35 HD3 PRO 12 HD1 PRO 12 38.910 -11.679 4.540 36 H ASP 13 HN ASP 13 36.743 -9.740 8.239 37 HA ASP 13 HA ASP 13 34.179 -10.277 8.978 38 HB2 ASP 13 HB2 ASP 13 36.045 -12.011 10.473 39 HB3 ASP 13 HB1 ASP 13 34.852 -11.176 11.467 40 H GLY 14 HN GLY 14 33.773 -8.189 9.410 41 HA2 GLY 14 HA2 GLY 14 33.630 -6.502 11.186 42 HA3 GLY 14 HA1 GLY 14 35.271 -6.938 11.664 43 H TRP 15 HN TRP 15 35.177 -6.905 8.317 44 HA TRP 15 HA TRP 15 35.445 -4.019 7.985 45 HB2 TRP 15 HB2 TRP 15 37.746 -3.846 7.686 46 HB3 TRP 15 HB1 TRP 15 37.614 -4.931 9.065 47 HD1 TRP 15 HD1 TRP 15 37.612 -7.681 8.286 48 HE1 TRP 15 HE1 TRP 15 39.210 -8.781 6.597 49 HE3 TRP 15 HE3 TRP 15 39.141 -3.556 5.703 50 HZ2 TRP 15 HZ2 TRP 15 40.920 -8.017 4.433 51 HZ3 TRP 15 HZ3 TRP 15 40.748 -3.767 3.833 52 HH2 TRP 15 HH2 TRP 15 41.641 -5.992 3.193 53 H GLU 16 HN GLU 16 36.096 -3.435 5.727 54 HA GLU 16 HA GLU 16 35.939 -5.580 3.720 55 HB2 GLU 16 HB2 GLU 16 33.620 -3.897 4.455 56 HB3 GLU 16 HB1 GLU 16 33.949 -4.000 2.725 57 HG2 GLU 16 HG2 GLU 16 34.095 -6.527 3.034 58 HG3 GLU 16 HG1 GLU 16 33.427 -6.274 4.647 59 H GLN 17 HN GLN 17 36.574 -4.832 1.628 60 HA GLN 17 HA GLN 17 38.080 -2.308 1.674 61 HB2 GLN 17 HB2 GLN 17 39.358 -3.872 0.549 62 HB3 GLN 17 HB1 GLN 17 37.948 -4.709 -0.099 63 HG2 GLN 17 HG2 GLN 17 37.604 -3.045 -1.773 64 HG3 GLN 17 HG1 GLN 17 38.722 -1.927 -0.993 65 HE21 GLN 17 HE21 GLN 17 40.650 -1.817 -2.138 66 HE22 GLN 17 HE22 GLN 17 41.403 -3.124 -2.915 67 H ALA 18 HN ALA 18 37.431 -0.448 0.607 68 HA ALA 18 HA ALA 18 35.267 -0.600 -1.384 69 HB1 ALA 18 HB1 ALA 18 34.016 1.237 -0.099 70 HB2 ALA 18 HB2 ALA 18 34.991 0.764 1.294 71 HB3 ALA 18 HB3 ALA 18 33.899 -0.400 0.545 72 H MET 19 HN MET 19 34.684 2.047 -1.689 73 HA MET 19 HA MET 19 37.343 3.332 -2.068 74 HB2 MET 19 HB2 MET 19 36.052 4.428 -4.100 75 HB3 MET 19 HB1 MET 19 36.794 2.837 -4.271 76 HG2 MET 19 HG2 MET 19 33.961 3.079 -3.291 77 HG3 MET 19 HG1 MET 19 34.308 3.157 -5.017 78 HE1 MET 19 HE1 MET 19 36.960 0.732 -5.120 79 HE2 MET 19 HE2 MET 19 35.935 1.815 -6.059 80 HE3 MET 19 HE3 MET 19 35.678 0.074 -6.148 81 H THR 20 HN THR 20 37.221 5.733 -2.177 82 HA THR 20 HA THR 20 35.216 6.723 -0.251 83 HB THR 20 HB THR 20 36.736 8.835 -0.503 84 HG1 THR 20 HG1 THR 20 37.728 7.817 -2.418 85 HG21 THR 20 HG21 THR 20 37.578 6.209 0.728 86 HG22 THR 20 HG22 THR 20 36.797 7.578 1.522 87 HG23 THR 20 HG23 THR 20 38.474 7.706 0.991 88 H GLN 21 HN GLN 21 35.223 9.456 -1.129 89 HA GLN 21 HA GLN 21 33.290 9.222 -3.328 90 HB2 GLN 21 HB2 GLN 21 33.052 10.778 -1.305 91 HB3 GLN 21 HB1 GLN 21 34.298 11.775 -2.056 92 HG2 GLN 21 HG2 GLN 21 32.313 11.080 -4.025 93 HG3 GLN 21 HG1 GLN 21 31.521 11.787 -2.615 94 HE21 GLN 21 HE21 GLN 21 31.089 13.758 -3.936 95 HE22 GLN 21 HE22 GLN 21 32.334 14.875 -4.219 96 H ASP 22 HN ASP 22 36.623 9.682 -3.007 97 HA ASP 22 HA ASP 22 36.777 10.947 -5.690 98 HB2 ASP 22 HB2 ASP 22 37.840 12.213 -3.792 99 HB3 ASP 22 HB1 ASP 22 38.932 10.847 -3.566 100 H GLY 23 HN GLY 23 36.488 8.082 -4.710 101 HA2 GLY 23 HA2 GLY 23 37.283 5.974 -5.344 102 HA3 GLY 23 HA1 GLY 23 37.972 6.798 -6.744 103 H GLU 24 HN GLU 24 38.763 7.315 -3.320 104 HA GLU 24 HA GLU 24 41.607 6.968 -3.962 105 HB2 GLU 24 HB2 GLU 24 40.439 7.464 -1.231 106 HB3 GLU 24 HB1 GLU 24 42.038 7.907 -1.829 107 HG2 GLU 24 HG2 GLU 24 40.343 9.162 -3.619 108 HG3 GLU 24 HG1 GLU 24 39.494 9.338 -2.083 109 H ILE 25 HN ILE 25 39.456 4.815 -3.731 110 HA ILE 25 HA ILE 25 39.182 2.684 -2.716 111 HB ILE 25 HB ILE 25 40.789 2.181 -4.432 112 HG12 ILE 25 HG12 ILE 25 42.166 0.409 -3.278 113 HG13 ILE 25 HG11 ILE 25 41.601 1.051 -1.735 114 HG21 ILE 25 HG21 ILE 25 43.230 2.420 -3.992 115 HG22 ILE 25 HG22 ILE 25 42.852 3.230 -2.474 116 HG23 ILE 25 HG23 ILE 25 42.388 3.968 -4.006 117 HD11 ILE 25 HD11 ILE 25 39.681 -0.100 -1.927 118 HD12 ILE 25 HD12 ILE 25 40.281 -0.811 -3.425 119 HD13 ILE 25 HD13 ILE 25 39.341 0.680 -3.472 120 H TYR 26 HN TYR 26 38.710 2.684 -0.567 121 HA TYR 26 HA TYR 26 41.013 2.697 1.298 122 HB2 TYR 26 HB2 TYR 26 39.985 4.183 2.826 123 HB3 TYR 26 HB1 TYR 26 39.752 4.933 1.251 124 HD1 TYR 26 HD1 TYR 26 37.549 2.811 0.421 125 HD2 TYR 26 HD2 TYR 26 38.101 5.373 3.822 126 HE1 TYR 26 HE1 TYR 26 35.103 2.837 0.801 127 HE2 TYR 26 HE2 TYR 26 35.650 5.398 4.198 128 HH TYR 26 HH TYR 26 33.442 3.637 2.021 129 H TYR 27 HN TYR 27 40.563 1.561 3.327 130 HA TYR 27 HA TYR 27 38.517 -0.569 2.914 131 HB2 TYR 27 HB2 TYR 27 40.933 -0.532 4.746 132 HB3 TYR 27 HB1 TYR 27 39.841 -1.892 4.509 133 HD1 TYR 27 HD1 TYR 27 42.696 -2.275 4.043 134 HD2 TYR 27 HD2 TYR 27 39.680 -0.771 1.375 135 HE1 TYR 27 HE1 TYR 27 44.037 -3.020 2.095 136 HE2 TYR 27 HE2 TYR 27 41.020 -1.515 -0.561 137 HH TYR 27 HH TYR 27 43.970 -2.021 -0.672 138 H ILE 28 HN ILE 28 37.155 -1.158 4.677 139 HA ILE 28 HA ILE 28 36.990 0.905 6.810 140 HB ILE 28 HB ILE 28 35.086 1.478 5.765 141 HG12 ILE 28 HG12 ILE 28 33.116 0.201 6.445 142 HG13 ILE 28 HG11 ILE 28 34.120 -1.209 6.786 143 HG21 ILE 28 HG21 ILE 28 34.983 -1.278 4.512 144 HG22 ILE 28 HG22 ILE 28 35.730 0.142 3.778 145 HG23 ILE 28 HG23 ILE 28 33.989 0.106 4.059 146 HD11 ILE 28 HD11 ILE 28 35.321 0.866 8.219 147 HD12 ILE 28 HD12 ILE 28 34.326 -0.428 8.881 148 HD13 ILE 28 HD13 ILE 28 33.592 1.112 8.445 149 H ASN 29 HN ASN 29 37.020 0.123 8.850 150 HA ASN 29 HA ASN 29 36.727 -2.824 9.202 151 HB2 ASN 29 HB2 ASN 29 38.743 -1.212 10.033 152 HB3 ASN 29 HB1 ASN 29 37.693 -1.148 11.449 153 HD21 ASN 29 HD21 ASN 29 40.342 -2.724 10.608 154 HD22 ASN 29 HD22 ASN 29 40.019 -4.284 11.194 155 H HIS 30 HN HIS 30 34.591 -3.244 9.621 156 HA HIS 30 HA HIS 30 32.842 -1.425 11.008 157 HB2 HIS 30 HB2 HIS 30 32.617 -4.394 10.435 158 HB3 HIS 30 HB1 HIS 30 31.318 -3.424 11.132 159 HD1 HIS 30 HD1 HIS 30 31.181 -0.960 9.543 160 HD2 HIS 30 HD2 HIS 30 32.122 -4.597 7.728 161 HE1 HIS 30 HE1 HIS 30 30.666 -0.686 7.077 162 HE2 HIS 30 HE2 HIS 30 31.234 -2.894 5.964 163 H LYS 31 HN LYS 31 35.396 -3.197 12.168 164 HA LYS 31 HA LYS 31 34.150 -3.900 14.745 165 HB2 LYS 31 HB2 LYS 31 36.713 -4.487 13.373 166 HB3 LYS 31 HB1 LYS 31 36.796 -4.356 15.130 167 HG2 LYS 31 HG2 LYS 31 34.792 -6.087 13.656 168 HG3 LYS 31 HG1 LYS 31 36.313 -6.685 14.320 169 HD2 LYS 31 HD2 LYS 31 35.360 -5.411 16.498 170 HD3 LYS 31 HD1 LYS 31 33.833 -5.842 15.729 171 HE2 LYS 31 HE2 LYS 31 34.415 -7.676 17.164 172 HE3 LYS 31 HE1 LYS 31 34.736 -8.206 15.513 173 HZ1 LYS 31 HZ1 LYS 31 36.867 -6.923 17.086 174 HZ2 LYS 31 HZ2 LYS 31 36.997 -8.018 15.792 175 HZ3 LYS 31 HZ3 LYS 31 36.516 -8.565 17.328 176 H ASN 32 HN ASN 32 36.567 -1.658 13.448 177 HA ASN 32 HA ASN 32 36.596 -0.249 16.065 178 HB2 ASN 32 HB2 ASN 32 38.793 -0.907 15.065 179 HB3 ASN 32 HB1 ASN 32 38.428 0.118 13.676 180 HD21 ASN 32 HD21 ASN 32 40.450 1.335 14.417 181 HD22 ASN 32 HD22 ASN 32 40.277 2.505 15.634 182 H LYS 33 HN LYS 33 34.731 -0.190 13.476 183 HA LYS 33 HA LYS 33 33.519 1.452 12.316 184 HB2 LYS 33 HB2 LYS 33 33.809 2.305 15.119 185 HB3 LYS 33 HB1 LYS 33 33.448 3.625 14.006 186 HG2 LYS 33 HG2 LYS 33 31.448 2.584 13.250 187 HG3 LYS 33 HG1 LYS 33 31.893 1.036 13.968 188 HD2 LYS 33 HD2 LYS 33 31.386 3.549 15.582 189 HD3 LYS 33 HD1 LYS 33 30.163 2.313 15.285 190 HE2 LYS 33 HE2 LYS 33 30.965 1.368 17.191 191 HE3 LYS 33 HE1 LYS 33 32.269 0.790 16.154 192 HZ1 LYS 33 HZ1 LYS 33 32.632 2.299 18.334 193 HZ2 LYS 33 HZ2 LYS 33 32.588 3.494 17.127 194 HZ3 LYS 33 HZ3 LYS 33 33.720 2.231 17.034 195 H THR 34 HN THR 34 36.343 1.403 11.754 196 HA THR 34 HA THR 34 36.675 4.221 10.909 197 HB THR 34 HB THR 34 39.265 3.364 11.507 198 HG1 THR 34 HG1 THR 34 37.367 2.539 13.421 199 HG21 THR 34 HG21 THR 34 37.276 5.200 12.820 200 HG22 THR 34 HG22 THR 34 38.677 5.616 11.832 201 HG23 THR 34 HG23 THR 34 38.903 5.011 13.474 202 H THR 35 HN THR 35 38.267 4.404 9.105 203 HA THR 35 HA THR 35 38.342 1.881 7.546 204 HB THR 35 HB THR 35 38.847 3.659 5.654 205 HG1 THR 35 HG1 THR 35 38.892 5.354 7.270 206 HG21 THR 35 HG21 THR 35 36.914 2.435 5.311 207 HG22 THR 35 HG22 THR 35 36.216 4.018 5.631 208 HG23 THR 35 HG23 THR 35 36.271 2.813 6.911 209 H SER 36 HN SER 36 40.261 1.645 6.106 210 HA SER 36 HA SER 36 42.679 3.137 6.786 211 HB2 SER 36 HB2 SER 36 43.505 1.814 8.408 212 HB3 SER 36 HB1 SER 36 42.005 0.893 8.393 213 HG SER 36 HG SER 36 44.408 0.444 6.986 214 H TRP 37 HN TRP 37 44.632 1.478 5.892 215 HA TRP 37 HA TRP 37 43.660 0.631 3.190 216 HB2 TRP 37 HB2 TRP 37 46.497 1.487 3.605 217 HB3 TRP 37 HB1 TRP 37 45.483 1.628 2.169 218 HD1 TRP 37 HD1 TRP 37 46.462 3.426 5.336 219 HE1 TRP 37 HE1 TRP 37 45.388 5.770 5.358 220 HE3 TRP 37 HE3 TRP 37 43.312 2.995 1.336 221 HZ2 TRP 37 HZ2 TRP 37 43.450 7.265 3.875 222 HZ3 TRP 37 HZ3 TRP 37 41.866 4.894 0.664 223 HH2 TRP 37 HH2 TRP 37 41.931 7.024 1.928 224 H LEU 38 HN LEU 38 44.987 -0.403 6.080 225 HA LEU 38 HA LEU 38 47.026 -2.164 5.648 226 HB2 LEU 38 HB2 LEU 38 45.931 -2.108 7.801 227 HB3 LEU 38 HB1 LEU 38 44.430 -2.724 7.108 228 HG LEU 38 HG LEU 38 46.697 -4.458 6.508 229 HD11 LEU 38 HD11 LEU 38 47.616 -3.794 8.616 230 HD12 LEU 38 HD12 LEU 38 46.799 -5.330 8.902 231 HD13 LEU 38 HD13 LEU 38 46.030 -3.818 9.389 232 HD21 LEU 38 HD21 LEU 38 44.110 -4.822 6.446 233 HD22 LEU 38 HD22 LEU 38 44.279 -5.129 8.175 234 HD23 LEU 38 HD23 LEU 38 45.134 -6.142 7.011 235 H ASP 39 HN ASP 39 47.416 -3.580 4.021 236 HA ASP 39 HA ASP 39 45.091 -4.841 2.664 237 HB2 ASP 39 HB2 ASP 39 47.031 -5.425 0.972 238 HB3 ASP 39 HB1 ASP 39 46.323 -3.810 0.981 239 HA PRO 40 HA PRO 40 46.771 -8.413 4.917 240 HB2 PRO 40 HB2 PRO 40 44.430 -9.788 5.046 241 HB3 PRO 40 HB1 PRO 40 44.821 -8.457 6.151 242 HG2 PRO 40 HG2 PRO 40 43.016 -8.497 3.802 243 HG3 PRO 40 HG1 PRO 40 42.887 -7.591 5.317 244 HD2 PRO 40 HD2 PRO 40 43.784 -6.541 2.885 245 HD3 PRO 40 HD1 PRO 40 44.062 -5.814 4.482 246 H ARG 41 HN ARG 41 44.222 -9.085 2.479 247 HA ARG 41 HA ARG 41 46.148 -10.946 1.170 248 HB2 ARG 41 HB2 ARG 41 44.270 -12.435 0.650 249 HB3 ARG 41 HB1 ARG 41 44.373 -12.180 2.393 250 HG2 ARG 41 HG2 ARG 41 42.754 -10.097 1.603 251 HG3 ARG 41 HG1 ARG 41 42.258 -11.389 0.507 252 HD2 ARG 41 HD2 ARG 41 40.991 -11.328 2.698 253 HD3 ARG 41 HD1 ARG 41 41.777 -12.868 2.348 254 HE ARG 41 HE ARG 41 43.434 -11.063 3.936 255 HH11 ARG 41 HH11 ARG 41 43.841 -11.742 6.053 256 HH12 ARG 41 HH12 ARG 41 42.888 -13.016 6.737 257 HH21 ARG 41 HH21 ARG 41 40.953 -13.457 3.894 258 HH22 ARG 41 HH22 ARG 41 41.254 -13.987 5.515 259 H LEU 42 HN LEU 42 46.009 -8.328 0.324 260 HA LEU 42 HA LEU 42 44.991 -8.673 -2.400 261 HB2 LEU 42 HB2 LEU 42 43.550 -7.104 -0.384 262 HB3 LEU 42 HB1 LEU 42 43.947 -6.174 -1.830 263 HG LEU 42 HG LEU 42 42.807 -8.936 -2.122 264 HD11 LEU 42 HD11 LEU 42 41.338 -7.690 -0.528 265 HD12 LEU 42 HD12 LEU 42 40.545 -8.029 -2.066 266 HD13 LEU 42 HD13 LEU 42 41.168 -6.414 -1.734 267 HD21 LEU 42 HD21 LEU 42 42.666 -6.363 -3.726 268 HD22 LEU 42 HD22 LEU 42 41.887 -7.877 -4.188 269 HD23 LEU 42 HD23 LEU 42 43.646 -7.779 -4.109 270 H ASP 43 HN ASP 43 47.391 -8.488 -2.591 271 HA ASP 43 HA ASP 43 48.274 -6.060 -3.614 272 HB2 ASP 43 HB2 ASP 43 48.326 -6.122 -0.662 273 HB3 ASP 43 HB1 ASP 43 49.839 -5.617 -1.414 274 HA PRO 44 HA PRO 44 51.209 -9.593 -3.884 275 HB2 PRO 44 HB2 PRO 44 51.432 -9.575 -6.596 276 HB3 PRO 44 HB1 PRO 44 50.107 -10.394 -5.748 277 HG2 PRO 44 HG2 PRO 44 50.118 -7.795 -7.177 278 HG3 PRO 44 HG1 PRO 44 48.840 -9.014 -7.052 279 HD2 PRO 44 HD2 PRO 44 48.931 -6.660 -5.570 280 HD3 PRO 44 HD1 PRO 44 47.998 -8.104 -5.123 281 H ARG 45 HN ARG 45 53.012 -8.486 -3.027 282 HA ARG 45 HA ARG 45 54.722 -6.788 -3.024 283 HB2 ARG 45 HB2 ARG 45 55.849 -7.934 -5.452 284 HB3 ARG 45 HB1 ARG 45 56.437 -8.032 -3.792 285 HG2 ARG 45 HG2 ARG 45 54.202 -9.728 -4.942 286 HG3 ARG 45 HG1 ARG 45 55.863 -10.271 -4.704 287 HD2 ARG 45 HD2 ARG 45 55.107 -9.146 -2.244 288 HD3 ARG 45 HD1 ARG 45 53.708 -10.082 -2.769 289 HE ARG 45 HE ARG 45 56.250 -11.178 -1.905 290 HH11 ARG 45 HH11 ARG 45 56.459 -13.425 -2.024 291 HH12 ARG 45 HH12 ARG 45 55.347 -14.336 -2.992 292 HH21 ARG 45 HH21 ARG 45 53.551 -11.552 -4.018 293 HH22 ARG 45 HH22 ARG 45 53.700 -13.275 -4.119 294 H GLY 46 HN GLY 46 53.497 -4.877 -3.660 295 HA2 GLY 46 HA2 GLY 46 54.106 -4.055 -6.466 296 HA3 GLY 46 HA1 GLY 46 52.516 -3.741 -5.769 297 H GLY 47 HN GLY 47 55.889 -2.806 -5.735 298 HA2 GLY 47 HA2 GLY 47 56.923 -0.862 -4.923 299 HA3 GLY 47 HA1 GLY 47 55.315 -0.133 -4.915 300 H GLY 48 HN GLY 48 55.627 0.899 -2.885 301 HA2 GLY 48 HA2 GLY 48 55.140 -0.847 -0.578 302 HA3 GLY 48 HA1 GLY 48 56.677 0.018 -0.523 303 H GLY 49 HN GLY 49 56.467 1.767 0.783 304 HA2 GLY 49 HA2 GLY 49 55.471 3.607 1.868 305 HA3 GLY 49 HA1 GLY 49 54.928 4.021 0.242 306 H ASN 50 HN ASN 50 53.007 4.870 1.486 307 HA ASN 50 HA ASN 50 50.925 2.777 1.560 308 HB2 ASN 50 HB2 ASN 50 50.116 3.540 3.793 309 HB3 ASN 50 HB1 ASN 50 51.715 2.800 3.874 310 HD21 ASN 50 HD21 ASN 50 50.631 6.126 2.964 311 HD22 ASN 50 HD22 ASN 50 51.659 6.916 4.061 312 H ARG 51 HN ARG 51 49.109 4.668 2.970 313 HA ARG 51 HA ARG 51 48.873 6.752 0.836 314 HB2 ARG 51 HB2 ARG 51 47.204 4.942 0.519 315 HB3 ARG 51 HB1 ARG 51 46.609 5.222 2.156 316 HG2 ARG 51 HG2 ARG 51 45.151 6.440 0.696 317 HG3 ARG 51 HG1 ARG 51 46.197 7.637 1.463 318 HD2 ARG 51 HD2 ARG 51 46.940 8.302 -0.552 319 HD3 ARG 51 HD1 ARG 51 47.507 6.667 -0.895 320 HE ARG 51 HE ARG 51 44.956 7.838 -1.792 321 HH11 ARG 51 HH11 ARG 51 43.832 6.562 -3.283 322 HH12 ARG 51 HH12 ARG 51 44.333 4.926 -3.554 323 HH21 ARG 51 HH21 ARG 51 46.951 5.072 -1.283 324 HH22 ARG 51 HH22 ARG 51 46.100 4.083 -2.421 325 H GLN 52 HN GLN 52 47.946 8.764 1.542 326 HA GLN 52 HA GLN 52 48.774 9.864 3.914 327 HB2 GLN 52 HB2 GLN 52 46.308 10.399 2.271 328 HB3 GLN 52 HB1 GLN 52 46.604 11.309 3.753 329 HG2 GLN 52 HG2 GLN 52 48.826 11.977 2.892 330 HG3 GLN 52 HG1 GLN 52 48.507 11.091 1.401 331 HE21 GLN 52 HE21 GLN 52 47.328 12.174 -0.219 332 HE22 GLN 52 HE22 GLN 52 46.580 13.684 -0.004 333 HA PRO 53 HA PRO 53 46.879 8.137 7.476 334 HB2 PRO 53 HB2 PRO 53 45.725 10.849 7.991 335 HB3 PRO 53 HB1 PRO 53 46.649 9.792 9.075 336 HG2 PRO 53 HG2 PRO 53 47.742 11.927 7.876 337 HG3 PRO 53 HG1 PRO 53 48.662 10.457 8.232 338 HD2 PRO 53 HD2 PRO 53 47.757 11.499 5.615 339 HD3 PRO 53 HD1 PRO 53 49.062 10.352 5.983 340 HA PRO 54 HA PRO 54 42.723 7.447 5.924 341 HB2 PRO 54 HB2 PRO 54 42.077 5.405 7.602 342 HB3 PRO 54 HB1 PRO 54 43.163 5.201 6.215 343 HG2 PRO 54 HG2 PRO 54 43.810 5.479 9.102 344 HG3 PRO 54 HG1 PRO 54 44.579 4.475 7.861 345 HD2 PRO 54 HD2 PRO 54 45.607 6.882 8.761 346 HD3 PRO 54 HD1 PRO 54 45.976 6.167 7.176 347 HA PRO 55 HA PRO 55 40.681 9.889 9.137 348 HB2 PRO 55 HB2 PRO 55 38.592 10.712 7.598 349 HB3 PRO 55 HB1 PRO 55 40.211 11.429 7.482 350 HG2 PRO 55 HG2 PRO 55 38.875 9.469 5.698 351 HG3 PRO 55 HG1 PRO 55 39.992 10.785 5.301 352 HD2 PRO 55 HD2 PRO 55 40.708 8.103 5.469 353 HD3 PRO 55 HD1 PRO 55 41.842 9.464 5.600 354 HA PRO 56 HA PRO 56 37.534 7.193 10.658 355 HB2 PRO 56 HB2 PRO 56 35.693 8.974 11.673 356 HB3 PRO 56 HB1 PRO 56 37.218 8.554 12.474 357 HG2 PRO 56 HG2 PRO 56 36.522 10.952 10.867 358 HG3 PRO 56 HG1 PRO 56 37.552 10.810 12.301 359 HD2 PRO 56 HD2 PRO 56 38.556 11.051 9.763 360 HD3 PRO 56 HD1 PRO 56 39.414 10.207 11.072 361 H TYR 57 HN TYR 57 36.274 6.079 9.221 362 HA TYR 57 HA TYR 57 34.672 7.418 7.203 363 HB2 TYR 57 HB2 TYR 57 34.609 5.367 6.251 364 HB3 TYR 57 HB1 TYR 57 35.722 4.870 7.524 365 HD1 TYR 57 HD1 TYR 57 32.656 4.131 6.000 366 HD2 TYR 57 HD2 TYR 57 34.502 4.364 9.873 367 HE1 TYR 57 HE1 TYR 57 30.930 2.603 6.915 368 HE2 TYR 57 HE2 TYR 57 32.775 2.837 10.787 369 HH TYR 57 HH TYR 57 31.217 0.969 9.707 370 HA PRO 58 HA PRO 58 31.061 7.944 9.736 371 HB2 PRO 58 HB2 PRO 58 29.265 8.509 7.772 372 HB3 PRO 58 HB1 PRO 58 30.520 9.655 8.281 373 HG2 PRO 58 HG2 PRO 58 30.435 7.874 5.900 374 HG3 PRO 58 HG1 PRO 58 31.046 9.530 6.053 375 HD2 PRO 58 HD2 PRO 58 32.666 7.294 6.030 376 HD3 PRO 58 HD1 PRO 58 33.114 8.839 6.787 377 H LEU 59 HN LEU 59 29.596 6.497 10.577 378 HA LEU 59 HA LEU 59 29.197 3.930 9.254 379 HB2 LEU 59 