NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
592901 | 2mw2 | 25296 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H LEU 6 HT1 LEU 6 8.332 14.264 5.072 2 HA LEU 6 HA LEU 6 9.764 15.992 3.144 3 HB2 LEU 6 HB2 LEU 6 10.573 13.651 4.754 4 HB3 LEU 6 HB1 LEU 6 11.049 13.619 3.069 5 HG LEU 6 HG LEU 6 11.777 16.162 3.905 6 HD11 LEU 6 HD11 LEU 6 12.381 14.156 6.073 7 HD12 LEU 6 HD12 LEU 6 11.448 15.648 6.221 8 HD13 LEU 6 HD13 LEU 6 13.178 15.721 5.896 9 HD21 LEU 6 HD21 LEU 6 14.061 15.287 3.701 10 HD22 LEU 6 HD22 LEU 6 13.022 14.747 2.384 11 HD23 LEU 6 HD23 LEU 6 13.421 13.645 3.700 12 H THR 7 HN THR 7 10.142 14.760 1.073 13 HA THR 7 HA THR 7 7.628 13.538 0.273 14 HB THR 7 HB THR 7 9.526 13.685 -1.873 15 HG1 THR 7 HG1 THR 7 10.662 15.285 -0.874 16 HG21 THR 7 HG21 THR 7 7.030 15.260 -1.223 17 HG22 THR 7 HG22 THR 7 7.131 13.788 -2.195 18 HG23 THR 7 HG23 THR 7 7.857 15.288 -2.778 19 H LYS 8 HN LYS 8 7.563 11.530 -0.912 20 HA LYS 8 HA LYS 8 9.257 9.533 0.206 21 HB2 LYS 8 HB2 LYS 8 8.053 7.989 -1.410 22 HB3 LYS 8 HB1 LYS 8 7.054 8.820 -0.234 23 HG2 LYS 8 HG2 LYS 8 6.231 10.328 -1.870 24 HG3 LYS 8 HG1 LYS 8 7.419 9.786 -3.060 25 HD2 LYS 8 HD2 LYS 8 6.361 7.659 -3.259 26 HD3 LYS 8 HD1 LYS 8 5.344 7.959 -1.850 27 HE2 LYS 8 HE2 LYS 8 4.112 9.653 -3.039 28 HE3 LYS 8 HE1 LYS 8 5.211 9.547 -4.415 29 HZ1 LYS 8 HZ1 LYS 8 3.606 7.223 -3.488 30 HZ2 LYS 8 HZ2 LYS 8 4.391 7.438 -4.974 31 HZ3 LYS 8 HZ3 LYS 8 3.011 8.347 -4.619 32 H THR 9 HN THR 9 9.450 11.500 -2.580 33 HA THR 9 HA THR 9 11.040 9.836 -4.229 34 HB THR 9 HB THR 9 11.786 12.430 -4.827 35 HG1 THR 9 HG1 THR 9 9.982 13.696 -4.511 36 HG21 THR 9 HG21 THR 9 9.336 10.953 -5.799 37 HG22 THR 9 HG22 THR 9 10.979 10.701 -6.389 38 HG23 THR 9 HG23 THR 9 10.173 12.252 -6.645 39 H ASP 10 HN ASP 10 11.767 12.147 -1.675 40 HA ASP 10 HA ASP 10 14.554 12.304 -1.994 41 HB2 ASP 10 HB2 ASP 10 12.878 12.557 0.520 42 HB3 ASP 10 HB1 ASP 10 14.585 12.972 0.419 43 H TYR 11 HN TYR 11 12.576 10.250 0.097 44 HA TYR 11 HA TYR 11 14.711 8.733 1.142 45 HB2 TYR 11 HB2 TYR 11 11.769 8.081 0.895 46 HB3 TYR 11 HB1 TYR 11 12.920 7.112 1.805 47 HD1 TYR 11 HD1 TYR 11 14.188 8.300 3.704 48 HD2 TYR 11 HD2 TYR 11 10.648 9.833 1.911 49 HE1 TYR 11 HE1 TYR 11 13.800 9.699 5.688 50 HE2 TYR 11 HE2 TYR 11 10.247 11.242 3.886 51 HH TYR 11 HH TYR 11 12.602 11.791 6.253 52 H LEU 12 HN LEU 12 12.672 8.372 -1.699 53 HA LEU 12 HA LEU 12 13.366 5.752 -2.393 54 HB2 LEU 12 HB2 LEU 12 11.522 6.965 -3.437 55 HB3 LEU 12 HB1 LEU 12 12.654 8.080 -4.175 56 HG LEU 12 HG LEU 12 13.586 6.230 -5.519 57 HD11 LEU 12 HD11 LEU 12 13.145 4.363 -4.071 58 HD12 LEU 12 HD12 LEU 12 12.319 4.101 -5.608 59 HD13 LEU 12 HD13 LEU 12 11.409 4.628 -4.194 60 HD21 LEU 12 HD21 LEU 12 10.593 6.401 -5.803 61 HD22 LEU 12 HD22 LEU 12 11.779 6.073 -7.068 62 HD23 LEU 12 HD23 LEU 12 11.704 7.667 -6.318 63 H MET 13 HN MET 13 14.912 8.855 -3.170 64 HA MET 13 HA MET 13 16.887 7.694 -4.861 65 HB2 MET 13 HB2 MET 13 16.851 10.357 -3.430 66 HB3 MET 13 HB1 MET 13 18.043 9.885 -4.633 67 HG2 MET 13 HG2 MET 13 15.105 10.351 -5.022 68 HG3 MET 13 HG1 MET 13 16.457 11.220 -5.748 69 HE1 MET 13 HE1 MET 13 14.342 9.017 -8.478 70 HE2 MET 13 HE2 MET 13 14.559 10.663 -7.878 71 HE3 MET 13 HE3 MET 13 13.704 9.471 -6.899 72 H ARG 14 HN ARG 14 16.697 8.369 -1.435 73 HA ARG 14 HA ARG 14 19.460 7.873 -0.903 74 HB2 ARG 14 HB2 ARG 14 18.062 9.257 0.584 75 HB3 ARG 14 HB1 ARG 14 17.087 7.850 0.981 76 HG2 ARG 14 HG2 ARG 14 19.943 7.481 1.453 77 HG3 ARG 14 HG1 ARG 14 19.213 8.762 2.418 78 HD2 ARG 14 HD2 ARG 14 17.544 7.235 3.254 79 HD3 ARG 14 HD1 ARG 14 18.147 5.950 2.214 80 HE ARG 14 HE ARG 14 19.278 6.868 4.711 81 HH11 ARG 14 HH11 ARG 14 19.857 5.097 1.746 82 HH12 ARG 14 HH12 ARG 14 21.168 4.178 2.407 83 HH21 ARG 14 HH21 ARG 14 20.990 5.637 5.589 84 HH22 ARG 14 HH22 ARG 14 21.803 4.468 4.596 85 H LEU 15 HN LEU 15 16.565 5.916 -1.043 86 HA LEU 15 HA LEU 15 17.902 3.606 0.083 87 HB2 LEU 15 HB2 LEU 15 15.136 4.013 -1.033 88 HB3 LEU 15 HB1 LEU 15 15.724 2.458 -0.475 89 HG LEU 15 HG LEU 15 15.467 4.934 1.238 90 HD11 LEU 15 HD11 LEU 15 13.829 2.410 1.338 91 HD12 LEU 15 HD12 LEU 15 13.316 3.872 0.497 92 HD13 LEU 15 HD13 LEU 15 13.575 3.903 2.242 93 HD21 LEU 15 HD21 LEU 15 17.265 3.576 2.049 94 HD22 LEU 15 HD22 LEU 15 16.301 2.109 1.884 95 HD23 LEU 15 HD23 LEU 15 15.870 3.318 3.097 96 H ARG 16 HN ARG 16 17.419 4.980 -3.009 97 HA ARG 16 HA ARG 16 17.565 2.579 -4.539 98 HB2 ARG 16 HB2 ARG 16 17.526 5.467 -5.108 99 HB3 ARG 16 HB1 ARG 16 18.437 4.503 -6.267 100 HG2 ARG 16 HG2 ARG 16 16.505 3.098 -6.658 101 HG3 ARG 16 HG1 ARG 16 15.588 3.984 -5.441 102 HD2 ARG 16 HD2 ARG 16 15.689 5.993 -6.776 103 HD3 ARG 16 HD1 ARG 16 16.729 5.194 -7.956 104 HE ARG 16 HE ARG 16 14.374 3.696 -7.710 105 HH11 ARG 16 HH11 ARG 16 15.447 6.806 -8.952 106 HH12 ARG 16 HH12 ARG 16 14.146 6.929 -10.094 107 HH21 ARG 16 HH21 ARG 16 12.673 3.865 -9.188 108 HH22 ARG 16 HH22 ARG 16 12.555 5.279 -10.209 109 H ARG 17 HN ARG 17 19.813 4.131 -2.667 110 HA ARG 17 HA ARG 17 22.106 3.530 -4.317 111 HB2 ARG 17 HB2 ARG 17 21.878 4.533 -1.479 112 HB3 ARG 17 HB1 ARG 17 23.406 4.279 -2.314 113 HG2 ARG 17 HG2 ARG 17 22.511 5.871 -4.090 114 HG3 ARG 17 HG1 ARG 17 21.269 6.293 -2.911 115 HD2 ARG 17 HD2 ARG 17 24.251 6.547 -2.558 116 HD3 ARG 17 HD1 ARG 17 23.104 7.865 -2.780 117 HE ARG 17 HE ARG 17 23.299 6.155 -0.388 118 HH11 ARG 17 HH11 ARG 17 22.275 9.136 -1.938 119 HH12 ARG 17 HH12 ARG 17 21.823 9.895 -0.442 120 HH21 ARG 17 HH21 ARG 17 22.710 7.159 1.563 121 HH22 ARG 17 HH22 ARG 17 22.070 8.771 1.544 122 H CYS 18 HN CYS 18 20.098 1.885 -2.188 123 HA CYS 18 HA CYS 18 22.113 -0.096 -1.438 124 HB2 CYS 18 HB2 CYS 18 19.183 -0.073 -0.689 125 HB3 CYS 18 HB1 CYS 18 20.481 -0.979 0.079 126 HG CYS 18 HG CYS 18 20.651 0.741 1.963 127 H GLN 19 HN GLN 19 22.208 -2.095 -2.323 128 HA GLN 19 HA GLN 19 20.166 -2.786 -4.341 129 HB2 GLN 19 HB2 GLN 19 23.115 -3.454 -4.414 130 HB3 GLN 19 HB1 GLN 19 21.930 -3.854 -5.646 131 HG2 GLN 19 HG2 GLN 19 22.387 -1.002 -4.883 132 HG3 GLN 19 HG1 GLN 19 23.504 -1.822 -5.973 133 HE21 GLN 19 HE21 GLN 19 22.948 -0.446 -7.658 134 HE22 GLN 19 HE22 GLN 19 21.450 -0.607 -8.508 135 H THR 20 HN THR 20 21.009 -5.296 -4.934 136 HA THR 20 HA THR 20 20.785 -7.464 -4.427 137 HB THR 20 HB THR 20 21.979 -8.403 -2.626 138 HG1 THR 20 HG1 THR 20 22.363 -7.412 -0.736 139 HG21 THR 20 HG21 THR 20 24.127 -7.225 -2.679 140 HG22 THR 20 HG22 THR 20 23.330 -5.811 -3.371 141 HG23 THR 20 HG23 THR 20 23.398 -7.319 -4.281 142 H ILE 21 HN ILE 21 18.883 -5.263 -2.844 143 HA ILE 21 HA ILE 21 16.818 -5.411 -1.883 144 HB ILE 21 HB ILE 21 17.110 -8.386 -2.341 145 HG12 ILE 21 HG12 ILE 21 15.406 -6.342 -3.779 146 HG13 ILE 21 HG11 ILE 21 16.964 -6.910 -4.364 147 HG21 ILE 21 HG21 ILE 21 14.583 -6.916 -1.608 148 HG22 ILE 21 HG22 ILE 21 15.596 -7.742 -0.429 149 HG23 ILE 21 HG23 ILE 21 14.830 -8.659 -1.728 150 HD11 ILE 21 HD11 ILE 21 14.497 -8.584 -3.956 151 HD12 ILE 21 HD12 ILE 21 16.062 -9.183 -4.506 152 HD13 ILE 21 HD13 ILE 21 15.158 -8.040 -5.497 153 H ASP 22 HN ASP 22 18.901 -8.048 -0.775 154 HA ASP 22 HA ASP 22 18.006 -8.305 1.834 155 HB2 ASP 22 HB2 ASP 22 19.432 -9.982 1.048 156 HB3 ASP 22 HB1 ASP 22 20.622 -8.832 0.455 157 H THR 23 HN THR 23 20.415 -6.075 0.500 158 HA THR 23 HA THR 23 21.273 -4.993 2.962 159 HB THR 23 HB THR 23 21.216 -3.474 0.358 160 HG1 THR 23 HG1 THR 23 22.236 -5.243 -0.345 161 HG21 THR 23 HG21 THR 23 23.271 -2.490 1.205 162 HG22 THR 23 HG22 THR 23 23.198 -3.516 2.639 163 HG23 THR 23 HG23 THR 23 21.969 -2.277 2.371 164 H LEU 24 HN LEU 24 18.588 -4.259 0.829 165 HA LEU 24 HA LEU 24 17.874 -1.767 1.987 166 HB2 LEU 24 HB2 LEU 24 17.169 -2.481 -0.271 167 HB3 LEU 24 HB1 LEU 24 16.158 -3.717 0.450 168 HG LEU 24 HG LEU 24 14.894 -1.861 1.609 169 HD11 LEU 24 HD11 LEU 24 15.059 0.371 0.563 170 HD12 LEU 24 HD12 LEU 24 16.484 -0.176 -0.318 171 HD13 LEU 24 HD13 LEU 24 16.517 -0.083 1.441 172 HD21 LEU 24 HD21 LEU 24 13.609 -1.298 -0.413 173 HD22 LEU 24 HD22 LEU 24 13.998 -3.014 -0.315 174 HD23 LEU 24 HD23 LEU 24 14.907 -1.963 -1.404 175 H GLU 25 HN GLU 25 16.960 -5.108 2.608 176 HA GLU 25 HA GLU 25 14.818 -4.596 4.365 177 HB2 GLU 25 HB2 GLU 25 15.315 -6.783 3.263 178 HB3 GLU 25 HB1 GLU 25 16.661 -6.990 4.373 179 HG2 GLU 25 HG2 GLU 25 14.846 -8.245 5.226 180 HG3 GLU 25 HG1 GLU 25 15.030 -6.826 6.253 181 H ARG 26 HN ARG 26 18.259 -4.515 4.808 182 HA ARG 26 HA ARG 26 18.120 -4.686 7.673 183 HB2 ARG 26 HB2 ARG 26 20.294 -4.301 5.680 184 HB3 ARG 26 HB1 ARG 26 20.587 -3.773 7.334 185 HG2 ARG 26 HG2 ARG 26 19.893 -6.066 8.080 186 HG3 ARG 26 HG1 ARG 26 19.906 -6.538 6.381 187 HD2 ARG 26 HD2 ARG 26 22.304 -5.573 6.378 188 HD3 ARG 26 HD1 ARG 26 22.197 -5.729 8.132 189 HE ARG 26 HE ARG 26 22.248 -8.034 7.920 190 HH11 ARG 26 HH11 ARG 26 22.072 -6.497 4.783 191 HH12 ARG 26 HH12 ARG 26 22.271 -7.981 3.894 192 HH21 ARG 26 HH21 ARG 26 22.561 -9.987 6.758 193 HH22 ARG 26 HH22 ARG 26 22.566 -9.954 5.023 194 H VAL 27 HN VAL 27 18.533 -2.082 5.295 195 HA VAL 27 HA VAL 27 18.988 -0.084 7.255 196 HB VAL 27 HB VAL 27 19.733 0.220 4.941 197 HG11 VAL 27 HG11 VAL 27 17.859 -0.798 3.774 198 HG12 VAL 27 HG12 VAL 27 18.166 0.836 3.178 199 HG13 VAL 27 HG13 VAL 27 16.815 0.532 4.271 200 HG21 VAL 27 HG21 VAL 27 19.495 2.182 6.319 201 HG22 VAL 27 HG22 VAL 27 17.787 2.308 5.907 202 HG23 VAL 27 HG23 VAL 27 19.012 2.571 4.666 203 H ILE 28 HN ILE 28 16.038 -1.193 5.589 204 HA ILE 28 HA ILE 28 14.377 0.829 6.698 205 HB ILE 28 HB ILE 28 12.471 -0.619 6.081 206 HG12 ILE 28 HG12 ILE 28 14.535 -2.553 5.022 207 HG13 ILE 28 HG11 ILE 28 13.706 -2.776 6.558 208 HG21 ILE 28 HG21 ILE 28 13.390 0.908 4.447 209 HG22 ILE 28 HG22 ILE 28 12.877 -0.585 3.655 210 HG23 ILE 28 HG23 ILE 28 14.590 -0.293 3.959 211 HD11 ILE 28 HD11 ILE 28 12.387 -2.620 3.858 212 HD12 ILE 28 HD12 ILE 28 11.569 -2.884 5.398 213 HD13 ILE 28 HD13 ILE 28 12.696 -4.091 4.777 214 H GLU 29 HN GLU 29 15.494 -2.267 7.820 215 HA GLU 29 HA GLU 29 13.661 -2.609 9.942 216 HB2 GLU 29 HB2 GLU 29 14.950 -4.488 9.131 217 HB3 GLU 29 HB1 GLU 29 16.459 -3.668 9.498 218 HG2 GLU 29 HG2 GLU 29 16.089 -5.332 11.149 219 HG3 GLU 29 HG1 GLU 29 15.867 -3.752 11.897 220 H LYS 30 HN LYS 30 16.799 -1.034 9.665 221 HA LYS 30 HA LYS 30 17.007 -0.438 12.457 222 HB2 LYS 30 HB2 LYS 30 18.569 0.191 10.004 223 HB3 LYS 30 HB1 LYS 30 18.789 1.240 11.397 224 HG2 LYS 30 HG2 LYS 30 19.571 -0.536 12.733 225 HG3 LYS 30 HG1 LYS 30 19.032 -1.745 11.568 226 HD2 LYS 30 HD2 LYS 30 20.739 -1.195 10.048 227 HD3 LYS 30 HD1 LYS 30 21.098 0.323 10.873 228 HE2 LYS 30 HE2 LYS 30 22.823 -1.310 11.340 229 HE3 LYS 30 HE1 LYS 30 21.918 -0.946 12.808 230 HZ1 LYS 30 HZ1 LYS 30 20.628 -2.991 12.428 231 HZ2 LYS 30 HZ2 LYS 30 22.273 -3.294 12.650 232 HZ3 LYS 30 HZ3 LYS 30 21.611 -3.351 11.097 233 H ASN 31 HN ASN 31 16.228 1.484 9.554 234 HA ASN 31 HA ASN 31 15.866 3.934 10.881 235 HB2 ASN 31 HB2 ASN 31 14.661 2.905 8.308 236 HB3 ASN 31 HB1 ASN 31 14.472 4.558 8.873 237 HD21 ASN 31 HD21 ASN 31 17.234 4.630 9.956 238 HD22 ASN 31 HD22 ASN 31 18.258 4.759 8.568 239 H LYS 32 HN LYS 32 13.865 1.146 10.635 240 HA LYS 32 HA LYS 32 11.325 2.184 11.076 241 HB2 LYS 32 HB2 LYS 32 11.798 -0.167 10.504 242 HB3 LYS 32 HB1 LYS 32 12.500 -0.411 12.093 243 HG2 LYS 32 HG2 LYS 32 10.083 0.460 12.834 244 HG3 LYS 32 HG1 LYS 32 9.666 -0.245 11.275 245 HD2 LYS 32 HD2 LYS 32 10.982 -1.616 13.615 246 HD3 LYS 32 HD1 LYS 32 9.381 -1.932 12.951 247 HE2 LYS 32 HE2 LYS 32 10.306 -2.849 10.951 248 HE3 LYS 32 HE1 LYS 32 11.929 -2.315 11.384 249 HZ1 LYS 32 HZ1 LYS 32 11.839 -4.598 11.867 250 HZ2 LYS 32 HZ2 LYS 32 10.333 -4.468 12.639 251 HZ3 LYS 32 HZ3 LYS 32 11.716 -3.826 13.372 252 H TYR 33 HN TYR 33 13.992 1.696 13.282 253 HA TYR 33 HA TYR 33 12.283 2.379 15.564 254 HB2 TYR 33 HB2 TYR 33 15.163 1.456 15.586 255 HB3 TYR 33 HB1 TYR 33 14.092 1.598 16.975 256 HD1 TYR 33 HD1 TYR 33 11.815 0.186 16.707 257 HD2 TYR 33 HD2 TYR 33 15.477 -0.643 14.694 258 HE1 TYR 33 HE1 TYR 33 11.085 -2.131 16.336 259 HE2 TYR 33 HE2 TYR 33 14.754 -2.968 14.330 260 HH TYR 33 HH TYR 33 13.219 -4.562 15.059 261 H GLU 34 HN GLU 34 13.845 4.052 13.330 262 HA GLU 34 HA GLU 34 14.926 6.032 15.215 263 HB2 GLU 34 HB2 GLU 34 15.492 5.614 12.280 264 HB3 GLU 34 HB1 GLU 34 16.087 6.987 13.205 265 HG2 GLU 34 HG2 GLU 34 17.317 5.460 14.669 266 HG3 GLU 34 HG1 GLU 34 16.736 4.090 13.721 267 H LEU 35 HN LEU 35 12.706 5.529 12.560 268 HA LEU 35 HA LEU 35 12.060 8.250 12.121 269 HB2 LEU 35 HB2 LEU 35 10.414 5.789 11.575 270 HB3 LEU 35 HB1 LEU 35 10.130 7.378 10.893 271 HG LEU 35 HG LEU 35 12.453 5.537 10.340 272 HD11 LEU 35 HD11 LEU 35 10.342 5.039 9.182 273 HD12 LEU 35 HD12 LEU 35 11.621 5.543 8.079 274 HD13 LEU 35 HD13 LEU 35 10.340 6.673 8.519 275 HD21 LEU 35 HD21 LEU 35 13.342 7.758 10.446 276 HD22 LEU 35 HD22 LEU 35 12.017 8.391 9.471 277 HD23 LEU 35 HD23 LEU 35 13.200 7.298 8.750 278 H SER 36 HN SER 36 10.124 9.367 12.647 279 HA SER 36 HA SER 36 9.208 8.735 15.352 280 HB2 SER 36 HB2 SER 36 8.520 11.248 13.854 281 HB3 SER 36 HB1 SER 36 8.710 11.006 15.591 282 HG SER 36 HG SER 36 10.958 10.750 15.235 283 H ASP 37 H ASP 37 8.249 7.603 12.598 284 HA ASP 37 HA ASP 37 6.350 6.498 11.953 285 HB2 ASP 37 3HB ASP 37 5.147 7.892 14.440 286 HB3 ASP 37 2HB ASP 37 4.180 6.894 13.361 287 H ASN 38 HN ASN 38 6.378 9.978 12.394 288 HA ASN 38 HA ASN 38 4.043 10.450 10.806 289 HB2 ASN 38 HB2 ASN 38 4.893 12.821 10.702 290 HB3 ASN 38 HB1 ASN 38 4.651 12.189 12.325 291 HD21 ASN 38 HD21 ASN 38 6.963 13.279 9.978 292 HD22 ASN 38 HD22 ASN 38 8.314 13.332 11.056 293 H GLU 39 HN GLU 39 7.500 10.271 10.136 294 HA GLU 39 HA GLU 39 7.066 10.965 7.337 295 HB2 GLU 39 HB2 GLU 39 9.455 10.946 7.119 296 HB3 GLU 39 HB1 GLU 39 9.065 11.798 8.606 297 HG2 GLU 39 HG2 GLU 39 9.807 8.891 8.576 298 HG3 GLU 39 HG1 GLU 39 11.015 10.168 8.656 299 H LEU 40 HN LEU 40 7.011 8.268 9.313 300 HA LEU 40 HA LEU 40 8.084 6.242 7.715 301 HB2 LEU 40 HB2 LEU 40 7.487 5.943 10.066 302 HB3 LEU 40 HB1 LEU 40 5.790 6.138 9.671 303 HG LEU 40 HG LEU 40 5.935 4.063 8.287 304 HD11 LEU 40 HD11 LEU 40 8.421 4.182 7.977 305 HD12 LEU 40 HD12 LEU 40 7.802 2.604 8.462 306 HD13 LEU 40 HD13 LEU 40 8.585 3.644 9.647 307 HD21 LEU 40 HD21 LEU 40 5.947 2.540 10.207 308 HD22 LEU 40 HD22 LEU 40 5.027 4.012 10.533 309 HD23 LEU 40 HD23 LEU 40 6.648 3.815 11.205 310 H ALA 41 HN ALA 41 5.110 7.998 7.487 311 HA ALA 41 HA ALA 41 3.548 6.219 6.001 312 HB1 ALA 41 HB1 ALA 41 3.573 9.233 5.929 313 HB2 ALA 41 HB2 ALA 41 2.594 8.210 6.982 314 HB3 ALA 41 HB3 ALA 41 2.313 8.212 5.242 315 H VAL 42 HN VAL 42 5.693 8.839 4.814 316 HA VAL 42 HA VAL 42 5.363 7.948 2.099 317 HB VAL 42 HB VAL 42 7.208 9.623 1.610 318 HG11 VAL 42 HG11 VAL 42 4.626 9.956 1.637 319 HG12 VAL 42 HG12 VAL 42 5.690 11.354 1.494 320 HG13 VAL 42 HG13 VAL 42 4.958 10.962 3.046 321 HG21 VAL 42 HG21 VAL 42 7.658 11.292 3.372 322 HG22 VAL 42 HG22 VAL 42 8.257 9.688 3.799 323 HG23 VAL 42 HG23 VAL 42 6.764 10.292 4.518 324 H PHE 43 HN PHE 43 7.550 7.326 4.705 325 HA PHE 43 HA PHE 43 9.743 6.379 3.209 326 HB2 PHE 43 HB2 PHE 43 9.741 6.897 5.679 327 HB3 PHE 43 HB1 PHE 43 8.886 5.379 5.931 328 HD1 PHE 43 HD1 PHE 43 12.049 6.888 4.823 329 HD2 PHE 43 HD2 PHE 43 10.025 3.301 5.875 330 HE1 PHE 43 HE1 PHE 43 14.205 5.694 4.905 331 HE2 PHE 43 HE2 PHE 43 12.167 2.100 5.958 332 HZ PHE 43 HZ PHE 43 14.264 3.303 5.473 333 H TYR 44 HN TYR 44 6.803 4.839 4.397 334 HA TYR 44 HA TYR 44 7.406 2.198 3.712 335 HB2 TYR 44 HB2 TYR 44 4.894 3.740 4.138 336 HB3 TYR 44 HB1 TYR 44 4.755 2.193 3.311 337 HD1 TYR 44 HD1 TYR 44 6.868 0.647 4.781 338 HD2 TYR 44 HD2 TYR 44 3.860 3.312 6.191 339 HE1 TYR 44 HE1 TYR 44 6.863 -0.512 6.946 340 HE2 TYR 44 HE2 TYR 44 3.848 2.153 8.358 341 HH TYR 44 HH TYR 44 4.481 0.128 9.380 342 H SER 45 HN SER 45 5.873 4.786 1.849 343 HA SER 45 HA SER 45 5.385 3.332 -0.493 344 HB2 SER 45 HB2 SER 45 5.789 6.272 0.041 345 HB3 SER 45 HB1 SER 45 5.472 5.657 -1.581 346 HG SER 45 HG SER 45 3.453 5.562 -1.072 347 H ALA 46 HN ALA 46 8.208 5.130 0.614 348 HA ALA 46 HA ALA 46 9.672 4.998 -1.792 349 HB1 ALA 46 HB1 ALA 46 10.211 6.558 0.010 350 HB2 ALA 46 HB2 ALA 46 11.608 5.579 -0.434 351 HB3 ALA 46 HB3 ALA 46 10.704 5.209 1.032 352 H ALA 47 HN ALA 47 9.670 2.935 1.089 353 HA ALA 47 HA ALA 47 11.663 1.141 0.208 354 HB1 ALA 47 HB1 ALA 47 10.986 1.306 2.555 355 HB2 ALA 47 HB2 ALA 47 10.851 -0.346 1.963 356 HB3 ALA 47 HB3 ALA 47 9.406 0.644 2.148 357 H ASP 48 HN ASP 48 8.113 0.933 0.108 358 HA ASP 48 HA ASP 48 7.908 -1.549 -1.170 359 HB2 ASP 48 HB2 ASP 48 6.115 0.846 -0.969 360 HB3 ASP 48 HB1 ASP 48 5.682 -0.461 -2.062 361 H HIS 49 HN HIS 49 8.081 1.729 -2.484 362 HA HIS 49 HA HIS 49 7.789 1.101 -5.211 363 HB2 HIS 49 HB2 HIS 49 8.090 3.409 -3.729 364 HB3 HIS 49 HB1 HIS 49 9.603 3.340 -4.618 365 HD1 HIS 49 HD1 HIS 49 6.001 4.119 -4.992 366 HD2 HIS 49 HD2 HIS 49 9.314 3.512 -7.452 367 HE1 HIS 49 HE1 HIS 49 5.353 5.020 -7.250 368 HE2 HIS 49 HE2 HIS 49 7.435 4.830 -8.653 369 H ARG 50 HN ARG 50 10.672 1.460 -3.188 370 HA ARG 50 HA ARG 50 12.596 1.038 -5.194 371 HB2 ARG 50 HB2 ARG 50 13.149 2.053 -3.059 372 HB3 ARG 50 HB1 ARG 50 12.729 0.570 -2.215 373 HG2 ARG 50 HG2 ARG 50 15.125 0.795 -2.367 374 HG3 ARG 50 HG1 ARG 50 14.588 -0.579 -3.333 375 HD2 ARG 50 HD2 ARG 50 14.682 0.863 -5.351 376 HD3 ARG 50 HD1 ARG 50 15.328 2.163 -4.352 377 HE ARG 50 HE ARG 50 17.140 0.390 -3.835 378 HH11 ARG 50 HH11 ARG 50 15.564 0.941 -6.924 379 HH12 ARG 50 HH12 ARG 50 16.903 0.311 -7.842 380 HH21 ARG 50 HH21 ARG 50 18.889 -0.422 -5.049 381 HH22 ARG 50 HH22 ARG 50 18.780 -0.476 -6.786 382 H LEU 51 HN LEU 51 10.958 -1.213 -3.007 383 HA LEU 51 HA LEU 51 12.494 -3.471 -3.754 384 HB2 LEU 51 HB2 LEU 51 11.149 -3.303 -1.667 385 HB3 LEU 51 HB1 LEU 51 9.691 -3.427 -2.636 386 HG LEU 51 HG LEU 51 10.376 -5.681 -3.370 387 HD11 LEU 51 HD11 LEU 51 12.609 -5.428 -1.363 388 HD12 LEU 51 HD12 LEU 51 12.833 -5.289 -3.105 389 HD13 LEU 51 HD13 LEU 51 12.261 -6.805 -2.410 390 HD21 LEU 51 HD21 LEU 51 8.973 -5.288 -1.334 391 HD22 LEU 51 HD22 LEU 51 10.436 -5.464 -0.367 392 HD23 LEU 51 HD23 LEU 51 9.856 -6.812 -1.341 393 H ALA 52 HN ALA 52 9.443 -2.139 -4.919 394 HA ALA 52 HA ALA 52 8.682 -4.234 -6.609 395 HB1 ALA 52 HB1 ALA 52 7.300 -2.562 -7.754 396 HB2 ALA 52 HB2 ALA 52 8.169 -1.276 -6.913 397 HB3 ALA 52 HB3 ALA 52 7.185 -2.421 -6.000 398 H GLU 53 HN GLU 53 10.554 -1.284 -7.397 399 HA GLU 53 HA GLU 53 10.929 -1.959 -10.116 400 HB2 GLU 53 HB2 GLU 53 12.776 -0.245 -10.026 401 HB3 GLU 53 HB1 GLU 53 11.197 0.323 -9.497 402 HG2 GLU 53 HG2 GLU 53 11.886 0.027 -7.165 403 HG3 GLU 53 HG1 GLU 53 13.475 -0.506 -7.710 404 H LEU 54 HN LEU 54 12.747 -2.687 -7.212 405 HA LEU 54 HA LEU 54 15.034 -3.698 -8.573 406 HB2 LEU 54 HB2 LEU 54 14.655 -2.873 -6.080 407 HB3 LEU 54 HB1 LEU 54 14.363 -4.581 -5.814 408 HG LEU 54 HG LEU 54 16.580 -5.152 -6.529 409 HD11 LEU 54 HD11 LEU 54 18.169 -3.242 -7.102 410 HD12 LEU 54 HD12 LEU 54 16.718 -2.283 -7.391 411 HD13 LEU 54 HD13 LEU 54 17.017 -3.737 -8.343 412 HD21 LEU 54 HD21 LEU 54 16.323 -4.365 -4.214 413 HD22 LEU 54 HD22 LEU 54 16.713 -2.725 -4.740 414 HD23 LEU 54 HD23 LEU 54 17.920 -4.003 -4.868 415 H THR 55 HN THR 55 12.057 -5.127 -7.353 416 HA THR 55 HA THR 55 12.892 -7.835 -7.653 417 HB THR 55 HB THR 55 10.083 -6.706 -7.582 418 HG1 THR 55 HG1 THR 55 11.176 -6.207 -5.688 419 HG21 THR 55 HG21 THR 55 9.483 -8.993 -6.784 420 HG22 THR 55 HG22 THR 55 11.120 -9.514 -7.176 421 HG23 THR 55 HG23 THR 55 10.042 -8.959 -8.457 422 H MET 56 HN MET 56 11.072 -5.597 -9.716 423 HA MET 56 HA MET 56 10.713 -7.567 -11.793 424 HB2 MET 56 HB2 MET 56 10.167 -4.603 -11.668 425 HB3 MET 56 HB1 MET 56 9.864 -5.571 -13.101 426 HG2 MET 56 HG2 MET 56 8.639 -6.101 -10.407 427 HG3 MET 56 HG1 MET 56 7.865 -5.187 -11.696 428 HE1 MET 56 HE1 MET 56 8.607 -6.862 -14.370 429 HE2 MET 56 HE2 MET 56 7.092 -6.090 -13.896 430 HE3 MET 56 HE3 MET 56 7.102 -7.779 -14.402 431 H ASN 57 HN ASN 57 13.211 -5.578 -10.816 432 HA ASN 57 HA ASN 57 15.245 -5.024 -11.643 433 HB2 ASN 57 HB2 ASN 57 14.921 -7.564 -12.376 434 HB3 ASN 57 HB1 ASN 57 14.961 -6.849 -13.982 435 HD21 ASN 57 HD21 ASN 57 16.895 -7.873 -14.463 436 HD22 ASN 57 HD22 ASN 57 18.401 -7.346 -13.801 437 H LYS 58 HN LYS 58 13.006 -3.497 -12.452 438 HA LYS 58 HA LYS 58 14.135 -2.177 -14.766 439 HB2 LYS 58 HB2 LYS 58 12.316 -3.948 -15.462 440 HB3 LYS 58 HB1 LYS 58 11.192 -2.734 -14.875 441 HG2 LYS 58 HG2 LYS 58 11.389 -2.418 -17.211 442 HG3 LYS 58 HG1 LYS 58 12.280 -1.105 -16.444 443 HD2 LYS 58 HD2 LYS 58 14.373 -2.161 -16.903 444 HD3 LYS 58 HD1 LYS 58 13.573 -3.648 -17.415 445 HE2 LYS 58 HE2 LYS 58 14.368 -2.373 -19.337 446 HE3 LYS 58 HE1 LYS 58 12.613 -2.487 -19.331 447 HZ1 LYS 58 HZ1 LYS 58 13.927 -0.138 -18.136 448 HZ2 LYS 58 HZ2 LYS 58 12.383 -0.271 -18.814 449 HZ3 LYS 58 HZ3 LYS 58 13.743 -0.230 -19.813 450 H LEU 59 HN LEU 59 14.333 -0.178 -14.049 451 HA LEU 59 HA LEU 59 12.810 0.863 -11.885 452 HB2 LEU 59 HB2 LEU 59 15.082 1.668 -13.481 453 HB3 LEU 59 HB1 LEU 59 13.999 3.020 -13.213 454 HG LEU 59 HG LEU 59 14.128 2.560 -10.757 455 HD11 LEU 59 HD11 LEU 59 14.756 0.212 -10.874 456 HD12 LEU 59 HD12 LEU 59 15.933 1.136 -9.943 457 HD13 LEU 59 HD13 LEU 59 16.301 0.653 -11.602 458 HD21 LEU 59 HD21 LEU 59 15.481 4.299 -11.749 459 HD22 LEU 59 HD22 LEU 59 16.711 3.123 -12.202 460 HD23 LEU 59 HD23 LEU 59 16.405 3.468 -10.500 461 H TYR 60 HN TYR 60 10.997 1.969 -11.849 462 HA TYR 60 HA TYR 60 10.007 3.269 -14.277 463 HB2 TYR 60 HB2 TYR 60 8.524 1.236 -12.607 464 HB3 TYR 60 HB1 TYR 60 7.674 2.416 -13.593 465 HD1 TYR 60 HD1 TYR 60 9.075 2.509 -16.075 466 HD2 TYR 60 HD2 TYR 60 8.341 -0.850 -13.564 467 HE1 TYR 60 HE1 TYR 60 9.233 1.020 -18.025 468 HE2 TYR 60 HE2 TYR 60 8.500 -2.348 -15.507 469 HH TYR 60 HH TYR 60 8.293 -2.286 -17.906 470 H ASP 61 HN ASP 61 8.944 5.191 -13.863 471 HA ASP 61 HA ASP 61 9.303 6.454 -11.374 472 HB2 ASP 61 HB2 ASP 61 7.361 7.146 -13.592 473 HB3 ASP 61 HB1 ASP 61 7.743 8.193 -12.229 474 H LYS 62 HN LYS 62 6.372 5.242 -12.915 475 HA LYS 62 HA LYS 62 5.071 5.089 -10.301 476 HB2 LYS 62 HB2 LYS 62 2.975 4.833 -11.573 477 HB3 LYS 62 HB1 LYS 62 3.822 6.301 -12.036 478 HG2 LYS 62 HG2 LYS 62 3.403 5.612 -14.126 479 HG3 LYS 62 HG1 LYS 62 4.790 4.554 -13.869 480 HD2 LYS 62 HD2 LYS 62 3.097 3.154 -14.712 481 HD3 LYS 62 HD1 LYS 62 3.118 2.845 -12.975 482 HE2 LYS 62 HE2 LYS 62 0.840 3.025 -13.659 483 HE3 LYS 62 HE1 LYS 62 1.238 4.478 -12.743 484 HZ1 LYS 62 HZ1 LYS 62 1.399 5.731 -14.726 485 HZ2 LYS 62 HZ2 LYS 62 -0.038 4.849 -14.836 486 HZ3 LYS 62 HZ3 LYS 62 1.327 4.346 -15.701 487 H ILE 63 HN ILE 63 4.219 3.074 -9.584 488 HA ILE 63 HA ILE 63 5.452 0.793 -10.971 489 HB ILE 63 HB ILE 63 4.555 1.066 -8.102 490 HG12 ILE 63 HG12 ILE 63 6.668 2.185 -8.554 491 HG13 ILE 63 HG11 ILE 63 6.962 0.726 -7.612 492 HG21 ILE 63 HG21 ILE 63 4.085 -1.170 -8.682 493 HG22 ILE 63 HG22 ILE 63 5.649 -1.204 -7.864 494 HG23 ILE 63 HG23 ILE 63 5.569 -1.317 -9.625 495 HD11 ILE 63 HD11 ILE 63 7.480 -0.395 -9.843 496 HD12 ILE 63 HD12 ILE 63 8.653 0.762 -9.214 497 HD13 ILE 63 HD13 ILE 63 7.547 1.239 -10.500 498 HA PRO 64 HA PRO 64 1.333 -0.325 -12.365 499 HB2 PRO 64 HB2 PRO 64 2.743 -2.921 -12.785 500 HB3 PRO 64 HB1 PRO 64 1.783 -1.960 -13.925 501 HG2 PRO 64 HG2 PRO 64 4.423 -2.053 -14.111 502 HG3 PRO 64 HG1 PRO 64 3.521 -0.564 -14.446 503 HD2 PRO 64 HD2 PRO 64 5.152 -1.279 -12.060 504 HD3 PRO 64 HD1 PRO 64 4.923 0.294 -12.849 505 H SER 65 HN SER 65 -0.345 -1.425 -11.440 506 HA SER 65 HA SER 65 -0.258 -2.110 -8.765 507 HB2 SER 65 HB2 SER 65 -2.383 -3.476 -10.209 508 HB3 SER 65 HB1 SER 65 -2.484 -2.186 -9.006 509 HG SER 65 HG SER 65 -2.096 -0.670 -10.613 510 H SER 66 H SER 66 0.015 -4.258 -11.573 511 HA SER 66 HA SER 66 -0.256 -6.699 -10.065 512 HB2 SER 66 3HB SER 66 0.395 -7.841 -12.149 513 HB3 SER 66 2HB SER 66 -0.763 -6.582 -12.543 514 HG SER 66 HG SER 66 1.032 -5.253 -13.168 515 H VAL 67 HN VAL 67 2.267 -4.481 -10.128 516 HA VAL 67 HA VAL 67 4.395 -6.435 -9.974 517 HB VAL 67 HB VAL 67 4.436 -3.452 -9.488 518 HG11 VAL 67 HG11 VAL 67 6.698 -5.437 -9.703 519 HG12 VAL 67 HG12 VAL 67 6.249 -4.502 -8.278 520 HG13 VAL 67 HG13 VAL 67 6.891 -3.686 -9.707 521 HG21 VAL 67 HG21 VAL 67 3.885 -4.240 -11.801 522 HG22 VAL 67 HG22 VAL 67 5.467 -5.017 -11.850 523 HG23 VAL 67 HG23 VAL 67 5.347 -3.266 -11.684 524 H TRP 68 HN TRP 68 2.353 -4.656 -7.777 525 HA TRP 68 HA TRP 68 3.888 -4.883 -5.429 526 HB2 TRP 68 HB2 TRP 68 0.881 -4.761 -5.680 527 HB3 TRP 68 HB1 TRP 68 1.809 -4.434 -4.221 528 HD1 TRP 68 HD1 TRP 68 0.120 -2.666 -6.852 529 HE1 TRP 68 HE1 TRP 68 0.964 -0.246 -7.108 530 HE3 TRP 68 HE3 TRP 68 4.436 -3.047 -4.166 531 HZ2 TRP 68 HZ2 TRP 68 3.171 1.301 -6.259 532 HZ3 TRP 68 HZ3 TRP 68 5.859 -1.056 -3.933 533 HH2 TRP 68 HH2 TRP 68 5.244 1.069 -4.956 534 H LYS 69 HN LYS 69 2.258 -7.221 -7.224 535 HA LYS 69 HA LYS 69 1.549 -9.031 -5.128 536 HB2 LYS 69 HB2 LYS 69 0.571 -8.909 -7.470 537 HB3 LYS 69 HB1 LYS 69 2.031 -9.705 -8.029 538 HG2 LYS 69 HG2 LYS 69 0.396 -11.383 -7.788 539 HG3 LYS 69 HG1 LYS 69 1.498 -11.567 -6.420 540 HD2 LYS 69 HD2 LYS 69 -0.039 -10.565 -4.930 541 HD3 LYS 69 HD1 LYS 69 -1.063 -10.000 -6.254 542 HE2 LYS 69 HE2 LYS 69 -2.101 -11.912 -5.230 543 HE3 LYS 69 HE1 LYS 69 -1.532 -12.361 -6.836 544 HZ1 LYS 69 HZ1 LYS 69 -1.054 -14.045 -5.123 545 HZ2 LYS 69 HZ2 LYS 69 -0.056 -12.929 -4.312 546 HZ3 LYS 69 HZ3 LYS 69 0.351 -13.458 -5.867 547 H PHE 70 HN PHE 70 4.494 -8.254 -6.685 548 HA PHE 70 HA PHE 70 5.687 -10.848 -6.047 549 HB2 PHE 70 HB2 PHE 70 6.863 -8.480 -7.515 550 HB3 PHE 70 HB1 PHE 70 7.643 -10.041 -7.298 551 HD1 PHE 70 HD1 PHE 70 5.776 -12.030 -7.937 552 HD2 PHE 70 HD2 PHE 70 6.169 -8.163 -9.676 553 HE1 PHE 70 HE1 PHE 70 4.713 -12.851 -10.000 554 HE2 PHE 70 HE2 PHE 70 5.115 -8.979 -11.739 555 HZ PHE 70 HZ PHE 70 4.384 -11.322 -11.904 556 H ILE 71 HN ILE 71 5.017 -8.310 -4.243 557 HA ILE 71 HA ILE 71 7.645 -7.907 -3.061 558 HB ILE 71 HB ILE 71 4.988 -6.578 -2.753 559 HG12 ILE 71 HG12 ILE 71 6.401 -4.543 -2.935 560 HG13 ILE 71 HG11 ILE 71 7.832 -5.564 -3.010 561 HG21 ILE 71 HG21 ILE 71 5.706 -5.395 -0.742 562 HG22 ILE 71 HG22 ILE 71 7.175 -6.369 -0.685 563 HG23 ILE 71 HG23 ILE 71 5.604 -7.132 -0.445 564 HD11 ILE 71 HD11 ILE 71 7.095 -6.496 -5.108 565 HD12 ILE 71 HD12 ILE 71 7.124 -4.738 -5.210 566 HD13 ILE 71 HD13 ILE 71 5.592 -5.586 -5.015 567 H ARG 72 HN ARG 72 8.370 -8.966 -1.353 568 HA ARG 72 HA ARG 72 6.566 -10.816 0.020 569 HB2 ARG 72 HB2 ARG 72 9.579 -10.692 -0.166 570 HB3 ARG 72 HB1 ARG 72 8.716 -11.826 0.862 571 HG2 ARG 72 HG2 ARG 72 8.064 -11.725 -2.046 572 HG3 ARG 72 HG1 ARG 72 9.542 -12.531 -1.521 573 HD2 ARG 72 HD2 ARG 72 7.963 -14.247 -1.560 574 HD3 ARG 72 HD1 ARG 72 8.026 -13.781 0.136 575 HE ARG 72 HE ARG 72 5.896 -12.973 -1.739 576 HH11 ARG 72 HH11 ARG 72 7.005 -13.770 1.480 577 HH12 ARG 72 HH12 ARG 72 5.426 -13.670 2.188 578 HH21 ARG 72 HH21 ARG 72 3.812 -12.812 -0.816 579 HH22 ARG 72 HH22 ARG 72 3.609 -13.098 0.884 580 H GLU 3 HN GLU 3 -5.511 7.075 11.191 581 HA GLU 3 HA GLU 3 -2.898 6.070 12.061 582 HB2 GLU 3 HB2 GLU 3 -3.987 5.104 13.964 583 HB3 GLU 3 HB1 GLU 3 -4.518 6.770 13.830 584 HG2 GLU 3 HG2 GLU 3 -6.120 4.390 12.898 585 HG3 GLU 3 HG1 GLU 3 -6.317 5.182 14.459 586 H ALA 4 HN ALA 4 -6.035 5.038 10.785 587 HA ALA 4 HA ALA 4 -5.209 2.313 10.436 588 HB1 ALA 4 HB1 ALA 4 -7.608 3.784 9.341 589 HB2 ALA 4 HB2 ALA 4 -7.551 2.851 10.834 590 HB3 ALA 4 HB3 ALA 4 -7.361 2.039 9.281 591 H LEU 5 HN LEU 5 -5.465 5.169 8.388 592 HA LEU 5 HA LEU 5 -4.929 3.799 5.945 593 HB2 LEU 5 HB2 LEU 5 -4.912 6.690 6.760 594 HB3 LEU 5 HB1 LEU 5 -4.343 6.205 5.179 595 HG LEU 5 HG LEU 5 -6.634 5.092 4.881 596 HD11 LEU 5 HD11 LEU 5 -8.453 6.100 6.190 597 HD12 LEU 5 HD12 LEU 5 -7.257 6.894 7.217 598 HD13 LEU 5 HD13 LEU 5 -7.365 5.134 7.187 599 HD21 LEU 5 HD21 LEU 5 -6.215 8.064 4.998 600 HD22 LEU 5 HD22 LEU 5 -7.687 7.336 4.356 601 HD23 LEU 5 HD23 LEU 5 -6.132 6.998 3.596 602 H LYS 6 HN LYS 6 -2.977 4.550 8.554 603 HA LYS 6 HA LYS 6 -0.547 5.174 7.173 604 HB2 LYS 6 HB2 LYS 6 -1.390 5.381 9.774 605 HB3 LYS 6 HB1 LYS 6 -0.301 4.001 9.855 606 HG2 LYS 6 HG2 LYS 6 1.048 5.841 10.326 607 HG3 LYS 6 HG1 LYS 6 1.383 5.475 8.634 608 HD2 LYS 6 HD2 LYS 6 0.261 7.346 7.871 609 HD3 LYS 6 HD1 LYS 6 -0.754 7.453 9.311 610 HE2 LYS 6 HE2 LYS 6 1.301 8.076 10.601 611 HE3 LYS 6 HE1 LYS 6 2.163 8.175 9.066 612 HZ1 LYS 6 HZ1 LYS 6 -0.274 9.745 9.680 613 HZ2 LYS 6 HZ2 LYS 6 0.764 9.942 8.365 614 HZ3 LYS 6 HZ3 LYS 6 1.293 10.329 9.924 615 H ILE 7 HN ILE 7 -1.819 2.286 8.794 616 HA ILE 7 HA ILE 7 0.414 0.657 8.028 617 HB ILE 7 HB ILE 7 -0.991 -1.234 8.893 618 HG12 ILE 7 HG12 ILE 7 -2.911 0.979 9.664 619 HG13 ILE 7 HG11 ILE 7 -3.197 -0.182 8.370 620 HG21 ILE 7 HG21 ILE 7 -0.971 -0.388 11.270 621 HG22 ILE 7 HG22 ILE 7 -0.483 1.178 10.613 622 HG23 ILE 7 HG23 ILE 7 0.549 -0.235 10.386 623 HD11 ILE 7 HD11 ILE 7 -4.380 -0.748 10.437 624 HD12 ILE 7 HD12 ILE 7 -2.834 -0.888 11.273 625 HD13 ILE 7 HD13 ILE 7 -3.230 -1.991 9.958 626 H LEU 8 HN LEU 8 -2.452 1.661 6.516 627 HA LEU 8 HA LEU 8 -2.891 -0.617 4.846 628 HB2 LEU 8 HB2 LEU 