HB2 LEU 59 29.022 4.897 11.892 380 HB3 LEU 59 HB1 LEU 59 27.382 4.412 11.463 381 HG LEU 59 HG LEU 59 29.869 2.697 11.195 382 HD11 LEU 59 HD11 LEU 59 27.453 2.301 12.975 383 HD12 LEU 59 HD12 LEU 59 28.925 3.102 13.523 384 HD13 LEU 59 HD13 LEU 59 28.977 1.415 13.015 385 HD21 LEU 59 HD21 LEU 59 27.477 2.597 9.731 386 HD22 LEU 59 HD22 LEU 59 27.289 1.365 10.979 387 HD23 LEU 59 HD23 LEU 59 28.668 1.305 9.881 388 H THR 60 HN THR 60 27.978 4.237 7.372 389 HA THR 60 HA THR 60 25.139 4.980 7.827 390 HB THR 60 HB THR 60 26.666 6.061 5.453 391 HG1 THR 60 HG1 THR 60 26.088 8.000 7.098 392 HG21 THR 60 HG21 THR 60 24.053 6.864 6.763 393 HG22 THR 60 HG22 THR 60 24.194 5.882 5.305 394 HG23 THR 60 HG23 THR 60 24.737 7.560 5.294 395 H ALA 61 HN ALA 61 23.831 3.506 6.850 396 HA ALA 61 HA ALA 61 24.955 1.318 5.335 397 HB1 ALA 61 HB1 ALA 61 22.356 2.061 6.442 398 HB2 ALA 61 HB2 ALA 61 23.041 0.458 6.175 399 HB3 ALA 61 HB3 ALA 61 22.210 1.292 4.861 Start of MODEL 15 1 H1 SER 8 HT1 SER 8 29.500 -4.119 -0.120 2 H2 SER 8 HT2 SER 8 30.023 -3.944 -1.727 3 H3 SER 8 HT3 SER 8 30.999 -4.752 -0.596 4 HA SER 8 HA SER 8 28.605 -6.093 -0.522 5 HB2 SER 8 HB2 SER 8 29.463 -5.440 -3.356 6 HB3 SER 8 HB1 SER 8 28.309 -6.698 -2.924 7 HG SER 8 HG SER 8 27.376 -4.620 -3.484 8 H GLY 9 HN GLY 9 31.171 -6.400 0.467 9 HA2 GLY 9 HA2 GLY 9 31.844 -9.050 -0.554 10 HA3 GLY 9 HA1 GLY 9 33.092 -7.846 -0.884 11 HA PRO 10 HA PRO 10 32.325 -8.063 4.043 12 HB2 PRO 10 HB2 PRO 10 31.613 -10.964 3.943 13 HB3 PRO 10 HB1 PRO 10 31.050 -9.702 5.055 14 HG2 PRO 10 HG2 PRO 10 29.525 -10.608 3.057 15 HG3 PRO 10 HG1 PRO 10 29.477 -8.920 3.590 16 HD2 PRO 10 HD2 PRO 10 30.624 -10.063 1.102 17 HD3 PRO 10 HD1 PRO 10 30.029 -8.419 1.420 18 H LEU 11 HN LEU 11 34.464 -8.062 4.656 19 HA LEU 11 HA LEU 11 36.292 -10.102 3.601 20 HB2 LEU 11 HB2 LEU 11 36.497 -7.521 5.076 21 HB3 LEU 11 HB1 LEU 11 37.813 -8.657 5.298 22 HG LEU 11 HG LEU 11 36.782 -7.939 2.554 23 HD11 LEU 11 HD11 LEU 11 39.280 -6.662 3.147 24 HD12 LEU 11 HD12 LEU 11 38.100 -6.194 4.371 25 HD13 LEU 11 HD13 LEU 11 37.758 -5.921 2.663 26 HD21 LEU 11 HD21 LEU 11 38.886 -8.811 1.794 27 HD22 LEU 11 HD22 LEU 11 38.254 -9.985 2.946 28 HD23 LEU 11 HD23 LEU 11 39.528 -8.868 3.433 29 HA PRO 12 HA PRO 12 37.280 -12.936 6.948 30 HB2 PRO 12 HB2 PRO 12 38.334 -10.643 8.579 31 HB3 PRO 12 HB1 PRO 12 38.967 -12.295 8.429 32 HG2 PRO 12 HG2 PRO 12 39.845 -10.097 6.978 33 HG3 PRO 12 HG1 PRO 12 40.125 -11.791 6.557 34 HD2 PRO 12 HD2 PRO 12 38.608 -9.944 5.049 35 HD3 PRO 12 HD1 PRO 12 38.633 -11.700 4.816 36 H ASP 13 HN ASP 13 36.211 -9.793 8.290 37 HA ASP 13 HA ASP 13 33.641 -10.221 8.952 38 HB2 ASP 13 HB2 ASP 13 33.766 -12.306 9.965 39 HB3 ASP 13 HB1 ASP 13 35.359 -11.989 10.655 40 H GLY 14 HN GLY 14 33.321 -8.127 9.456 41 HA2 GLY 14 HA2 GLY 14 33.212 -6.491 11.287 42 HA3 GLY 14 HA1 GLY 14 34.814 -7.030 11.793 43 H TRP 15 HN TRP 15 34.968 -6.965 8.504 44 HA TRP 15 HA TRP 15 35.319 -4.078 8.192 45 HB2 TRP 15 HB2 TRP 15 37.650 -4.026 7.921 46 HB3 TRP 15 HB1 TRP 15 37.402 -5.015 9.354 47 HD1 TRP 15 HD1 TRP 15 37.162 -7.829 8.610 48 HE1 TRP 15 HE1 TRP 15 38.823 -9.092 7.112 49 HE3 TRP 15 HE3 TRP 15 39.325 -3.898 6.185 50 HZ2 TRP 15 HZ2 TRP 15 40.820 -8.518 5.140 51 HZ3 TRP 15 HZ3 TRP 15 41.098 -4.279 4.509 52 HH2 TRP 15 HH2 TRP 15 41.854 -6.582 3.978 53 H GLU 16 HN GLU 16 36.277 -3.603 5.918 54 HA GLU 16 HA GLU 16 36.004 -5.717 3.925 55 HB2 GLU 16 HB2 GLU 16 33.711 -3.991 4.622 56 HB3 GLU 16 HB1 GLU 16 34.068 -4.083 2.897 57 HG2 GLU 16 HG2 GLU 16 34.193 -6.647 3.274 58 HG3 GLU 16 HG1 GLU 16 33.352 -6.317 4.789 59 H GLN 17 HN GLN 17 36.522 -4.927 1.766 60 HA GLN 17 HA GLN 17 38.157 -2.478 1.836 61 HB2 GLN 17 HB2 GLN 17 38.972 -4.619 0.773 62 HB3 GLN 17 HB1 GLN 17 37.730 -4.407 -0.462 63 HG2 GLN 17 HG2 GLN 17 38.695 -2.304 -1.166 64 HG3 GLN 17 HG1 GLN 17 39.839 -2.327 0.177 65 HE21 GLN 17 HE21 GLN 17 41.818 -2.560 -0.962 66 HE22 GLN 17 HE22 GLN 17 42.161 -3.866 -1.990 67 H ALA 18 HN ALA 18 37.654 -0.615 0.658 68 HA ALA 18 HA ALA 18 35.356 -0.655 -1.185 69 HB1 ALA 18 HB1 ALA 18 34.742 1.570 0.332 70 HB2 ALA 18 HB2 ALA 18 35.234 0.397 1.554 71 HB3 ALA 18 HB3 ALA 18 33.922 0.012 0.440 72 H MET 19 HN MET 19 35.004 2.011 -1.601 73 HA MET 19 HA MET 19 37.730 3.104 -2.072 74 HB2 MET 19 HB2 MET 19 37.321 3.535 -4.328 75 HB3 MET 19 HB1 MET 19 36.507 1.985 -4.115 76 HG2 MET 19 HG2 MET 19 34.455 3.532 -3.452 77 HG3 MET 19 HG1 MET 19 35.326 4.718 -4.425 78 HE1 MET 19 HE1 MET 19 36.036 4.322 -6.976 79 HE2 MET 19 HE2 MET 19 34.546 5.143 -6.516 80 HE3 MET 19 HE3 MET 19 34.539 4.008 -7.863 81 H THR 20 HN THR 20 37.747 5.463 -2.310 82 HA THR 20 HA THR 20 35.601 6.709 -0.709 83 HB THR 20 HB THR 20 37.316 8.729 -1.099 84 HG1 THR 20 HG1 THR 20 38.717 6.346 -1.660 85 HG21 THR 20 HG21 THR 20 37.024 6.604 0.864 86 HG22 THR 20 HG22 THR 20 37.363 8.316 1.115 87 HG23 THR 20 HG23 THR 20 38.685 7.193 0.795 88 H GLN 21 HN GLN 21 35.792 9.342 -1.743 89 HA GLN 21 HA GLN 21 34.117 9.051 -4.126 90 HB2 GLN 21 HB2 GLN 21 34.344 10.951 -2.090 91 HB3 GLN 21 HB1 GLN 21 34.991 11.769 -3.512 92 HG2 GLN 21 HG2 GLN 21 32.942 11.069 -4.778 93 HG3 GLN 21 HG1 GLN 21 32.286 10.423 -3.274 94 HE21 GLN 21 HE21 GLN 21 31.844 12.002 -1.508 95 HE22 GLN 21 HE22 GLN 21 31.602 13.640 -1.878 96 H ASP 22 HN ASP 22 37.409 9.241 -3.504 97 HA ASP 22 HA ASP 22 37.955 10.319 -6.217 98 HB2 ASP 22 HB2 ASP 22 38.973 11.622 -4.364 99 HB3 ASP 22 HB1 ASP 22 39.806 10.165 -3.824 100 H GLY 23 HN GLY 23 37.277 7.561 -5.115 101 HA2 GLY 23 HA2 GLY 23 37.945 5.342 -5.472 102 HA3 GLY 23 HA1 GLY 23 38.694 5.977 -6.937 103 H GLU 24 HN GLU 24 39.457 6.534 -3.491 104 HA GLU 24 HA GLU 24 42.292 6.027 -4.110 105 HB2 GLU 24 HB2 GLU 24 41.167 6.741 -1.411 106 HB3 GLU 24 HB1 GLU 24 42.785 7.059 -2.040 107 HG2 GLU 24 HG2 GLU 24 41.214 8.342 -3.887 108 HG3 GLU 24 HG1 GLU 24 40.296 8.593 -2.401 109 H ILE 25 HN ILE 25 39.964 4.057 -3.728 110 HA ILE 25 HA ILE 25 39.549 2.017 -2.574 111 HB ILE 25 HB ILE 25 41.019 1.283 -4.321 112 HG12 ILE 25 HG12 ILE 25 42.234 -0.559 -3.195 113 HG13 ILE 25 HG11 ILE 25 42.018 0.254 -1.644 114 HG21 ILE 25 HG21 ILE 25 43.257 2.297 -2.544 115 HG22 ILE 25 HG22 ILE 25 42.762 2.972 -4.096 116 HG23 ILE 25 HG23 ILE 25 43.495 1.369 -4.024 117 HD11 ILE 25 HD11 ILE 25 40.288 -1.608 -2.621 118 HD12 ILE 25 HD12 ILE 25 39.541 -0.126 -3.217 119 HD13 ILE 25 HD13 ILE 25 39.823 -0.339 -1.489 120 H TYR 26 HN TYR 26 39.207 1.974 -0.421 121 HA TYR 26 HA TYR 26 41.581 2.067 1.363 122 HB2 TYR 26 HB2 TYR 26 40.432 3.467 2.951 123 HB3 TYR 26 HB1 TYR 26 40.318 4.258 1.381 124 HD1 TYR 26 HD1 TYR 26 38.462 1.927 3.643 125 HD2 TYR 26 HD2 TYR 26 38.218 4.826 0.488 126 HE1 TYR 26 HE1 TYR 26 35.989 1.892 3.808 127 HE2 TYR 26 HE2 TYR 26 35.743 4.793 0.656 128 HH TYR 26 HH TYR 26 34.024 2.467 2.029 129 H TYR 27 HN TYR 27 40.776 1.305 3.684 130 HA TYR 27 HA TYR 27 38.975 -1.045 3.247 131 HB2 TYR 27 HB2 TYR 27 41.391 -0.785 5.064 132 HB3 TYR 27 HB1 TYR 27 40.295 -2.169 5.052 133 HD1 TYR 27 HD1 TYR 27 43.188 -0.696 3.554 134 HD2 TYR 27 HD2 TYR 27 39.897 -3.342 2.782 135 HE1 TYR 27 HE1 TYR 27 44.407 -1.650 1.622 136 HE2 TYR 27 HE2 TYR 27 41.115 -4.299 0.852 137 HH TYR 27 HH TYR 27 44.450 -3.342 0.127 138 H ILE 28 HN ILE 28 37.432 -1.443 4.883 139 HA ILE 28 HA ILE 28 37.254 0.689 6.950 140 HB ILE 28 HB ILE 28 35.420 1.291 5.787 141 HG12 ILE 28 HG12 ILE 28 33.376 0.138 6.449 142 HG13 ILE 28 HG11 ILE 28 34.292 -1.310 6.866 143 HG21 ILE 28 HG21 ILE 28 36.139 -0.263 3.925 144 HG22 ILE 28 HG22 ILE 28 34.397 -0.028 4.049 145 HG23 ILE 28 HG23 ILE 28 35.131 -1.506 4.666 146 HD11 ILE 28 HD11 ILE 28 35.528 0.791 8.268 147 HD12 ILE 28 HD12 ILE 28 34.518 -0.488 8.938 148 HD13 ILE 28 HD13 ILE 28 33.796 1.045 8.460 149 H ASN 29 HN ASN 29 37.101 -0.009 9.020 150 HA ASN 29 HA ASN 29 36.655 -2.932 9.454 151 HB2 ASN 29 HB2 ASN 29 38.808 -1.605 10.228 152 HB3 ASN 29 HB1 ASN 29 37.767 -1.118 11.566 153 HD21 ASN 29 HD21 ASN 29 39.996 -2.786 12.080 154 HD22 ASN 29 HD22 ASN 29 39.446 -4.336 12.500 155 H HIS 30 HN HIS 30 34.490 -3.187 9.852 156 HA HIS 30 HA HIS 30 32.850 -1.205 11.142 157 HB2 HIS 30 HB2 HIS 30 32.372 -4.185 10.820 158 HB3 HIS 30 HB1 HIS 30 31.147 -2.983 11.225 159 HD1 HIS 30 HD1 HIS 30 30.882 -0.992 9.350 160 HD2 HIS 30 HD2 HIS 30 32.718 -4.520 8.087 161 HE1 HIS 30 HE1 HIS 30 30.802 -0.976 6.817 162 HE2 HIS 30 HE2 HIS 30 31.914 -3.119 6.039 163 H LYS 31 HN LYS 31 35.293 -2.995 12.428 164 HA LYS 31 HA LYS 31 34.025 -3.763 14.946 165 HB2 LYS 31 HB2 LYS 31 36.912 -3.643 14.041 166 HB3 LYS 31 HB1 LYS 31 36.428 -4.169 15.653 167 HG2 LYS 31 HG2 LYS 31 34.753 -5.643 14.034 168 HG3 LYS 31 HG1 LYS 31 36.243 -5.594 13.089 169 HD2 LYS 31 HD2 LYS 31 36.620 -7.454 14.446 170 HD3 LYS 31 HD1 LYS 31 37.384 -6.173 15.387 171 HE2 LYS 31 HE2 LYS 31 36.026 -7.370 16.938 172 HE3 LYS 31 HE1 LYS 31 35.131 -5.895 16.570 173 HZ1 LYS 31 HZ1 LYS 31 34.702 -8.525 15.259 174 HZ2 LYS 31 HZ2 LYS 31 33.815 -7.105 14.972 175 HZ3 LYS 31 HZ3 LYS 31 33.725 -7.876 16.484 176 H ASN 32 HN ASN 32 36.240 -1.206 13.867 177 HA ASN 32 HA ASN 32 35.613 0.256 16.388 178 HB2 ASN 32 HB2 ASN 32 38.021 -0.388 16.082 179 HB3 ASN 32 HB1 ASN 32 38.049 0.597 14.619 180 HD21 ASN 32 HD21 ASN 32 39.810 1.451 16.507 181 HD22 ASN 32 HD22 ASN 32 39.236 2.823 17.324 182 H LYS 33 HN LYS 33 34.453 0.138 13.467 183 HA LYS 33 HA LYS 33 33.544 1.675 11.945 184 HB2 LYS 33 HB2 LYS 33 33.267 2.773 14.646 185 HB3 LYS 33 HB1 LYS 33 33.269 4.022 13.400 186 HG2 LYS 33 HG2 LYS 33 31.469 2.913 12.206 187 HG3 LYS 33 HG1 LYS 33 31.532 1.540 13.313 188 HD2 LYS 33 HD2 LYS 33 31.208 3.576 15.085 189 HD3 LYS 33 HD1 LYS 33 30.331 4.221 13.697 190 HE2 LYS 33 HE2 LYS 33 29.775 1.750 15.306 191 HE3 LYS 33 HE1 LYS 33 28.655 2.992 14.747 192 HZ1 LYS 33 HZ1 LYS 33 29.463 2.094 12.422 193 HZ2 LYS 33 HZ2 LYS 33 28.180 1.365 13.263 194 HZ3 LYS 33 HZ3 LYS 33 29.734 0.682 13.322 195 H THR 34 HN THR 34 36.285 1.474 11.672 196 HA THR 34 HA THR 34 36.997 4.263 10.949 197 HB THR 34 HB THR 34 39.420 3.070 11.653 198 HG1 THR 34 HG1 THR 34 39.040 1.814 13.276 199 HG21 THR 34 HG21 THR 34 38.693 5.429 11.971 200 HG22 THR 34 HG22 THR 34 39.437 4.750 13.418 201 HG23 THR 34 HG23 THR 34 37.682 4.908 13.319 202 H THR 35 HN THR 35 38.589 4.352 9.188 203 HA THR 35 HA THR 35 38.629 1.830 7.616 204 HB THR 35 HB THR 35 39.140 3.696 5.745 205 HG1 THR 35 HG1 THR 35 38.078 4.979 7.935 206 HG21 THR 35 HG21 THR 35 37.368 2.147 5.439 207 HG22 THR 35 HG22 THR 35 36.596 3.727 5.389 208 HG23 THR 35 HG23 THR 35 36.499 2.744 6.851 209 H SER 36 HN SER 36 40.570 1.654 6.128 210 HA SER 36 HA SER 36 42.948 3.190 6.878 211 HB2 SER 36 HB2 SER 36 42.382 1.098 8.552 212 HB3 SER 36 HB1 SER 36 43.416 0.317 7.359 213 HG SER 36 HG SER 36 44.407 1.463 9.260 214 H TRP 37 HN TRP 37 44.899 2.369 5.656 215 HA TRP 37 HA TRP 37 44.010 1.328 3.016 216 HB2 TRP 37 HB2 TRP 37 46.766 2.376 3.660 217 HB3 TRP 37 HB1 TRP 37 45.953 2.318 2.098 218 HD1 TRP 37 HD1 TRP 37 46.440 4.472 5.113 219 HE1 TRP 37 HE1 TRP 37 45.100 6.660 4.853 220 HE3 TRP 37 HE3 TRP 37 43.603 3.289 1.035 221 HZ2 TRP 37 HZ2 TRP 37 43.093 7.763 3.139 222 HZ3 TRP 37 HZ3 TRP 37 41.985 4.925 0.111 223 HH2 TRP 37 HH2 TRP 37 41.728 7.158 1.158 224 H LEU 38 HN LEU 38 45.687 0.361 5.852 225 HA LEU 38 HA LEU 38 47.578 -1.484 4.873 226 HB2 LEU 38 HB2 LEU 38 47.237 -0.879 7.286 227 HB3 LEU 38 HB1 LEU 38 45.794 -1.892 7.290 228 HG LEU 38 HG LEU 38 47.313 -3.775 6.424 229 HD11 LEU 38 HD11 LEU 38 49.323 -1.668 7.215 230 HD12 LEU 38 HD12 LEU 38 49.269 -2.636 5.742 231 HD13 LEU 38 HD13 LEU 38 49.730 -3.383 7.271 232 HD21 LEU 38 HD21 LEU 38 48.418 -3.824 8.894 233 HD22 LEU 38 HD22 LEU 38 46.720 -4.199 8.600 234 HD23 LEU 38 HD23 LEU 38 47.186 -2.588 9.148 235 H ASP 39 HN ASP 39 47.435 -3.638 4.184 236 HA ASP 39 HA ASP 39 44.672 -4.663 3.729 237 HB2 ASP 39 HB2 ASP 39 46.090 -5.919 1.795 238 HB3 ASP 39 HB1 ASP 39 45.275 -4.376 1.539 239 HA PRO 40 HA PRO 40 46.653 -7.569 6.711 240 HB2 PRO 40 HB2 PRO 40 43.855 -8.592 6.454 241 HB3 PRO 40 HB1 PRO 40 44.835 -8.341 7.912 242 HG2 PRO 40 HG2 PRO 40 42.884 -6.655 7.224 243 HG3 PRO 40 HG1 PRO 40 44.375 -6.099 8.001 244 HD2 PRO 40 HD2 PRO 40 43.497 -5.770 5.179 245 HD3 PRO 40 HD1 PRO 40 44.597 -4.762 6.145 246 H ARG 41 HN ARG 41 44.223 -8.739 4.341 247 HA ARG 41 HA ARG 41 46.231 -10.756 3.465 248 HB2 ARG 41 HB2 ARG 41 44.112 -12.221 3.048 249 HB3 ARG 41 HB1 ARG 41 44.739 -12.092 4.692 250 HG2 ARG 41 HG2 ARG 41 42.906 -9.916 4.087 251 HG3 ARG 41 HG1 ARG 41 42.137 -11.487 3.860 252 HD2 ARG 41 HD2 ARG 41 42.075 -10.440 6.233 253 HD3 ARG 41 HD1 ARG 41 42.530 -12.138 6.092 254 HE ARG 41 HE ARG 41 44.775 -10.236 6.053 255 HH11 ARG 41 HH11 ARG 41 46.233 -10.487 7.761 256 HH12 ARG 41 HH12 ARG 41 45.806 -11.493 9.106 257 HH21 ARG 41 HH21 ARG 41 42.698 -12.341 7.825 258 HH22 ARG 41 HH22 ARG 41 43.805 -12.542 9.142 259 H LEU 42 HN LEU 42 45.890 -8.312 2.167 260 HA LEU 42 HA LEU 42 44.787 -9.239 -0.418 261 HB2 LEU 42 HB2 LEU 42 43.234 -7.638 1.121 262 HB3 LEU 42 HB1 LEU 42 44.181 -6.416 0.272 263 HG LEU 42 HG LEU 42 43.595 -7.560 -1.889 264 HD11 LEU 42 HD11 LEU 42 41.296 -8.951 -1.289 265 HD12 LEU 42 HD12 LEU 42 42.360 -9.407 0.042 266 HD13 LEU 42 HD13 LEU 42 42.861 -9.693 -1.625 267 HD21 LEU 42 HD21 LEU 42 42.330 -5.590 -0.983 268 HD22 LEU 42 HD22 LEU 42 41.196 -6.714 -0.233 269 HD23 LEU 42 HD23 LEU 42 41.340 -6.646 -1.990 270 H ASP 43 HN ASP 43 47.387 -9.270 -0.179 271 HA ASP 43 HA ASP 43 48.356 -7.274 -1.995 272 HB2 ASP 43 HB2 ASP 43 48.143 -6.054 0.313 273 HB3 ASP 43 HB1 ASP 43 49.595 -6.965 0.729 274 HA PRO 44 HA PRO 44 50.590 -11.317 -1.947 275 HB2 PRO 44 HB2 PRO 44 51.378 -10.119 -4.566 276 HB3 PRO 44 HB1 PRO 44 50.831 -11.766 -4.198 277 HG2 PRO 44 HG2 PRO 44 49.236 -9.980 -5.382 278 HG3 PRO 44 HG1 PRO 44 48.617 -11.187 -4.243 279 HD2 PRO 44 HD2 PRO 44 48.986 -8.258 -3.858 280 HD3 PRO 44 HD1 PRO 44 47.833 -9.363 -3.080 281 H ARG 45 HN ARG 45 52.783 -11.704 -1.522 282 HA ARG 45 HA ARG 45 54.438 -9.782 -0.429 283 HB2 ARG 45 HB2 ARG 45 55.036 -12.123 -0.294 284 HB3 ARG 45 HB1 ARG 45 55.238 -12.219 -2.044 285 HG2 ARG 45 HG2 ARG 45 57.176 -10.839 -2.002 286 HG3 ARG 45 HG1 ARG 45 56.859 -10.315 -0.348 287 HD2 ARG 45 HD2 ARG 45 58.010 -12.064 0.476 288 HD3 ARG 45 HD1 ARG 45 57.017 -13.196 -0.442 289 HE ARG 45 HE ARG 45 58.675 -13.198 -2.167 290 HH11 ARG 45 HH11 ARG 45 60.807 -12.810 -2.813 291 HH12 ARG 45 HH12 ARG 45 61.776 -11.685 -1.923 292 HH21 ARG 45 HH21 ARG 45 59.272 -10.922 0.352 293 HH22 ARG 45 HH22 ARG 45 60.906 -10.615 -0.130 294 H GLY 46 HN GLY 46 55.682 -8.118 -1.201 295 HA2 GLY 46 HA2 GLY 46 57.233 -7.532 -3.190 296 HA3 GLY 46 HA1 GLY 46 55.786 -7.786 -4.167 297 H GLY 47 HN GLY 47 56.312 -6.117 -1.045 298 HA2 GLY 47 HA2 GLY 47 56.375 -3.522 -1.410 299 HA3 GLY 47 HA1 GLY 47 54.806 -3.804 -2.167 300 H GLY 48 HN GLY 48 54.647 -2.140 -0.106 301 HA2 GLY 48 HA2 GLY 48 52.950 -3.494 1.775 302 HA3 GLY 48 HA1 GLY 48 54.509 -3.143 2.522 303 H GLY 49 HN GLY 49 52.418 -1.319 0.258 304 HA2 GLY 49 HA2 GLY 49 53.060 1.237 1.277 305 HA3 GLY 49 HA1 GLY 49 51.561 0.860 0.425 306 H ASN 50 HN ASN 50 51.529 2.685 2.531 307 HA ASN 50 HA ASN 50 49.684 1.321 4.369 308 HB2 ASN 50 HB2 ASN 50 52.102 1.162 5.297 309 HB3 ASN 50 HB1 ASN 50 51.949 2.894 5.591 310 HD21 ASN 50 HD21 ASN 50 51.957 2.531 7.944 311 HD22 ASN 50 HD22 ASN 50 50.594 1.889 8.728 312 H ARG 51 HN ARG 51 51.278 4.265 3.274 313 HA ARG 51 HA ARG 51 50.556 6.503 3.302 314 HB2 ARG 51 HB2 ARG 51 48.878 5.476 1.781 315 HB3 ARG 51 HB1 ARG 51 47.845 5.147 3.173 316 HG2 ARG 51 HG2 ARG 51 47.299 7.371 3.469 317 HG3 ARG 51 HG1 ARG 51 48.829 7.944 2.803 318 HD2 ARG 51 HD2 ARG 51 46.662 8.253 1.384 319 HD3 ARG 51 HD1 ARG 51 48.116 7.657 0.583 320 HE ARG 51 HE ARG 51 46.332 5.564 1.623 321 HH11 ARG 51 HH11 ARG 51 45.465 4.207 0.037 322 HH12 ARG 51 HH12 ARG 51 45.601 4.650 -1.632 323 HH21 ARG 51 HH21 ARG 51 47.301 7.601 -0.983 324 HH22 ARG 51 HH22 ARG 51 46.641 