8 -4.195 1.855 5.404 629 HB3 LEU 8 HB1 LEU 8 -3.985 1.731 3.668 630 HG LEU 8 HG LEU 8 -5.054 -0.576 3.845 631 HD11 LEU 8 HD11 LEU 8 -4.807 -0.934 6.222 632 HD12 LEU 8 HD12 LEU 8 -6.519 -0.904 5.803 633 HD13 LEU 8 HD13 LEU 8 -5.775 0.497 6.569 634 HD21 LEU 8 HD21 LEU 8 -6.209 1.363 2.934 635 HD22 LEU 8 HD22 LEU 8 -6.687 1.858 4.558 636 HD23 LEU 8 HD23 LEU 8 -7.312 0.358 3.872 637 H ASN 9 HN ASN 9 -0.675 1.984 4.730 638 HA ASN 9 HA ASN 9 -0.430 2.001 1.855 639 HB2 ASN 9 HB2 ASN 9 -0.000 4.030 3.297 640 HB3 ASN 9 HB1 ASN 9 1.480 3.243 3.834 641 HD21 ASN 9 HD21 ASN 9 2.730 4.934 2.936 642 HD22 ASN 9 HD22 ASN 9 2.992 5.051 1.227 643 H ASN 10 HN ASN 10 0.609 -0.139 4.187 644 HA ASN 10 HA ASN 10 2.841 -0.937 2.446 645 HB2 ASN 10 HB2 ASN 10 3.686 -0.130 4.616 646 HB3 ASN 10 HB1 ASN 10 2.714 -1.351 5.438 647 HD21 ASN 10 HD21 ASN 10 4.931 -1.257 2.647 648 HD22 ASN 10 HD22 ASN 10 5.863 -2.624 3.140 649 H ILE 11 HN ILE 11 2.778 -2.871 1.623 650 HA ILE 11 HA ILE 11 0.479 -4.465 1.723 651 HB ILE 11 HB ILE 11 3.209 -5.353 0.802 652 HG12 ILE 11 HG12 ILE 11 1.146 -4.018 -0.932 653 HG13 ILE 11 HG11 ILE 11 2.352 -3.077 -0.067 654 HG21 ILE 11 HG21 ILE 11 1.361 -7.052 0.965 655 HG22 ILE 11 HG22 ILE 11 2.065 -6.853 -0.638 656 HG23 ILE 11 HG23 ILE 11 0.505 -6.124 -0.264 657 HD11 ILE 11 HD11 ILE 11 2.873 -3.630 -2.459 658 HD12 ILE 11 HD12 ILE 11 3.072 -5.305 -1.946 659 HD13 ILE 11 HD13 ILE 11 4.117 -4.048 -1.284 660 H ARG 12 HN ARG 12 3.538 -4.732 3.458 661 HA ARG 12 HA ARG 12 3.163 -7.356 4.418 662 HB2 ARG 12 HB2 ARG 12 4.831 -5.063 5.419 663 HB3 ARG 12 HB1 ARG 12 4.827 -6.638 6.201 664 HG2 ARG 12 HG2 ARG 12 5.619 -7.681 4.160 665 HG3 ARG 12 HG1 ARG 12 5.561 -6.128 3.325 666 HD2 ARG 12 HD2 ARG 12 7.299 -5.239 4.687 667 HD3 ARG 12 HD1 ARG 12 7.232 -6.626 5.776 668 HE ARG 12 HE ARG 12 7.805 -7.567 3.205 669 HH11 ARG 12 HH11 ARG 12 9.333 -5.628 5.706 670 HH12 ARG 12 HH12 ARG 12 10.947 -6.061 5.230 671 HH21 ARG 12 HH21 ARG 12 9.914 -8.127 2.589 672 HH22 ARG 12 HH22 ARG 12 11.280 -7.486 3.480 673 H THR 13 HN THR 13 2.532 -4.210 5.989 674 HA THR 13 HA THR 13 1.441 -5.333 8.342 675 HB THR 13 HB THR 13 0.269 -2.920 8.318 676 HG1 THR 13 HG1 THR 13 0.869 -1.989 6.483 677 HG21 THR 13 HG21 THR 13 2.228 -2.071 9.485 678 HG22 THR 13 HG22 THR 13 3.221 -3.348 8.786 679 HG23 THR 13 HG23 THR 13 1.945 -3.754 9.934 680 H LEU 14 HN LEU 14 0.069 -4.329 5.279 681 HA LEU 14 HA LEU 14 -2.644 -4.424 5.949 682 HB2 LEU 14 HB2 LEU 14 -1.506 -3.495 3.860 683 HB3 LEU 14 HB1 LEU 14 -1.512 -5.138 3.254 684 HG LEU 14 HG LEU 14 -3.894 -5.191 3.161 685 HD11 LEU 14 HD11 LEU 14 -3.780 -2.594 4.678 686 HD12 LEU 14 HD12 LEU 14 -4.524 -4.112 5.182 687 HD13 LEU 14 HD13 LEU 14 -5.225 -3.181 3.857 688 HD21 LEU 14 HD21 LEU 14 -3.060 -2.461 2.208 689 HD22 LEU 14 HD22 LEU 14 -4.337 -3.488 1.556 690 HD23 LEU 14 HD23 LEU 14 -2.649 -3.958 1.376 691 H ARG 15 HN ARG 15 -0.428 -6.940 4.861 692 HA ARG 15 HA ARG 15 -2.298 -8.985 4.424 693 HB2 ARG 15 HB2 ARG 15 0.627 -8.946 5.091 694 HB3 ARG 15 HB1 ARG 15 -0.240 -10.471 5.035 695 HG2 ARG 15 HG2 ARG 15 -0.796 -10.129 2.719 696 HG3 ARG 15 HG1 ARG 15 -0.094 -8.508 2.752 697 HD2 ARG 15 HD2 ARG 15 2.100 -9.422 3.159 698 HD3 ARG 15 HD1 ARG 15 1.438 -11.049 3.289 699 HE ARG 15 HE ARG 15 0.737 -10.655 0.859 700 HH11 ARG 15 HH11 ARG 15 3.619 -9.299 2.314 701 HH12 ARG 15 HH12 ARG 15 4.501 -9.238 0.822 702 HH21 ARG 15 HH21 ARG 15 1.884 -10.600 -1.091 703 HH22 ARG 15 HH22 ARG 15 3.512 -9.969 -1.126 704 H ALA 16 HN ALA 16 -0.657 -7.913 7.356 705 HA ALA 16 HA ALA 16 -1.440 -10.097 8.985 706 HB1 ALA 16 HB1 ALA 16 0.413 -8.343 9.371 707 HB2 ALA 16 HB2 ALA 16 -0.488 -8.954 10.761 708 HB3 ALA 16 HB3 ALA 16 -0.876 -7.371 10.084 709 H GLN 17 HN GLN 17 -2.894 -6.902 8.415 710 HA GLN 17 HA GLN 17 -4.949 -7.307 10.365 711 HB2 GLN 17 HB2 GLN 17 -3.998 -5.131 8.945 712 HB3 GLN 17 HB1 GLN 17 -5.606 -5.383 8.280 713 HG2 GLN 17 HG2 GLN 17 -5.787 -3.835 10.071 714 HG3 GLN 17 HG1 GLN 17 -6.496 -5.358 10.604 715 HE21 GLN 17 HE21 GLN 17 -5.601 -6.453 12.302 716 HE22 GLN 17 HE22 GLN 17 -4.287 -5.829 13.244 717 H ALA 18 HN ALA 18 -4.570 -8.062 6.996 718 HA ALA 18 HA ALA 18 -7.366 -8.500 6.487 719 HB1 ALA 18 HB1 ALA 18 -4.965 -9.440 4.918 720 HB2 ALA 18 HB2 ALA 18 -5.796 -7.899 4.697 721 HB3 ALA 18 HB3 ALA 18 -6.637 -9.411 4.357 722 H ARG 19 HN ARG 19 -5.308 -10.117 8.421 723 HA ARG 19 HA ARG 19 -6.107 -12.813 7.690 724 HB2 ARG 19 HB2 ARG 19 -4.319 -11.710 9.850 725 HB3 ARG 19 HB1 ARG 19 -4.768 -13.409 9.778 726 HG2 ARG 19 HG2 ARG 19 -3.457 -11.992 7.479 727 HG3 ARG 19 HG1 ARG 19 -2.540 -12.784 8.761 728 HD2 ARG 19 HD2 ARG 19 -3.506 -14.908 8.229 729 HD3 ARG 19 HD1 ARG 19 -4.635 -14.167 7.096 730 HE ARG 19 HE ARG 19 -1.763 -13.917 6.584 731 HH11 ARG 19 HH11 ARG 19 -4.828 -15.396 5.732 732 HH12 ARG 19 HH12 ARG 19 -4.305 -15.856 4.136 733 HH21 ARG 19 HH21 ARG 19 -1.073 -14.548 4.507 734 HH22 ARG 19 HH22 ARG 19 -2.171 -15.404 3.454 735 H GLU 20 HN GLU 20 -7.408 -10.293 9.479 736 HA GLU 20 HA GLU 20 -8.835 -12.155 11.255 737 HB2 GLU 20 HB2 GLU 20 -9.388 -10.242 12.647 738 HB3 GLU 20 HB1 GLU 20 -7.651 -10.343 12.405 739 HG2 GLU 20 HG2 GLU 20 -7.937 -8.627 10.573 740 HG3 GLU 20 HG1 GLU 20 -9.584 -8.405 11.165 741 H CYS 21 H CYS 21 -9.238 -11.049 8.323 742 HA CYS 21 HA CYS 21 -12.173 -10.721 8.641 743 HB2 CYS 21 3HB CYS 21 -10.336 -9.199 6.662 744 HB3 CYS 21 2HB CYS 21 -12.097 -9.053 6.721 745 HG CYS 21 HG CYS 21 -12.271 -7.541 8.548 746 H THR 22 HN THR 22 -13.382 -11.991 7.440 747 HA THR 22 HA THR 22 -12.259 -14.112 5.959 748 HB THR 22 HB THR 22 -15.024 -13.539 5.249 749 HG1 THR 22 HG1 THR 22 -14.971 -14.159 7.922 750 HG21 THR 22 HG21 THR 22 -14.111 -15.745 5.035 751 HG22 THR 22 HG22 THR 22 -15.338 -15.782 6.300 752 HG23 THR 22 HG23 THR 22 -13.626 -15.762 6.730 753 H LEU 23 HN LEU 23 -12.633 -14.596 3.685 754 HA LEU 23 HA LEU 23 -11.609 -12.735 1.948 755 HB2 LEU 23 HB2 LEU 23 -11.770 -15.168 1.533 756 HB3 LEU 23 HB1 LEU 23 -13.489 -14.983 1.236 757 HG LEU 23 HG LEU 23 -12.870 -13.400 -0.645 758 HD11 LEU 23 HD11 LEU 23 -10.149 -14.602 -0.169 759 HD12 LEU 23 HD12 LEU 23 -10.597 -12.914 0.082 760 HD13 LEU 23 HD13 LEU 23 -10.611 -13.598 -1.541 761 HD21 LEU 23 HD21 LEU 23 -12.734 -15.132 -2.186 762 HD22 LEU 23 HD22 LEU 23 -13.471 -15.906 -0.781 763 HD23 LEU 23 HD23 LEU 23 -11.756 -16.138 -1.119 764 H GLU 24 HN GLU 24 -15.007 -13.482 2.533 765 HA GLU 24 HA GLU 24 -16.216 -11.943 0.588 766 HB2 GLU 24 HB2 GLU 24 -17.202 -13.563 2.345 767 HB3 GLU 24 HB1 GLU 24 -17.352 -12.132 3.355 768 HG2 GLU 24 HG2 GLU 24 -19.152 -11.436 2.270 769 HG3 GLU 24 HG1 GLU 24 -18.410 -11.701 0.691 770 H THR 25 HN THR 25 -15.344 -10.925 3.891 771 HA THR 25 HA THR 25 -16.294 -8.294 3.705 772 HB THR 25 HB THR 25 -13.960 -8.398 5.368 773 HG1 THR 25 HG1 THR 25 -14.090 -10.609 5.452 774 HG21 THR 25 HG21 THR 25 -16.194 -7.121 5.595 775 HG22 THR 25 HG22 THR 25 -15.453 -7.764 7.058 776 HG23 THR 25 HG23 THR 25 -16.806 -8.614 6.311 777 H LEU 26 HN LEU 26 -13.157 -9.703 2.905 778 HA LEU 26 HA LEU 26 -11.806 -7.271 2.411 779 HB2 LEU 26 HB2 LEU 26 -11.314 -10.046 1.330 780 HB3 LEU 26 HB1 LEU 26 -10.215 -8.694 1.119 781 HG LEU 26 HG LEU 26 -11.038 -9.756 3.821 782 HD11 LEU 26 HD11 LEU 26 -8.629 -10.416 2.136 783 HD12 LEU 26 HD12 LEU 26 -9.873 -11.523 2.723 784 HD13 LEU 26 HD13 LEU 26 -8.763 -10.762 3.861 785 HD21 LEU 26 HD21 LEU 26 -8.917 -8.549 4.476 786 HD22 LEU 26 HD22 LEU 26 -10.282 -7.533 4.024 787 HD23 LEU 26 HD23 LEU 26 -8.962 -7.793 2.885 788 H GLU 27 HN GLU 27 -13.562 -9.499 0.287 789 HA GLU 27 HA GLU 27 -13.080 -8.050 -2.092 790 HB2 GLU 27 HB2 GLU 27 -14.837 -10.264 -1.246 791 HB3 GLU 27 HB1 GLU 27 -15.437 -9.317 -2.599 792 HG2 GLU 27 HG2 GLU 27 -13.326 -9.717 -3.790 793 HG3 GLU 27 HG1 GLU 27 -12.777 -10.713 -2.440 794 H GLU 28 HN GLU 28 -15.729 -8.006 0.247 795 HA GLU 28 HA GLU 28 -17.409 -6.219 -1.109 796 HB2 GLU 28 HB2 GLU 28 -18.018 -7.627 0.890 797 HB3 GLU 28 HB1 GLU 28 -17.157 -6.465 1.892 798 HG2 GLU 28 HG2 GLU 28 -18.714 -4.722 0.787 799 HG3 GLU 28 HG1 GLU 28 -19.700 -6.123 0.363 800 H MET 29 HN MET 29 -14.873 -5.604 1.316 801 HA MET 29 HA MET 29 -15.304 -2.796 1.370 802 HB2 MET 29 HB2 MET 29 -13.385 -2.633 2.739 803 HB3 MET 29 HB1 MET 29 -14.146 -4.158 3.163 804 HG2 MET 29 HG2 MET 29 -12.517 -5.383 1.885 805 HG3 MET 29 HG1 MET 29 -11.795 -3.885 1.303 806 HE1 MET 29 HE1 MET 29 -11.552 -5.420 5.654 807 HE2 MET 29 HE2 MET 29 -12.133 -6.389 4.304 808 HE3 MET 29 HE3 MET 29 -13.077 -5.010 4.865 809 H LEU 30 HN LEU 30 -13.341 -4.891 -0.636 810 HA LEU 30 HA LEU 30 -11.675 -2.892 -1.742 811 HB2 LEU 30 HB2 LEU 30 -11.205 -5.300 -1.939 812 HB3 LEU 30 HB1 LEU 30 -12.610 -5.492 -2.969 813 HG LEU 30 HG LEU 30 -11.560 -4.075 -4.678 814 HD11 LEU 30 HD11 LEU 30 -10.216 -2.651 -3.239 815 HD12 LEU 30 HD12 LEU 30 -9.208 -3.427 -4.461 816 HD13 LEU 30 HD13 LEU 30 -9.199 -4.024 -2.801 817 HD21 LEU 30 HD21 LEU 30 -9.918 -6.399 -3.693 818 HD22 LEU 30 HD22 LEU 30 -9.699 -5.630 -5.263 819 HD23 LEU 30 HD23 LEU 30 -11.223 -6.435 -4.880 820 H GLU 31 HN GLU 31 -14.789 -4.233 -2.720 821 HA GLU 31 HA GLU 31 -15.111 -2.757 -5.094 822 HB2 GLU 31 HB2 GLU 31 -17.129 -3.957 -3.196 823 HB3 GLU 31 HB1 GLU 31 -17.562 -3.244 -4.745 824 HG2 GLU 31 HG2 GLU 31 -15.453 -5.307 -4.783 825 HG3 GLU 31 HG1 GLU 31 -17.090 -5.849 -4.409 826 H LYS 32 HN LYS 32 -15.988 -2.094 -1.744 827 HA LYS 32 HA LYS 32 -17.414 0.298 -2.239 828 HB2 LYS 32 HB2 LYS 32 -16.049 -0.775 0.229 829 HB3 LYS 32 HB1 LYS 32 -16.958 0.733 0.223 830 HG2 LYS 32 HG2 LYS 32 -18.973 -0.420 -0.379 831 HG3 LYS 32 HG1 LYS 32 -18.095 -1.939 -0.566 832 HD2 LYS 32 HD2 LYS 32 -17.597 -1.980 1.803 833 HD3 LYS 32 HD1 LYS 32 -18.357 -0.399 2.018 