6.572 -2.209 325 H GLN 52 HN GLN 52 49.108 8.094 4.550 326 HA GLN 52 HA GLN 52 49.315 7.452 7.392 327 HB2 GLN 52 HB2 GLN 52 48.398 9.776 7.678 328 HB3 GLN 52 HB1 GLN 52 49.851 9.709 6.681 329 HG2 GLN 52 HG2 GLN 52 48.493 9.776 4.645 330 HG3 GLN 52 HG1 GLN 52 47.015 9.764 5.608 331 HE21 GLN 52 HE21 GLN 52 50.069 11.626 6.070 332 HE22 GLN 52 HE22 GLN 52 49.317 13.146 6.048 333 HA PRO 53 HA PRO 53 45.355 5.692 8.210 334 HB2 PRO 53 HB2 PRO 53 45.206 7.789 10.341 335 HB3 PRO 53 HB1 PRO 53 44.924 6.041 10.458 336 HG2 PRO 53 HG2 PRO 53 47.194 7.193 11.307 337 HG3 PRO 53 HG1 PRO 53 47.144 5.556 10.636 338 HD2 PRO 53 HD2 PRO 53 48.283 8.013 9.457 339 HD3 PRO 53 HD1 PRO 53 48.610 6.313 9.056 340 HA PRO 54 HA PRO 54 42.733 8.657 6.095 341 HB2 PRO 54 HB2 PRO 54 40.572 7.034 5.780 342 HB3 PRO 54 HB1 PRO 54 42.046 6.865 4.809 343 HG2 PRO 54 HG2 PRO 54 41.122 5.271 7.139 344 HG3 PRO 54 HG1 PRO 54 41.964 4.747 5.671 345 HD2 PRO 54 HD2 PRO 54 43.208 5.135 8.114 346 HD3 PRO 54 HD1 PRO 54 44.040 5.206 6.546 347 HA PRO 55 HA PRO 55 40.043 10.281 9.211 348 HB2 PRO 55 HB2 PRO 55 38.075 11.427 7.696 349 HB3 PRO 55 HB1 PRO 55 39.710 12.102 7.839 350 HG2 PRO 55 HG2 PRO 55 38.504 10.513 5.638 351 HG3 PRO 55 HG1 PRO 55 39.646 11.865 5.564 352 HD2 PRO 55 HD2 PRO 55 40.384 9.224 5.274 353 HD3 PRO 55 HD1 PRO 55 41.481 10.500 5.843 354 HA PRO 56 HA PRO 56 36.771 7.592 10.423 355 HB2 PRO 56 HB2 PRO 56 34.948 9.955 10.435 356 HB3 PRO 56 HB1 PRO 56 35.255 8.759 11.709 357 HG2 PRO 56 HG2 PRO 56 36.290 11.235 11.782 358 HG3 PRO 56 HG1 PRO 56 37.130 9.827 12.451 359 HD2 PRO 56 HD2 PRO 56 37.761 11.392 10.017 360 HD3 PRO 56 HD1 PRO 56 38.817 10.351 10.996 361 H TYR 57 HN TYR 57 36.058 6.275 8.784 362 HA TYR 57 HA TYR 57 34.974 7.213 6.304 363 HB2 TYR 57 HB2 TYR 57 34.852 4.991 5.726 364 HB3 TYR 57 HB1 TYR 57 35.926 4.837 7.116 365 HD1 TYR 57 HD1 TYR 57 32.999 3.589 5.663 366 HD2 TYR 57 HD2 TYR 57 34.612 4.750 9.471 367 HE1 TYR 57 HE1 TYR 57 31.315 2.172 6.808 368 HE2 TYR 57 HE2 TYR 57 32.929 3.334 10.615 369 HH TYR 57 HH TYR 57 31.538 1.146 9.844 370 HA PRO 58 HA PRO 58 30.868 8.156 7.750 371 HB2 PRO 58 HB2 PRO 58 29.697 8.524 5.313 372 HB3 PRO 58 HB1 PRO 58 30.792 9.710 6.048 373 HG2 PRO 58 HG2 PRO 58 31.323 7.713 3.911 374 HG3 PRO 58 HG1 PRO 58 31.924 9.370 4.086 375 HD2 PRO 58 HD2 PRO 58 33.409 7.132 4.711 376 HD3 PRO 58 HD1 PRO 58 33.674 8.731 5.441 377 H LEU 59 HN LEU 59 29.565 6.541 8.526 378 HA LEU 59 HA LEU 59 29.247 4.000 7.198 379 HB2 LEU 59 HB2 LEU 59 28.910 4.745 9.739 380 HB3 LEU 59 HB1 LEU 59 27.239 4.933 9.206 381 HG LEU 59 HG LEU 59 28.867 2.423 8.731 382 HD11 LEU 59 HD11 LEU 59 26.836 1.898 10.591 383 HD12 LEU 59 HD12 LEU 59 27.566 3.406 11.140 384 HD13 LEU 59 HD13 LEU 59 28.567 1.970 10.921 385 HD21 LEU 59 HD21 LEU 59 25.954 3.186 8.423 386 HD22 LEU 59 HD22 LEU 59 26.490 1.507 8.465 387 HD23 LEU 59 HD23 LEU 59 27.051 2.580 7.183 388 H THR 60 HN THR 60 28.051 3.724 5.381 389 HA THR 60 HA THR 60 26.246 5.619 4.302 390 HB THR 60 HB THR 60 25.365 3.103 3.408 391 HG1 THR 60 HG1 THR 60 28.181 3.149 3.700 392 HG21 THR 60 HG21 THR 60 27.628 4.728 2.232 393 HG22 THR 60 HG22 THR 60 25.941 5.236 2.143 394 HG23 THR 60 HG23 THR 60 26.452 3.733 1.374 395 H ALA 61 HN ALA 61 23.900 5.570 4.203 396 HA ALA 61 HA ALA 61 22.712 4.575 6.728 397 HB1 ALA 61 HB1 ALA 61 21.859 6.549 4.619 398 HB2 ALA 61 HB2 ALA 61 22.073 6.806 6.351 399 HB3 ALA 61 HB3 ALA 61 20.683 5.898 5.760 Start of MODEL 16 1 H1 SER 8 HT1 SER 8 33.203 -13.163 -3.181 2 H2 SER 8 HT2 SER 8 33.063 -12.572 -1.595 3 H3 SER 8 HT3 SER 8 34.328 -12.037 -2.596 4 HA SER 8 HA SER 8 33.093 -10.395 -3.380 5 HB2 SER 8 HB2 SER 8 30.743 -12.198 -3.875 6 HB3 SER 8 HB1 SER 8 31.342 -10.859 -4.851 7 HG SER 8 HG SER 8 32.391 -12.320 -5.923 8 H GLY 9 HN GLY 9 32.910 -11.157 -0.547 9 HA2 GLY 9 HA2 GLY 9 30.509 -9.574 0.105 10 HA3 GLY 9 HA1 GLY 9 30.550 -11.209 0.766 11 HA PRO 10 HA PRO 10 32.339 -8.347 3.984 12 HB2 PRO 10 HB2 PRO 10 31.650 -10.831 5.494 13 HB3 PRO 10 HB1 PRO 10 31.379 -9.134 5.932 14 HG2 PRO 10 HG2 PRO 10 29.399 -10.700 5.062 15 HG3 PRO 10 HG1 PRO 10 29.472 -8.972 4.679 16 HD2 PRO 10 HD2 PRO 10 29.965 -11.307 2.905 17 HD3 PRO 10 HD1 PRO 10 29.425 -9.666 2.489 18 H LEU 11 HN LEU 11 34.397 -8.495 5.014 19 HA LEU 11 HA LEU 11 36.126 -10.642 3.976 20 HB2 LEU 11 HB2 LEU 11 36.401 -7.906 4.705 21 HB3 LEU 11 HB1 LEU 11 37.474 -8.824 5.744 22 HG LEU 11 HG LEU 11 38.550 -9.855 3.819 23 HD11 LEU 11 HD11 LEU 11 37.174 -10.261 2.068 24 HD12 LEU 11 HD12 LEU 11 37.547 -8.612 1.565 25 HD13 LEU 11 HD13 LEU 11 36.092 -8.938 2.506 26 HD21 LEU 11 HD21 LEU 11 39.796 -8.020 3.355 27 HD22 LEU 11 HD22 LEU 11 38.676 -7.143 4.397 28 HD23 LEU 11 HD23 LEU 11 38.422 -7.168 2.653 29 HA PRO 12 HA PRO 12 37.253 -13.018 7.663 30 HB2 PRO 12 HB2 PRO 12 38.416 -10.632 9.071 31 HB3 PRO 12 HB1 PRO 12 38.988 -12.313 9.050 32 HG2 PRO 12 HG2 PRO 12 40.037 -10.369 7.488 33 HG3 PRO 12 HG1 PRO 12 40.012 -12.079 7.039 34 HD2 PRO 12 HD2 PRO 12 38.583 -9.879 5.813 35 HD3 PRO 12 HD1 PRO 12 38.677 -11.559 5.263 36 H ASP 13 HN ASP 13 35.385 -10.186 7.753 37 HA ASP 13 HA ASP 13 33.240 -10.124 8.855 38 HB2 ASP 13 HB2 ASP 13 33.815 -12.468 9.791 39 HB3 ASP 13 HB1 ASP 13 34.460 -11.596 11.185 40 H GLY 14 HN GLY 14 33.146 -8.016 9.358 41 HA2 GLY 14 HA2 GLY 14 33.177 -6.396 11.219 42 HA3 GLY 14 HA1 GLY 14 34.721 -7.088 11.717 43 H TRP 15 HN TRP 15 34.907 -7.038 8.438 44 HA TRP 15 HA TRP 15 35.444 -4.207 8.045 45 HB2 TRP 15 HB2 TRP 15 37.785 -4.240 7.965 46 HB3 TRP 15 HB1 TRP 15 37.396 -5.170 9.408 47 HD1 TRP 15 HD1 TRP 15 37.189 -7.975 8.848 48 HE1 TRP 15 HE1 TRP 15 38.857 -9.370 7.481 49 HE3 TRP 15 HE3 TRP 15 39.469 -4.262 6.194 50 HZ2 TRP 15 HZ2 TRP 15 40.898 -8.972 5.514 51 HZ3 TRP 15 HZ3 TRP 15 41.267 -4.795 4.583 52 HH2 TRP 15 HH2 TRP 15 41.988 -7.143 4.237 53 H GLU 16 HN GLU 16 36.487 -3.825 5.840 54 HA GLU 16 HA GLU 16 36.465 -6.003 3.914 55 HB2 GLU 16 HB2 GLU 16 33.998 -4.544 4.458 56 HB3 GLU 16 HB1 GLU 16 34.483 -4.425 2.767 57 HG2 GLU 16 HG2 GLU 16 34.845 -6.977 2.878 58 HG3 GLU 16 HG1 GLU 16 33.921 -6.915 4.380 59 H GLN 17 HN GLN 17 36.735 -5.110 1.637 60 HA GLN 17 HA GLN 17 38.487 -2.744 1.753 61 HB2 GLN 17 HB2 GLN 17 39.393 -4.542 0.473 62 HB3 GLN 17 HB1 GLN 17 37.872 -4.792 -0.385 63 HG2 GLN 17 HG2 GLN 17 38.284 -3.113 -1.863 64 HG3 GLN 17 HG1 GLN 17 38.981 -2.067 -0.626 65 HE21 GLN 17 HE21 GLN 17 39.868 -3.471 -3.431 66 HE22 GLN 17 HE22 GLN 17 41.496 -3.824 -3.106 67 H ALA 18 HN ALA 18 38.002 -0.783 0.720 68 HA ALA 18 HA ALA 18 35.585 -0.603 -0.949 69 HB1 ALA 18 HB1 ALA 18 35.851 0.706 1.757 70 HB2 ALA 18 HB2 ALA 18 34.516 -0.267 1.140 71 HB3 ALA 18 HB3 ALA 18 34.784 1.360 0.514 72 H MET 19 HN MET 19 35.327 2.100 -1.175 73 HA MET 19 HA MET 19 38.058 3.138 -1.710 74 HB2 MET 19 HB2 MET 19 37.481 3.817 -3.937 75 HB3 MET 19 HB1 MET 19 37.008 2.125 -3.794 76 HG2 MET 19 HG2 MET 19 35.192 4.539 -3.554 77 HG3 MET 19 HG1 MET 19 35.190 3.341 -4.848 78 HE1 MET 19 HE1 MET 19 31.971 3.229 -2.581 79 HE2 MET 19 HE2 MET 19 32.975 4.432 -3.389 80 HE3 MET 19 HE3 MET 19 33.103 4.215 -1.645 81 H THR 20 HN THR 20 38.059 5.525 -2.027 82 HA THR 20 HA THR 20 35.968 6.769 -0.332 83 HB THR 20 HB THR 20 37.777 8.747 -0.721 84 HG1 THR 20 HG1 THR 20 38.989 7.220 -2.046 85 HG21 THR 20 HG21 THR 20 37.369 8.260 1.493 86 HG22 THR 20 HG22 THR 20 38.974 7.543 1.341 87 HG23 THR 20 HG23 THR 20 37.539 6.521 1.251 88 H GLN 21 HN GLN 21 36.243 9.424 -1.294 89 HA GLN 21 HA GLN 21 34.626 9.213 -3.741 90 HB2 GLN 21 HB2 GLN 21 35.543 11.638 -2.160 91 HB3 GLN 21 HB1 GLN 21 34.383 11.666 -3.488 92 HG2 GLN 21 HG2 GLN 21 32.700 10.896 -2.182 93 HG3 GLN 21 HG1 GLN 21 33.733 9.688 -1.419 94 HE21 GLN 21 HE21 GLN 21 32.905 10.269 0.734 95 HE22 GLN 21 HE22 GLN 21 33.378 11.715 1.487 96 H ASP 22 HN ASP 22 37.894 9.433 -2.995 97 HA ASP 22 HA ASP 22 38.497 10.689 -5.618 98 HB2 ASP 22 HB2 ASP 22 39.400 11.806 -3.510 99 HB3 ASP 22 HB1 ASP 22 40.414 10.378 -3.301 100 H GLY 23 HN GLY 23 37.863 7.852 -4.689 101 HA2 GLY 23 HA2 GLY 23 38.547 5.687 -5.253 102 HA3 GLY 23 HA1 GLY 23 39.453 6.451 -6.560 103 H GLU 24 HN GLU 24 39.932 6.972 -3.086 104 HA GLU 24 HA GLU 24 42.781 6.386 -3.401 105 HB2 GLU 24 HB2 GLU 24 41.332 6.885 -0.808 106 HB3 GLU 24 HB1 GLU 24 43.024 7.209 -1.188 107 HG2 GLU 24 HG2 GLU 24 41.788 8.690 -3.107 108 HG3 GLU 24 HG1 GLU 24 40.614 8.811 -1.795 109 H ILE 25 HN ILE 25 40.486 4.388 -3.513 110 HA ILE 25 HA ILE 25 39.888 2.316 -2.426 111 HB ILE 25 HB ILE 25 41.267 1.699 -4.302 112 HG12 ILE 25 HG12 ILE 25 42.306 -0.363 -3.425 113 HG13 ILE 25 HG11 ILE 25 42.225 0.289 -1.788 114 HG21 ILE 25 HG21 ILE 25 43.141 3.290 -3.639 115 HG22 ILE 25 HG22 ILE 25 43.664 1.723 -4.253 116 HG23 ILE 25 HG23 ILE 25 43.690 2.044 -2.519 117 HD11 ILE 25 HD11 ILE 25 39.990 -0.103 -1.596 118 HD12 ILE 25 HD12 ILE 25 40.290 -1.285 -2.871 119 HD13 ILE 25 HD13 ILE 25 39.671 0.315 -3.279 120 H TYR 26 HN TYR 26 39.613 2.107 -0.273 121 HA TYR 26 HA TYR 26 42.031 1.705 1.379 122 HB2 TYR 26 HB2 TYR 26 41.291 3.170 3.128 123 HB3 TYR 26 HB1 TYR 26 41.250 4.087 1.628 124 HD1 TYR 26 HD1 TYR 26 39.733 4.977 3.981 125 HD2 TYR 26 HD2 TYR 26 38.611 2.236 0.868 126 HE1 TYR 26 HE1 TYR 26 37.345 5.503 4.376 127 HE2 TYR 26 HE2 TYR 26 36.227 2.764 1.267 128 HH TYR 26 HH TYR 26 35.018 3.986 3.847 129 H TYR 27 HN TYR 27 41.189 0.946 3.700 130 HA TYR 27 HA TYR 27 39.159 -1.166 3.124 131 HB2 TYR 27 HB2 TYR 27 41.381 -1.068 5.184 132 HB3 TYR 27 HB1 TYR 27 40.203 -2.373 5.046 133 HD1 TYR 27 HD1 TYR 27 43.245 -0.924 3.702 134 HD2 TYR 27 HD2 TYR 27 40.074 -3.708 2.918 135 HE1 TYR 27 HE1 TYR 27 44.609 -1.973 1.923 136 HE2 TYR 27 HE2 TYR 27 41.438 -4.761 1.141 137 HH TYR 27 HH TYR 27 43.544 -3.714 -0.425 138 H ILE 28 HN ILE 28 37.639 -1.684 4.840 139 HA ILE 28 HA ILE 28 37.214 0.554 6.745 140 HB ILE 28 HB ILE 28 35.418 0.992 5.456 141 HG12 ILE 28 HG12 ILE 28 33.408 -0.216 6.099 142 HG13 ILE 28 HG11 ILE 28 34.365 -1.606 6.613 143 HG21 ILE 28 HG21 ILE 28 36.263 -0.530 3.683 144 HG22 ILE 28 HG22 ILE 28 34.503 -0.555 3.796 145 HG23 ILE 28 HG23 ILE 28 35.449 -1.876 4.481 146 HD11 ILE 28 HD11 ILE 28 35.442 0.614 7.977 147 HD12 ILE 28 HD12 ILE 28 34.479 -0.695 8.658 148 HD13 ILE 28 HD13 ILE 28 33.691 0.775 8.095 149 H ASN 29 HN ASN 29 37.095 -0.093 8.834 150 HA ASN 29 HA ASN 29 36.718 -3.012 9.347 151 HB2 ASN 29 HB2 ASN 29 38.612 -1.119 10.309 152 HB3 ASN 29 HB1 ASN 29 37.593 -1.579 11.674 153 HD21 ASN 29 HD21 ASN 29 38.084 -3.556 12.658 154 HD22 ASN 29 HD22 ASN 29 39.069 -4.757 11.973 155 H HIS 30 HN HIS 30 34.553 -3.319 9.705 156 HA HIS 30 HA HIS 30 32.838 -1.348 10.924 157 HB2 HIS 30 HB2 HIS 30 32.418 -4.342 10.658 158 HB3 HIS 30 HB1 HIS 30 31.166 -3.140 10.970 159 HD1 HIS 30 HD1 HIS 30 30.808 -1.309 9.015 160 HD2 HIS 30 HD2 HIS 30 33.029 -4.678 7.954 161 HE1 HIS 30 HE1 HIS 30 30.872 -1.359 6.482 162 HE2 HIS 30 HE2 HIS 30 32.219 -3.407 5.827 163 H LYS 31 HN LYS 31 35.273 -3.147 12.262 164 HA LYS 31 HA LYS 31 33.965 -3.835 14.785 165 HB2 LYS 31 HB2 LYS 31 36.876 -3.795 13.944 166 HB3 LYS 31 HB1 LYS 31 36.313 -4.351 15.520 167 HG2 LYS 31 HG2 LYS 31 34.684 -5.678 13.656 168 HG3 LYS 31 HG1 LYS 31 36.311 -5.756 12.981 169 HD2 LYS 31 HD2 LYS 31 36.136 -7.662 14.395 170 HD3 LYS 31 HD1 LYS 31 37.075 -6.490 15.319 171 HE2 LYS 31 HE2 LYS 31 34.405 -5.889 15.918 172 HE3 LYS 31 HE1 LYS 31 34.484 -7.651 15.934 173 HZ1 LYS 31 HZ1 LYS 31 36.678 -6.250 17.228 174 HZ2 LYS 31 HZ2 LYS 31 35.867 -7.669 17.693 175 HZ3 LYS 31 HZ3 LYS 31 35.173 -6.150 18.004 176 H ASN 32 HN ASN 32 36.209 -1.344 13.629 177 HA ASN 32 HA ASN 32 35.772 0.126 16.181 178 HB2 ASN 32 HB2 ASN 32 38.142 -0.384 15.622 179 HB3 ASN 32 HB1 ASN 32 37.954 0.502 14.108 180 HD21 ASN 32 HD21 ASN 32 39.878 1.623 15.566 181 HD22 ASN 32 HD22 ASN 32 39.353 2.991 16.422 182 H LYS 33 HN LYS 33 34.555 -0.039 13.160 183 HA LYS 33 HA LYS 33 33.297 1.444 11.858 184 HB2 LYS 33 HB2 LYS 33 33.126 2.382 14.576 185 HB3 LYS 33 HB1 LYS 33 33.172 3.765 13.481 186 HG2 LYS 33 HG2 LYS 33 31.382 2.607 12.108 187 HG3 LYS 33 HG1 LYS 33 31.239 1.434 13.420 188 HD2 LYS 33 HD2 LYS 33 31.184 3.994 14.630 189 HD3 LYS 33 HD1 LYS 33 30.102 4.077 13.238 190 HE2 LYS 33 HE2 LYS 33 28.732 3.275 14.998 191 HE3 LYS 33 HE1 LYS 33 29.149 1.832 14.075 192 HZ1 LYS 33 HZ1 LYS 33 29.561 2.221 16.749 193 HZ2 LYS 33 HZ2 LYS 33 31.103 2.427 16.065 194 HZ3 LYS 33 HZ3 LYS 33 30.236 0.990 15.799 195 H THR 34 HN THR 34 36.112 1.420 11.482 196 HA THR 34 HA THR 34 36.488 4.171 10.467 197 HB THR 34 HB THR 34 39.027 3.421 11.351 198 HG1 THR 34 HG1 THR 34 37.096 2.274 12.856 199 HG21 THR 34 HG21 THR 34 36.907 5.309 12.342 200 HG22 THR 34 HG22 THR 34 38.378 5.678 11.442 201 HG23 THR 34 HG23 THR 34 38.477 5.209 13.140 202 H THR 35 HN THR 35 38.237 4.241 8.801 203 HA THR 35 HA THR 35 38.485 1.605 7.464 204 HB THR 35 HB THR 35 39.119 3.241 5.484 205 HG1 THR 35 HG1 THR 35 38.464 4.891 7.438 206 HG21 THR 35 HG21 THR 35 36.457 2.440 6.583 207 HG22 THR 35 HG22 THR 35 37.247 1.935 5.088 208 HG23 THR 35 HG23 THR 35 36.497 3.523 5.195 209 H SER 36 HN SER 36 40.548 1.270 6.247 210 HA SER 36 HA SER 36 42.843 2.870 7.223 211 HB2 SER 36 HB2 SER 36 42.713 -0.119 7.703 212 HB3 SER 36 HB1 SER 36 44.024 0.966 8.159 213 HG SER 36 HG SER 36 42.500 0.467 9.865 214 H TRP 37 HN TRP 37 44.736 2.571 5.925 215 HA TRP 37 HA TRP 37 44.160 1.611 3.219 216 HB2 TRP 37 HB2 TRP 37 46.874 2.464 4.225 217 HB3 TRP 37 HB1 TRP 37 46.211 2.605 2.597 218 HD1 TRP 37 HD1 TRP 37 46.483 4.414 5.858 219 HE1 TRP 37 HE1 TRP 37 45.245 6.671 5.716 220 HE3 TRP 37 HE3 TRP 37 44.004 3.782 1.437 221 HZ2 TRP 37 HZ2 TRP 37 43.445 8.029 3.957 222 HZ3 TRP 37 HZ3 TRP 37 42.535 5.574 0.553 223 HH2 TRP 37 HH2 TRP 37 42.252 7.693 1.807 224 H LEU 38 HN LEU 38 45.902 0.475 6.044 225 HA LEU 38 HA LEU 38 47.646 -1.423 5.023 226 HB2 LEU 38 HB2 LEU 38 45.867 -1.411 7.443 227 HB3 LEU 38 HB1 LEU 38 46.798 -2.860 7.061 228 HG LEU 38 HG LEU 38 48.216 -0.229 6.996 229 HD11 LEU 38 HD11 LEU 38 46.976 -0.088 9.094 230 HD12 LEU 38 HD12 LEU 38 48.667 -0.445 9.444 231 HD13 LEU 38 HD13 LEU 38 47.460 -1.728 9.523 232 HD21 LEU 38 HD21 LEU 38 50.048 -1.677 7.867 233 HD22 LEU 38 HD22 LEU 38 49.382 -2.289 6.354 234 HD23 LEU 38 HD23 LEU 38 48.932 -3.043 7.884 235 H ASP 39 HN ASP 39 47.457 -3.510 4.167 236 HA ASP 39 HA ASP 39 44.684 -4.369 3.486 237 HB2 ASP 39 HB2 ASP 39 45.785 -5.507 1.502 238 HB3 ASP 39 HB1 ASP 39 45.807 -3.744 1.452 239 HA PRO 40 HA PRO 40 46.256 -7.513 6.465 240 HB2 PRO 40 HB2 PRO 40 43.395 -8.287 6.095 241 HB3 PRO 40 HB1 PRO 40 44.337 -8.123 7.590 242 HG2 PRO 40 HG2 PRO 40 42.553 -6.285 6.858 243 HG3 PRO 40 HG1 PRO 40 44.062 -5.848 7.674 244 HD2 PRO 40 HD2 PRO 40 43.304 -5.491 4.811 245 HD3 PRO 40 HD1 PRO 40 44.397 -4.519 5.821 246 H ARG 41 HN ARG 41 43.686 -8.608 4.210 247 HA ARG 41 HA ARG 41 45.646 -10.526 3.061 248 HB2 ARG 41 HB2 ARG 41 43.597 -12.164 3.061 249 HB3 ARG 41 HB1 ARG 41 44.552 -11.975 4.533 250 HG2 ARG 41 HG2 ARG 41 42.422 -9.977 4.293 251 HG3 ARG 41 HG1 ARG 41 41.810 -11.630 4.350 252 HD2 ARG 41 HD2 ARG 41 42.248 -10.344 6.596 253 HD3 ARG 41 HD1 ARG 41 42.720 -12.037 6.462 254 HE ARG 41 HE ARG 41 44.933 -10.482 5.623 255 HH11 ARG 41 HH11 ARG 41 46.614 -10.067 7.076 256 HH12 ARG 41 HH12 ARG 41 46.319 -10.190 8.778 257 HH21 ARG 41 HH21 ARG 41 42.987 -11.077 8.407 258 HH22 ARG 41 HH22 ARG 41 44.266 -10.762 9.532 259 H LEU 42 HN LEU 42 44.771 -8.123 1.858 260 HA LEU 42 HA LEU 42 42.884 -9.113 -0.224 261 HB2 LEU 42 HB2 LEU 42 42.733 -6.796 1.276 262 HB3 LEU 42 HB1 LEU 42 43.465 -6.237 -0.229 263 HG LEU 42 HG LEU 42 41.097 -6.091 -0.549 264 HD11 LEU 42 HD11 LEU 42 42.692 -7.556 -2.194 265 HD12 LEU 42 HD12 LEU 42 41.003 -7.191 -2.548 266 HD13 LEU 42 HD13 LEU 42 41.440 -8.742 -1.830 267 HD21 LEU 42 HD21 LEU 42 41.117 -8.438 1.157 268 HD22 LEU 42 HD22 LEU 42 40.129 -8.722 -0.276 269 HD23 LEU 42 HD23 LEU 42 39.780 -7.353 0.779 270 H ASP 43 HN ASP 43 45.389 -10.051 -0.570 271 HA ASP 43 HA ASP 43 47.209 -10.074 -2.052 272 HB2 ASP 43 HB2 ASP 43 45.309 -9.970 -3.675 273 HB3 ASP 43 HB1 ASP 43 45.436 -8.211 -3.659 274 HA PRO 44 HA PRO 44 48.902 -6.097 -0.589 275 HB2 PRO 44 HB2 PRO 44 51.313 -7.088 0.182 276 HB3 PRO 44 HB1 PRO 44 49.857 -7.219 1.188 277 HG2 PRO 44 HG2 PRO 44 51.190 -9.269 -0.487 278 HG3 PRO 44 HG1 PRO 44 50.337 -9.445 1.054 279 HD2 PRO 44 HD2 PRO 44 49.264 -10.062 -1.448 280 HD3 PRO 44 HD1 PRO 44 48.315 -9.771 0.026 281 H ARG 45 HN ARG 45 49.110 -5.163 -2.695 282 HA ARG 45 HA ARG 45 50.821 -6.050 -4.763 283 HB2 ARG 45 HB2 ARG 45 50.839 -3.579 -5.434 284 HB3 ARG 45 HB1 ARG 45 49.250 -4.328 -5.278 285 HG2 ARG 45 HG2 ARG 45 48.904 -3.346 -3.115 286 HG3 ARG 45 HG1 ARG 45 50.584 -2.814 -3.022 287 HD2 ARG 45 HD2 ARG 45 50.270 -1.118 -4.613 288 HD3 ARG 45 HD1 ARG 45 48.820 -1.874 -5.273 289 HE ARG 45 HE ARG 45 48.534 -1.035 -2.486 290 HH11 ARG 45 HH11 ARG 45 47.049 0.633 -2.138 291 HH12 ARG 45 HH12 ARG 45 46.471 1.556 -3.486 292 HH21 ARG 45 HH21 ARG 45 48.341 -0.194 -5.824 293 HH22 ARG 45 HH22 ARG 45 47.203 1.087 -5.573 294 H GLY 46 HN GLY 46 52.060 -3.047 -4.382 295 HA2 GLY 46 HA2 GLY 46 54.033 -3.196 -2.385 296 HA3 GLY 46 HA1 GLY 46 54.713 -3.997 -3.803 297 H GLY 47 HN GLY 47 55.278 -1.314 -2.430 298 HA2 GLY 47 HA2 GLY 47 56.407 0.488 -3.659 299 HA3 GLY 47 HA1 GLY 47 55.219 0.287 -4.949 300 H GLY 48 HN GLY 48 55.042 2.716 -4.558 301 HA2 GLY 48 HA2 GLY 48 53.095 4.111 -3.981 302 HA3 GLY 48 HA1 GLY 48 52.945 3.189 -2.484 303 H GLY 49 HN GLY 49 53.168 4.946 -1.064 304 HA2 GLY 49 HA2 GLY 49 55.912 5.847 -0.616 305 HA3 GLY 49 HA1 GLY 49 54.827 7.136 -1.138 306 H ASN 50 HN ASN 50 53.426 8.020 0.356 307 HA ASN 50 HA ASN 50 53.371 6.722 3.054 308 HB2 ASN 50 HB2 ASN 50 52.815 9.588 3.054 309 HB3 ASN 50 HB1 ASN 50 53.979 8.675 4.014 310 HD21 ASN 50 HD21 ASN 50 53.531 10.164 0.782 311 HD22 ASN 50 HD22 ASN 50 55.188 10.360 0.470 312 H ARG 51 HN ARG 51 51.355 5.966 3.461 313 HA ARG 51 HA ARG 51 49.043 6.645 1.932 314 HB2 ARG 51 HB2 ARG 51 47.779 5.437 3.653 315 HB3 ARG 51 HB1 ARG 51 49.261 4.559 3.268 316 HG2 ARG 51 HG2 ARG 51 50.024 6.321 5.293 317 HG3 ARG 51 HG1 ARG 51 48.430 5.755 5.793 318 HD2 ARG 51 HD2 ARG 51 50.376 4.314 6.566 319 HD3 ARG 51 HD1 ARG 51 49.115 3.457 5.678 320 HE ARG 51 HE ARG 51 51.396 4.435 4.076 321 HH11 ARG 51 HH11 ARG 51 52.512 2.797 2.989 322 HH12 ARG 51 HH12 ARG 51 52.183 1.141 3.374 323 HH21 ARG 51 HH21 ARG 51 49.799 1.896 5.777 324 HH22 ARG 51 HH22 ARG 51 50.648 0.630 4.953 325 H GLN 52 HN GLN 52 47.629 8.334 2.119 326 HA GLN 52 HA GLN 52 48.233 10.511 3.927 327 HB2 GLN 52 HB2 GLN 52 45.820 10.002 2.161 328 HB3 GLN 52 HB1 GLN 52 46.146 11.518 3.000 329 HG2 GLN 52 HG2 GLN 52 46.927 11.608 0.655 330 HG3 GLN 52 HG1 GLN 52 48.275 11.745 1.783 331 HE21 GLN 52 HE21 GLN 52 46.449 8.890 0.529 332 HE22 GLN 52 HE22 GLN 52 47.832 8.060 -0.004 333 HA PRO 53 HA PRO 53 46.196 9.428 7.678 334 HB2 PRO 53 HB2 PRO 53 44.801 12.055 7.348 335 HB3 PRO 53 HB1 PRO 53 45.659 11.405 8.757 336 HG2 PRO 53 HG2 PRO 53 46.739 13.254 7.135 337 HG3 PRO 53 HG1 PRO 53 47.706 12.027 7.969 338 HD2 PRO 53 HD2 PRO 53 47.086 12.262 5.092 339 HD3 PRO 53 HD1 PRO 53 48.380 11.349 5.896 340 HA PRO 54 HA PRO 54 42.300 8.074 5.802 341 HB2 PRO 54 HB2 PRO 54 41.962 5.887 7.371 342 HB3 PRO 54 HB1 PRO 54 43.110 5.921 6.020 343 HG2 PRO 54 HG2 PRO 54 43.612 6.145 8.935 344 HG3 PRO 54 HG1 PRO 54 44.588 5.376 7.674 345 HD2 PRO 54 HD2 PRO 54 45.085 7.897 8.765 346 HD3 PRO 54 HD1 PRO 54 45.722 7.313 7.212 347 HA PRO 55 HA PRO 55 39.951 10.046 9.156 348 HB2 PRO 55 HB2 PRO 55 37.913 10.934 7.586 349 HB3 PRO 55 HB1 PRO 55 39.480 11.762 7.685 350 HG2 PRO 55 HG2 PRO 55 38.403 9.996 5.562 351 HG3 PRO 55 HG1 PRO 55 39.464 11.407 5.433 352 HD2 PRO 55 HD2 PRO 55 40.318 8.755 5.307 353 HD3 PRO 55 HD1 PRO 55 41.362 10.146 5.671 354 HA PRO 56 HA PRO 56 36.930 7.017 10.206 355 HB2 PRO 56 HB2 PRO 56 34.758 8.620 10.917 356 HB3 PRO 56 HB1 PRO 56 36.110 8.187 11.978 357 HG2 PRO 56 HG2 PRO 56 35.616 10.688 10.469 358 HG3 PRO 56 HG1 PRO 56 36.399 10.447 12.039 359 HD2 PRO 56 HD2 PRO 56 37.813 10.969 9.770 360 HD3 PRO 56 HD1 PRO 56 38.462 9.971 11.091 361 H TYR 57 HN TYR 57 36.083 5.840 8.538 362 HA TYR 57 HA TYR 57 34.765 6.948 6.261 363 HB2 TYR 57 HB2 TYR 57 34.741 4.800 5.512 364 HB3 TYR 57 HB1 TYR 57 35.747 4.483 6.924 365 HD1 TYR 57 HD1 TYR 57 34.439 4.052 9.178 366 HD2 TYR 57 HD2 TYR 57 32.750 3.607 5.253 367 HE1 TYR 57 HE1 TYR 57 32.681 2.568 10.102 368 HE2 TYR 57 HE2 TYR 57 30.992 2.123 6.178 369 HH TYR 57 HH TYR 57 30.579 0.726 8.077 370 HA PRO 58 HA PRO 58 30.836 7.732 8.253 371 HB2 PRO 58 HB2 PRO 58 29.535 8.681 6.056 372 HB3 PRO 58 HB1 PRO 58 30.740 9.632 6.946 373 HG2 PRO 58 HG2 PRO 58 31.014 8.152 4.385 374 HG3 PRO 58 HG1 PRO 58 31.719 9.700 4.879 375 HD2 PRO 58 HD2 PRO 58 33.101 7.303 4.877 376 HD3 PRO 58 HD1 PRO 58 33.526 8.699 5.891 377 H LEU 59 HN LEU 59 29.732 5.849 8.744 378 HA LEU 59 HA LEU 59 29.177 3.708 6.987 379 HB2 LEU 59 HB2 LEU 59 28.913 3.448 9.388 380 HB3 LEU 59 HB1 LEU 59 27.635 4.664 9.417 381 HG LEU 59 HG LEU 59 26.198 3.251 8.047 382 HD11 LEU 59 HD11 LEU 59 28.722 1.658 7.807 383 HD12 LEU 59 HD12 LEU 59 27.526 2.052 6.572 384 HD13 LEU 59 HD13 LEU 59 27.183 0.799 7.764 385 HD21 LEU 59 HD21 LEU 59 26.546 1.066 9.686 386 HD22 LEU 59 HD22 LEU 59 25.656 2.521 10.133 387 HD23 LEU 59 HD23 LEU 59 27.345 2.342 10.606 388 H THR 60 HN THR 60 27.584 3.357 5.469 389 HA THR 60 HA THR 60 25.917 3.944 3.920 390 HB THR 60 HB THR 60 23.833 4.830 4.952 391 HG1 THR 60 HG1 THR 60 25.425 4.928 7.297 392 HG21 THR 60 HG21 THR 60 24.148 2.982 7.011 393 HG22 THR 60 HG22 THR 60 25.307 2.456 5.791 394 HG23 THR 60 HG23 THR 60 23.603 2.626 5.371 395 H ALA 61 HN ALA 61 24.325 6.138 3.573 396 HA ALA 61 HA ALA 61 26.265 8.417 3.536 397 HB1 ALA 61 HB1 ALA 61 24.353 7.444 1.410 398 HB2 ALA 61 HB2 ALA 61 26.089 7.714 1.273 399 HB3 ALA 61 HB3 ALA 61 24.990 9.087 1.402 Start of MODEL 17 1 H1 SER 8 HT1 SER 8 26.079 -9.705 3.826 2 H2 SER 8 HT2 SER 8 26.501 -8.807 2.448 3 H3 SER 8 HT3 SER 8 27.698 -9.634 3.325 4 HA SER 8 HA SER 8 25.733 -11.488 2.589 5 HB2 SER 8 HB2 SER 8 26.110 -9.359 0.674 6 HB3 SER 8 HB1 SER 8 26.729 -10.870 0.016 7 HG SER 8 HG SER 8 24.173 -10.085 0.466 8 H GLY 9 HN GLY 9 28.887 -10.005 1.870 9 HA2 GLY 9 HA2 GLY 9 30.259 -12.470 2.572 10 HA3 GLY 9 HA1 GLY 9 30.309 -12.149 0.838 11 HA PRO 10 HA PRO 10 32.543 -8.364 2.786 12 HB2 PRO 10 HB2 PRO 10 32.837 -8.331 5.510 13 HB3 PRO 10 HB1 PRO 10 31.457 -7.606 4.666 14 HG2 PRO 10 HG2 PRO 10 31.648 -10.193 6.110 15 HG3 PRO 10 HG1 PRO 10 30.300 -9.050 6.010 16 HD2 PRO 10 HD2 PRO 10 30.427 -11.384 4.554 17 HD3 PRO 10 HD1 PRO 10 29.509 -9.951 4.042 18 H LEU 11 HN LEU 11 34.579 -8.204 4.688 19 HA LEU 11 HA LEU 11 36.375 -10.326 3.736 20 HB2 LEU 11 HB2 LEU 11 36.607 -7.665 5.043 21 HB3 LEU 11 HB1 LEU 11 37.895 -8.802 5.386 22 HG LEU 11 HG LEU 11 36.951 -8.265 2.569 23 HD11 LEU 11 HD11 LEU 11 39.448 -6.996 3.058 24 HD12 LEU 11 HD12 LEU 11 38.337 -6.461 4.319 25 HD13 LEU 11 HD13 LEU 11 37.918 -6.238 2.620 26 HD21 LEU 11 HD21 LEU 11 39.669 -9.164 3.551 27 HD22 LEU 11 HD22 LEU 11 39.016 -9.270 1.918 28 HD23 LEU 11 HD23 LEU 11 38.379 -10.309 3.191 29 HA PRO 12 HA PRO 12 37.283 -12.969 7.277 30 HB2 PRO 12 HB2 PRO 12 38.448 -10.656 8.792 31 HB3 PRO 12 HB1 PRO 12 39.021 -12.332 8.683 32 HG2 PRO 12 HG2 PRO 12 39.963 -10.216 7.171 33 HG3 PRO 12 HG1 PRO 12 40.165 -11.929 6.785 34 HD2 PRO 12 HD2 PRO 12 38.696 -10.032 5.280 35 HD3 PRO 12 HD1 PRO 12 38.700 -11.786 5.037 36 H ASP 13 HN ASP 13 35.554 -10.004 7.604 37 HA ASP 13 HA ASP 13 33.361 -10.006 8.674 38 HB2 ASP 13 HB2 ASP 13 33.809 -12.393 9.477 39 HB3 ASP 13 HB1 ASP 13 34.611 -11.663 10.872 40 H GLY 14 HN GLY 14 33.290 -7.935 9.319 41 HA2 GLY 14 HA2 GLY 14 33.405 -6.446 11.303 42 HA3 GLY 14 HA1 GLY 14 34.992 -7.142 11.645 43 H TRP 15 HN TRP 15 35.065 -6.965 8.422 44 HA TRP 15 HA TRP 15 35.466 -4.098 8.081 45 HB2 TRP 15 HB2 TRP 15 37.807 -4.082 7.810 46 HB3 TRP 15 HB1 TRP 15 37.531 -5.008 9.282 47 HD1 TRP 15 HD1 TRP 15 37.279 -7.840 8.681 48 HE1 TRP 15 HE1 TRP 15 38.920 -9.196 7.245 49 HE3 TRP 15 HE3 TRP 15 39.465 -4.062 6.036 50 HZ2 TRP 15 HZ2 TRP 15 40.909 -8.749 5.238 51 HZ3 TRP 15 HZ3 TRP 15 41.227 -4.556 4.374 52 HH2 TRP 15 HH2 TRP 15 41.954 -6.891 3.966 53 H GLU 16 HN GLU 16 36.455 -3.683 5.802 54 HA GLU 16 HA GLU 16 36.194 -5.854 3.871 55 HB2 GLU 16 HB2 GLU 16 33.890 -4.159 4.519 56 HB3 GLU 16 HB1 GLU 16 34.286 -4.167 2.801 57 HG2 GLU 16 HG2 GLU 16 34.398 -6.716 2.985 58 HG3 GLU 16 HG1 GLU 16 33.640 -6.533 4.567 59 H GLN 17 HN GLN 17 36.778 -5.161 1.714 60 HA GLN 17 HA GLN 17 38.474 -2.761 1.704 61 HB2 GLN 17 HB2 GLN 17 39.403 -4.707 0.633 62 HB3 GLN 17 HB1 GLN 17 37.945 -4.945 -0.326 63 HG2 GLN 17 HG2 GLN 17 39.799 -3.884 -1.627 64 HG3 GLN 17 HG1 GLN 17 38.350 -2.881 -1.548 65 HE21 GLN 17 HE21 GLN 17 41.702 -2.805 -1.090 66 HE22 GLN 17 HE22 GLN 17 41.794 -1.405 -0.135 67 H ALA 18 HN ALA 18 37.952 -0.857 0.622 68 HA ALA 18 HA ALA 18 35.688 -0.852 -1.261 69 HB1 ALA 18 HB1 ALA 18 34.538 -0.550 0.854 70 HB2 ALA 18 HB2 ALA 18 34.547 0.989 -0.005 71 HB3 ALA 18 HB3 ALA 18 35.669 0.715 1.330 72 H MET 19 HN MET 19 35.303 1.808 -1.602 73 HA MET 19 HA MET 19 37.996 3.010 -1.941 74 HB2 MET 19 HB2 MET 19 37.068 3.835 -4.230 75 HB3 MET 19 HB1 MET 19 37.661 2.177 -4.117 76 HG2 MET 19 HG2 MET 19 35.328 1.409 -3.685 77 HG3 MET 19 HG1 MET 19 34.769 3.065 -3.921 78 HE1 MET 19 HE1 MET 19 33.260 1.480 -6.625 79 HE2 MET 19 HE2 MET 19 33.659 0.864 -5.024 80 HE3 MET 19 HE3 MET 19 34.294 0.054 -6.453 81 H THR 20 HN THR 20 37.848 5.390 -2.331 82 HA THR 20 HA THR 20 35.583 6.507 -0.792 83 HB THR 20 HB THR 20 37.171 8.640 -1.217 84 HG1 THR 20 HG1 THR 20 38.595 6.394 -1.934 85 HG21 THR 20 HG21 THR 20 36.514 7.591 0.962 86 HG22 THR 20 HG22 THR 20 38.182 8.166 0.938 87 HG23 THR 20 HG23 THR 20 37.841 6.445 0.760 88 H GLN 21 HN GLN 21 35.600 9.123 -1.881 89 HA GLN 21 HA GLN 21 34.057 8.630 -4.333 90 HB2 GLN 21 HB2 GLN 21 34.699 11.390 -3.357 91 HB3 GLN 21 HB1 GLN 21 33.196 10.765 -4.038 92 HG2 GLN 21 HG2 GLN 21 34.290 10.058 -1.298 93 HG3 GLN 21 HG1 GLN 21 32.989 11.210 -1.603 94 HE21 GLN 21 HE21 GLN 21 33.770 7.840 -2.673 95 HE22 GLN 21 HE22 GLN 21 32.201 7.245 -2.414 96 H ASP 22 HN ASP 22 37.272 9.259 -3.538 97 HA ASP 22 HA ASP 22 37.802 10.373 -6.239 98 HB2 ASP 22 HB2 ASP 22 38.512 11.756 -4.227 99 HB3 ASP 22 HB1 ASP 22 39.654 10.467 -3.851 100 H GLY 23 HN GLY 23 37.464 7.561 -5.103 101 HA2 GLY 23 HA2 GLY 23 38.394 5.454 -5.508 102 HA3 GLY 23 HA1 GLY 23 39.288 6.228 -6.816 103 H GLU 24 HN GLU 24 39.535 7.098 -3.398 104 HA GLU 24 HA GLU 24 42.434 6.776 -3.517 105 HB2 GLU 24 HB2 GLU 24 40.811 7.266 -1.028 106 HB3 GLU 24 HB1 GLU 24 42.464 7.776 -1.372 107 HG2 GLU 24 HG2 GLU 24 41.247 9.021 -3.402 108 HG3 GLU 24 HG1 GLU 24 39.886 8.966 -2.279 109 H ILE 25 HN ILE 25 40.403 4.524 -3.626 110 HA ILE 25 HA ILE 25 39.991 2.439 -2.518 111 HB ILE 25 HB ILE 25 41.752 1.977 -4.127 112 HG12 ILE 25 HG12 ILE 25 42.913 0.111 -2.913 113 HG13 ILE 25 HG11 ILE 25 42.258 0.743 -1.402 114 HG21 ILE 25 HG21 ILE 25 44.088 2.250 -3.626 115 HG22 ILE 25 HG22 ILE 25 43.741 2.663 -1.949 116 HG23 ILE 25 HG23 ILE 25 43.299 3.777 -3.241 117 HD11 ILE 25 HD11 ILE 25 40.322 0.302 -3.619 118 HD12 ILE 25 HD12 ILE 25 40.117 0.068 -1.884 119 HD13 ILE 25 HD13 ILE 25 40.980 -1.136 -2.838 120 H TYR 26 HN TYR 26 39.371 2.466 -0.408 121 HA TYR 26 HA TYR 26 41.536 2.513 1.614 122 HB2 TYR 26 HB2 TYR 26 40.363 3.989 3.060 123 HB3 TYR 26 HB1 TYR 26 40.300 4.741 1.471 124 HD1 TYR 26 HD1 TYR 26 38.164 2.630 0.425 125 HD2 TYR 26 HD2 TYR 26 38.403 5.211 3.850 126 HE1 TYR 26 HE1 TYR 26 35.693 2.690 0.557 127 HE2 TYR 26 HE2 TYR 26 35.929 5.267 3.978 128 HH TYR 26 HH TYR 26 33.931 3.980 1.451 129 H TYR 27 HN TYR 27 41.061 1.279 3.520 130 HA TYR 27 HA TYR 27 39.051 -0.843 3.007 131 HB2 TYR 27 HB2 TYR 27 41.365 -0.661 4.957 132 HB3 TYR 27 HB1 TYR 27 40.242 -2.019 4.888 133 HD1 TYR 27 HD1 TYR 27 40.140 -3.472 2.885 134 HD2 TYR 27 HD2 TYR 27 43.033 -0.320 3.241 135 HE1 TYR 27 HE1 TYR 27 41.450 -4.462 1.029 136 HE2 TYR 27 HE2 TYR 27 44.339 -1.307 1.383 137 HH TYR 27 HH TYR 27 44.594 -3.133 0.083 138 H ILE 28 HN ILE 28 37.547 -1.441 4.701 139 HA ILE 28 HA ILE 28 37.138 0.715 6.706 140 HB ILE 28 HB ILE 28 35.329 1.179 5.445 141 HG12 ILE 28 HG12 ILE 28 33.331 -0.007 6.142 142 HG13 ILE 28 HG11 ILE 28 34.284 -1.419 6.603 143 HG21 ILE 28 HG21 ILE 28 34.366 -0.332 3.791 144 HG22 ILE 28 HG22 ILE 28 35.286 -1.682 4.452 145 HG23 ILE 28 HG23 ILE 28 36.123 -0.355 3.646 146 HD11 ILE 28 HD11 ILE 28 34.657 -0.544 8.627 147 HD12 ILE 28 HD12 ILE 28 33.622 0.816 8.208 148 HD13 ILE 28 HD13 ILE 28 35.357 0.902 7.905 149 H ASN 29 HN ASN 29 37.112 0.022 8.767 150 HA ASN 29 HA ASN 29 36.784 -2.904 9.249 151 HB2 ASN 29 HB2 ASN 29 38.889 -1.891 10.052 152 HB3 ASN 29 HB1 ASN 29 37.963 -0.751 11.029 153 HD21 ASN 29 HD21 ASN 29 38.666 -1.565 13.096 154 HD22 ASN 29 HD22 ASN 29 38.248 -3.112 13.654 155 H HIS 30 HN HIS 30 34.629 -3.283 9.613 156 HA HIS 30 HA HIS 30 32.832 -1.398 10.816 157 HB2 HIS 30 HB2 HIS 30 32.634 -4.413 10.550 158 HB3 HIS 30 HB1 HIS 30 31.304 -3.358 11.031 159 HD1 HIS 30 HD1 HIS 30 31.078 -1.196 9.170 160 HD2 HIS 30 HD2 HIS 30 32.539 -4.869 7.833 161 HE1 HIS 30 HE1 HIS 30 30.786 -1.213 6.652 162 HE2 HIS 30 HE2 HIS 30 31.669 -3.443 5.829 163 H LYS 31 HN LYS 31 35.319 -3.216 12.173 164 HA LYS 31 HA LYS 31 34.038 -3.672 14.768 165 HB2 LYS 31 HB2 LYS 31 36.800 -4.084 13.649 166 HB3 LYS 31 HB1 LYS 31 36.538 -4.141 15.392 167 HG2 LYS 31 HG2 LYS 31 34.524 -5.669 13.930 168 HG3 LYS 31 HG1 LYS 31 36.159 -6.254 13.617 169 HD2 LYS 31 HD2 LYS 31 35.281 -5.654 16.432 170 HD3 LYS 31 HD1 LYS 31 34.866 -7.196 15.682 171 HE2 LYS 31 HE2 LYS 31 37.250 -6.638 16.974 172 HE3 LYS 31 HE1 LYS 31 36.987 -7.968 15.845 173 HZ1 LYS 31 HZ1 LYS 31 37.808 -5.244 15.009 174 HZ2 LYS 31 HZ2 LYS 31 37.765 -6.648 14.053 175 HZ3 LYS 31 HZ3 LYS 31 38.906 -6.502 15.303 176 H ASN 32 HN ASN 32 36.545 -1.521 13.459 177 HA ASN 32 HA ASN 32 36.349 0.132 15.915 178 HB2 ASN 32 HB2 ASN 32 38.344 0.079 13.636 179 HB3 ASN 32 HB1 ASN 32 38.354 1.313 14.896 180 HD21 ASN 32 HD21 ASN 32 40.597 0.247 15.308 181 HD22 ASN 32 HD22 ASN 32 40.630 -1.087 16.358 182 H LYS 33 HN LYS 33 34.452 -0.069 13.486 183 HA LYS 33 HA LYS 33 33.357 1.392 11.995 184 HB2 LYS 33 HB2 LYS 33 32.951 3.655 13.429 185 HB3 LYS 33 HB1 LYS 33 32.044 2.167 13.693 186 HG2 LYS 33 HG2 LYS 33 33.772 1.496 15.392 187 HG3 LYS 33 HG1 LYS 33 34.496 3.095 15.212 188 HD2 LYS 33 HD2 LYS 33 31.827 3.688 15.586 189 HD3 LYS 33 HD1 LYS 33 32.064 2.300 16.647 190 HE2 LYS 33 HE2 LYS 33 34.216 3.551 17.416 191 HE3 LYS 33 HE1 LYS 33 33.450 4.972 16.704 192 HZ1 LYS 33 HZ1 LYS 33 32.816 3.577 19.129 193 HZ2 LYS 33 HZ2 LYS 33 31.455 3.832 18.145 194 HZ3 LYS 33 HZ3 LYS 33 32.404 5.149 18.646 195 H THR 34 HN THR 34 36.166 1.430 11.602 196 HA THR 34 HA THR 34 36.475 4.203 10.608 197 HB THR 34 HB THR 34 39.052 3.453 11.363 198 HG1 THR 34 HG1 THR 34 38.667 2.034 12.868 199 HG21 THR 34 HG21 THR 34 38.554 5.179 13.236 200 HG22 THR 34 HG22 THR 34 36.962 5.297 12.486 201 HG23 THR 34 HG23 THR 34 38.407 5.699 11.558 202 H THR 35 HN THR 35 38.319 4.291 8.966 203 HA THR 35 HA THR 35 38.422 1.710 7.503 204 HB THR 35 HB THR 35 39.076 3.415 5.579 205 HG1 THR 35 HG1 THR 35 37.461 5.245 6.187 206 HG21 THR 35 HG21 THR 35 36.419 2.593 6.670 207 HG22 THR 35 HG22 THR 35 37.174 2.178 5.130 208 HG23 THR 35 HG23 THR 35 36.449 3.763 5.357 209 H SER 36 HN SER 36 40.439 1.327 6.266 210 HA SER 36 HA SER 36 42.802 2.726 7.449 211 HB2 SER 36 HB2 SER 36 42.710 -0.268 7.047 212 HB3 SER 36 HB1 SER 36 43.924 0.670 7.912 213 HG SER 36 HG SER 36 42.161 -0.458 9.146 214 H TRP 37 HN TRP 37 44.527 2.987 6.007 215 HA TRP 37 HA TRP 37 43.909 2.682 3.184 216 HB2 TRP 37 HB2 TRP 37 46.501 3.449 4.555 217 HB3 TRP 37 HB1 TRP 37 46.178 3.605 2.829 218 HD1 TRP 37 HD1 TRP 37 46.087 