834 HE2 LYS 32 HE2 LYS 32 -20.504 -1.322 1.349 835 HE3 LYS 32 HE1 LYS 32 -19.757 -2.888 1.050 836 HZ1 LYS 32 HZ1 LYS 32 -19.575 -1.649 3.716 837 HZ2 LYS 32 HZ2 LYS 32 -19.491 -3.292 3.286 838 HZ3 LYS 32 HZ3 LYS 32 -20.978 -2.483 3.256 839 H LEU 33 HN LEU 33 -14.006 -0.344 -1.499 840 HA LEU 33 HA LEU 33 -13.284 2.411 -1.357 841 HB2 LEU 33 HB2 LEU 33 -11.961 0.513 -0.377 842 HB3 LEU 33 HB1 LEU 33 -11.497 0.069 -2.009 843 HG LEU 33 HG LEU 33 -10.479 2.367 -2.244 844 HD11 LEU 33 HD11 LEU 33 -11.655 3.509 -0.490 845 HD12 LEU 33 HD12 LEU 33 -9.927 3.529 -0.141 846 HD13 LEU 33 HD13 LEU 33 -10.988 2.418 0.723 847 HD21 LEU 33 HD21 LEU 33 -8.443 1.757 -1.178 848 HD22 LEU 33 HD22 LEU 33 -9.207 0.267 -1.729 849 HD23 LEU 33 HD23 LEU 33 -9.283 0.719 -0.028 850 H GLU 34 HN GLU 34 -13.368 0.000 -3.898 851 HA GLU 34 HA GLU 34 -11.985 1.290 -5.924 852 HB2 GLU 34 HB2 GLU 34 -12.636 -0.971 -6.241 853 HB3 GLU 34 HB1 GLU 34 -14.332 -0.593 -5.988 854 HG2 GLU 34 HG2 GLU 34 -14.250 -0.877 -8.260 855 HG3 GLU 34 HG1 GLU 34 -14.064 0.870 -8.113 856 H VAL 35 HN VAL 35 -15.501 1.436 -5.264 857 HA VAL 35 HA VAL 35 -16.039 3.282 -7.334 858 HB VAL 35 HB VAL 35 -18.208 3.666 -6.272 859 HG11 VAL 35 HG11 VAL 35 -17.287 0.803 -6.392 860 HG12 VAL 35 HG12 VAL 35 -18.026 1.753 -7.680 861 HG13 VAL 35 HG13 VAL 35 -18.978 1.286 -6.270 862 HG21 VAL 35 HG21 VAL 35 -17.433 1.783 -4.066 863 HG22 VAL 35 HG22 VAL 35 -18.835 2.849 -4.176 864 HG23 VAL 35 HG23 VAL 35 -17.230 3.529 -3.904 865 H VAL 36 HN VAL 36 -14.968 3.712 -4.039 866 HA VAL 36 HA VAL 36 -15.563 6.485 -3.850 867 HB VAL 36 HB VAL 36 -13.709 4.682 -2.306 868 HG11 VAL 36 HG11 VAL 36 -12.525 6.706 -2.199 869 HG12 VAL 36 HG12 VAL 36 -13.493 6.668 -0.722 870 HG13 VAL 36 HG13 VAL 36 -14.002 7.664 -2.086 871 HG21 VAL 36 HG21 VAL 36 -15.272 5.185 -0.479 872 HG22 VAL 36 HG22 VAL 36 -16.073 4.439 -1.860 873 HG23 VAL 36 HG23 VAL 36 -16.228 6.174 -1.582 874 H VAL 37 HN VAL 37 -12.619 4.658 -4.680 875 HA VAL 37 HA VAL 37 -11.015 6.931 -5.202 876 HB VAL 37 HB VAL 37 -10.737 4.178 -6.437 877 HG11 VAL 37 HG11 VAL 37 -8.762 6.432 -6.097 878 HG12 VAL 37 HG12 VAL 37 -9.431 5.835 -7.615 879 HG13 VAL 37 HG13 VAL 37 -8.359 4.814 -6.660 880 HG21 VAL 37 HG21 VAL 37 -9.052 3.829 -4.615 881 HG22 VAL 37 HG22 VAL 37 -10.724 3.919 -4.059 882 HG23 VAL 37 HG23 VAL 37 -9.652 5.303 -3.862 883 H ASN 38 HN ASN 38 -13.243 5.034 -7.123 884 HA ASN 38 HA ASN 38 -12.687 6.123 -9.653 885 HB2 ASN 38 HB2 ASN 38 -14.086 4.101 -9.274 886 HB3 ASN 38 HB1 ASN 38 -15.351 5.128 -8.610 887 HD21 ASN 38 HD21 ASN 38 -16.883 4.712 -10.113 888 HD22 ASN 38 HD22 ASN 38 -16.748 5.147 -11.780 889 H GLU 39 HN GLU 39 -14.866 7.137 -7.061 890 HA GLU 39 HA GLU 39 -16.106 9.268 -8.399 891 HB2 GLU 39 HB2 GLU 39 -15.558 8.738 -5.481 892 HB3 GLU 39 HB1 GLU 39 -16.353 10.212 -6.010 893 HG2 GLU 39 HG2 GLU 39 -18.095 8.829 -7.094 894 HG3 GLU 39 HG1 GLU 39 -17.323 7.396 -6.421 895 H ARG 40 HN ARG 40 -13.212 9.169 -6.346 896 HA ARG 40 HA ARG 40 -12.592 11.911 -6.555 897 HB2 ARG 40 HB2 ARG 40 -11.046 9.465 -5.796 898 HB3 ARG 40 HB1 ARG 40 -10.173 10.959 -6.099 899 HG2 ARG 40 HG2 ARG 40 -12.349 10.551 -4.059 900 HG3 ARG 40 HG1 ARG 40 -10.619 10.700 -3.740 901 HD2 ARG 40 HD2 ARG 40 -12.538 12.799 -4.710 902 HD3 ARG 40 HD1 ARG 40 -11.525 12.820 -3.271 903 HE ARG 40 HE ARG 40 -9.936 12.691 -5.620 904 HH11 ARG 40 HH11 ARG 40 -11.884 14.906 -3.739 905 HH12 ARG 40 HH12 ARG 40 -11.005 16.312 -4.248 906 HH21 ARG 40 HH21 ARG 40 -8.780 14.525 -6.320 907 HH22 ARG 40 HH22 ARG 40 -9.226 16.095 -5.700 908 H ARG 41 HN ARG 41 -11.596 9.090 -8.443 909 HA ARG 41 HA ARG 41 -9.761 10.375 -10.132 910 HB2 ARG 41 HB2 ARG 41 -11.374 7.870 -10.305 911 HB3 ARG 41 HB1 ARG 41 -10.603 8.462 -11.769 912 HG2 ARG 41 HG2 ARG 41 -8.435 8.337 -10.739 913 HG3 ARG 41 HG1 ARG 41 -9.162 7.918 -9.188 914 HD2 ARG 41 HD2 ARG 41 -9.920 5.818 -10.024 915 HD3 ARG 41 HD1 ARG 41 -9.474 6.251 -11.673 916 HE ARG 41 HE ARG 41 -7.159 6.395 -10.131 917 HH11 ARG 41 HH11 ARG 41 -9.480 3.950 -11.079 918 HH12 ARG 41 HH12 ARG 41 -8.305 2.679 -11.145 919 HH21 ARG 41 HH21 ARG 41 -5.623 4.731 -10.193 920 HH22 ARG 41 HH22 ARG 41 -6.110 3.117 -10.627 921 H GLU 42 HN GLU 42 -13.246 9.943 -10.361 922 HA GLU 42 HA GLU 42 -13.643 10.995 -12.920 923 HB2 GLU 42 HB2 GLU 42 -15.383 9.809 -11.672 924 HB3 GLU 42 HB1 GLU 42 -15.453 11.112 -10.496 925 HG2 GLU 42 HG2 GLU 42 -17.293 11.463 -11.866 926 HG3 GLU 42 HG1 GLU 42 -16.093 12.612 -12.451 927 H GLU 43 HN GLU 43 -13.756 12.597 -9.752 928 HA GLU 43 HA GLU 43 -14.221 15.195 -10.756 929 HB2 GLU 43 HB2 GLU 43 -12.839 14.473 -8.173 930 HB3 GLU 43 HB1 GLU 43 -13.691 15.968 -8.533 931 HG2 GLU 43 HG2 GLU 43 -15.794 14.680 -8.721 932 HG3 GLU 43 HG1 GLU 43 -14.912 13.226 -8.264 933 H GLU 44 HN GLU 44 -11.294 13.400 -10.004 934 HA GLU 44 HA GLU 44 -9.429 15.480 -10.260 935 HB2 GLU 44 HB2 GLU 44 -9.306 12.868 -9.551 936 HB3 GLU 44 HB1 GLU 44 -8.598 12.793 -11.157 937 HG2 GLU 44 HG2 GLU 44 -6.781 13.058 -9.738 938 HG3 GLU 44 HG1 GLU 44 -7.062 14.674 -10.381 939 H SER 45 HN SER 45 -10.940 13.416 -12.686 940 HA SER 45 HA SER 45 -9.181 14.494 -14.748 941 HB2 SER 45 HB2 SER 45 -10.635 12.909 -16.226 942 HB3 SER 45 HB1 SER 45 -9.449 12.219 -15.119 943 HG SER 45 HG SER 45 -11.140 11.832 -13.641 944 H ALA 46 HN ALA 46 -12.436 14.883 -13.583 945 HA ALA 46 HA ALA 46 -13.402 16.194 -15.952 946 HB1 ALA 46 HB1 ALA 46 -14.933 15.017 -14.468 947 HB2 ALA 46 HB2 ALA 46 -15.377 16.717 -14.606 948 HB3 ALA 46 HB3 ALA 46 -14.551 16.139 -13.161 949 H GLU 3 HN GLU 3 -10.850 -3.594 15.221 950 HA GLU 3 HA GLU 3 -12.661 -1.487 15.187 951 HB2 GLU 3 HB2 GLU 3 -9.761 -1.250 15.992 952 HB3 GLU 3 HB1 GLU 3 -11.126 -0.336 16.612 953 HG2 GLU 3 HG2 GLU 3 -10.886 -1.799 18.321 954 HG3 GLU 3 HG1 GLU 3 -11.957 -2.757 17.303 955 H ALA 4 HN ALA 4 -9.457 -1.680 13.654 956 HA ALA 4 HA ALA 4 -9.767 0.909 12.429 957 HB1 ALA 4 HB1 ALA 4 -7.637 -1.143 11.876 958 HB2 ALA 4 HB2 ALA 4 -7.589 -0.002 13.219 959 HB3 ALA 4 HB3 ALA 4 -7.571 0.592 11.559 960 H LEU 5 HN LEU 5 -11.432 -1.673 11.686 961 HA LEU 5 HA LEU 5 -11.150 -1.268 8.783 962 HB2 LEU 5 HB2 LEU 5 -11.863 -3.839 10.193 963 HB3 LEU 5 HB1 LEU 5 -11.824 -3.611 8.455 964 HG LEU 5 HG LEU 5 -9.420 -3.343 10.260 965 HD11 LEU 5 HD11 LEU 5 -8.733 -5.499 9.558 966 HD12 LEU 5 HD12 LEU 5 -10.044 -5.608 8.382 967 HD13 LEU 5 HD13 LEU 5 -10.402 -5.656 10.108 968 HD21 LEU 5 HD21 LEU 5 -8.160 -3.405 8.155 969 HD22 LEU 5 HD22 LEU 5 -9.250 -2.023 8.226 970 HD23 LEU 5 HD23 LEU 5 -9.675 -3.431 7.250 971 H LYS 6 HN LYS 6 -13.247 -1.466 11.519 972 HA LYS 6 HA LYS 6 -15.695 -1.979 10.296 973 HB2 LYS 6 HB2 LYS 6 -15.237 -1.911 12.756 974 HB3 LYS 6 HB1 LYS 6 -15.264 -0.158 12.657 975 HG2 LYS 6 HG2 LYS 6 -17.386 -1.030 13.458 976 HG3 LYS 6 HG1 LYS 6 -17.580 -0.227 11.899 977 HD2 LYS 6 HD2 LYS 6 -17.702 -2.321 10.752 978 HD3 LYS 6 HD1 LYS 6 -17.230 -3.206 12.206 979 HE2 LYS 6 HE2 LYS 6 -19.740 -1.551 12.041 980 HE3 LYS 6 HE1 LYS 6 -19.689 -3.258 11.603 981 HZ1 LYS 6 HZ1 LYS 6 -19.042 -3.825 13.812 982 HZ2 LYS 6 HZ2 LYS 6 -20.404 -2.831 13.918 983 HZ3 LYS 6 HZ3 LYS 6 -18.870 -2.201 14.250 984 H ILE 7 HN ILE 7 -14.134 1.151 10.926 985 HA ILE 7 HA ILE 7 -16.210 2.694 9.774 986 HB ILE 7 HB ILE 7 -14.779 4.591 9.938 987 HG12 ILE 7 HG12 ILE 7 -12.758 3.304 8.955 988 HG13 ILE 7 HG11 ILE 7 -12.446 4.585 10.119 989 HG21 ILE 7 HG21 ILE 7 -15.539 4.129 12.055 990 HG22 ILE 7 HG22 ILE 7 -13.794 4.181 12.311 991 HG23 ILE 7 HG23 ILE 7 -14.619 2.629 12.174 992 HD11 ILE 7 HD11 ILE 7 -12.148 2.910 11.875 993 HD12 ILE 7 HD12 ILE 7 -11.038 2.653 10.527 994 HD13 ILE 7 HD13 ILE 7 -12.461 1.629 10.703 995 H LEU 8 HN LEU 8 -13.753 0.816 8.372 996 HA LEU 8 HA LEU 8 -13.535 2.340 5.929 997 HB2 LEU 8 HB2 LEU 8 -12.206 0.057 7.152 998 HB3 LEU 8 HB1 LEU 8 -12.491 -0.178 5.440 999 HG LEU 8 HG LEU 8 -11.344 2.059 5.069 1000 HD11 LEU 8 HD11 LEU 8 -10.789 1.648 7.984 1001 HD12 LEU 8 HD12 LEU 8 -11.386 3.092 7.165 1002 HD13 LEU 8 HD13 LEU 8 -9.710 2.588 6.956 1003 HD21 LEU 8 HD21 LEU 8 -9.767 -0.211 6.273 1004 HD22 LEU 8 HD22 LEU 8 -9.102 1.086 5.280 1005 HD23 LEU 8 HD23 LEU 8 -10.253 -0.053 4.587 1006 H ASN 9 HN ASN 9 -15.618 -0.038 7.192 1007 HA ASN 9 HA ASN 9 -16.337 -1.155 4.619 1008 HB2 ASN 9 HB2 ASN 9 -16.276 -2.448 6.812 1009 HB3 ASN 9 HB1 ASN 9 -17.769 -1.613 7.232 1010 HD21 ASN 9 HD21 ASN 9 -16.289 -3.706 4.823 1011 HD22 ASN 9 HD22 ASN 9 -17.765 -4.458 4.305 1012 H ASN 10 HN ASN 10 -17.128 1.616 6.276 1013 HA ASN 10 HA ASN 10 -19.834 1.724 5.134 1014 HB2 ASN 10 HB2 ASN 10 -18.516 3.517 7.189 1015 HB3 ASN 10 HB1 ASN 10 -20.155 3.713 6.584 1016 HD21 ASN 10 HD21 ASN 10 -20.963 1.050 6.540 1017 HD22 ASN 10 HD22 ASN 10 -21.028 0.454 8.159 1018 H ILE 11 HN ILE 11 -20.066 2.762 3.252 1019 HA ILE 11 HA ILE 11 -17.932 4.093 1.984 1020 HB ILE 11 HB ILE 11 -19.817 3.019 0.767 1021 HG12 ILE 11 HG12 ILE 11 -19.696 5.893 -0.093 1022 HG13 ILE 11 HG11 ILE 11 -18.240 4.900 -0.129 1023 HG21 ILE 11 HG21 ILE 11 -21.876 4.355 0.404 1024 HG22 ILE 11 HG22 ILE 11 -21.346 5.449 1.680 1025 HG23 ILE 11 HG23 ILE 11 -21.695 3.762 2.052 1026 HD11 ILE 11 HD11 ILE 11 -19.618 3.255 -1.511 1027 HD12 ILE 11 HD12 ILE 11 -19.114 4.757 -2.281 1028 HD13 ILE 11 HD13 ILE 11 -20.770 4.578 -1.696 1029 H ARG 12 HN ARG 12 -20.417 5.237 4.128 1030 HA ARG 12 HA ARG 12 -20.342 7.977 3.479 1031 HB2 ARG 12 HB2 ARG 12 -21.053 6.506 6.012 1032 HB3 ARG 12 HB1 ARG 12 -21.144 8.255 5.889 1033 HG2 ARG 12 HG2 ARG 12 -22.633 6.361 4.090 1034 HG3 ARG 12 HG1 ARG 12 -23.305 7.106 5.541 1035 HD2 ARG 12 HD2 ARG 12 -22.837 9.327 4.568 1036 HD3 ARG 12 HD1 ARG 12 -22.269 8.540 3.099 1037 HE ARG 12 HE ARG 12 -24.897 7.696 3.782 1038 HH11 ARG 12 HH11 