5.560 5.877 219 HE1 TRP 37 HE1 TRP 37 44.604 7.653 5.619 220 HE3 TRP 37 HE3 TRP 37 43.592 4.351 1.582 221 HZ2 TRP 37 HZ2 TRP 37 42.624 8.679 3.828 222 HZ3 TRP 37 HZ3 TRP 37 41.919 5.906 0.625 223 HH2 TRP 37 HH2 TRP 37 41.430 8.065 1.741 224 H LEU 38 HN LEU 38 46.548 1.362 5.193 225 HA LEU 38 HA LEU 38 47.379 -0.558 3.229 226 HB2 LEU 38 HB2 LEU 38 47.795 -0.368 6.219 227 HB3 LEU 38 HB1 LEU 38 48.489 -1.668 5.250 228 HG LEU 38 HG LEU 38 49.048 0.744 3.871 229 HD11 LEU 38 HD11 LEU 38 48.596 1.944 5.973 230 HD12 LEU 38 HD12 LEU 38 50.317 1.991 5.592 231 HD13 LEU 38 HD13 LEU 38 49.718 0.885 6.827 232 HD21 LEU 38 HD21 LEU 38 50.761 -1.088 5.582 233 HD22 LEU 38 HD22 LEU 38 51.401 0.116 4.462 234 HD23 LEU 38 HD23 LEU 38 50.460 -1.245 3.850 235 H ASP 39 HN ASP 39 47.092 -2.913 3.362 236 HA ASP 39 HA ASP 39 44.400 -3.602 4.410 237 HB2 ASP 39 HB2 ASP 39 45.493 -5.693 2.794 238 HB3 ASP 39 HB1 ASP 39 44.120 -4.646 2.438 239 HA PRO 40 HA PRO 40 46.353 -6.074 7.532 240 HB2 PRO 40 HB2 PRO 40 44.204 -7.631 8.203 241 HB3 PRO 40 HB1 PRO 40 44.372 -5.935 8.698 242 HG2 PRO 40 HG2 PRO 40 42.750 -7.118 6.505 243 HG3 PRO 40 HG1 PRO 40 42.367 -5.779 7.600 244 HD2 PRO 40 HD2 PRO 40 43.203 -5.412 5.006 245 HD3 PRO 40 HD1 PRO 40 43.472 -4.223 6.300 246 H ARG 41 HN ARG 41 44.031 -8.223 5.850 247 HA ARG 41 HA ARG 41 46.311 -10.081 5.358 248 HB2 ARG 41 HB2 ARG 41 44.372 -11.833 5.308 249 HB3 ARG 41 HB1 ARG 41 44.950 -11.247 6.868 250 HG2 ARG 41 HG2 ARG 41 42.918 -9.469 5.830 251 HG3 ARG 41 HG1 ARG 41 42.310 -11.123 5.878 252 HD2 ARG 41 HD2 ARG 41 42.080 -9.648 8.018 253 HD3 ARG 41 HD1 ARG 41 42.632 -11.313 8.193 254 HE ARG 41 HE ARG 41 44.749 -9.281 7.893 255 HH11 ARG 41 HH11 ARG 41 46.176 -9.183 9.643 256 HH12 ARG 41 HH12 ARG 41 45.794 -10.031 11.104 257 HH21 ARG 41 HH21 ARG 41 42.793 -11.287 9.902 258 HH22 ARG 41 HH22 ARG 41 43.878 -11.221 11.251 259 H LEU 42 HN LEU 42 45.717 -8.074 3.497 260 HA LEU 42 HA LEU 42 44.929 -9.733 1.196 261 HB2 LEU 42 HB2 LEU 42 43.046 -8.054 2.380 262 HB3 LEU 42 HB1 LEU 42 43.664 -7.109 1.024 263 HG LEU 42 HG LEU 42 42.449 -9.879 0.936 264 HD11 LEU 42 HD11 LEU 42 41.716 -7.455 -0.701 265 HD12 LEU 42 HD12 LEU 42 41.059 -7.686 0.919 266 HD13 LEU 42 HD13 LEU 42 40.738 -8.877 -0.342 267 HD21 LEU 42 HD21 LEU 42 43.977 -10.247 -0.717 268 HD22 LEU 42 HD22 LEU 42 44.368 -8.535 -0.865 269 HD23 LEU 42 HD23 LEU 42 42.939 -9.185 -1.668 270 H ASP 43 HN ASP 43 47.239 -9.425 0.765 271 HA ASP 43 HA ASP 43 48.998 -8.356 -0.362 272 HB2 ASP 43 HB2 ASP 43 47.030 -7.865 -1.945 273 HB3 ASP 43 HB1 ASP 43 46.980 -6.268 -1.198 274 HA PRO 44 HA PRO 44 48.876 -5.132 3.092 275 HB2 PRO 44 HB2 PRO 44 50.629 -6.389 4.780 276 HB3 PRO 44 HB1 PRO 44 48.872 -6.626 4.842 277 HG2 PRO 44 HG2 PRO 44 50.977 -8.361 3.664 278 HG3 PRO 44 HG1 PRO 44 49.494 -8.805 4.525 279 HD2 PRO 44 HD2 PRO 44 49.745 -8.910 1.788 280 HD3 PRO 44 HD1 PRO 44 48.194 -8.680 2.624 281 H ARG 45 HN ARG 45 50.282 -4.870 0.712 282 HA ARG 45 HA ARG 45 52.729 -3.591 1.633 283 HB2 ARG 45 HB2 ARG 45 52.828 -6.295 0.539 284 HB3 ARG 45 HB1 ARG 45 53.790 -5.164 -0.414 285 HG2 ARG 45 HG2 ARG 45 53.975 -5.240 2.598 286 HG3 ARG 45 HG1 ARG 45 54.958 -6.298 1.586 287 HD2 ARG 45 HD2 ARG 45 55.754 -4.250 0.353 288 HD3 ARG 45 HD1 ARG 45 54.915 -3.270 1.554 289 HE ARG 45 HE ARG 45 56.866 -5.234 2.591 290 HH11 ARG 45 HH11 ARG 45 58.515 -4.306 3.824 291 HH12 ARG 45 HH12 ARG 45 58.699 -2.584 3.845 292 HH21 ARG 45 HH21 ARG 45 56.032 -2.008 1.705 293 HH22 ARG 45 HH22 ARG 45 57.293 -1.282 2.645 294 H GLY 46 HN GLY 46 53.417 -2.035 0.133 295 HA2 GLY 46 HA2 GLY 46 53.258 -0.622 -1.734 296 HA3 GLY 46 HA1 GLY 46 52.755 -2.045 -2.648 297 H GLY 47 HN GLY 47 51.228 -0.552 -3.736 298 HA2 GLY 47 HA2 GLY 47 48.929 -0.063 -4.049 299 HA3 GLY 47 HA1 GLY 47 48.624 -0.597 -2.396 300 H GLY 48 HN GLY 48 47.854 1.057 -1.185 301 HA2 GLY 48 HA2 GLY 48 47.658 3.198 -0.245 302 HA3 GLY 48 HA1 GLY 48 49.315 3.484 -0.778 303 H GLY 49 HN GLY 49 48.993 5.562 -1.622 304 HA2 GLY 49 HA2 GLY 49 48.439 6.038 -4.236 305 HA3 GLY 49 HA1 GLY 49 46.816 6.032 -3.544 306 H ASN 50 HN ASN 50 46.951 7.347 -1.244 307 HA ASN 50 HA ASN 50 48.671 9.651 -1.195 308 HB2 ASN 50 HB2 ASN 50 47.071 10.050 -3.213 309 HB3 ASN 50 HB1 ASN 50 45.846 10.349 -1.979 310 HD21 ASN 50 HD21 ASN 50 47.657 12.123 -3.933 311 HD22 ASN 50 HD22 ASN 50 48.118 13.399 -2.913 312 H ARG 51 HN ARG 51 48.003 11.168 0.552 313 HA ARG 51 HA ARG 51 47.088 11.624 2.668 314 HB2 ARG 51 HB2 ARG 51 44.949 10.670 1.173 315 HB3 ARG 51 HB1 ARG 51 44.948 9.627 2.596 316 HG2 ARG 51 HG2 ARG 51 43.586 11.594 3.055 317 HG3 ARG 51 HG1 ARG 51 45.049 11.666 4.038 318 HD2 ARG 51 HD2 ARG 51 45.829 13.506 2.960 319 HD3 ARG 51 HD1 ARG 51 45.324 12.906 1.380 320 HE ARG 51 HE ARG 51 42.928 13.572 2.434 321 HH11 ARG 51 HH11 ARG 51 42.030 15.645 2.515 322 HH12 ARG 51 HH12 ARG 51 43.074 17.026 2.561 323 HH21 ARG 51 HH21 ARG 51 45.992 15.154 2.477 324 HH22 ARG 51 HH22 ARG 51 45.318 16.747 2.539 325 H GLN 52 HN GLN 52 48.540 10.803 4.127 326 HA GLN 52 HA GLN 52 49.021 7.946 4.395 327 HB2 GLN 52 HB2 GLN 52 50.231 10.386 5.322 328 HB3 GLN 52 HB1 GLN 52 49.963 9.315 6.699 329 HG2 GLN 52 HG2 GLN 52 51.213 8.337 4.127 330 HG3 GLN 52 HG1 GLN 52 52.177 9.014 5.440 331 HE21 GLN 52 HE21 GLN 52 52.462 7.737 7.356 332 HE22 GLN 52 HE22 GLN 52 51.889 6.144 7.489 333 HA PRO 53 HA PRO 53 46.529 8.483 8.439 334 HB2 PRO 53 HB2 PRO 53 45.350 10.869 8.977 335 HB3 PRO 53 HB1 PRO 53 47.041 10.524 9.391 336 HG2 PRO 53 HG2 PRO 53 45.927 12.121 7.152 337 HG3 PRO 53 HG1 PRO 53 47.403 12.371 8.097 338 HD2 PRO 53 HD2 PRO 53 47.315 11.243 5.548 339 HD3 PRO 53 HD1 PRO 53 48.657 11.060 6.696 340 HA PRO 54 HA PRO 54 42.764 7.918 5.994 341 HB2 PRO 54 HB2 PRO 54 41.834 5.773 7.371 342 HB3 PRO 54 HB1 PRO 54 43.156 5.650 6.194 343 HG2 PRO 54 HG2 PRO 54 43.258 5.679 9.158 344 HG3 PRO 54 HG1 PRO 54 44.264 4.797 7.998 345 HD2 PRO 54 HD2 PRO 54 45.015 7.151 9.300 346 HD3 PRO 54 HD1 PRO 54 45.763 6.520 7.817 347 HA PRO 55 HA PRO 55 40.155 10.163 8.896 348 HB2 PRO 55 HB2 PRO 55 38.145 10.727 7.144 349 HB3 PRO 55 HB1 PRO 55 39.690 11.597 7.150 350 HG2 PRO 55 HG2 PRO 55 38.733 9.451 5.336 351 HG3 PRO 55 HG1 PRO 55 39.732 10.870 4.984 352 HD2 PRO 55 HD2 PRO 55 40.731 8.307 5.302 353 HD3 PRO 55 HD1 PRO 55 41.684 9.788 5.534 354 HA PRO 56 HA PRO 56 37.139 7.235 10.241 355 HB2 PRO 56 HB2 PRO 56 35.085 8.865 11.072 356 HB3 PRO 56 HB1 PRO 56 36.581 8.610 11.989 357 HG2 PRO 56 HG2 PRO 56 35.784 10.890 10.262 358 HG3 PRO 56 HG1 PRO 56 36.717 10.882 11.767 359 HD2 PRO 56 HD2 PRO 56 37.868 11.145 9.290 360 HD3 PRO 56 HD1 PRO 56 38.710 10.438 10.687 361 H TYR 57 HN TYR 57 36.113 5.994 8.725 362 HA TYR 57 HA TYR 57 34.614 7.096 6.525 363 HB2 TYR 57 HB2 TYR 57 34.679 4.972 5.748 364 HB3 TYR 57 HB1 TYR 57 35.708 4.631 7.139 365 HD1 TYR 57 HD1 TYR 57 34.484 4.060 9.380 366 HD2 TYR 57 HD2 TYR 57 32.647 3.839 5.504 367 HE1 TYR 57 HE1 TYR 57 32.752 2.538 10.286 368 HE2 TYR 57 HE2 TYR 57 30.914 2.316 6.411 369 HH TYR 57 HH TYR 57 31.053 0.579 8.776 370 HA PRO 58 HA PRO 58 30.874 7.710 8.915 371 HB2 PRO 58 HB2 PRO 58 29.376 8.770 6.907 372 HB3 PRO 58 HB1 PRO 58 30.650 9.684 7.736 373 HG2 PRO 58 HG2 PRO 58 30.696 8.360 5.078 374 HG3 PRO 58 HG1 PRO 58 31.436 9.882 5.597 375 HD2 PRO 58 HD2 PRO 58 32.815 7.493 5.327 376 HD3 PRO 58 HD1 PRO 58 33.338 8.843 6.359 377 H LEU 59 HN LEU 59 29.048 6.445 9.256 378 HA LEU 59 HA LEU 59 28.714 4.052 7.642 379 HB2 LEU 59 HB2 LEU 59 27.600 5.150 10.146 380 HB3 LEU 59 HB1 LEU 59 26.474 4.158 9.220 381 HG LEU 59 HG LEU 59 29.289 3.208 9.699 382 HD11 LEU 59 HD11 LEU 59 28.216 1.913 11.655 383 HD12 LEU 59 HD12 LEU 59 26.937 3.124 11.592 384 HD13 LEU 59 HD13 LEU 59 28.597 3.612 11.932 385 HD21 LEU 59 HD21 LEU 59 28.122 1.000 9.516 386 HD22 LEU 59 HD22 LEU 59 27.938 1.992 8.069 387 HD23 LEU 59 HD23 LEU 59 26.611 1.861 9.223 388 H THR 60 HN THR 60 28.414 5.929 5.788 389 HA THR 60 HA THR 60 25.504 6.493 5.513 390 HB THR 60 HB THR 60 26.454 7.787 3.429 391 HG1 THR 60 HG1 THR 60 28.697 8.404 4.649 392 HG21 THR 60 HG21 THR 60 25.464 8.826 5.442 393 HG22 THR 60 HG22 THR 60 26.850 9.746 4.857 394 HG23 THR 60 HG23 THR 60 27.020 8.698 6.264 395 H ALA 61 HN ALA 61 24.924 4.287 4.973 396 HA ALA 61 HA ALA 61 25.749 3.531 2.198 397 HB1 ALA 61 HB1 ALA 61 25.199 1.127 3.087 398 HB2 ALA 61 HB2 ALA 61 25.468 1.847 4.674 399 HB3 ALA 61 HB3 ALA 61 26.761 1.849 3.475 Start of MODEL 18 1 H1 SER 8 HT1 SER 8 36.591 -9.231 -3.172 2 H2 SER 8 HT2 SER 8 35.773 -9.940 -1.862 3 H3 SER 8 HT3 SER 8 35.851 -8.249 -2.004 4 HA SER 8 HA SER 8 34.521 -8.323 -4.017 5 HB2 SER 8 HB2 SER 8 33.394 -10.607 -4.429 6 HB3 SER 8 HB1 SER 8 35.066 -10.432 -4.955 7 HG SER 8 HG SER 8 33.983 -12.044 -3.042 8 H GLY 9 HN GLY 9 34.452 -8.254 -0.935 9 HA2 GLY 9 HA2 GLY 9 31.941 -7.410 -0.383 10 HA3 GLY 9 HA1 GLY 9 31.705 -9.159 -0.373 11 HA PRO 10 HA PRO 10 32.532 -8.086 4.035 12 HB2 PRO 10 HB2 PRO 10 31.799 -10.982 4.119 13 HB3 PRO 10 HB1 PRO 10 31.256 -9.649 5.158 14 HG2 PRO 10 HG2 PRO 10 29.698 -10.664 3.243 15 HG3 PRO 10 HG1 PRO 10 29.676 -8.943 3.657 16 HD2 PRO 10 HD2 PRO 10 30.802 -10.277 1.251 17 HD3 PRO 10 HD1 PRO 10 30.197 -8.618 1.443 18 H LEU 11 HN LEU 11 34.665 -8.085 4.658 19 HA LEU 11 HA LEU 11 36.475 -10.179 3.672 20 HB2 LEU 11 HB2 LEU 11 36.706 -7.534 5.023 21 HB3 LEU 11 HB1 LEU 11 38.021 -8.664 5.290 22 HG LEU 11 HG LEU 11 36.965 -8.116 2.520 23 HD11 LEU 11 HD11 LEU 11 39.392 -6.727 2.867 24 HD12 LEU 11 HD12 LEU 11 38.387 -6.288 4.248 25 HD13 LEU 11 HD13 LEU 11 37.795 -6.031 2.607 26 HD21 LEU 11 HD21 LEU 11 38.473 -10.100 3.020 27 HD22 LEU 11 HD22 LEU 11 39.726 -8.941 3.455 28 HD23 LEU 11 HD23 LEU 11 39.097 -8.979 1.811 29 HA PRO 12 HA PRO 12 37.485 -12.860 7.141 30 HB2 PRO 12 HB2 PRO 12 38.488 -10.488 8.689 31 HB3 PRO 12 HB1 PRO 12 39.141 -12.139 8.621 32 HG2 PRO 12 HG2 PRO 12 40.017 -9.999 7.083 33 HG3 PRO 12 HG1 PRO 12 40.320 -11.708 6.744 34 HD2 PRO 12 HD2 PRO 12 38.808 -9.950 5.129 35 HD3 PRO 12 HD1 PRO 12 38.848 -11.716 4.982 36 H ASP 13 HN ASP 13 36.465 -9.701 8.504 37 HA ASP 13 HA ASP 13 33.842 -10.162 9.068 38 HB2 ASP 13 HB2 ASP 13 35.556 -11.928 10.704 39 HB3 ASP 13 HB1 ASP 13 34.315 -11.057 11.602 40 H GLY 14 HN GLY 14 33.473 -8.053 9.453 41 HA2 GLY 14 HA2 GLY 14 33.263 -6.352 11.219 42 HA3 GLY 14 HA1 GLY 14 34.867 -6.821 11.785 43 H TRP 15 HN TRP 15 35.009 -6.844 8.463 44 HA TRP 15 HA TRP 15 35.325 -3.967 8.082 45 HB2 TRP 15 HB2 TRP 15 37.649 -3.843 7.905 46 HB3 TRP 15 HB1 TRP 15 37.408 -4.866 9.316 47 HD1 TRP 15 HD1 TRP 15 37.403 -7.649 8.654 48 HE1 TRP 15 HE1 TRP 15 39.078 -8.846 7.114 49 HE3 TRP 15 HE3 TRP 15 39.169 -3.663 6.006 50 HZ2 TRP 15 HZ2 TRP 15 40.934 -8.202 5.033 51 HZ3 TRP 15 HZ3 TRP 15 40.885 -3.980 4.251 52 HH2 TRP 15 HH2 TRP 15 41.773 -6.244 3.759 53 H GLU 16 HN GLU 16 36.132 -3.456 5.842 54 HA GLU 16 HA GLU 16 36.057 -5.658 3.894 55 HB2 GLU 16 HB2 GLU 16 33.726 -3.906 4.424 56 HB3 GLU 16 HB1 GLU 16 34.147 -4.124 2.725 57 HG2 GLU 16 HG2 GLU 16 34.196 -6.614 3.146 58 HG3 GLU 16 HG1 GLU 16 33.536 -6.290 4.750 59 H GLN 17 HN GLN 17 36.771 -4.969 1.796 60 HA GLN 17 HA GLN 17 38.310 -2.462 1.850 61 HB2 GLN 17 HB2 GLN 17 39.613 -4.133 0.885 62 HB3 GLN 17 HB1 GLN 17 38.229 -4.893 0.097 63 HG2 GLN 17 HG2 GLN 17 38.101 -3.135 -1.546 64 HG3 GLN 17 HG1 GLN 17 39.298 -2.170 -0.683 65 HE21 GLN 17 HE21 GLN 17 41.234 -2.238 -1.832 66 HE22 GLN 17 HE22 GLN 17 41.891 -3.626 -2.553 67 H ALA 18 HN ALA 18 37.748 -0.637 0.668 68 HA ALA 18 HA ALA 18 35.690 -0.853 -1.428 69 HB1 ALA 18 HB1 ALA 18 35.272 0.516 1.214 70 HB2 ALA 18 HB2 ALA 18 34.165 -0.522 0.316 71 HB3 ALA 18 HB3 ALA 18 34.470 1.126 -0.233 72 H MET 19 HN MET 19 35.147 1.776 -1.873 73 HA MET 19 HA MET 19 37.830 3.035 -2.167 74 HB2 MET 19 HB2 MET 19 37.135 3.878 -4.358 75 HB3 MET 19 HB1 MET 19 36.990 2.120 -4.323 76 HG2 MET 19 HG2 MET 19 34.529 3.020 -3.364 77 HG3 MET 19 HG1 MET 19 34.912 4.135 -4.675 78 HE1 MET 19 HE1 MET 19 32.429 1.044 -5.526 79 HE2 MET 19 HE2 MET 19 32.483 2.762 -5.910 80 HE3 MET 19 HE3 MET 19 32.648 2.235 -4.237 81 H THR 20 HN THR 20 37.739 5.426 -2.352 82 HA THR 20 HA THR 20 35.616 6.498 -0.598 83 HB THR 20 HB THR 20 37.204 8.583 -0.821 84 HG1 THR 20 HG1 THR 20 39.368 7.777 -1.216 85 HG21 THR 20 HG21 THR 20 38.114 6.058 0.582 86 HG22 THR 20 HG22 THR 20 36.910 7.184 1.207 87 HG23 THR 20 HG23 THR 20 38.581 7.706 1.002 88 H GLN 21 HN GLN 21 35.737 9.207 -1.542 89 HA GLN 21 HA GLN 21 33.984 8.941 -3.885 90 HB2 GLN 21 HB2 GLN 21 34.282 10.803 -1.756 91 HB3 GLN 21 HB1 GLN 21 34.611 11.677 -3.253 92 HG2 GLN 21 HG2 GLN 21 32.496 10.900 -4.208 93 HG3 GLN 21 HG1 GLN 21 32.174 9.941 -2.764 94 HE21 GLN 21 HE21 GLN 21 32.994 11.811 -0.763 95 HE22 GLN 21 HE22 GLN 21 31.941 13.141 -0.804 96 H ASP 22 HN ASP 22 37.285 9.364 -3.303 97 HA ASP 22 HA ASP 22 37.677 10.566 -5.992 98 HB2 ASP 22 HB2 ASP 22 38.601 11.852 -4.025 99 HB3 ASP 22 HB1 ASP 22 39.666 10.481 -3.711 100 H GLY 23 HN GLY 23 37.260 7.731 -4.983 101 HA2 GLY 23 HA2 GLY 23 38.069 5.597 -5.500 102 HA3 GLY 23 HA1 GLY 23 38.879 6.376 -6.859 103 H GLU 24 HN GLU 24 39.402 6.942 -3.389 104 HA GLU 24 HA GLU 24 42.284 6.544 -3.797 105 HB2 GLU 24 HB2 GLU 24 40.909 7.114 -1.181 106 HB3 GLU 24 HB1 GLU 24 42.560 7.516 -1.655 107 HG2 GLU 24 HG2 GLU 24 41.160 8.811 -3.594 108 HG3 GLU 24 HG1 GLU 24 40.030 8.932 -2.245 109 H ILE 25 HN ILE 25 40.110 4.418 -3.717 110 HA ILE 25 HA ILE 25 39.691 2.342 -2.609 111 HB ILE 25 HB ILE 25 41.315 1.762 -4.297 112 HG12 ILE 25 HG12 ILE 25 42.468 -0.121 -3.155 113 HG13 ILE 25 HG11 ILE 25 42.057 0.596 -1.595 114 HG21 ILE 25 HG21 ILE 25 42.981 3.514 -3.688 115 HG22 ILE 25 HG22 ILE 25 43.717 1.928 -3.903 116 HG23 ILE 25 HG23 ILE 25 43.436 2.555 -2.280 117 HD11 ILE 25 HD11 ILE 25 39.906 -0.110 -1.702 118 HD12 ILE 25 HD12 ILE 25 40.492 -1.223 -2.938 119 HD13 ILE 25 HD13 ILE 25 39.760 0.309 -3.409 120 H TYR 26 HN TYR 26 39.202 2.316 -0.470 121 HA TYR 26 HA TYR 26 41.476 2.298 1.426 122 HB2 TYR 26 HB2 TYR 26 40.464 3.833 2.931 123 HB3 TYR 26 HB1 TYR 26 40.339 4.583 1.345 124 HD1 TYR 26 HD1 TYR 26 38.053 2.435 0.557 125 HD2 TYR 26 HD2 TYR 26 38.614 5.288 3.718 126 HE1 TYR 26 HE1 TYR 26 35.599 2.607 0.842 127 HE2 TYR 26 HE2 TYR 26 36.157 5.460 3.997 128 HH TYR 26 HH TYR 26 33.938 3.590 1.924 129 H TYR 27 HN TYR 27 40.813 1.354 3.571 130 HA TYR 27 HA TYR 27 38.771 -0.776 3.106 131 HB2 TYR 27 HB2 TYR 27 41.084 -0.734 5.068 132 HB3 TYR 27 HB1 TYR 27 39.973 -2.074 4.809 133 HD1 TYR 27 HD1 TYR 27 42.866 -2.488 4.523 134 HD2 TYR 27 HD2 TYR 27 39.995 -1.109 1.640 135 HE1 TYR 27 HE1 TYR 27 44.298 -3.332 2.684 136 HE2 TYR 27 HE2 TYR 27 41.425 -1.951 -0.191 137 HH TYR 27 HH TYR 27 43.341 -2.923 -0.728 138 H ILE 28 HN ILE 28 37.282 -1.243 4.785 139 HA ILE 28 HA ILE 28 37.062 0.892 6.843 140 HB ILE 28 HB ILE 28 35.224 1.470 5.693 141 HG12 ILE 28 HG12 ILE 28 33.195 0.236 6.288 142 HG13 ILE 28 HG11 ILE 28 34.158 -1.174 6.730 143 HG21 ILE 28 HG21 ILE 28 34.196 0.079 3.959 144 HG22 ILE 28 HG22 ILE 28 35.134 -1.313 4.500 145 HG23 ILE 28 HG23 ILE 28 35.950 0.073 3.775 146 HD11 ILE 28 HD11 ILE 28 34.255 -0.328 8.808 147 HD12 ILE 28 HD12 ILE 28 33.567 1.206 8.283 148 HD13 ILE 28 HD13 ILE 28 35.304 0.932 8.163 149 H ASN 29 HN ASN 29 36.951 0.186 8.911 150 HA ASN 29 HA ASN 29 36.579 -2.743 9.345 151 HB2 ASN 29 HB2 ASN 29 38.628 -1.288 10.196 152 HB3 ASN 29 HB1 ASN 29 37.510 -0.888 11.501 153 HD21 ASN 29 HD21 ASN 29 36.174 -3.619 11.186 154 HD22 ASN 29 HD22 ASN 29 37.242 -4.702 11.941 155 H HIS 30 HN HIS 30 34.414 -3.105 9.663 156 HA HIS 30 HA HIS 30 32.653 -1.191 10.921 157 HB2 HIS 30 HB2 HIS 30 32.340 -4.149 10.337 158 HB3 HIS 30 HB1 HIS 30 31.043 -3.128 10.960 159 HD1 HIS 30 HD1 HIS 30 31.126 -0.654 9.361 160 HD2 HIS 30 HD2 HIS 30 31.958 -4.347 7.611 161 HE1 HIS 30 HE1 HIS 30 30.751 -0.369 6.872 162 HE2 HIS 30 HE2 HIS 30 31.251 -2.612 5.797 163 H LYS 31 HN LYS 31 35.130 -2.675 12.314 164 HA LYS 31 HA LYS 31 33.687 -3.472 14.782 165 HB2 LYS 31 HB2 LYS 31 36.414 -4.038 13.669 166 HB3 LYS 31 HB1 LYS 31 36.163 -4.133 15.413 167 HG2 LYS 31 HG2 LYS 31 34.318 -5.534 13.477 168 HG3 LYS 31 HG1 LYS 31 35.801 -6.296 14.052 169 HD2 LYS 31 HD2 LYS 31 34.482 -5.195 16.324 170 HD3 LYS 31 HD1 LYS 31 33.275 -6.084 15.395 171 HE2 LYS 31 HE2 LYS 31 34.236 -7.713 16.823 172 HE3 LYS 31 HE1 LYS 31 35.023 -7.974 15.267 173 HZ1 LYS 31 HZ1 LYS 31 36.422 -7.771 17.438 174 HZ2 LYS 31 HZ2 LYS 31 36.236 -6.103 17.174 175 HZ3 LYS 31 HZ3 LYS 31 36.977 -7.076 15.994 176 H ASN 32 HN ASN 32 36.037 -1.180 13.519 177 HA ASN 32 HA ASN 32 35.997 0.209 16.155 178 HB2 ASN 32 HB2 ASN 32 38.253 -0.499 15.535 179 HB3 ASN 32 HB1 ASN 32 38.085 0.269 13.956 180 HD21 ASN 32 HD21 ASN 32 36.933 1.655 17.042 181 HD22 ASN 32 HD22 ASN 32 37.986 2.986 17.023 182 H LYS 33 HN LYS 33 34.306 0.314 13.503 183 HA LYS 33 HA LYS 33 33.293 1.988 12.197 184 HB2 LYS 33 HB2 LYS 33 33.531 2.969 14.970 185 HB3 LYS 33 HB1 LYS 33 33.287 4.236 13.767 186 HG2 LYS 33 HG2 LYS 33 31.201 3.447 13.153 187 HG3 LYS 33 HG1 LYS 33 31.588 1.783 13.589 188 HD2 LYS 33 HD2 LYS 33 31.332 2.226 15.918 189 HD3 LYS 33 HD1 LYS 33 31.325 3.970 15.658 190 HE2 LYS 33 HE2 LYS 33 29.223 2.169 14.449 191 HE3 LYS 33 HE1 LYS 33 29.042 2.864 16.060 192 HZ1 LYS 33 HZ1 LYS 33 28.817 4.951 15.240 193 HZ2 LYS 33 HZ2 LYS 33 28.195 4.098 13.910 194 HZ3 LYS 33 HZ3 LYS 33 29.797 4.663 13.886 195 H THR 34 HN THR 34 36.077 1.693 11.693 196 HA THR 34 HA THR 34 36.697 4.449 10.816 197 HB THR 34 HB THR 34 39.178 3.384 11.527 198 HG1 THR 34 HG1 THR 34 37.905 3.274 13.914 199 HG21 THR 34 HG21 THR 34 38.743 5.692 11.768 200 HG22 THR 34 HG22 THR 34 38.930 5.107 13.422 201 HG23 THR 34 HG23 THR 34 37.319 5.403 12.768 202 H THR 35 HN THR 35 38.475 4.417 9.139 203 HA THR 35 HA THR 35 38.372 1.865 7.620 204 HB THR 35 HB THR 35 39.082 3.608 5.722 205 HG1 THR 35 HG1 THR 35 39.074 5.355 7.195 206 HG21 THR 35 HG21 THR 35 36.390 2.858 6.811 207 HG22 THR 35 HG22 THR 35 37.161 2.349 5.308 208 HG23 THR 35 HG23 THR 35 36.494 3.968 5.451 209 H SER 36 HN SER 36 40.319 1.216 6.521 210 HA SER 36 HA SER 36 42.798 2.647 7.334 211 HB2 SER 36 HB2 SER 36 42.658 -0.338 7.673 212 HB3 SER 36 HB1 SER 36 43.788 0.805 8.393 213 HG SER 36 HG SER 36 41.012 0.887 8.922 214 H TRP 37 HN TRP 37 44.743 1.207 6.318 215 HA TRP 37 HA TRP 37 43.895 0.519 3.530 216 HB2 TRP 37 HB2 TRP 37 46.641 1.570 4.147 217 HB3 TRP 37 HB1 TRP 37 45.737 1.643 2.635 218 HD1 TRP 37 HD1 TRP 37 46.110 3.375 6.004 219 HE1 TRP 37 HE1 TRP 37 44.910 5.655 5.911 220 HE3 TRP 37 HE3 TRP 37 43.779 2.957 1.477 221 HZ2 TRP 37 HZ2 TRP 37 43.187 7.108 4.145 222 HZ3 TRP 37 HZ3 TRP 37 42.368 4.803 0.616 223 HH2 TRP 37 HH2 TRP 37 42.069 6.875 1.944 224 H LEU 38 HN LEU 38 45.723 -0.330 6.350 225 HA LEU 38 HA LEU 38 47.692 -2.050 5.673 226 HB2 LEU 38 HB2 LEU 38 46.238 -1.785 7.918 227 HB3 LEU 38 HB1 LEU 38 45.603 -3.334 7.364 228 HG LEU 38 HG LEU 38 48.165 -3.888 6.992 229 HD11 LEU 38 HD11 LEU 38 48.418 -2.077 9.379 230 HD12 LEU 38 HD12 LEU 38 48.626 -1.417 7.757 231 HD13 LEU 38 HD13 LEU 38 49.682 -2.710 8.324 232 HD21 LEU 38 HD21 LEU 38 48.161 -4.448 9.598 233 HD22 LEU 38 HD22 LEU 38 47.088 -5.297 8.486 234 HD23 LEU 38 HD23 LEU 38 46.471 -3.962 9.461 235 H ASP 39 HN ASP 39 47.970 -3.832 4.398 236 HA ASP 39 HA ASP 39 45.524 -5.045 3.210 237 HB2 ASP 39 HB2 ASP 39 47.171 -5.812 1.407 238 HB3 ASP 39 HB1 ASP 39 46.840 -4.081 1.470 239 HA PRO 40 HA PRO 40 47.182 -8.449 5.744 240 HB2 PRO 40 HB2 PRO 40 44.786 -9.673 6.158 241 HB3 PRO 40 HB1 PRO 40 45.327 -8.270 7.101 242 HG2 PRO 40 HG2 PRO 40 43.365 -8.419 4.884 243 HG3 PRO 40 HG1 PRO 40 43.379 -7.380 6.318 244 HD2 PRO 40 HD2 PRO 40 44.151 -6.578 3.762 245 HD3 PRO 40 HD1 PRO 40 44.606 -5.754 5.270 246 H ARG 41 HN ARG 41 44.434 -9.234 3.570 247 HA ARG 41 HA ARG 41 46.206 -11.195 2.208 248 HB2 ARG 41 HB2 ARG 41 44.282 -12.794 2.152 249 HB3 ARG 41 HB1 ARG 41 44.867 -12.482 3.786 250 HG2 ARG 41 HG2 ARG 41 42.996 -10.483 3.433 251 HG3 ARG 41 HG1 ARG 41 42.266 -11.845 2.582 252 HD2 ARG 41 HD2 ARG 41 41.688 -11.726 5.038 253 HD3 ARG 41 HD1 ARG 41 42.425 -13.248 4.538 254 HE ARG 41 HE ARG 41 44.348 -11.269 5.518 255 HH11 ARG 41 HH11 ARG 41 45.411 -11.843 7.428 256 HH12 ARG 41 HH12 ARG 41 44.806 -13.158 8.379 257 HH21 ARG 41 HH21 ARG 41 42.162 -13.835 6.240 258 HH22 ARG 41 HH22 ARG 41 42.966 -14.286 7.707 259 H LEU 42 HN LEU 42 45.820 -8.799 1.054 260 HA LEU 42 HA LEU 42 43.963 -9.442 -1.167 261 HB2 LEU 42 HB2 LEU 42 43.153 -7.676 0.691 262 HB3 LEU 42 HB1 LEU 42 44.105 -6.591 -0.321 263 HG LEU 42 HG LEU 42 41.842 -6.574 -1.164 264 HD11 LEU 42 HD11 LEU 42 43.252 -8.476 -3.024 265 HD12 LEU 42 HD12 LEU 42 43.898 -6.857 -2.750 266 HD13 LEU 42 HD13 LEU 42 42.279 -7.059 -3.419 267 HD21 LEU 42 HD21 LEU 42 41.747 -9.175 -0.197 268 HD22 LEU 42 HD22 LEU 42 41.710 -9.397 -1.946 269 HD23 LEU 42 HD23 LEU 42 40.491 -8.394 -1.158 270 H ASP 43 HN ASP 43 46.235 -9.998 -1.975 271 HA ASP 43 HA ASP 43 48.131 -9.451 -3.253 272 HB2 ASP 43 HB2 ASP 43 45.897 -7.804 -4.136 273 HB3 ASP 43 HB1 ASP 43 47.442 -6.999 -4.414 274 HA PRO 44 HA PRO 44 49.829 -6.828 0.135 275 HB2 PRO 44 HB2 PRO 44 52.270 -8.004 -1.122 276 HB3 PRO 44 HB1 PRO 44 51.836 -7.869 0.594 277 HG2 PRO 44 HG2 PRO 44 51.667 -10.185 -0.723 278 HG3 PRO 44 HG1 PRO 44 50.518 -9.739 0.550 279 HD2 PRO 44 HD2 PRO 44 50.107 -9.843 -2.397 280 HD3 PRO 44 HD1 PRO 44 48.927 -10.045 -1.083 281 H ARG 45 HN ARG 45 49.003 -5.183 -1.685 282 HA ARG 45 HA ARG 45 50.886 -4.235 -3.632 283 HB2 ARG 45 HB2 ARG 45 48.638 -3.567 -3.963 284 HB3 ARG 45 HB1 ARG 45 48.473 -3.004 -2.300 285 HG2 ARG 45 HG2 ARG 45 48.741 -1.153 -3.997 286 HG3 ARG 45 HG1 ARG 45 49.946 -1.137 -2.710 287 HD2 ARG 45 HD2 ARG 45 51.654 -1.844 -4.109 288 HD3 ARG 45 HD1 ARG 45 50.551 -2.678 -5.204 289 HE ARG 45 HE ARG 45 50.475 -0.689 -6.450 290 HH11 ARG 45 HH11 ARG 45 50.680 1.543 -6.746 291 HH12 ARG 45 HH12 ARG 45 51.061 2.551 -5.391 292 HH21 ARG 45 HH21 ARG 45 51.189 -0.077 -3.133 293 HH22 ARG 45 HH22 ARG 45 51.348 1.635 -3.345 294 H GLY 46 HN GLY 46 52.840 -3.374 -3.129 295 HA2 GLY 46 HA2 GLY 46 54.183 -1.583 -2.221 296 HA3 GLY 46 HA1 GLY 46 52.975 -1.356 -0.955 297 H GLY 47 HN GLY 47 55.831 -1.697 -0.538 298 HA2 GLY 47 HA2 GLY 47 56.083 -4.437 0.554 299 HA3 GLY 47 HA1 GLY 47 57.375 -3.239 0.468 300 H GLY 48 HN GLY 48 56.888 -1.205 1.878 301 HA2 GLY 48 HA2 GLY 48 56.145 -2.211 4.567 302 HA3 GLY 48 HA1 GLY 48 57.025 -0.718 4.236 303 H GLY 49 HN GLY 49 54.783 -0.779 5.957 304 HA2 GLY 49 HA2 GLY 49 52.348 -0.043 4.615 305 HA3 GLY 49 HA1 GLY 49 52.718 0.285 6.309 306 H ASN 50 HN ASN 50 51.388 2.191 4.739 307 HA ASN 50 HA ASN 50 52.979 4.517 5.189 308 HB2 ASN 50 HB2 ASN 50 53.769 3.211 2.879 309 HB3 ASN 50 HB1 ASN 50 52.635 4.419 2.276 310 HD21 ASN 50 HD21 ASN 50 55.665 4.016 4.111 311 HD22 ASN 50 HD22 ASN 50 56.176 5.626 3.940 312 H ARG 51 HN ARG 51 51.785 5.871 2.754 313 HA ARG 51 HA ARG 51 49.717 6.792 2.080 314 HB2 ARG 51 HB2 ARG 51 49.007 4.247 2.859 315 HB3 ARG 51 HB1 ARG 51 48.038 5.248 3.942 316 HG2 ARG 51 HG2 ARG 51 46.799 4.817 1.869 317 HG3 ARG 51 HG1 ARG 51 47.209 6.529 1.983 318 HD2 ARG 51 HD2 ARG 51 47.787 4.837 -0.162 319 HD3 ARG 51 HD1 ARG 51 48.468 6.440 0.114 320 HE ARG 51 HE ARG 51 50.086 4.824 1.642 321 HH11 ARG 51 HH11 ARG 51 51.926 3.782 0.844 322 HH12 ARG 51 HH12 ARG 51 52.029 3.406 -0.844 323 HH21 ARG 51 HH21 ARG 51 48.928 4.759 -1.605 324 HH22 ARG 51 HH22 ARG 51 50.332 3.959 -2.230 325 H GLN 52 HN GLN 52 48.280 8.407 2.965 326 HA GLN 52 HA GLN 52 49.225 9.474 5.527 327 HB2 GLN 52 HB2 GLN 52 47.368 10.436 3.365 328 HB3 GLN 52 HB1 GLN 52 47.375 11.233 4.939 329 HG2 GLN 52 HG2 GLN 52 49.819 10.804 3.194 330 HG3 GLN 52 HG1 GLN 52 48.940 12.326 3.353 331 HE21 GLN 52 HE21 GLN 52 48.619 12.931 5.867 332 HE22 GLN 52 HE22 GLN 52 50.018 12.772 6.813 333 HA PRO 53 HA PRO 53 46.327 7.776 8.359 334 HB2 PRO 53 HB2 PRO 53 45.645 10.618 9.000 335 HB3 PRO 53 HB1 PRO 53 46.071 9.287 10.093 336 HG2 PRO 53 HG2 PRO 53 47.811 11.224 9.432 337 HG3 PRO 53 HG1 PRO 53 48.312 9.562 9.776 338 HD2 PRO 53 HD2 PRO 53 48.276 10.994 7.193 339 HD3 PRO 53 HD1 PRO 53 49.177 9.536 7.662 340 HA PRO 54 HA PRO 54 42.560 8.199 5.941 341 HB2 PRO 54 HB2 PRO 54 41.253 6.074 7.009 342 HB3 PRO 54 HB1 PRO 54 42.589 5.887 5.856 343 HG2 PRO 54 HG2 PRO 54 42.579 5.566 8.810 344 HG3 PRO 54 HG1 PRO 54 43.453 4.648 7.574 345 HD2 PRO 54 HD2 PRO 54 44.585 6.650 9.128 346 HD3 PRO 54 HD1 PRO 54 45.220 6.110 7.559 347 HA PRO 55 HA PRO 55 40.158 10.427 9.017 348 HB2 PRO 55 HB2 PRO 55 38.255 11.386 7.316 349 HB3 PRO 55 HB1 PRO 55 39.893 12.062 7.408 350 HG2 PRO 55 HG2 PRO 55 38.716 10.217 5.400 351 HG3 PRO 55 HG1 PRO 55 39.879 11.536 5.183 352 HD2 PRO 55 HD2 PRO 55 40.571 8.856 5.268 353 HD3 PRO 55 HD1 PRO 55 41.684 10.190 5.643 354 HA PRO 56 HA PRO 56 37.069 7.579 10.406 355 HB2 PRO 56 HB2 PRO 56 35.346 10.005 10.673 356 HB3 PRO 56 HB1 PRO 56 35.691 8.730 11.857 357 HG2 PRO 56 HG2 PRO 56 36.848 11.158 11.959 358 HG3 PRO 56 HG1 PRO 56 37.654 9.683 12.515 359 HD2 PRO 56 HD2 PRO 56 38.239 11.334 10.139 360 HD3 PRO 56 HD1 PRO 56 39.266 10.142 10.963 361 H TYR 57 HN TYR 57 36.166 6.354 8.791 362 HA TYR 57 HA TYR 57 34.901 7.441 6.457 363 HB2 TYR 57 HB2 TYR 57 34.801 5.274 5.768 364 HB3 TYR 57 HB1 TYR 57 35.833 4.978 7.167 365 HD1 TYR 57 HD1 TYR 57 32.796 4.097 5.583 366 HD2 TYR 57 HD2 TYR 57 34.554 4.655 9.463 367 HE1 TYR 57 HE1 TYR 57 31.029 2.675 6.587 368 HE2 TYR 57 HE2 TYR 57 32.787 3.233 10.466 369 HH TYR 57 HH TYR 57 30.710 2.329 10.070 370 HA PRO 58 HA PRO 58 30.992 8.362 8.430 371 HB2 PRO 58 HB2 PRO 58 29.713 9.288 6.212 372 HB3 PRO 58 HB1 PRO 58 30.941 10.233 7.077 373 HG2 PRO 58 HG2 PRO 58 31.176 8.683 4.553 374 HG3 PRO 58 HG1 PRO 58 31.920 10.224 5.009 375 HD2 PRO 58 HD2 PRO 58 33.239 7.792 5.064 376 HD3 PRO 58 HD1 PRO 58 33.704 9.204 6.038 377 H LEU 59 HN LEU 59 29.741 6.600 8.962 378 HA LEU 59 HA LEU 59 29.218 4.271 7.654 379 HB2 LEU 59 HB2 LEU 59 28.174 5.280 9.863 380 HB3 LEU 59 HB1 LEU 59 26.824 5.672 8.797 381 HG LEU 59 HG LEU 59 27.066 3.182 8.013 382 HD11 LEU 59 HD11 LEU 59 27.833 2.447 10.728 383 HD12 LEU 59 HD12 LEU 59 29.132 3.298 9.891 384 HD13 LEU 59 HD13 LEU 59 28.442 1.834 9.190 385 HD21 LEU 59 HD21 LEU 59 25.064 3.839 9.100 386 HD22 LEU 59 HD22 LEU 59 25.897 4.161 10.621 387 HD23 LEU 59 HD23 LEU 59 25.665 2.500 10.078 388 H THR 60 HN THR 60 29.101 4.352 5.399 389 HA THR 60 HA THR 60 27.896 4.412 3.371 390 HB THR 60 HB THR 60 25.628 5.959 4.508 391 HG1 THR 60 HG1 THR 60 25.921 3.243 5.184 392 HG21 THR 60 HG21 THR 60 25.595 3.293 3.105 393 HG22 THR 60 HG22 THR 60 25.845 4.791 2.209 394 HG23 THR 60 HG23 THR 60 24.353 4.545 3.117 395 H ALA 61 HN ALA 61 28.295 5.881 1.772 396 HA ALA 61 HA ALA 61 28.020 8.775 2.369 397 HB1 ALA 61 HB1 ALA 61 30.251 9.035 2.580 398 HB2 ALA 61 HB2 ALA 61 30.392 8.590 0.878 399 HB3 ALA 61 HB3 ALA 61 30.544 7.355 2.128 Start of MODEL 19 1 H1 SER 8 HT1 SER 8 29.618 -14.562 -2.359 2 H2 SER 8 HT2 SER 8 29.022 -13.689 -3.690 3 H3 SER 8 HT3 SER 8 28.190 -13.661 -2.209 4 HA SER 8 HA SER 8 30.975 -12.725 -2.324 5 HB2 SER 8 HB2 SER 8 30.031 -11.437 -4.090 6 HB3 SER 8 HB1 SER 8 28.496 -11.261 -3.245 7 HG SER 8 HG SER 8 30.474 -10.355 -1.694 8 H GLY 9 HN GLY 9 31.492 -11.737 -0.372 9 HA2 GLY 9 HA2 GLY 9 29.404 -10.894 1.492 10 HA3 GLY 9 HA1 GLY 9 30.257 -12.352 2.000 11 HA PRO 10 HA PRO 10 32.366 -8.100 3.130 12 HB2 PRO 10 HB2 PRO 10 32.096 -9.482 5.770 13 HB3 PRO 10 HB1 PRO 10 31.954 -7.757 5.381 14 HG2 PRO 10 HG2 PRO 10 29.813 -9.294 5.846 15 HG3 PRO 10 HG1 PRO 10 29.785 -7.949 4.695 16 HD2 PRO 10 HD2 PRO 10 29.745 -10.863 4.160 17 HD3 PRO 10 HD1 PRO 10 29.185 -9.521 3.142 18 H LEU 11 HN LEU 11 34.460 -8.147 4.686 19 HA LEU 11 HA LEU 11 36.160 -10.280 3.603 20 HB2 LEU 11 HB2 LEU 11 36.529 -7.681 5.017 21 HB3 LEU 11 HB1 LEU 11 37.814 -8.863 5.193 22 HG LEU 11 HG LEU 11 36.669 -8.197 2.486 23 HD11 LEU 11 HD11 LEU 11 39.169 -6.890 2.850 24 HD12 LEU 11 HD12 LEU 11 38.134 -6.424 4.199 25 HD13 LEU 11 HD13 LEU 11 37.597 -6.155 2.543 26 HD21 LEU 11 HD21 LEU 11 38.135 -10.230 2.844 27 HD22 LEU 11 HD22 LEU 11 39.434 -9.133 3.307 28 HD23 LEU 11 HD23 LEU 11 38.770 -9.073 1.677 29 HA PRO 12 HA PRO 12 37.205 -13.084 6.960 30 HB2 PRO 12 HB2 PRO 12 38.351 -10.776 8.509 31 HB3 PRO 12 HB1 PRO 12 38.943 -12.446 8.389 32 HG2 PRO 12 HG2 PRO 12 39.831 -10.314 6.849 33 HG3 PRO 12 HG1 PRO 12 40.053 -12.026 6.465 34 HD2 PRO 12 HD2 PRO 12 38.538 -10.182 4.953 35 HD3 PRO 12 HD1 PRO 12 38.504 -11.945 4.773 36 H ASP 13 HN ASP 13 36.197 -9.895 8.244 37 HA ASP 13 HA ASP 13 33.650 -10.263 8.983 38 HB2 ASP 13 HB2 ASP 13 33.765 -12.347 10.008 39 HB3 ASP 13 HB1 ASP 13 35.363 -12.036 10.689 40 H GLY 14 HN GLY 14 33.369 -8.167 9.488 41 HA2 GLY 14 HA2 GLY 14 33.327 -6.518 11.308 42 HA3 GLY 14 HA1 GLY 14 34.931 -7.078 11.783 43 H TRP 15 HN TRP 15 34.973 -7.007 8.473 44 HA TRP 15 HA TRP 15 35.364 -4.134 8.152 45 HB2 TRP 15 HB2 TRP 15 37.680 -4.062 7.932 46 HB3 TRP 15 HB1 TRP 15 37.457 -5.147 9.299 47 HD1 TRP 15 HD1 TRP 15 37.348 -7.895 8.491 48 HE1 TRP 15 HE1 TRP 15 38.957 -9.053 6.854 49 HE3 TRP 15 HE3 TRP 15 39.170 -3.823 6.014 50 HZ2 TRP 15 HZ2 TRP 15 40.783 -8.352 4.765 51 HZ3 TRP 15 HZ3 TRP 15 40.837 -4.094 4.206 52 HH2 TRP 15 HH2 TRP 15 41.648 -6.351 3.576 53 H GLU 16 HN GLU 16 36.125 -3.595 5.904 54 HA GLU 16 HA GLU 16 35.913 -5.729 3.896 55 HB2 GLU 16 HB2 GLU 16 33.657 -3.935 4.572 56 HB3 GLU 16 HB1 GLU 16 34.015 -4.081 2.852 57 HG2 GLU 16 HG2 GLU 16 33.926 -6.552 3.060 58 HG3 GLU 16 HG1 GLU 16 33.505 -6.377 4.763 59 H GLN 17 HN GLN 17 36.646 -5.008 1.824 60 HA GLN 17 HA GLN 17 38.235 -2.541 1.909 61 HB2 GLN 17 HB2 GLN 17 39.442 -4.235 0.853 62 HB3 GLN 17 HB1 GLN 17 38.013 -4.894 0.059 63 HG2 GLN 17 HG2 GLN 17 37.932 -3.022 -1.481 64 HG3 GLN 17 HG1 GLN 17 39.235 -2.204 -0.618 65 HE21 GLN 17 HE21 GLN 17 41.184 -2.421 -1.719 66 HE22 GLN 17 HE22 GLN 17 41.669 -3.795 -2.588 67 H ALA 18 HN ALA 18 37.740 -0.675 0.751 68 HA ALA 18 HA ALA 18 35.555 -0.741 -1.227 69 HB1 ALA 18 HB1 ALA 18 34.265 -0.365 0.760 70 HB2 ALA 18 HB2 ALA 18 34.423 1.201 -0.035 71 HB3 ALA 18 HB3 ALA 18 35.426 0.818 1.364 72 H MET 19 HN MET 19 35.183 1.922 -1.654 73 HA MET 19 HA MET 19 37.908 3.069 -1.965 74 HB2 MET 19 HB2 MET 19 37.621 3.499 -4.249 75 HB3 MET 19 HB1 MET 19 36.872 1.911 -4.076 76 HG2 MET 19 HG2 MET 19 34.732 3.440 -3.518 77 HG3 MET 19 HG1 MET 19 35.604 4.562 -4.562 78 HE1 MET 19 HE1 MET 19 32.614 2.583 -6.384 79 HE2 MET 19 HE2 MET 19 32.923 3.724 -5.077 80 HE3 MET 19 HE3 MET 19 32.841 1.998 -4.730 81 H THR 20 HN THR 20 37.843 5.446 -2.360 82 HA THR 20 HA THR 20 35.610 6.658 -0.842 83 HB THR 20 HB THR 20 37.281 8.718 -1.196 84 HG1 THR 20 HG1 THR 20 38.626 7.448 -2.571 85 HG21 THR 20 HG21 THR 20 37.448 8.393 1.019 86 HG22 THR 20 HG22 THR 20 38.587 7.076 0.743 87 HG23 THR 20 HG23 THR 20 36.858 6.744 0.822 88 H GLN 21 HN GLN 21 35.768 9.271 -1.924 89 HA GLN 21 HA GLN 21 34.252 8.856 -4.406 90 HB2 GLN 21 HB2 GLN 21 35.013 11.456 -3.039 91 HB3 GLN 21 HB1 GLN 21 33.764 11.235 -4.265 92 HG2 GLN 21 HG2 GLN 21 32.621 9.629 -2.685 93 HG3 GLN 21 HG1 GLN 21 33.783 10.116 -1.451 94 HE21 GLN 21 HE21 GLN 21 33.873 12.592 -1.052 95 HE22 GLN 21 HE22 GLN 21 32.406 13.441 -1.143 96 H ASP 22 HN ASP 22 37.476 9.314 -3.560 97 HA ASP 22 HA ASP 22 38.102 10.447 -6.232 98 HB2 ASP 22 HB2 ASP 22 38.885 11.815 -4.302 99 HB3 ASP 22 HB1 ASP 22 39.826 10.434 -3.741 100 H GLY 23 HN GLY 23 37.607 7.636 -5.142 101 HA2 GLY 23 HA2 GLY 23 38.445 5.488 -5.541 102 HA3 GLY 23 HA1 GLY 23 39.328 6.222 -6.879 103 H GLU 24 HN GLU 24 39.610 6.714 -3.351 104 HA GLU 24 HA GLU 24 42.530 6.383 -3.615 105 HB2 GLU 24 HB2 GLU 24 41.006 7.016 -1.094 106 HB3 GLU 24 HB1 GLU 24 42.690 7.385 -1.468 107 HG2 GLU 24 HG2 GLU 24 41.620 8.736 -3.470 108 HG3 GLU 24 HG1 GLU 24 40.196 8.737 -2.429 109 H ILE 25 HN ILE 25 40.339 4.279 -3.623 110 HA ILE 25 HA ILE 25 39.824 2.238 -2.487 111 HB ILE 25 HB ILE 25 41.496 