ARG 12 -23.094 10.313 2.321 1039 HH12 ARG 12 HH12 ARG 12 -24.427 10.879 1.367 1040 HH21 ARG 12 HH21 ARG 12 -26.665 8.440 2.547 1041 HH22 ARG 12 HH22 ARG 12 -26.471 9.810 1.502 1042 H THR 13 HN THR 13 -18.665 6.176 6.064 1043 HA THR 13 HA THR 13 -17.082 8.414 6.833 1044 HB THR 13 HB THR 13 -15.682 6.372 7.864 1045 HG1 THR 13 HG1 THR 13 -16.666 4.551 7.449 1046 HG21 THR 13 HG21 THR 13 -18.388 7.231 8.901 1047 HG22 THR 13 HG22 THR 13 -16.890 8.130 9.124 1048 HG23 THR 13 HG23 THR 13 -17.081 6.536 9.854 1049 H LEU 14 HN LEU 14 -16.597 5.640 4.730 1050 HA LEU 14 HA LEU 14 -13.850 5.888 4.297 1051 HB2 LEU 14 HB2 LEU 14 -15.437 4.008 3.625 1052 HB3 LEU 14 HB1 LEU 14 -15.827 4.982 2.221 1053 HG LEU 14 HG LEU 14 -13.432 4.910 1.547 1054 HD11 LEU 14 HD11 LEU 14 -12.029 3.144 2.641 1055 HD12 LEU 14 HD12 LEU 14 -13.231 3.078 3.929 1056 HD13 LEU 14 HD13 LEU 14 -12.330 4.566 3.640 1057 HD21 LEU 14 HD21 LEU 14 -14.935 3.360 0.529 1058 HD22 LEU 14 HD22 LEU 14 -14.865 2.287 1.926 1059 HD23 LEU 14 HD23 LEU 14 -13.440 2.504 0.906 1060 H ARG 15 HN ARG 15 -16.572 7.270 2.485 1061 HA ARG 15 HA ARG 15 -14.968 8.653 0.593 1062 HB2 ARG 15 HB2 ARG 15 -17.346 8.078 0.220 1063 HB3 ARG 15 HB1 ARG 15 -17.810 9.219 1.470 1064 HG2 ARG 15 HG2 ARG 15 -16.742 11.021 0.092 1065 HG3 ARG 15 HG1 ARG 15 -16.563 9.828 -1.197 1066 HD2 ARG 15 HD2 ARG 15 -19.208 10.389 0.102 1067 HD3 ARG 15 HD1 ARG 15 -18.622 11.341 -1.257 1068 HE ARG 15 HE ARG 15 -18.607 9.283 -2.572 1069 HH11 ARG 15 HH11 ARG 15 -20.472 9.274 0.408 1070 HH12 ARG 15 HH12 ARG 15 -21.546 8.023 -0.133 1071 HH21 ARG 15 HH21 ARG 15 -20.017 7.654 -3.268 1072 HH22 ARG 15 HH22 ARG 15 -21.269 7.081 -2.203 1073 H ALA 16 HN ALA 16 -15.907 9.339 3.838 1074 HA ALA 16 HA ALA 16 -15.478 12.185 3.672 1075 HB1 ALA 16 HB1 ALA 16 -15.809 12.162 6.090 1076 HB2 ALA 16 HB2 ALA 16 -15.778 10.400 6.084 1077 HB3 ALA 16 HB3 ALA 16 -17.082 11.263 5.268 1078 H GLN 17 HN GLN 17 -13.770 9.441 5.177 1079 HA GLN 17 HA GLN 17 -11.538 11.045 5.956 1080 HB2 GLN 17 HB2 GLN 17 -11.707 8.040 5.750 1081 HB3 GLN 17 HB1 GLN 17 -10.521 8.960 6.663 1082 HG2 GLN 17 HG2 GLN 17 -12.454 9.877 8.010 1083 HG3 GLN 17 HG1 GLN 17 -13.461 8.676 7.209 1084 HE21 GLN 17 HE21 GLN 17 -10.130 8.173 8.173 1085 HE22 GLN 17 HE22 GLN 17 -10.460 6.993 9.392 1086 H ALA 18 HN ALA 18 -12.461 9.779 2.982 1087 HA ALA 18 HA ALA 18 -9.875 9.191 1.910 1088 HB1 ALA 18 HB1 ALA 18 -11.751 8.162 0.864 1089 HB2 ALA 18 HB2 ALA 18 -11.072 9.305 -0.295 1090 HB3 ALA 18 HB3 ALA 18 -12.533 9.719 0.597 1091 H ARG 19 HN ARG 19 -11.308 12.033 2.833 1092 HA ARG 19 HA ARG 19 -10.141 13.687 0.736 1093 HB2 ARG 19 HB2 ARG 19 -12.343 13.945 2.447 1094 HB3 ARG 19 HB1 ARG 19 -11.179 15.130 3.023 1095 HG2 ARG 19 HG2 ARG 19 -11.297 16.385 1.123 1096 HG3 ARG 19 HG1 ARG 19 -11.721 15.006 0.104 1097 HD2 ARG 19 HD2 ARG 19 -13.518 16.399 2.085 1098 HD3 ARG 19 HD1 ARG 19 -13.619 16.494 0.326 1099 HE ARG 19 HE ARG 19 -13.967 13.925 1.720 1100 HH11 ARG 19 HH11 ARG 19 -15.193 16.438 -0.405 1101 HH12 ARG 19 HH12 ARG 19 -16.543 15.494 -0.944 1102 HH21 ARG 19 HH21 ARG 19 -15.735 12.681 0.991 1103 HH22 ARG 19 HH22 ARG 19 -16.857 13.368 -0.150 1104 H GLU 20 HN GLU 20 -9.042 12.157 3.414 1105 HA GLU 20 HA GLU 20 -7.504 14.198 4.673 1106 HB2 GLU 20 HB2 GLU 20 -8.155 11.547 5.254 1107 HB3 GLU 20 HB1 GLU 20 -6.416 11.519 5.000 1108 HG2 GLU 20 HG2 GLU 20 -7.150 13.766 6.627 1109 HG3 GLU 20 HG1 GLU 20 -7.800 12.274 7.303 1110 H CYS 21 H CYS 21 -6.986 12.043 1.983 1111 HA CYS 21 HA CYS 21 -4.382 13.367 1.499 1112 HB2 CYS 21 3HB CYS 21 -4.923 10.318 1.381 1113 HB3 CYS 21 2HB CYS 21 -3.434 11.080 0.805 1114 HG CYS 21 HG CYS 21 -2.352 11.386 2.901 1115 H THR 22 HN THR 22 -3.658 13.229 -0.691 1116 HA THR 22 HA THR 22 -5.791 13.690 -2.544 1117 HB THR 22 HB THR 22 -2.987 13.417 -3.495 1118 HG1 THR 22 HG1 THR 22 -3.852 15.490 -1.722 1119 HG21 THR 22 HG21 THR 22 -4.627 14.257 -5.039 1120 HG22 THR 22 HG22 THR 22 -3.576 15.598 -4.578 1121 HG23 THR 22 HG23 THR 22 -5.185 15.455 -3.871 1122 H LEU 23 HN LEU 23 -5.660 12.689 -4.788 1123 HA LEU 23 HA LEU 23 -6.151 9.958 -4.695 1124 HB2 LEU 23 HB2 LEU 23 -6.880 11.596 -6.458 1125 HB3 LEU 23 HB1 LEU 23 -5.262 11.504 -7.124 1126 HG LEU 23 HG LEU 23 -5.623 9.034 -7.446 1127 HD11 LEU 23 HD11 LEU 23 -8.453 9.773 -6.717 1128 HD12 LEU 23 HD12 LEU 23 -7.400 8.629 -5.884 1129 HD13 LEU 23 HD13 LEU 23 -7.980 8.272 -7.509 1130 HD21 LEU 23 HD21 LEU 23 -5.902 10.805 -9.215 1131 HD22 LEU 23 HD22 LEU 23 -7.637 10.717 -8.905 1132 HD23 LEU 23 HD23 LEU 23 -6.774 9.299 -9.493 1133 H GLU 24 HN GLU 24 -3.173 11.676 -5.137 1134 HA GLU 24 HA GLU 24 -1.539 9.823 -6.365 1135 HB2 GLU 24 HB2 GLU 24 -0.593 11.924 -6.045 1136 HB3 GLU 24 HB1 GLU 24 -1.074 12.008 -4.361 1137 HG2 GLU 24 HG2 GLU 24 1.323 11.818 -4.552 1138 HG3 GLU 24 HG1 GLU 24 0.660 10.375 -3.791 1139 H THR 25 HN THR 25 -1.754 10.306 -2.828 1140 HA THR 25 HA THR 25 -0.372 7.929 -2.198 1141 HB THR 25 HB THR 25 -2.304 8.985 -0.215 1142 HG1 THR 25 HG1 THR 25 -0.373 10.713 -0.081 1143 HG21 THR 25 HG21 THR 25 -0.661 7.377 0.487 1144 HG22 THR 25 HG22 THR 25 -0.233 8.934 1.193 1145 HG23 THR 25 HG23 THR 25 0.648 8.329 -0.212 1146 H LEU 26 HN LEU 26 -3.788 8.694 -2.589 1147 HA LEU 26 HA LEU 26 -4.879 6.356 -1.476 1148 HB2 LEU 26 HB2 LEU 26 -5.855 8.316 -3.531 1149 HB3 LEU 26 HB1 LEU 26 -6.796 6.892 -3.139 1150 HG LEU 26 HG LEU 26 -5.976 9.004 -1.138 1151 HD11 LEU 26 HD11 LEU 26 -8.596 8.530 -2.555 1152 HD12 LEU 26 HD12 LEU 26 -7.549 9.937 -2.722 1153 HD13 LEU 26 HD13 LEU 26 -8.371 9.625 -1.193 1154 HD21 LEU 26 HD21 LEU 26 -6.289 6.791 -0.144 1155 HD22 LEU 26 HD22 LEU 26 -7.870 6.666 -0.915 1156 HD23 LEU 26 HD23 LEU 26 -7.588 7.887 0.326 1157 H GLU 27 HN GLU 27 -3.821 7.081 -4.777 1158 HA GLU 27 HA GLU 27 -4.710 4.620 -5.877 1159 HB2 GLU 27 HB2 GLU 27 -4.142 6.776 -7.119 1160 HB3 GLU 27 HB1 GLU 27 -2.458 6.284 -6.983 1161 HG2 GLU 27 HG2 GLU 27 -2.726 4.487 -8.396 1162 HG3 GLU 27 HG1 GLU 27 -4.463 4.394 -8.111 1163 H GLU 28 HN GLU 28 -1.507 5.717 -4.726 1164 HA GLU 28 HA GLU 28 -0.103 3.396 -5.435 1165 HB2 GLU 28 HB2 GLU 28 0.868 5.627 -4.654 1166 HB3 GLU 28 HB1 GLU 28 0.568 5.067 -3.015 1167 HG2 GLU 28 HG2 GLU 28 2.045 3.191 -3.339 1168 HG3 GLU 28 HG1 GLU 28 2.265 3.611 -5.036 1169 H MET 29 HN MET 29 -1.997 4.128 -2.526 1170 HA MET 29 HA MET 29 -1.220 1.637 -1.287 1171 HB2 MET 29 HB2 MET 29 -2.625 2.236 0.552 1172 HB3 MET 29 HB1 MET 29 -1.757 3.678 0.051 1173 HG2 MET 29 HG2 MET 29 -3.727 4.509 -1.075 1174 HG3 MET 29 HG1 MET 29 -4.599 3.026 -0.690 1175 HE1 MET 29 HE1 MET 29 -2.825 6.197 0.789 1176 HE2 MET 29 HE2 MET 29 -2.103 4.906 1.744 1177 HE3 MET 29 HE3 MET 29 -3.200 6.059 2.504 1178 H LEU 30 HN LEU 30 -3.847 2.781 -3.270 1179 HA LEU 30 HA LEU 30 -5.705 0.722 -2.752 1180 HB2 LEU 30 HB2 LEU 30 -6.489 2.646 -3.893 1181 HB3 LEU 30 HB1 LEU 30 -5.241 2.524 -5.121 1182 HG LEU 30 HG LEU 30 -6.398 0.280 -5.735 1183 HD11 LEU 30 HD11 LEU 30 -8.798 0.249 -5.295 1184 HD12 LEU 30 HD12 LEU 30 -8.638 1.696 -4.300 1185 HD13 LEU 30 HD13 LEU 30 -7.876 0.191 -3.793 1186 HD21 LEU 30 HD21 LEU 30 -7.905 1.457 -7.263 1187 HD22 LEU 30 HD22 LEU 30 -6.323 2.235 -7.188 1188 HD23 LEU 30 HD23 LEU 30 -7.694 2.939 -6.331 1189 H GLU 31 HN GLU 31 -3.194 1.082 -5.213 1190 HA GLU 31 HA GLU 31 -3.678 -1.352 -6.532 1191 HB2 GLU 31 HB2 GLU 31 -1.107 0.222 -6.345 1192 HB3 GLU 31 HB1 GLU 31 -1.466 -1.017 -7.533 1193 HG2 GLU 31 HG2 GLU 31 -3.399 0.411 -8.286 1194 HG3 GLU 31 HG1 GLU 31 -2.762 1.677 -7.242 1195 H LYS 32 HN LYS 32 -2.087 -0.627 -3.574 1196 HA LYS 32 HA LYS 32 -0.563 -3.074 -3.462 1197 HB2 LYS 32 HB2 LYS 32 -1.156 -0.939 -1.408 1198 HB3 LYS 32 HB1 LYS 32 -0.176 -2.357 -1.072 1199 HG2 LYS 32 HG2 LYS 32 1.404 -1.667 -2.818 1200 HG3 LYS 32 HG1 LYS 32 0.430 -0.220 -3.097 1201 HD2 LYS 32 HD2 LYS 32 0.747 0.337 -0.663 1202 HD3 LYS 32 HD1 LYS 32 1.917 -0.980 -0.593 1203 HE2 LYS 32 HE2 LYS 32 3.252 0.119 -2.330 1204 HE3 LYS 32 HE1 LYS 32 2.084 1.439 -2.379 1205 HZ1 LYS 32 HZ1 LYS 32 3.876 2.117 -1.006 1206 HZ2 LYS 32 HZ2 LYS 32 3.844 0.679 -0.108 1207 HZ3 LYS 32 HZ3 LYS 32 2.574 1.797 0.027 1208 H LEU 33 HN LEU 33 -3.688 -1.943 -2.463 1209 HA LEU 33 HA LEU 33 -4.166 -4.056 -0.583 1210 HB2 LEU 33 HB2 LEU 33 -5.296 -2.008 -0.200 1211 HB3 LEU 33 HB1 LEU 33 -5.923 -1.965 -1.838 1212 HG LEU 33 HG LEU 33 -7.250 -4.055 -1.240 1213 HD11 LEU 33 HD11 LEU 33 -7.689 -4.440 1.117 1214 HD12 LEU 33 HD12 LEU 33 -6.525 -3.189 1.555 1215 HD13 LEU 33 HD13 LEU 33 -5.975 -4.664 0.759 1216 HD21 LEU 33 HD21 LEU 33 -7.868 -1.507 0.246 1217 HD22 LEU 33 HD22 LEU 33 -9.021 -2.770 -0.189 1218 HD23 LEU 33 HD23 LEU 33 -8.232 -1.821 -1.451 1219 H GLU 34 HN GLU 34 -5.170 -3.389 -3.925 1220 HA GLU 34 HA GLU 34 -6.969 -5.513 -4.154 1221 HB2 GLU 34 HB2 GLU 34 -6.567 -5.328 -6.623 1222 HB3 GLU 34 HB1 GLU 34 -7.068 -3.856 -5.815 1223 HG2 GLU 34 HG2 GLU 34 -4.735 -3.088 -5.813 1224 HG3 GLU 34 HG1 GLU 34 -4.269 -4.552 -6.678 1225 H VAL 35 HN VAL 35 -3.460 -5.499 -4.540 1226 HA VAL 35 HA VAL 35 -3.386 -8.130 -5.649 1227 HB VAL 35 HB VAL 35 -0.970 -8.118 -5.157 1228 HG11 VAL 35 HG11 VAL 35 -1.880 -7.124 -7.218 1229 HG12 VAL 35 HG12 VAL 35 -0.380 -6.352 -6.695 1230 HG13 VAL 35 HG13 VAL 35 -1.929 -5.555 -6.413 1231 HG21 VAL 35 HG21 VAL 35 -1.129 -5.289 -4.234 1232 HG22 VAL 35 HG22 VAL 35 0.126 -6.498 -3.955 1233 HG23 VAL 35 HG23 VAL 35 -1.396 -6.581 -3.064 1234 H VAL 36 HN VAL 36 -3.368 -6.824 -2.405 1235 HA VAL 36 HA VAL 36 -2.514 -9.177 -1.067 1236 HB VAL 36 HB VAL 36 -4.101 -6.794 -0.127 1237 HG11 VAL 36 HG11 VAL 36 -4.867 -8.464 1.323 1238 HG12 VAL 36 HG12 VAL 36 -3.543 -7.689 2.197 1239 HG13 VAL 36 HG13 VAL 36 -3.288 -9.246 1.405 1240 HG21 VAL 36 HG21 VAL 36 -2.082 -6.156 0.983 1241 HG22 VAL 36 HG22 VAL 36 -1.709 -6.503 -0.706 1242 HG23 VAL 36 HG23 VAL 36 -1.304 -7.679 0.544 1243 H VAL 37 HN VAL 37 -5.694 -7.855 -1.861 1244 HA VAL 37 HA VAL 37 -7.261 -9.831 -0.629 1245 HB VAL 37 HB VAL 37 -7.919 -8.278 -3.147 1246 HG11 VAL 37 HG11 VAL 37 -9.720 -9.639 -1.148 1247 HG12 VAL 37 HG12 VAL 37 -9.411 -10.173 -2.797 1248 HG13 VAL 37 HG13 VAL 37 -10.254 -8.651 -2.507 1249 HG21 VAL 37 HG21 VAL 37 -7.335 -6.749 -1.378 1250 HG22 VAL 37 HG22 VAL 37 -8.373 -7.607 -0.240 1251 HG23 VAL 37 HG23 VAL 37 -9.086 -6.729 -1.594 1252 H ASN 38 HN ASN 38 -5.705 -9.702 -3.782 1253 HA ASN 38 HA ASN 38 -6.907 -11.991 -4.889 1254 HB2 ASN 38 HB2 ASN 38 -5.433 -10.189 -6.027 1255 HB3 ASN 38 HB1 ASN 38 -4.083 -11.209 -5.532 1256 HD21 ASN 38 HD21 ASN 38 -3.979 -13.376 -6.370 1257 HD22 ASN 38 HD22 ASN 38 -4.767 -13.762 -7.858 1258 H GLU 39 HN GLU 39 -3.994 -11.582 -2.900 1259 HA GLU 39 HA GLU 39 -3.080 -14.247 -3.066 1260 HB2 GLU 39 HB2 GLU 39 -2.770 -12.493 -0.624 1261 HB3 GLU 39 HB1 GLU 39 -1.698 -13.766 -1.185 1262 HG2 GLU 39 HG2 GLU 39 -1.695 -12.081 -3.313 1263 HG3 GLU 39 HG1 GLU 39 -1.858 -10.957 -1.968 1264 H ARG 40 HN ARG 40 -5.281 -12.619 -0.838 1265 HA ARG 40 HA ARG 40 -5.781 -14.836 0.838 1266 HB2 ARG 40 HB2 ARG 40 -7.349 -12.331 0.220 1267 HB3 ARG 40 HB1 ARG 40 -7.937 -13.540 1.356 1268 HG2 ARG 40 HG2 ARG 40 -5.243 -12.246 1.643 1269 HG3 ARG 40 HG1 ARG 40 -6.713 -11.544 2.318 1270 HD2 ARG 40 HD2 ARG 40 -5.681 -14.312 2.919 1271 HD3 ARG 40 HD1 ARG 40 -5.449 -12.899 3.946 1272 HE ARG 40 HE ARG 40 -7.774 -12.890 4.413 1273 HH11 ARG 40 HH11 ARG 40 -6.644 -15.740 2.697 1274 HH12 ARG 40 HH12 ARG 40 -8.144 -16.612 2.906 1275 HH21 ARG 40 HH21 ARG 40 -9.727 -14.046 4.719 1276 HH22 ARG 40 HH22 ARG 40 -9.906 -15.638 4.030 1277 H ARG 41 HN ARG 41 -7.154 -13.741 -2.196 1278 HA ARG 41 HA ARG 41 -9.379 -15.469 -2.310 1279 HB2 ARG 41 HB2 ARG 41 -7.687 -14.169 -4.452 1280 HB3 ARG 41 HB1 ARG 41 -9.053 -15.199 -4.849 1281 HG2 ARG 41 HG2 ARG 41 -9.443 -12.888 -3.002 1282 HG3 ARG 41 HG1 ARG 41 -9.334 -12.618 -4.743 1283 HD2 ARG 41 HD2 ARG 41 -11.311 -14.372 -3.298 1284 HD3 ARG 41 HD1 ARG 41 -11.649 -12.852 -4.121 1285 HE ARG 41 HE ARG 41 -10.491 -14.765 -5.882 1286 HH11 ARG 41 HH11 ARG 41 -13.512 -13.859 -4.340 1287 HH12 ARG 41 HH12 ARG 41 -14.488 -14.636 -5.548 1288 HH21 ARG 41 HH21 ARG 41 -11.775 -15.764 -7.460 1289 HH22 ARG 41 HH22 ARG 41 -13.506 -15.704 -7.328 1290 H GLU 42 HN GLU 42 -6.052 -15.787 -3.466 1291 HA GLU 42 HA GLU 42 -6.257 -18.303 -4.662 1292 HB2 GLU 42 HB2 GLU 42 -3.877 -17.068 -3.263 1293 HB3 GLU 42 HB1 GLU 42 -3.816 -18.431 -4.378 1294 HG2 GLU 42 HG2 GLU 42 -4.507 -17.058 -6.201 1295 HG3 GLU 42 HG1 GLU 42 -4.836 -15.702 -5.122 1296 H GLU 43 HN GLU 43 -5.721 -17.387 -1.296 1297 HA GLU 43 HA GLU 43 -5.103 -20.019 -0.385 1298 HB2 GLU 43 HB2 GLU 43 -6.217 -17.733 1.245 1299 HB3 GLU 43 HB1 GLU 43 -5.311 -19.118 1.835 1300 HG2 GLU 43 HG2 GLU 43 -3.312 -18.341 0.796 1301 HG3 GLU 43 HG1 GLU 43 -4.189 -17.056 -0.036 1302 H GLU 44 HN GLU 44 -8.038 -18.029 -0.326 1303 HA GLU 44 HA GLU 44 -9.649 -19.955 0.971 1304 HB2 GLU 44 HB2 GLU 44 -9.971 -17.313 -0.034 1305 HB3 GLU 44 HB1 GLU 44 -11.276 -18.299 -0.681 1306 HG2 GLU 44 HG2 GLU 44 -12.152 -17.475 1.297 1307 HG3 GLU 44 HG1 GLU 44 -11.610 -19.094 1.728 1308 H SER 45 HN SER 45 -8.710 -19.521 -2.353 1309 HA SER 45 HA SER 45 -10.733 -21.308 -3.370 1310 HB2 SER 45 HB2 SER 45 -8.229 -20.224 -4.695 1311 HB3 SER 45 HB1 SER 45 -9.534 -21.081 -5.518 1312 HG SER 45 HG SER 45 -10.859 -19.268 -4.441 1313 H ALA 46 HN ALA 46 -7.575 -21.590 -2.033 1314 HA ALA 46 HA ALA 46 -7.133 -24.230 -3.163 1315 HB1 ALA 46 HB1 ALA 46 -5.467 -22.614 -1.239 1316 HB2 ALA 46 HB2 ALA 46 -5.244 -22.708 -2.985 1317 HB3 ALA 46 HB3 ALA 46 -4.987 -24.139 -1.986 Start of MODEL 2 1 H LEU 6 HT1 LEU 6 9.400 14.138 4.793 2 HA LEU 6 HA LEU 6 10.061 16.373 2.977 3 HB2 LEU 6 HB2 LEU 6 11.460 13.757 3.565 4 HB3 LEU 6 HB1 LEU 6 11.908 14.847 2.269 5 HG LEU 6 HG LEU 6 12.055 16.552 4.348 6 HD11 LEU 6 HD11 LEU 6 12.653 13.826 5.459 7 HD12 LEU 6 HD12 LEU 6 11.523 15.027 6.080 8 HD13 LEU 6 HD13 LEU 6 13.258 15.323 6.165 9 HD21 LEU 6 HD21 LEU 6 14.484 16.101 4.344 10 HD22 LEU 6 HD22 LEU 6 13.797 16.224 2.725 11 HD23 LEU 6 HD23 LEU 6 14.181 14.641 3.401 12 H THR 7 HN THR 7 10.432 15.383 0.694 13 HA THR 7 HA THR 7 7.937 14.292 -0.152 14 HB THR 7 HB THR 7 10.130 14.186 -2.097 15 HG1 THR 7 HG1 THR 7 11.034 15.961 -1.304 16 HG21 THR 7 HG21 THR 7 7.449 15.567 -1.947 17 HG22 THR 7 HG22 THR 7 7.868 14.117 -2.864 18 HG23 THR 7 HG23 THR 7 8.532 15.679 -3.337 19 H LYS 8 HN LYS 8 7.490 12.281 -1.087 20 HA LYS 8 HA LYS 8 8.835 10.058 0.004 21 HB2 LYS 8 HB2 LYS 8 7.291 8.703 -1.184 22 HB3 LYS 8 HB1 LYS 8 6.411 10.169 -0.776 23 HG2 LYS 8 HG2 LYS 8 6.778 11.012 -3.055 24 HG3 LYS 8 HG1 LYS 8 7.626 9.518 -3.457 25 HD2 LYS 8 HD2 LYS 8 5.375 8.449 -2.528 26 HD3 LYS 8 HD1 LYS 8 4.728 10.009 -3.029 27 HE2 LYS 8 HE2 LYS 8 5.664 9.647 -5.284 28 HE3 LYS 8 HE1 LYS 8 6.255 8.071 -4.770 29 HZ1 LYS 8 HZ1 LYS 8 3.879 7.516 -4.237 30 HZ2 LYS 8 HZ2 LYS 8 4.236 7.699 -5.880 31 HZ3 LYS 8 HZ3 LYS 8 3.432 8.937 -5.056 32 H THR 9 HN THR 9 9.253 11.836 -2.938 33 HA THR 9 HA THR 9 10.688 9.914 -4.422 34 HB THR 9 HB THR 9 11.556 12.529 -5.116 35 HG1 THR 9 HG1 THR 9 9.391 13.477 -5.329 36 HG21 THR 9 HG21 THR 9 9.327 10.879 -6.323 37 HG22 THR 9 HG22 THR 9 11.045 10.614 -6.634 38 HG23 THR 9 HG23 THR 9 10.280 12.123 -7.130 39 H ASP 10 HN ASP 10 11.592 12.181 -1.912 40 HA ASP 10 HA ASP 10 14.377 12.247 -2.376 41 HB2 ASP 10 HB2 ASP 10 12.623 12.839 -0.020 42 HB3 ASP 10 HB1 ASP 10 14.362 12.705 0.229 43 H TYR 11 HN TYR 11 12.410 10.316 -0.140 44 HA TYR 11 HA TYR 11 14.526 8.737 0.834 45 HB2 TYR 11 HB2 TYR 11 11.690 7.747 0.623 46 HB3 TYR 11 HB1 TYR 11 12.887 7.369 1.853 47 HD1 TYR 11 HD1 TYR 11 13.808 9.894 2.839 48 HD2 TYR 11 HD2 TYR 11 9.892 8.806 1.578 49 HE1 TYR 11 HE1 TYR 11 12.864 11.634 4.288 50 HE2 TYR 11 HE2 TYR 11 8.934 10.547 3.028 51 HH TYR 11 HH TYR 11 9.502 11.848 4.985 52 H LEU 12 HN LEU 12 12.312 8.364 -1.868 53 HA LEU 12 HA LEU 12 12.925 5.755 -2.637 54 HB2 LEU 12 HB2 LEU 12 11.048 6.929 -3.585 55 HB3 LEU 12 HB1 LEU 12 12.100 8.148 -4.277 56 HG LEU 12 HG LEU 12 13.093 6.325 -5.720 57 HD11 LEU 12 HD11 LEU 12 12.410 4.393 -4.438 58 HD12 LEU 12 HD12 LEU 12 11.701 4.319 -6.051 59 HD13 LEU 12 HD13 LEU 12 10.709 4.802 -4.672 60 HD21 LEU 12 HD21 LEU 12 10.214 7.157 -5.947 61 HD22 LEU 12 HD22 LEU 12 11.038 6.246 -7.212 62 HD23 LEU 12 HD23 LEU 12 11.622 7.847 -6.756 63 H MET 13 HN MET 13 14.423 8.820 -3.612 64 HA MET 13 HA MET 13 16.278 7.668 -5.403 65 HB2 MET 13 HB2 MET 13 15.989 10.313 -4.066 66 HB3 MET 13 HB1 MET 13 17.541 9.922 -4.794 67 HG2 MET 13 HG2 MET 13 14.867 10.181 -6.117 68 HG3 MET 13 HG1 MET 13 16.357 11.060 -6.455 69 HE1 MET 13 HE1 MET 13 18.451 9.984 -7.813 70 HE2 MET 13 HE2 MET 13 18.564 8.244 -8.079 71 HE3 MET 13 HE3 MET 13 18.512 8.883 -6.436 72 H ARG 14 HN ARG 14 16.430 8.411 -1.967 73 HA ARG 14 HA ARG 14 19.176 7.850 -1.624 74 HB2 ARG 14 HB2 ARG 14 17.809 9.105 0.009 75 HB3 ARG 14 HB1 ARG 14 16.921 7.636 0.383 76 HG2 ARG 14 HG2 ARG 14 19.869 7.571 0.678 77 HG3 ARG 14 HG1 ARG 14 18.947 8.492 1.864 78 HD2 ARG 14 HD2 ARG 14 17.652 6.552 2.444 79 HD3 ARG 14 HD1 ARG 14 18.385 5.622 1.143 80 HE ARG 14 HE ARG 14 19.618 6.346 3.692 81 HH11 ARG 14 HH11 ARG 14 19.961 4.835 0.546 82 HH12 ARG 14 HH12 ARG 14 21.332 3.881 1.026 83 HH21 ARG 14 HH21 ARG 14 21.419 5.087 4.312 84 HH22 ARG 14 HH22 ARG 14 22.155 4.019 3.157 85 H LEU 15 HN LEU 15 16.281 5.859 -1.579 86 HA LEU 15 HA LEU 15 17.653 3.487 -0.677 87 HB2 LEU 15 HB2 LEU 15 14.880 3.893 -1.806 88 HB3 LEU 15 HB1 LEU 15 15.475 2.381 -1.149 89 HG LEU 15 HG LEU 15 15.120 4.954 0.395 90 HD11 LEU 15 HD11 LEU 15 13.576 2.366 0.472 91 HD12 LEU 15 HD12 LEU 15 13.003 3.906 -0.167 92 HD13 LEU 15 HD13 LEU 15 13.343 3.738 1.556 93 HD21 LEU 15 HD21 LEU 15 16.953 3.814 1.361 94 HD22 LEU 15 HD22 LEU 15 16.160 2.249 1.197 95 HD23 LEU 15 HD23 LEU 15 15.551 3.428 2.358 96 H ARG 16 HN ARG 16 17.443 5.074 -3.619 97 HA ARG 16 HA ARG 16 17.356 2.822 -5.369 98 HB2 ARG 16 HB2 ARG 16 17.437 5.660 -5.639 99 HB3 ARG 16 HB1 ARG 16 18.742 4.986 -6.605 100 HG2 ARG 16 HG2 ARG 16 17.094 4.916 -8.156 101 HG3 ARG 16 HG1 ARG 16 16.800 3.353 -7.391 102 HD2 ARG 16 HD2 ARG 16 15.153 4.523 -5.889 103 HD3 ARG 16 HD1 ARG 16 15.348 5.949 -6.907 104 HE ARG 16 HE ARG 16 14.131 3.381 -7.708 105 HH11 ARG 16 HH11 ARG 16 14.810 6.773 -8.394 106 HH12 ARG 16 HH12 ARG 16 13.639 6.868 -9.667 107 HH21 ARG 16 HH21 ARG 16 12.570 3.528 -9.356 108 HH22 ARG 16 HH22 ARG 16 12.368 5.037 -10.210 109 H ARG 17 HN ARG 17 19.723 4.027 -3.303 110 HA ARG 17 HA ARG 17 21.992 3.148 -4.885 111 HB2 ARG 17 HB2 ARG 17 21.826 4.182 -2.044 112 HB3 ARG 17 HB1 ARG 17 23.322 3.819 -2.894 113 HG2 ARG 17 HG2 ARG 17 22.586 5.508 -4.626 114 HG3 ARG 17 HG1 ARG 17 21.335 5.993 -3.479 115 HD2 ARG 17 HD2 ARG 17 24.312 6.001 -2.967 116 HD3 ARG 17 HD1 ARG 17 23.326 7.418 -3.318 117 HE ARG 17 HE ARG 17 23.339 5.858 -0.836 118 HH11 ARG 17 HH11 ARG 17 22.034 8.540 -2.676 119 HH12 ARG 17 HH12 ARG 17 21.510 9.413 -1.271 120 HH21 ARG 17 HH21 ARG 17 22.645 6.996 1.023 121 HH22 ARG 17 HH22 ARG 17 21.857 8.533 0.846 122 H CYS 18 HN CYS 18 19.736 1.640 -2.966 123 HA CYS 18 HA CYS 18 21.619 -0.412 -2.027 124 HB2 CYS 18 HB2 CYS 18 18.699 -0.287 -1.320 125 HB3 CYS 18 HB1 CYS 18 20.015 -1.044 -0.431 126 HG CYS 18 HG CYS 18 20.737 1.019 0.982 127 H GLN 19 HN GLN 19 21.587 -2.442 -2.824 128 HA GLN 19 HA GLN 19 19.432 -3.169 -4.683 129 HB2 GLN 19 HB2 GLN 19 22.237 -2.799 -5.310 130 HB3 GLN 19 HB1 GLN 19 21.731 -4.447 -5.652 131 