1.630 -4.139 112 HG12 ILE 25 HG12 ILE 25 42.469 -0.333 -3.004 113 HG13 ILE 25 HG11 ILE 25 42.109 0.393 -1.437 114 HG21 ILE 25 HG21 ILE 25 43.588 2.216 -2.027 115 HG22 ILE 25 HG22 ILE 25 43.199 3.320 -3.346 116 HG23 ILE 25 HG23 ILE 25 43.865 1.728 -3.698 117 HD11 ILE 25 HD11 ILE 25 39.892 -0.106 -1.566 118 HD12 ILE 25 HD12 ILE 25 40.425 -1.314 -2.736 119 HD13 ILE 25 HD13 ILE 25 39.813 0.242 -3.293 120 H TYR 26 HN TYR 26 39.284 2.210 -0.373 121 HA TYR 26 HA TYR 26 41.497 2.281 1.609 122 HB2 TYR 26 HB2 TYR 26 40.277 3.713 3.071 123 HB3 TYR 26 HB1 TYR 26 40.156 4.462 1.481 124 HD1 TYR 26 HD1 TYR 26 38.368 2.061 3.726 125 HD2 TYR 26 HD2 TYR 26 38.049 4.960 0.578 126 HE1 TYR 26 HE1 TYR 26 35.895 1.917 3.848 127 HE2 TYR 26 HE2 TYR 26 35.575 4.821 0.705 128 HH TYR 26 HH TYR 26 33.881 2.935 1.516 129 H TYR 27 HN TYR 27 40.787 1.293 3.728 130 HA TYR 27 HA TYR 27 38.859 -0.937 3.213 131 HB2 TYR 27 HB2 TYR 27 41.217 -0.814 5.119 132 HB3 TYR 27 HB1 TYR 27 40.106 -2.172 4.974 133 HD1 TYR 27 HD1 TYR 27 42.955 -2.635 4.587 134 HD2 TYR 27 HD2 TYR 27 40.011 -1.300 1.759 135 HE1 TYR 27 HE1 TYR 27 44.310 -3.556 2.731 136 HE2 TYR 27 HE2 TYR 27 41.362 -2.219 -0.088 137 HH TYR 27 HH TYR 27 44.176 -4.211 0.503 138 H ILE 28 HN ILE 28 37.350 -1.421 4.880 139 HA ILE 28 HA ILE 28 37.144 0.689 6.969 140 HB ILE 28 HB ILE 28 35.310 1.283 5.810 141 HG12 ILE 28 HG12 ILE 28 33.277 0.118 6.489 142 HG13 ILE 28 HG11 ILE 28 34.204 -1.323 6.900 143 HG21 ILE 28 HG21 ILE 28 36.014 -0.251 3.935 144 HG22 ILE 28 HG22 ILE 28 34.269 -0.051 4.086 145 HG23 ILE 28 HG23 ILE 28 35.041 -1.516 4.686 146 HD11 ILE 28 HD11 ILE 28 33.723 1.049 8.485 147 HD12 ILE 28 HD12 ILE 28 35.450 0.763 8.298 148 HD13 ILE 28 HD13 ILE 28 34.415 -0.493 8.973 149 H ASN 29 HN ASN 29 37.041 -0.040 9.023 150 HA ASN 29 HA ASN 29 36.640 -2.972 9.426 151 HB2 ASN 29 HB2 ASN 29 38.625 -1.230 10.359 152 HB3 ASN 29 HB1 ASN 29 37.582 -1.507 11.756 153 HD21 ASN 29 HD21 ASN 29 37.933 -3.439 12.875 154 HD22 ASN 29 HD22 ASN 29 38.790 -4.770 12.263 155 H HIS 30 HN HIS 30 34.477 -3.275 9.812 156 HA HIS 30 HA HIS 30 32.818 -1.330 11.156 157 HB2 HIS 30 HB2 HIS 30 32.389 -4.272 10.560 158 HB3 HIS 30 HB1 HIS 30 31.146 -3.202 11.211 159 HD1 HIS 30 HD1 HIS 30 31.200 -0.754 9.629 160 HD2 HIS 30 HD2 HIS 30 32.037 -4.422 7.826 161 HE1 HIS 30 HE1 HIS 30 30.816 -0.436 7.145 162 HE2 HIS 30 HE2 HIS 30 31.318 -2.664 6.039 163 H LYS 31 HN LYS 31 35.262 -3.116 12.386 164 HA LYS 31 HA LYS 31 33.967 -4.016 14.855 165 HB2 LYS 31 HB2 LYS 31 36.580 -4.313 13.576 166 HB3 LYS 31 HB1 LYS 31 36.710 -4.003 15.308 167 HG2 LYS 31 HG2 LYS 31 35.255 -5.869 15.816 168 HG3 LYS 31 HG1 LYS 31 34.898 -6.114 14.105 169 HD2 LYS 31 HD2 LYS 31 37.074 -6.904 13.641 170 HD3 LYS 31 HD1 LYS 31 37.730 -6.232 15.135 171 HE2 LYS 31 HE2 LYS 31 37.010 -8.851 14.823 172 HE3 LYS 31 HE1 LYS 31 37.069 -8.021 16.378 173 HZ1 LYS 31 HZ1 LYS 31 34.744 -7.457 16.143 174 HZ2 LYS 31 HZ2 LYS 31 34.947 -9.139 16.021 175 HZ3 LYS 31 HZ3 LYS 31 34.679 -8.210 14.624 176 H ASN 32 HN ASN 32 36.118 -1.390 13.838 177 HA ASN 32 HA ASN 32 35.589 -0.071 16.458 178 HB2 ASN 32 HB2 ASN 32 38.046 -0.601 15.126 179 HB3 ASN 32 HB1 ASN 32 37.785 1.141 15.064 180 HD21 ASN 32 HD21 ASN 32 39.842 -0.034 16.704 181 HD22 ASN 32 HD22 ASN 32 39.438 0.239 18.330 182 H LYS 33 HN LYS 33 34.518 -0.062 13.407 183 HA LYS 33 HA LYS 33 33.417 1.526 12.085 184 HB2 LYS 33 HB2 LYS 33 33.143 2.379 14.826 185 HB3 LYS 33 HB1 LYS 33 33.296 3.791 13.780 186 HG2 LYS 33 HG2 LYS 33 31.496 2.926 12.336 187 HG3 LYS 33 HG1 LYS 33 31.343 1.508 13.374 188 HD2 LYS 33 HD2 LYS 33 31.039 3.295 15.282 189 HD3 LYS 33 HD1 LYS 33 30.597 4.359 13.947 190 HE2 LYS 33 HE2 LYS 33 28.523 3.478 14.097 191 HE3 LYS 33 HE1 LYS 33 29.207 2.007 13.405 192 HZ1 LYS 33 HZ1 LYS 33 29.854 2.019 16.105 193 HZ2 LYS 33 HZ2 LYS 33 28.768 0.988 15.302 194 HZ3 LYS 33 HZ3 LYS 33 28.212 2.432 16.006 195 H THR 34 HN THR 34 36.158 1.379 11.695 196 HA THR 34 HA THR 34 36.771 4.183 10.977 197 HB THR 34 HB THR 34 39.241 3.112 11.698 198 HG1 THR 34 HG1 THR 34 37.465 2.710 13.844 199 HG21 THR 34 HG21 THR 34 38.440 5.435 11.997 200 HG22 THR 34 HG22 THR 34 39.156 4.794 13.477 201 HG23 THR 34 HG23 THR 34 37.402 4.891 13.315 202 H THR 35 HN THR 35 38.427 4.298 9.247 203 HA THR 35 HA THR 35 38.498 1.777 7.677 204 HB THR 35 HB THR 35 39.068 3.622 5.817 205 HG1 THR 35 HG1 THR 35 38.923 5.429 7.001 206 HG21 THR 35 HG21 THR 35 36.394 2.740 6.894 207 HG22 THR 35 HG22 THR 35 37.254 2.139 5.480 208 HG23 THR 35 HG23 THR 35 36.521 3.737 5.446 209 H SER 36 HN SER 36 40.474 1.522 6.296 210 HA SER 36 HA SER 36 42.853 3.052 7.059 211 HB2 SER 36 HB2 SER 36 42.359 1.272 8.913 212 HB3 SER 36 HB1 SER 36 42.963 0.121 7.725 213 HG SER 36 HG SER 36 44.582 1.026 9.154 214 H TRP 37 HN TRP 37 44.870 1.902 6.038 215 HA TRP 37 HA TRP 37 44.004 0.792 3.399 216 HB2 TRP 37 HB2 TRP 37 46.732 1.948 3.768 217 HB3 TRP 37 HB1 TRP 37 45.672 2.001 2.360 218 HD1 TRP 37 HD1 TRP 37 46.377 3.757 5.665 219 HE1 TRP 37 HE1 TRP 37 45.138 6.019 5.692 220 HE3 TRP 37 HE3 TRP 37 43.597 3.291 1.406 221 HZ2 TRP 37 HZ2 TRP 37 43.220 7.440 4.116 222 HZ3 TRP 37 HZ3 TRP 37 42.075 5.111 0.693 223 HH2 TRP 37 HH2 TRP 37 41.881 7.183 2.040 224 H LEU 38 HN LEU 38 45.825 0.202 6.266 225 HA LEU 38 HA LEU 38 47.878 -1.493 5.604 226 HB2 LEU 38 HB2 LEU 38 45.750 -1.818 7.725 227 HB3 LEU 38 HB1 LEU 38 47.111 -2.932 7.594 228 HG LEU 38 HG LEU 38 47.585 0.039 7.670 229 HD11 LEU 38 HD11 LEU 38 46.526 -0.009 9.705 230 HD12 LEU 38 HD12 LEU 38 48.073 -0.675 10.228 231 HD13 LEU 38 HD13 LEU 38 46.721 -1.753 9.882 232 HD21 LEU 38 HD21 LEU 38 49.498 -1.291 7.081 233 HD22 LEU 38 HD22 LEU 38 49.162 -2.453 8.363 234 HD23 LEU 38 HD23 LEU 38 49.713 -0.828 8.768 235 H ASP 39 HN ASP 39 48.006 -3.846 5.276 236 HA ASP 39 HA ASP 39 45.618 -4.889 3.828 237 HB2 ASP 39 HB2 ASP 39 48.370 -5.976 3.357 238 HB3 ASP 39 HB1 ASP 39 47.005 -5.875 2.245 239 HA PRO 40 HA PRO 40 45.932 -7.492 7.613 240 HB2 PRO 40 HB2 PRO 40 43.270 -8.298 6.553 241 HB3 PRO 40 HB1 PRO 40 43.727 -7.794 8.190 242 HG2 PRO 40 HG2 PRO 40 42.350 -6.197 6.545 243 HG3 PRO 40 HG1 PRO 40 43.532 -5.568 7.705 244 HD2 PRO 40 HD2 PRO 40 43.771 -5.850 4.742 245 HD3 PRO 40 HD1 PRO 40 44.500 -4.645 5.826 246 H ARG 41 HN ARG 41 43.874 -9.079 5.198 247 HA ARG 41 HA ARG 41 46.051 -10.994 4.594 248 HB2 ARG 41 HB2 ARG 41 44.253 -12.838 4.874 249 HB3 ARG 41 HB1 ARG 41 44.986 -12.179 6.337 250 HG2 ARG 41 HG2 ARG 41 42.729 -10.556 5.551 251 HG3 ARG 41 HG1 ARG 41 42.238 -12.244 5.689 252 HD2 ARG 41 HD2 ARG 41 42.165 -10.783 7.832 253 HD3 ARG 41 HD1 ARG 41 42.903 -12.381 7.947 254 HE ARG 41 HE ARG 41 44.734 -10.139 7.362 255 HH11 ARG 41 HH11 ARG 41 46.375 -9.883 8.895 256 HH12 ARG 41 HH12 ARG 41 46.293 -10.762 10.385 257 HH21 ARG 41 HH21 ARG 41 43.307 -12.340 9.598 258 HH22 ARG 41 HH22 ARG 41 44.557 -12.152 10.783 259 H LEU 42 HN LEU 42 44.787 -8.896 3.022 260 HA LEU 42 HA LEU 42 43.082 -10.390 1.121 261 HB2 LEU 42 HB2 LEU 42 42.937 -7.812 2.013 262 HB3 LEU 42 HB1 LEU 42 43.820 -7.598 0.501 263 HG LEU 42 HG LEU 42 41.238 -9.166 0.742 264 HD11 LEU 42 HD11 LEU 42 40.046 -7.265 0.390 265 HD12 LEU 42 HD12 LEU 42 41.239 -6.620 -0.737 266 HD13 LEU 42 HD13 LEU 42 41.478 -6.437 1.000 267 HD21 LEU 42 HD21 LEU 42 41.268 -8.879 -1.752 268 HD22 LEU 42 HD22 LEU 42 42.616 -9.844 -1.149 269 HD23 LEU 42 HD23 LEU 42 42.872 -8.161 -1.610 270 H ASP 43 HN ASP 43 45.538 -11.487 1.041 271 HA ASP 43 HA ASP 43 47.166 -12.081 -0.555 272 HB2 ASP 43 HB2 ASP 43 45.229 -11.218 -2.132 273 HB3 ASP 43 HB1 ASP 43 46.304 -9.836 -2.351 274 HA PRO 44 HA PRO 44 49.704 -8.781 1.429 275 HB2 PRO 44 HB2 PRO 44 51.698 -10.923 0.836 276 HB3 PRO 44 HB1 PRO 44 51.457 -9.988 2.324 277 HG2 PRO 44 HG2 PRO 44 50.658 -12.526 2.111 278 HG3 PRO 44 HG1 PRO 44 49.752 -11.331 3.052 279 HD2 PRO 44 HD2 PRO 44 49.083 -12.544 0.417 280 HD3 PRO 44 HD1 PRO 44 48.001 -11.904 1.673 281 H ARG 45 HN ARG 45 49.695 -7.292 -0.326 282 HA ARG 45 HA ARG 45 50.758 -7.764 -2.914 283 HB2 ARG 45 HB2 ARG 45 50.318 -5.297 -1.253 284 HB3 ARG 45 HB1 ARG 45 51.177 -5.172 -2.789 285 HG2 ARG 45 HG2 ARG 45 49.304 -6.126 -3.989 286 HG3 ARG 45 HG1 ARG 45 48.462 -6.482 -2.479 287 HD2 ARG 45 HD2 ARG 45 48.092 -4.200 -3.964 288 HD3 ARG 45 HD1 ARG 45 47.728 -4.346 -2.245 289 HE ARG 45 HE ARG 45 50.448 -3.673 -2.391 290 HH11 ARG 45 HH11 ARG 45 51.112 -1.518 -2.228 291 HH12 ARG 45 HH12 ARG 45 49.997 -0.250 -2.609 292 HH21 ARG 45 HH21 ARG 45 47.397 -2.410 -3.384 293 HH22 ARG 45 HH22 ARG 45 47.893 -0.754 -3.263 294 H GLY 46 HN GLY 46 52.821 -6.778 -3.781 295 HA2 GLY 46 HA2 GLY 46 55.042 -7.423 -1.921 296 HA3 GLY 46 HA1 GLY 46 55.180 -7.280 -3.674 297 H GLY 47 HN GLY 47 55.186 -5.528 -0.657 298 HA2 GLY 47 HA2 GLY 47 56.758 -3.527 -0.747 299 HA3 GLY 47 HA1 GLY 47 55.840 -3.030 -2.171 300 H GLY 48 HN GLY 48 55.888 -1.172 -0.262 301 HA2 GLY 48 HA2 GLY 48 53.274 -1.473 1.167 302 HA3 GLY 48 HA1 GLY 48 54.620 -0.533 1.812 303 H GLY 49 HN GLY 49 55.346 1.334 0.392 304 HA2 GLY 49 HA2 GLY 49 54.830 3.016 -1.269 305 HA3 GLY 49 HA1 GLY 49 53.180 2.396 -1.343 306 H ASN 50 HN ASN 50 52.618 4.739 -1.061 307 HA ASN 50 HA ASN 50 52.766 5.533 1.822 308 HB2 ASN 50 HB2 ASN 50 53.716 6.962 -0.325 309 HB3 ASN 50 HB1 ASN 50 52.095 7.634 -0.134 310 HD21 ASN 50 HD21 ASN 50 55.256 7.989 0.953 311 HD22 ASN 50 HD22 ASN 50 54.941 8.773 2.425 312 H ARG 51 HN ARG 51 50.828 6.698 2.616 313 HA ARG 51 HA ARG 51 48.374 6.447 1.005 314 HB2 ARG 51 HB2 ARG 51 47.210 5.110 2.739 315 HB3 ARG 51 HB1 ARG 51 48.558 4.219 2.032 316 HG2 ARG 51 HG2 ARG 51 48.776 5.825 4.592 317 HG3 ARG 51 HG1 ARG 51 48.437 4.093 4.553 318 HD2 ARG 51 HD2 ARG 51 50.604 4.227 2.900 319 HD3 ARG 51 HD1 ARG 51 50.968 5.530 4.031 320 HE ARG 51 HE ARG 51 51.471 3.860 5.600 321 HH11 ARG 51 HH11 ARG 51 51.339 1.784 6.486 322 HH12 ARG 51 HH12 ARG 51 50.286 0.614 5.763 323 HH21 ARG 51 HH21 ARG 51 49.167 2.762 3.282 324 HH22 ARG 51 HH22 ARG 51 49.056 1.168 3.949 325 H GLN 52 HN GLN 52 46.794 7.906 1.691 326 HA GLN 52 HA GLN 52 47.644 10.066 3.401 327 HB2 GLN 52 HB2 GLN 52 45.219 9.357 1.847 328 HB3 GLN 52 HB1 GLN 52 44.951 10.414 3.233 329 HG2 GLN 52 HG2 GLN 52 45.467 11.620 1.063 330 HG3 GLN 52 HG1 GLN 52 46.533 12.029 2.408 331 HE21 GLN 52 HE21 GLN 52 46.363 9.699 -0.347 332 HE22 GLN 52 HE22 GLN 52 48.034 9.705 -0.642 333 HA PRO 53 HA PRO 53 46.471 8.763 7.427 334 HB2 PRO 53 HB2 PRO 53 44.977 10.947 8.306 335 HB3 PRO 53 HB1 PRO 53 46.745 10.832 8.346 336 HG2 PRO 53 HG2 PRO 53 44.982 12.224 6.410 337 HG3 PRO 53 HG1 PRO 53 46.586 12.675 7.009 338 HD2 PRO 53 HD2 PRO 53 46.210 11.618 4.533 339 HD3 PRO 53 HD1 PRO 53 47.690 11.330 5.474 340 HA PRO 54 HA PRO 54 42.561 6.713 6.452 341 HB2 PRO 54 HB2 PRO 54 42.885 6.060 9.355 342 HB3 PRO 54 HB1 PRO 54 42.481 4.992 7.997 343 HG2 PRO 54 HG2 PRO 54 44.928 5.049 9.064 344 HG3 PRO 54 HG1 PRO 54 44.662 4.784 7.333 345 HD2 PRO 54 HD2 PRO 54 45.749 7.175 8.715 346 HD3 PRO 54 HD1 PRO 54 45.984 6.636 7.038 347 HA PRO 55 HA PRO 55 40.220 10.094 8.441 348 HB2 PRO 55 HB2 PRO 55 38.452 10.449 6.413 349 HB3 PRO 55 HB1 PRO 55 40.094 11.118 6.369 350 HG2 PRO 55 HG2 PRO 55 38.980 8.745 4.985 351 HG3 PRO 55 HG1 PRO 55 40.206 9.899 4.443 352 HD2 PRO 55 HD2 PRO 55 40.739 7.356 5.474 353 HD3 PRO 55 HD1 PRO 55 41.915 8.681 5.358 354 HA PRO 56 HA PRO 56 36.810 7.799 10.051 355 HB2 PRO 56 HB2 PRO 56 34.848 9.727 10.226 356 HB3 PRO 56 HB1 PRO 56 36.196 9.565 11.367 357 HG2 PRO 56 HG2 PRO 56 35.846 11.460 9.109 358 HG3 PRO 56 HG1 PRO 56 36.607 11.709 10.687 359 HD2 PRO 56 HD2 PRO 56 38.040 11.324 8.383 360 HD3 PRO 56 HD1 PRO 56 38.642 10.865 9.991 361 H TYR 57 HN TYR 57 35.900 6.317 8.686 362 HA TYR 57 HA TYR 57 34.624 7.065 6.188 363 HB2 TYR 57 HB2 TYR 57 34.678 4.836 5.738 364 HB3 TYR 57 HB1 TYR 57 35.737 4.766 7.146 365 HD1 TYR 57 HD1 TYR 57 34.585 4.494 9.469 366 HD2 TYR 57 HD2 TYR 57 32.671 3.623 5.724 367 HE1 TYR 57 HE1 TYR 57 32.924 3.079 10.646 368 HE2 TYR 57 HE2 TYR 57 31.010 2.208 6.900 369 HH TYR 57 HH TYR 57 31.347 1.427 10.304 370 HA PRO 58 HA PRO 58 30.725 7.859 8.297 371 HB2 PRO 58 HB2 PRO 58 29.490 9.070 6.210 372 HB3 PRO 58 HB1 PRO 58 30.738 9.883 7.174 373 HG2 PRO 58 HG2 PRO 58 30.933 8.648 4.482 374 HG3 PRO 58 HG1 PRO 58 31.725 10.096 5.123 375 HD2 PRO 58 HD2 PRO 58 32.935 7.594 4.885 376 HD3 PRO 58 HD1 PRO 58 33.497 8.901 5.949 377 H LEU 59 HN LEU 59 30.030 5.627 8.440 378 HA LEU 59 HA LEU 59 29.177 4.039 6.241 379 HB2 LEU 59 HB2 LEU 59 27.718 2.904 8.052 380 HB3 LEU 59 HB1 LEU 59 29.465 2.896 8.291 381 HG LEU 59 HG LEU 59 28.139 5.290 9.366 382 HD11 LEU 59 HD11 LEU 59 27.239 4.065 11.350 383 HD12 LEU 59 HD12 LEU 59 27.539 2.544 10.509 384 HD13 LEU 59 HD13 LEU 59 26.364 3.691 9.864 385 HD21 LEU 59 HD21 LEU 59 30.547 4.445 9.685 386 HD22 LEU 59 HD22 LEU 59 29.861 3.234 10.768 387 HD23 LEU 59 HD23 LEU 59 29.693 4.949 11.143 388 H THR 60 HN THR 60 26.678 3.306 6.239 389 HA THR 60 HA THR 60 25.209 5.513 5.165 390 HB THR 60 HB THR 60 23.276 3.934 5.183 391 HG1 THR 60 HG1 THR 60 23.552 2.781 7.005 392 HG21 THR 60 HG21 THR 60 25.886 3.494 3.976 393 HG22 THR 60 HG22 THR 60 24.283 3.319 3.264 394 HG23 THR 60 HG23 THR 60 24.997 1.983 4.167 395 H ALA 61 HN ALA 61 22.625 5.119 6.359 396 HA ALA 61 HA ALA 61 22.893 6.911 8.632 397 HB1 ALA 61 HB1 ALA 61 20.959 6.864 6.966 398 HB2 ALA 61 HB2 ALA 61 20.499 6.942 8.666 399 HB3 ALA 61 HB3 ALA 61 20.401 5.411 7.795 Start of MODEL 20 1 H1 SER 8 HT1 SER 8 30.168 -13.162 -0.023 2 H2 SER 8 HT2 SER 8 28.731 -12.460 -0.599 3 H3 SER 8 HT3 SER 8 29.231 -13.977 -1.180 4 HA SER 8 HA SER 8 27.385 -14.041 0.488 5 HB2 SER 8 HB2 SER 8 29.830 -15.455 1.524 6 HB3 SER 8 HB1 SER 8 28.177 -16.050 1.404 7 HG SER 8 HG SER 8 30.078 -16.477 -0.286 8 H GLY 9 HN GLY 9 28.789 -11.520 1.094 9 HA2 GLY 9 HA2 GLY 9 28.133 -10.506 3.350 10 HA3 GLY 9 HA1 GLY 9 29.076 -11.819 4.057 11 HA PRO 10 HA PRO 10 31.735 -7.978 3.299 12 HB2 PRO 10 HB2 PRO 10 32.601 -7.837 5.928 13 HB3 PRO 10 HB1 PRO 10 31.242 -6.912 5.265 14 HG2 PRO 10 HG2 PRO 10 31.232 -9.384 6.904 15 HG3 PRO 10 HG1 PRO 10 30.105 -8.019 6.905 16 HD2 PRO 10 HD2 PRO 10 29.522 -10.411 5.723 17 HD3 PRO 10 HD1 PRO 10 28.865 -8.864 5.145 18 H LEU 11 HN LEU 11 34.125 -7.913 4.724 19 HA LEU 11 HA LEU 11 35.547 -10.167 3.558 20 HB2 LEU 11 HB2 LEU 11 36.191 -7.626 4.946 21 HB3 LEU 11 HB1 LEU 11 37.382 -8.898 5.126 22 HG LEU 11 HG LEU 11 36.248 -8.136 2.434 23 HD11 LEU 11 HD11 LEU 11 38.916 -7.178 2.760 24 HD12 LEU 11 HD12 LEU 11 37.954 -6.564 4.105 25 HD13 LEU 11 HD13 LEU 11 37.456 -6.243 2.444 26 HD21 LEU 11 HD21 LEU 11 38.937 -9.353 3.090 27 HD22 LEU 11 HD22 LEU 11 38.091 -9.344 1.545 28 HD23 LEU 11 HD23 LEU 11 37.502 -10.352 2.864 29 HA PRO 12 HA PRO 12 36.650 -13.094 6.823 30 HB2 PRO 12 HB2 PRO 12 37.989 -10.914 8.397 31 HB3 PRO 12 HB1 PRO 12 38.478 -12.608 8.189 32 HG2 PRO 12 HG2 PRO 12 39.441 -10.474 6.711 33 HG3 PRO 12 HG1 PRO 12 39.533 -12.176 6.241 34 HD2 PRO 12 HD2 PRO 12 38.080 -10.150 4.898 35 HD3 PRO 12 HD1 PRO 12 37.963 -11.892 4.596 36 H ASP 13 HN ASP 13 35.878 -9.882 8.199 37 HA ASP 13 HA ASP 13 33.348 -10.124 9.044 38 HB2 ASP 13 HB2 ASP 13 33.396 -12.222 10.044 39 HB3 ASP 13 HB1 ASP 13 35.038 -12.007 10.653 40 H GLY 14 HN GLY 14 33.204 -8.019 9.571 41 HA2 GLY 14 HA2 GLY 14 33.321 -6.364 11.367 42 HA3 GLY 14 HA1 GLY 14 34.876 -7.048 11.838 43 H TRP 15 HN TRP 15 34.826 -6.934 8.505 44 HA TRP 15 HA TRP 15 35.503 -4.114 8.209 45 HB2 TRP 15 HB2 TRP 15 37.817 -4.288 7.891 46 HB3 TRP 15 HB1 TRP 15 37.519 -5.313 9.290 47 HD1 TRP 15 HD1 TRP 15 37.007 -8.040 8.507 48 HE1 TRP 15 HE1 TRP 15 38.420 -9.422 6.869 49 HE3 TRP 15 HE3 TRP 15 39.357 -4.278 5.978 50 HZ2 TRP 15 HZ2 TRP 15 40.303 -9.001 4.758 51 HZ3 TRP 15 HZ3 TRP 15 40.954 -4.800 4.162 52 HH2 TRP 15 HH2 TRP 15 41.431 -7.153 3.545 53 H GLU 16 HN GLU 16 36.373 -3.688 5.922 54 HA GLU 16 HA GLU 16 35.937 -5.735 3.904 55 HB2 GLU 16 HB2 GLU 16 33.690 -4.118 4.788 56 HB3 GLU 16 HB1 GLU 16 34.029 -3.855 3.078 57 HG2 GLU 16 HG2 GLU 16 34.167 -6.440 2.920 58 HG3 GLU 16 HG1 GLU 16 33.344 -6.434 4.481 59 H GLN 17 HN GLN 17 36.566 -4.981 1.801 60 HA GLN 17 HA GLN 17 38.209 -2.545 1.866 61 HB2 GLN 17 HB2 GLN 17 38.981 -4.692 0.785 62 HB3 GLN 17 HB1 GLN 17 37.739 -4.449 -0.444 63 HG2 GLN 17 HG2 GLN 17 38.741 -2.358 -1.136 64 HG3 GLN 17 HG1 GLN 17 39.890 -2.414 0.201 65 HE21 GLN 17 HE21 GLN 17 41.895 -2.803 -0.790 66 HE22 GLN 17 HE22 GLN 17 42.190 -4.054 -1.897 67 H ALA 18 HN ALA 18 37.751 -0.672 0.658 68 HA ALA 18 HA ALA 18 35.410 -0.672 -1.132 69 HB1 ALA 18 HB1 ALA 18 34.038 0.041 0.527 70 HB2 ALA 18 HB2 ALA 18 34.880 1.581 0.361 71 HB3 ALA 18 HB3 ALA 18 35.389 0.428 1.594 72 H MET 19 HN MET 19 35.109 1.988 -1.579 73 HA MET 19 HA MET 19 37.837 3.042 -2.108 74 HB2 MET 19 HB2 MET 19 37.349 3.513 -4.378 75 HB3 MET 19 HB1 MET 19 36.734 1.878 -4.131 76 HG2 MET 19 HG2 MET 19 35.155 4.457 -4.203 77 HG3 MET 19 HG1 MET 19 35.000 3.064 -5.274 78 HE1 MET 19 HE1 MET 19 32.438 2.481 -4.959 79 HE2 MET 19 HE2 MET 19 32.583 4.141 -4.383 80 HE3 MET 19 HE3 MET 19 31.637 2.976 -3.460 81 H THR 20 HN THR 20 37.835 5.404 -2.474 82 HA THR 20 HA THR 20 35.681 6.694 -0.905 83 HB THR 20 HB THR 20 37.472 8.681 -1.371 84 HG1 THR 20 HG1 THR 20 38.906 7.476 -2.521 85 HG21 THR 20 HG21 THR 20 38.630 7.539 0.784 86 HG22 THR 20 HG22 THR 20 37.134 6.608 0.727 87 HG23 THR 20 HG23 THR 20 37.074 8.365 0.860 88 H GLN 21 HN GLN 21 35.936 9.308 -1.983 89 HA GLN 21 HA GLN 21 34.320 8.987 -4.409 90 HB2 GLN 21 HB2 GLN 21 34.563 10.943 -2.384 91 HB3 GLN 21 HB1 GLN 21 35.116 11.720 -3.867 92 HG2 GLN 21 HG2 GLN 21 33.037 10.907 -5.005 93 HG3 GLN 21 HG1 GLN 21 32.471 10.299 -3.450 94 HE21 GLN 21 HE21 GLN 21 30.977 12.307 -4.770 95 HE22 GLN 21 HE22 GLN 21 31.118 13.763 -3.910 96 H ASP 22 HN ASP 22 37.595 9.201 -3.691 97 HA ASP 22 HA ASP 22 38.211 10.254 -6.400 98 HB2 ASP 22 HB2 ASP 22 39.151 11.543 -4.452 99 HB3 ASP 22 HB1 ASP 22 40.062 10.100 -4.009 100 H GLY 23 HN GLY 23 37.517 7.504 -5.292 101 HA2 GLY 23 HA2 GLY 23 38.200 5.287 -5.620 102 HA3 GLY 23 HA1 GLY 23 39.013 5.917 -7.054 103 H GLU 24 HN GLU 24 39.591 6.414 -3.560 104 HA GLU 24 HA GLU 24 42.465 5.949 -4.052 105 HB2 GLU 24 HB2 GLU 24 41.206 6.679 -1.417 106 HB3 GLU 24 HB1 GLU 24 42.854 6.992 -1.963 107 HG2 GLU 24 HG2 GLU 24 41.536 8.315 -3.888 108 HG3 GLU 24 HG1 GLU 24 40.336 8.450 -2.603 109 H ILE 25 HN ILE 25 40.162 3.955 -3.808 110 HA ILE 25 HA ILE 25 39.676 1.946 -2.607 111 HB ILE 25 HB ILE 25 41.154 1.186 -4.338 112 HG12 ILE 25 HG12 ILE 25 42.336 -0.666 -3.192 113 HG13 ILE 25 HG11 ILE 25 42.113 0.156 -1.646 114 HG21 ILE 25 HG21 ILE 25 43.605 1.280 -4.089 115 HG22 ILE 25 HG22 ILE 25 43.421 2.100 -2.540 116 HG23 ILE 25 HG23 ILE 25 42.906 2.897 -4.027 117 HD11 ILE 25 HD11 ILE 25 39.641 -0.179 -3.225 118 HD12 ILE 25 HD12 ILE 25 39.922 -0.437 -1.503 119 HD13 ILE 25 HD13 ILE 25 40.366 -1.686 -2.666 120 H TYR 26 HN TYR 26 39.314 1.936 -0.456 121 HA TYR 26 HA TYR 26 41.679 2.034 1.342 122 HB2 TYR 26 HB2 TYR 26 40.508 3.426 2.919 123 HB3 TYR 26 HB1 TYR 26 40.377 4.207 1.344 124 HD1 TYR 26 HD1 TYR 26 38.264 4.753 0.471 125 HD2 TYR 26 HD2 TYR 26 38.569 1.833 3.602 126 HE1 TYR 26 HE1 TYR 26 35.790 4.673 0.645 127 HE2 TYR 26 HE2 TYR 26 36.098 1.748 3.772 128 HH TYR 26 HH TYR 26 34.140 2.239 2.291 129 H TYR 27 HN TYR 27 40.878 1.264 3.654 130 HA TYR 27 HA TYR 27 39.109 -1.112 3.221 131 HB2 TYR 27 HB2 TYR 27 41.550 -0.809 4.993 132 HB3 TYR 27 HB1 TYR 27 40.455 -2.192 5.052 133 HD1 TYR 27 HD1 TYR 27 43.322 -0.795 3.458 134 HD2 TYR 27 HD2 TYR 27 39.975 -3.401 2.804 135 HE1 TYR 27 HE1 TYR 27 44.488 -1.806 1.523 136 HE2 TYR 27 HE2 TYR 27 41.139 -4.415 0.871 137 HH TYR 27 HH TYR 27 44.207 -3.122 -0.313 138 H ILE 28 HN ILE 28 37.555 -1.505 4.843 139 HA ILE 28 HA ILE 28 37.395 0.613 6.926 140 HB ILE 28 HB ILE 28 35.548 1.215 5.782 141 HG12 ILE 28 HG12 ILE 28 33.515 0.082 6.495 142 HG13 ILE 28 HG11 ILE 28 34.428 -1.373 6.894 143 HG21 ILE 28 HG21 ILE 28 34.539 -0.043 4.032 144 HG22 ILE 28 HG22 ILE 28 35.128 -1.568 4.689 145 HG23 ILE 28 HG23 ILE 28 36.256 -0.433 3.946 146 HD11 ILE 28 HD11 ILE 28 35.713 0.715 8.268 147 HD12 ILE 28 HD12 ILE 28 34.701 -0.550 8.961 148 HD13 ILE 28 HD13 ILE 28 33.989 0.992 8.495 149 H ASN 29 HN ASN 29 37.313 -0.105 8.989 150 HA ASN 29 HA ASN 29 36.891 -3.032 9.408 151 HB2 ASN 29 HB2 ASN 29 38.901 -1.309 10.305 152 HB3 ASN 29 HB1 ASN 29 37.872 -1.553 11.717 153 HD21 ASN 29 HD21 ASN 29 37.120 -4.088 11.796 154 HD22 ASN 29 HD22 ASN 29 38.410 -5.180 11.642 155 H HIS 30 HN HIS 30 34.722 -3.316 9.821 156 HA HIS 30 HA HIS 30 33.073 -1.364 11.145 157 HB2 HIS 30 HB2 HIS 30 32.691 -4.333 10.664 158 HB3 HIS 30 HB1 HIS 30 31.445 -3.280 11.337 159 HD1 HIS 30 HD1 HIS 30 31.567 -0.822 9.647 160 HD2 HIS 30 HD2 HIS 30 32.032 -4.625 7.997 161 HE1 HIS 30 HE1 HIS 30 31.016 -0.607 7.183 162 HE2 HIS 30 HE2 HIS 30 31.294 -2.917 6.170 163 H LYS 31 HN LYS 31 35.562 -3.101 12.392 164 HA LYS 31 HA LYS 31 34.321 -3.891 14.925 165 HB2 LYS 31 HB2 LYS 31 37.232 -3.749 14.087 166 HB3 LYS 31 HB1 LYS 31 36.647 -4.452 15.595 167 HG2 LYS 31 HG2 LYS 31 35.087 -5.646 13.592 168 HG3 LYS 31 HG1 LYS 31 36.727 -5.626 12.941 169 HD2 LYS 31 HD2 LYS 31 35.997 -6.646 15.702 170 HD3 LYS 31 HD1 LYS 31 36.239 -7.677 14.291 171 HE2 LYS 31 HE2 LYS 31 38.430 -7.716 14.825 172 HE3 LYS 31 HE1 LYS 31 38.492 -6.024 14.334 173 HZ1 LYS 31 HZ1 LYS 31 39.311 -6.137 16.531 174 HZ2 LYS 31 HZ2 LYS 31 38.015 -7.103 17.053 175 HZ3 LYS 31 HZ3 LYS 31 37.754 -5.475 16.643 176 H ASN 32 HN ASN 32 36.509 -1.343 13.785 177 HA ASN 32 HA ASN 32 35.992 0.103 16.340 178 HB2 ASN 32 HB2 ASN 32 38.371 -0.490 16.023 179 HB3 ASN 32 HB1 ASN 32 38.367 0.349 14.471 180 HD21 ASN 32 HD21 ASN 32 40.167 1.609 15.761 181 HD22 ASN 32 HD22 ASN 32 39.639 2.956 16.649 182 H LYS 33 HN LYS 33 34.689 0.005 13.490 183 HA LYS 33 HA LYS 33 33.738 1.551 12.000 184 HB2 LYS 33 HB2 LYS 33 33.560 2.640 14.723 185 HB3 LYS 33 HB1 LYS 33 33.461 3.874 13.466 186 HG2 LYS 33 HG2 LYS 33 31.566 2.882 12.471 187 HG3 LYS 33 HG1 LYS 33 31.843 1.338 13.278 188 HD2 LYS 33 HD2 LYS 33 31.471 2.616 15.480 189 HD3 LYS 33 HD1 LYS 33 30.818 3.914 14.478 190 HE2 LYS 33 HE2 LYS 33 29.827 1.086 14.163 191 HE3 LYS 33 HE1 LYS 33 29.164 2.138 15.414 192 HZ1 LYS 33 HZ1 LYS 33 27.811 2.436 13.537 193 HZ2 LYS 33 HZ2 LYS 33 29.138 2.548 12.482 194 HZ3 LYS 33 HZ3 LYS 33 28.811 3.805 13.578 195 H THR 34 HN THR 34 36.489 1.379 11.674 196 HA THR 34 HA THR 34 37.141 4.177 10.934 197 HB THR 34 HB THR 34 39.596 3.016 11.585 198 HG1 THR 34 HG1 THR 34 37.530 2.273 13.340 199 HG21 THR 34 HG21 THR 34 39.446 4.633 13.538 200 HG22 THR 34 HG22 THR 34 37.786 4.951 13.037 201 HG23 THR 34 HG23 THR 34 39.123 5.332 11.951 202 H THR 35 HN THR 35 38.768 4.273 9.176 203 HA THR 35 HA THR 35 38.774 1.763 7.584 204 HB THR 35 HB THR 35 39.250 3.645 5.717 205 HG1 THR 35 HG1 THR 35 37.785 4.854 7.808 206 HG21 THR 35 HG21 THR 35 37.491 2.094 5.399 207 HG22 THR 35 HG22 THR 35 36.690 3.661 5.412 208 HG23 THR 35 HG23 THR 35 36.645 2.637 6.847 209 H SER 36 HN SER 36 40.702 1.591 6.076 210 HA SER 36 HA SER 36 43.079 3.132 6.861 211 HB2 SER 36 HB2 SER 36 43.141 0.147 7.315 212 HB3 SER 36 HB1 SER 36 44.342 1.342 7.794 213 HG SER 36 HG SER 36 42.449 0.453 9.274 214 H TRP 37 HN TRP 37 44.964 2.562 5.509 215 HA TRP 37 HA TRP 37 44.083 1.642 2.838 216 HB2 TRP 37 HB2 TRP 37 46.834 2.640 3.603 217 HB3 TRP 37 HB1 TRP 37 46.094 2.620 2.003 218 HD1 TRP 37 HD1 TRP 37 46.532 4.752 5.007 219 HE1 TRP 37 HE1 TRP 37 45.138 6.909 4.786 220 HE3 TRP 37 HE3 TRP 37 43.631 3.518 0.989 221 HZ2 TRP 37 HZ2 TRP 37 43.065 7.969 3.124 222 HZ3 TRP 37 HZ3 TRP 37 41.956 5.119 0.109 223 HH2 TRP 37 HH2 TRP 37 41.670 7.341 1.171 224 H LEU 38 HN LEU 38 45.998 0.570 5.548 225 HA LEU 38 HA LEU 38 47.544 -1.420 4.151 226 HB2 LEU 38 HB2 LEU 38 46.886 -0.801 6.989 227 HB3 LEU 38 HB1 LEU 38 47.406 -2.449 6.636 228 HG LEU 38 HG LEU 38 49.323 -0.967 7.198 229 HD11 LEU 38 HD11 LEU 38 49.875 -1.379 4.356 230 HD12 LEU 38 HD12 LEU 38 49.090 -2.775 5.096 231 HD13 LEU 38 HD13 LEU 38 50.602 -2.157 5.763 232 HD21 LEU 38 HD21 LEU 38 48.094 1.038 6.050 233 HD22 LEU 38 HD22 LEU 38 48.851 0.437 4.574 234 HD23 LEU 38 HD23 LEU 38 49.852 0.943 5.935 235 H ASP 39 HN ASP 39 47.091 -3.628 3.836 236 HA ASP 39 HA ASP 39 44.282 -4.440 4.405 237 HB2 ASP 39 HB2 ASP 39 44.086 -5.426 2.301 238 HB3 ASP 39 HB1 ASP 39 45.077 -4.015 1.931 239 HA PRO 40 HA PRO 40 46.283 -7.715 6.659 240 HB2 PRO 40 HB2 PRO 40 44.062 -9.255 7.096 241 HB3 PRO 40 HB1 PRO 40 44.410 -7.768 7.998 242 HG2 PRO 40 HG2 PRO 40 42.535 -8.214 5.735 243 HG3 PRO 40 HG1 PRO 40 42.355 -7.190 7.169 244 HD2 PRO 40 HD2 PRO 40 43.028 -6.213 4.688 245 HD3 PRO 40 HD1 PRO 40 43.485 -5.421 6.213 246 H ARG 41 HN ARG 41 43.704 -9.050 4.549 247 HA ARG 41 HA ARG 41 45.770 -10.799 3.313 248 HB2 ARG 41 HB2 ARG 41 43.919 -12.584 3.258 249 HB3 ARG 41 HB1 ARG 41 44.678 -12.276 4.820 250 HG2 ARG 41 HG2 ARG 41 42.542 -10.417 4.548 251 HG3 ARG 41 HG1 ARG 41 41.913 -12.002 4.097 252 HD2 ARG 41 HD2 ARG 41 41.823 -11.378 6.595 253 HD3 ARG 41 HD1 ARG 41 42.499 -12.955 6.187 254 HE ARG 41 HE ARG 41 44.448 -10.755 6.431 255 HH11 ARG 41 HH11 ARG 41 46.004 -11.084 8.037 256 HH12 ARG 41 HH12 ARG 41 45.794 -12.369 9.179 257 HH21 ARG 41 HH21 ARG 41 42.788 -13.440 7.819 258 HH22 ARG 41 HH22 ARG 41 43.973 -13.702 9.056 259 H LEU 42 HN LEU 42 45.041 -8.517 2.046 260 HA LEU 42 HA LEU 42 43.466 -9.558 -0.231 261 HB2 LEU 42 HB2 LEU 42 42.301 -7.851 1.616 262 HB3 LEU 42 HB1 LEU 42 42.844 -6.754 0.346 263 HG LEU 42 HG LEU 42 40.585 -7.528 -0.168 264 HD11 LEU 42 HD11 LEU 42 40.996 -7.954 -2.396 265 HD12 LEU 42 HD12 LEU 42 42.222 -9.172 -2.046 266 HD13 LEU 42 HD13 LEU 42 42.619 -7.458 -1.914 267 HD21 LEU 42 HD21 LEU 42 41.414 -10.337 -0.601 268 HD22 LEU 42 HD22 LEU 42 39.902 -9.697 0.042 269 HD23 LEU 42 HD23 LEU 42 41.314 -9.841 1.089 270 H ASP 43 HN ASP 43 45.585 -9.610 -1.242 271 HA ASP 43 HA ASP 43 47.569 -7.786 -1.478 272 HB2 ASP 43 HB2 ASP 43 46.688 -9.852 -3.082 273 HB3 ASP 43 HB1 ASP 43 46.575 -8.459 -4.159 274 HA PRO 44 HA PRO 44 45.129 -4.129 -2.551 275 HB2 PRO 44 HB2 PRO 44 46.938 -2.309 -1.662 276 HB3 PRO 44 HB1 PRO 44 45.873 -3.210 -0.566 277 HG2 PRO 44 HG2 PRO 44 48.749 -3.605 -1.157 278 HG3 PRO 44 HG1 PRO 44 47.860 -3.846 0.354 279 HD2 PRO 44 HD2 PRO 44 48.619 -5.880 -1.411 280 HD3 PRO 44 HD1 PRO 44 47.373 -6.024 -0.154 281 H ARG 45 HN ARG 45 45.123 -3.069 -4.504 282 HA ARG 45 HA ARG 45 47.357 -3.435 -6.338 283 HB2 ARG 45 HB2 ARG 45 45.133 -3.478 -7.266 284 HB3 ARG 45 HB1 ARG 45 44.746 -1.911 -6.552 285 HG2 ARG 45 HG2 ARG 45 45.264 -1.625 -8.926 286 HG3 ARG 45 HG1 ARG 45 46.523 -0.868 -7.952 287 HD2 ARG 45 HD2 ARG 45 47.098 -2.539 -9.973 288 HD3 ARG 45 HD1 ARG 45 48.107 -2.432 -8.531 289 HE ARG 45 HE ARG 45 46.498 -4.374 -7.716 290 HH11 ARG 45 HH11 ARG 45 46.443 -6.547 -8.332 291 HH12 ARG 45 HH12 ARG 45 46.955 -6.995 -9.925 292 HH21 ARG 45 HH21 ARG 45 47.706 -3.751 -10.888 293 HH22 ARG 45 HH22 ARG 45 47.668 -5.413 -11.372 294 H GLY 46 HN GLY 46 49.149 -2.175 -6.162 295 HA2 GLY 46 HA2 GLY 46 49.879 0.215 -6.659 296 HA3 GLY 46 HA1 GLY 46 48.765 0.688 -5.375 297 H GLY 47 HN GLY 47 51.363 1.458 -5.080 298 HA2 GLY 47 HA2 GLY 47 52.640 -0.550 -3.293 299 HA3 GLY 47 HA1 GLY 47 53.437 0.879 -3.952 300 H GLY 48 HN GLY 48 51.742 2.916 -3.310 301 HA2 GLY 48 HA2 GLY 48 50.455 3.757 -1.347 302 HA3 GLY 48 HA1 GLY 48 51.456 2.711 -0.338 303 H GLY 49 HN GLY 49 51.228 5.510 0.103 304 HA2 GLY 49 HA2 GLY 49 54.047 6.325 -0.454 305 HA3 GLY 49 HA1 GLY 49 52.727 7.475 -0.680 306 H ASN 50 HN ASN 50 53.194 5.073 1.913 307 HA ASN 50 HA ASN 50 52.960 5.410 4.244 308 HB2 ASN 50 HB2 ASN 50 55.355 6.353 3.317 309 HB3 ASN 50 HB1 ASN 50 54.724 7.780 4.140 310 HD21 ASN 50 HD21 ASN 50 55.920 7.734 6.090 311 HD22 ASN 50 HD22 ASN 50 55.913 6.424 7.169 312 H ARG 51 HN ARG 51 50.688 6.296 3.644 313 HA ARG 51 HA ARG 51 50.498 9.212 4.231 314 HB2 ARG 51 HB2 ARG 51 48.169 9.006 3.402 315 HB3 ARG 51 HB1 ARG 51 49.337 8.464 2.197 316 HG2 ARG 51 HG2 ARG 51 48.984 6.106 3.203 317 HG3 ARG 51 HG1 ARG 51 47.540 6.791 3.949 318 HD2 ARG 51 HD2 ARG 51 47.080 5.714 1.736 319 HD3 ARG 51 HD1 ARG 51 46.655 7.425 1.775 320 HE ARG 51 HE ARG 51 49.236 7.455 0.816 321 HH11 ARG 51 HH11 ARG 51 49.752 7.270 -1.377 322 HH12 ARG 51 HH12 ARG 51 48.657 6.459 -2.445 323 HH21 ARG 51 HH21 ARG 51 46.345 5.744 0.038 324 HH22 ARG 51 HH22 ARG 51 46.728 5.595 -1.645 325 H GLN 52 HN GLN 52 49.578 9.899 6.128 326 HA GLN 52 HA GLN 52 49.307 8.203 8.360 327 HB2 GLN 52 HB2 GLN 52 48.449 10.963 7.677 328 HB3 GLN 52 HB1 GLN 52 47.595 10.201 9.018 329 HG2 GLN 52 HG2 GLN 52 49.565 9.927 10.279 330 HG3 GLN 52 HG1 GLN 52 50.603 10.115 8.866 331 HE21 GLN 52 HE21 GLN 52 47.900 12.147 10.136 332 HE22 GLN 52 HE22 GLN 52 48.814 13.577 10.199 333 HA PRO 53 HA PRO 53 45.540 5.968 8.128 334 HB2 PRO 53 HB2 PRO 53 44.237 6.988 10.439 335 HB3 PRO 53 HB1 PRO 53 45.240 5.531 10.333 336 HG2 PRO 53 HG2 PRO 53 45.926 8.225 11.314 337 HG3 PRO 53 HG1 PRO 53 46.604 6.650 11.755 338 HD2 PRO 53 HD2 PRO 53 47.962 8.426 10.213 339 HD3 PRO 53 HD1 PRO 53 48.137 6.668 10.010 340 HA PRO 54 HA PRO 54 42.678 8.759 6.192 341 HB2 PRO 54 HB2 PRO 54 40.604 7.020 5.807 342 HB3 PRO 54 HB1 PRO 54 42.089 6.992 4.836 343 HG2 PRO 54 HG2 PRO 54 41.271 5.246 7.097 344 HG3 PRO 54 HG1 PRO 54 42.148 4.838 5.612 345 HD2 PRO 54 HD2 PRO 54 43.373 5.183 8.054 346 HD3 PRO 54 HD1 PRO 54 44.189 5.438 6.497 347 HA PRO 55 HA PRO 55 39.860 10.270 9.240 348 HB2 PRO 55 HB2 PRO 55 37.791 11.171 7.659 349 HB3 PRO 55 HB1 PRO 55 39.331 12.027 7.860 350 HG2 PRO 55 HG2 PRO 55 38.396 10.310 5.626 351 HG3 PRO 55 HG1 PRO 55 39.387 11.777 5.588 352 HD2 PRO 55 HD2 PRO 55 40.435 9.259 5.317 353 HD3 PRO 55 HD1 PRO 55 41.348 10.625 5.994 354 HA PRO 56 HA PRO 56 36.757 7.377 10.411 355 HB2 PRO 56 HB2 PRO 56 34.542 9.069 10.809 356 HB3 PRO 56 HB1 PRO 56 35.763 8.635 12.016 357 HG2 PRO 56 HG2 PRO 56 35.505 11.088 10.386 358 HG3 PRO 56 HG1 PRO 56 36.181 10.870 12.009 359 HD2 PRO 56 HD2 PRO 56 37.755 11.263 9.827 360 HD3 PRO 56 HD1 PRO 56 38.275 10.267 11.205 361 H TYR 57 HN TYR 57 36.060 6.066 8.773 362 HA TYR 57 HA TYR 57 34.851 6.963 6.348 363 HB2 TYR 57 HB2 TYR 57 34.823 4.744 5.773 364 HB3 TYR 57 HB1 TYR 57 35.884 4.609 7.175 365 HD1 TYR 57 HD1 TYR 57 33.011 3.287 5.684 366 HD2 TYR 57 HD2 TYR 57 34.533 4.497 9.514 367 HE1 TYR 57 HE1 TYR 57 31.343 1.835 6.804 368 HE2 TYR 57 HE2 TYR 57 32.865 3.044 10.635 369 HH TYR 57 HH TYR 57 30.614 1.029 8.739 370 HA PRO 58 HA PRO 58 30.707 7.697 7.759 371 HB2 PRO 58 HB2 PRO 58 29.434 7.683 5.350 372 HB3 PRO 58 HB1 PRO 58 30.489 9.012 5.871 373 HG2 PRO 58 HG2 PRO 58 31.048 6.776 3.993 374 HG3 PRO 58 HG1 PRO 58 31.559 8.470 3.920 375 HD2 PRO 58 HD2 PRO 58 33.189 6.411 4.772 376 HD3 PRO 58 HD1 PRO 58 33.399 8.109 5.251 377 H LEU 59 HN LEU 59 29.069 6.370 8.496 378 HA LEU 59 HA LEU 59 29.142 3.550 8.025 379 HB2 LEU 59 HB2 LEU 59 27.761 5.315 9.746 380 HB3 LEU 59 HB1 LEU 59 26.517 4.425 8.869 381 HG LEU 59 HG LEU 59 28.862 3.163 10.321 382 HD11 LEU 59 HD11 LEU 59 27.037 2.324 11.846 383 HD12 LEU 59 HD12 LEU 59 25.927 3.426 11.031 384 HD13 LEU 59 HD13 LEU 59 27.300 4.066 11.933 385 HD21 LEU 59 HD21 LEU 59 27.199 1.135 9.941 386 HD22 LEU 59 HD22 LEU 59 28.318 1.619 8.666 387 HD23 LEU 59 HD23 LEU 59 26.631 2.131 8.600 388 H THR 60 HN THR 60 29.206 3.971 5.537 389 HA THR 60 HA THR 60 28.058 4.148 3.453 390 HB THR 60 HB THR 60 27.883 1.837 3.613 391 HG1 THR 60 HG1 THR 60 26.034 2.715 2.522 392 HG21 THR 60 HG21 THR 60 27.752 1.837 6.092 393 HG22 THR 60 HG22 THR 60 26.646 0.667 5.372 394 HG23 THR 60 HG23 THR 60 26.030 2.203 5.984 395 H ALA 61 HN ALA 61 27.129 6.290 3.690 396 HA ALA 61 HA ALA 61 24.172 6.184 3.982 397 HB1 ALA 61 HB1 ALA 61 24.850 8.653 5.077 398 HB2 ALA 61 HB2 ALA 61 26.030 7.545 5.782 399 HB3 ALA 61 HB3 ALA 61 24.304 7.238 5.978
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