HG2 GLN 19 HG2 GLN 19 20.141 -2.109 -6.645 132 HG3 GLN 19 HG1 GLN 19 21.562 -2.681 -7.513 133 HE21 GLN 19 HE21 GLN 19 20.286 -3.242 -9.297 134 HE22 GLN 19 HE22 GLN 19 19.275 -4.648 -9.288 135 H THR 20 HN THR 20 19.822 -5.610 -5.309 136 HA THR 20 HA THR 20 19.797 -7.792 -4.710 137 HB THR 20 HB THR 20 21.401 -7.198 -2.236 138 HG1 THR 20 HG1 THR 20 22.714 -6.198 -3.622 139 HG21 THR 20 HG21 THR 20 22.440 -9.358 -2.787 140 HG22 THR 20 HG22 THR 20 21.400 -9.493 -4.203 141 HG23 THR 20 HG23 THR 20 20.694 -9.507 -2.587 142 H ILE 21 HN ILE 21 18.441 -5.401 -2.870 143 HA ILE 21 HA ILE 21 16.607 -5.311 -1.539 144 HB ILE 21 HB ILE 21 16.511 -8.323 -1.800 145 HG12 ILE 21 HG12 ILE 21 14.954 -6.151 -3.227 146 HG13 ILE 21 HG11 ILE 21 16.254 -7.104 -3.935 147 HG21 ILE 21 HG21 ILE 21 14.368 -6.428 -0.842 148 HG22 ILE 21 HG22 ILE 21 15.348 -7.453 0.207 149 HG23 ILE 21 HG23 ILE 21 14.251 -8.182 -0.968 150 HD11 ILE 21 HD11 ILE 21 14.935 -9.101 -3.781 151 HD12 ILE 21 HD12 ILE 21 13.993 -7.847 -4.584 152 HD13 ILE 21 HD13 ILE 21 13.670 -8.246 -2.899 153 H ASP 22 HN ASP 22 18.995 -7.752 -0.729 154 HA ASP 22 HA ASP 22 18.608 -8.182 1.941 155 HB2 ASP 22 HB2 ASP 22 20.312 -9.358 0.713 156 HB3 ASP 22 HB1 ASP 22 21.180 -7.863 0.387 157 H THR 23 HN THR 23 20.542 -5.550 0.532 158 HA THR 23 HA THR 23 21.169 -4.322 2.992 159 HB THR 23 HB THR 23 21.015 -2.827 0.391 160 HG1 THR 23 HG1 THR 23 22.888 -3.810 -0.283 161 HG21 THR 23 HG21 THR 23 23.044 -1.748 1.251 162 HG22 THR 23 HG22 THR 23 22.977 -2.765 2.689 163 HG23 THR 23 HG23 THR 23 21.703 -1.585 2.379 164 H LEU 24 HN LEU 24 18.490 -3.955 0.754 165 HA LEU 24 HA LEU 24 17.470 -1.534 1.831 166 HB2 LEU 24 HB2 LEU 24 16.972 -2.431 -0.446 167 HB3 LEU 24 HB1 LEU 24 15.985 -3.668 0.305 168 HG LEU 24 HG LEU 24 14.546 -1.862 1.258 169 HD11 LEU 24 HD11 LEU 24 14.709 0.359 0.106 170 HD12 LEU 24 HD12 LEU 24 16.306 -0.133 -0.459 171 HD13 LEU 24 HD13 LEU 24 15.987 0.015 1.270 172 HD21 LEU 24 HD21 LEU 24 13.280 -1.572 -0.698 173 HD22 LEU 24 HD22 LEU 24 14.113 -3.110 -0.907 174 HD23 LEU 24 HD23 LEU 24 14.702 -1.670 -1.731 175 H GLU 25 HN GLU 25 16.721 -4.953 2.350 176 HA GLU 25 HA GLU 25 14.519 -4.706 4.023 177 HB2 GLU 25 HB2 GLU 25 15.380 -6.832 3.056 178 HB3 GLU 25 HB1 GLU 25 16.718 -6.780 4.194 179 HG2 GLU 25 HG2 GLU 25 15.166 -8.274 5.110 180 HG3 GLU 25 HG1 GLU 25 14.985 -6.782 6.032 181 H ARG 26 HN ARG 26 17.964 -4.818 4.877 182 HA ARG 26 HA ARG 26 17.456 -4.498 7.671 183 HB2 ARG 26 HB2 ARG 26 19.704 -5.103 6.012 184 HB3 ARG 26 HB1 ARG 26 20.133 -3.779 7.088 185 HG2 ARG 26 HG2 ARG 26 19.721 -5.054 9.010 186 HG3 ARG 26 HG1 ARG 26 18.828 -6.280 8.108 187 HD2 ARG 26 HD2 ARG 26 21.627 -5.842 7.278 188 HD3 ARG 26 HD1 ARG 26 21.396 -6.554 8.872 189 HE ARG 26 HE ARG 26 20.263 -8.385 7.847 190 HH11 ARG 26 HH11 ARG 26 21.806 -6.200 5.582 191 HH12 ARG 26 HH12 ARG 26 21.856 -7.367 4.293 192 HH21 ARG 26 HH21 ARG 26 20.333 -9.915 6.159 193 HH22 ARG 26 HH22 ARG 26 21.011 -9.476 4.613 194 H VAL 27 HN VAL 27 18.046 -2.288 5.015 195 HA VAL 27 HA VAL 27 18.779 -0.089 6.678 196 HB VAL 27 HB VAL 27 19.169 -0.435 4.094 197 HG11 VAL 27 HG11 VAL 27 16.812 -0.443 3.449 198 HG12 VAL 27 HG12 VAL 27 17.690 0.890 2.697 199 HG13 VAL 27 HG13 VAL 27 16.637 1.196 4.079 200 HG21 VAL 27 HG21 VAL 27 20.073 1.371 5.474 201 HG22 VAL 27 HG22 VAL 27 18.580 2.278 5.257 202 HG23 VAL 27 HG23 VAL 27 19.613 1.933 3.870 203 H ILE 28 HN ILE 28 15.709 -1.226 5.318 204 HA ILE 28 HA ILE 28 14.281 1.068 6.324 205 HB ILE 28 HB ILE 28 12.227 -0.109 5.658 206 HG12 ILE 28 HG12 ILE 28 14.022 -2.356 4.719 207 HG13 ILE 28 HG11 ILE 28 13.095 -2.415 6.215 208 HG21 ILE 28 HG21 ILE 28 13.641 1.187 4.039 209 HG22 ILE 28 HG22 ILE 28 12.578 -0.016 3.307 210 HG23 ILE 28 HG23 ILE 28 14.301 -0.354 3.491 211 HD11 ILE 28 HD11 ILE 28 11.978 -2.172 3.429 212 HD12 ILE 28 HD12 ILE 28 11.029 -2.169 4.917 213 HD13 ILE 28 HD13 ILE 28 11.946 -3.603 4.461 214 H GLU 29 HN GLU 29 15.111 -2.110 7.444 215 HA GLU 29 HA GLU 29 13.227 -2.237 9.568 216 HB2 GLU 29 HB2 GLU 29 14.591 -4.145 8.485 217 HB3 GLU 29 HB1 GLU 29 15.892 -3.640 9.554 218 HG2 GLU 29 HG2 GLU 29 14.573 -5.526 10.429 219 HG3 GLU 29 HG1 GLU 29 14.556 -4.119 11.488 220 H LYS 30 HN LYS 30 16.610 -1.223 9.318 221 HA LYS 30 HA LYS 30 17.000 -0.648 12.049 222 HB2 LYS 30 HB2 LYS 30 18.409 -0.107 9.520 223 HB3 LYS 30 HB1 LYS 30 18.692 1.086 10.779 224 HG2 LYS 30 HG2 LYS 30 19.450 -0.649 12.291 225 HG3 LYS 30 HG1 LYS 30 19.110 -1.882 11.076 226 HD2 LYS 30 HD2 LYS 30 20.815 -1.050 9.639 227 HD3 LYS 30 HD1 LYS 30 21.021 0.399 10.621 228 HE2 LYS 30 HE2 LYS 30 22.841 -1.112 11.060 229 HE3 LYS 30 HE1 LYS 30 21.810 -1.028 12.486 230 HZ1 LYS 30 HZ1 LYS 30 20.841 -3.125 11.919 231 HZ2 LYS 30 HZ2 LYS 30 22.523 -3.298 11.913 232 HZ3 LYS 30 HZ3 LYS 30 21.686 -3.182 10.451 233 H ASN 31 HN ASN 31 15.825 1.317 9.356 234 HA ASN 31 HA ASN 31 15.688 3.728 10.893 235 HB2 ASN 31 HB2 ASN 31 14.521 2.964 8.217 236 HB3 ASN 31 HB1 ASN 31 14.243 4.532 8.959 237 HD21 ASN 31 HD21 ASN 31 17.007 4.518 10.111 238 HD22 ASN 31 HD22 ASN 31 18.028 4.912 8.768 239 H LYS 32 HN LYS 32 13.660 0.995 10.481 240 HA LYS 32 HA LYS 32 11.135 2.089 10.948 241 HB2 LYS 32 HB2 LYS 32 11.775 -0.296 10.256 242 HB3 LYS 32 HB1 LYS 32 11.997 -0.608 11.971 243 HG2 LYS 32 HG2 LYS 32 9.658 0.029 12.373 244 HG3 LYS 32 HG1 LYS 32 9.449 0.281 10.639 245 HD2 LYS 32 HD2 LYS 32 10.373 -2.334 11.802 246 HD3 LYS 32 HD1 LYS 32 8.670 -1.947 11.565 247 HE2 LYS 32 HE2 LYS 32 8.970 -1.753 9.201 248 HE3 LYS 32 HE1 LYS 32 10.721 -1.855 9.359 249 HZ1 LYS 32 HZ1 LYS 32 8.924 -4.056 10.197 250 HZ2 LYS 32 HZ2 LYS 32 10.599 -4.115 9.941 251 HZ3 LYS 32 HZ3 LYS 32 9.548 -3.937 8.627 252 H TYR 33 HN TYR 33 13.716 1.256 13.181 253 HA TYR 33 HA TYR 33 11.999 1.848 15.473 254 HB2 TYR 33 HB2 TYR 33 14.909 1.190 15.727 255 HB3 TYR 33 HB1 TYR 33 13.590 0.837 16.833 256 HD1 TYR 33 HD1 TYR 33 11.683 -0.706 15.531 257 HD2 TYR 33 HD2 TYR 33 15.881 -0.676 14.831 258 HE1 TYR 33 HE1 TYR 33 11.551 -2.997 14.650 259 HE2 TYR 33 HE2 TYR 33 15.756 -2.964 13.949 260 HH TYR 33 HH TYR 33 12.976 -4.416 12.986 261 H GLU 34 HN GLU 34 13.456 3.708 13.357 262 HA GLU 34 HA GLU 34 14.483 5.610 15.361 263 HB2 GLU 34 HB2 GLU 34 15.197 5.357 12.439 264 HB3 GLU 34 HB1 GLU 34 15.789 6.611 13.519 265 HG2 GLU 34 HG2 GLU 34 16.858 4.877 14.903 266 HG3 GLU 34 HG1 GLU 34 16.319 3.656 13.747 267 H LEU 35 HN LEU 35 12.276 5.055 12.775 268 HA LEU 35 HA LEU 35 11.640 7.756 12.201 269 HB2 LEU 35 HB2 LEU 35 10.288 5.126 11.694 270 HB3 LEU 35 HB1 LEU 35 9.469 6.636 11.324 271 HG LEU 35 HG LEU 35 12.218 6.129 10.235 272 HD11 LEU 35 HD11 LEU 35 11.001 4.143 9.621 273 HD12 LEU 35 HD12 LEU 35 11.168 5.185 8.210 274 HD13 LEU 35 HD13 LEU 35 9.634 5.111 9.070 275 HD21 LEU 35 HD21 LEU 35 9.850 7.609 9.100 276 HD22 LEU 35 HD22 LEU 35 11.513 7.640 8.507 277 HD23 LEU 35 HD23 LEU 35 11.119 8.369 10.067 278 H SER 36 HN SER 36 9.668 8.865 12.710 279 HA SER 36 HA SER 36 8.846 8.341 15.477 280 HB2 SER 36 HB2 SER 36 8.112 10.871 14.097 281 HB3 SER 36 HB1 SER 36 8.650 10.611 15.756 282 HG SER 36 HG SER 36 10.196 10.761 13.383 283 H ASP 37 H ASP 37 7.856 7.236 12.777 284 HA ASP 37 HA ASP 37 5.932 6.224 12.077 285 HB2 ASP 37 3HB ASP 37 4.762 7.609 14.584 286 HB3 ASP 37 2HB ASP 37 3.770 6.661 13.483 287 H ASN 38 HN ASN 38 5.727 9.692 12.863 288 HA ASN 38 HA ASN 38 3.579 10.226 11.103 289 HB2 ASN 38 HB2 ASN 38 4.190 12.591 11.323 290 HB3 ASN 38 HB1 ASN 38 4.150 11.781 12.885 291 HD21 ASN 38 HD21 ASN 38 5.556 14.200 11.811 292 HD22 ASN 38 HD22 ASN 38 7.210 13.974 12.271 293 H GLU 39 HN GLU 39 7.065 10.067 10.599 294 HA GLU 39 HA GLU 39 6.731 10.963 7.833 295 HB2 GLU 39 HB2 GLU 39 9.387 9.969 8.537 296 HB3 GLU 39 HB1 GLU 39 8.919 11.522 7.869 297 HG2 GLU 39 HG2 GLU 39 9.798 12.191 9.851 298 HG3 GLU 39 HG1 GLU 39 8.115 11.972 10.330 299 H LEU 40 HN LEU 40 6.849 8.147 9.692 300 HA LEU 40 HA LEU 40 7.906 6.281 7.872 301 HB2 LEU 40 HB2 LEU 40 7.674 5.693 10.185 302 HB3 LEU 40 HB1 LEU 40 5.955 6.022 10.157 303 HG LEU 40 HG LEU 40 5.638 4.061 8.662 304 HD11 LEU 40 HD11 LEU 40 7.965 4.082 7.762 305 HD12 LEU 40 HD12 LEU 40 7.392 2.499 8.288 306 HD13 LEU 40 HD13 LEU 40 8.503 3.413 9.303 307 HD21 LEU 40 HD21 LEU 40 5.258 3.821 11.023 308 HD22 LEU 40 HD22 LEU 40 6.978 3.580 11.320 309 HD23 LEU 40 HD23 LEU 40 6.059 2.370 10.425 310 H ALA 41 HN ALA 41 4.745 7.714 8.251 311 HA ALA 41 HA ALA 41 3.189 5.961 6.746 312 HB1 ALA 41 HB1 ALA 41 2.890 8.953 6.979 313 HB2 ALA 41 HB2 ALA 41 2.284 7.767 8.136 314 HB3 ALA 41 HB3 ALA 41 1.630 7.815 6.497 315 H VAL 42 HN VAL 42 5.080 8.791 5.679 316 HA VAL 42 HA VAL 42 4.372 8.252 2.914 317 HB VAL 42 HB VAL 42 5.768 10.222 2.365 318 HG11 VAL 42 HG11 VAL 42 4.291 11.890 3.421 319 HG12 VAL 42 HG12 VAL 42 3.687 10.640 4.506 320 HG13 VAL 42 HG13 VAL 42 3.401 10.514 2.770 321 HG21 VAL 42 HG21 VAL 42 6.853 11.526 3.971 322 HG22 VAL 42 HG22 VAL 42 7.260 9.870 4.425 323 HG23 VAL 42 HG23 VAL 42 6.010 10.748 5.310 324 H PHE 43 HN PHE 43 6.793 7.338 5.096 325 HA PHE 43 HA PHE 43 8.958 7.020 3.288 326 HB2 PHE 43 HB2 PHE 43 9.169 7.041 5.794 327 HB3 PHE 43 HB1 PHE 43 8.437 5.440 5.819 328 HD1 PHE 43 HD1 PHE 43 11.303 7.297 4.324 329 HD2 PHE 43 HD2 PHE 43 9.783 3.569 5.723 330 HE1 PHE 43 HE1 PHE 43 13.519 6.276 3.997 331 HE2 PHE 43 HE2 PHE 43 12.001 2.546 5.407 332 HZ PHE 43 HZ PHE 43 13.867 3.899 4.540 333 H TYR 44 HN TYR 44 6.174 5.122 4.133 334 HA TYR 44 HA TYR 44 6.935 2.643 3.055 335 HB2 TYR 44 HB2 TYR 44 4.245 3.946 3.454 336 HB3 TYR 44 HB1 TYR 44 4.407 2.336 2.766 337 HD1 TYR 44 HD1 TYR 44 6.626 1.261 4.445 338 HD2 TYR 44 HD2 TYR 44 3.188 3.536 5.504 339 HE1 TYR 44 HE1 TYR 44 6.678 0.275 6.696 340 HE2 TYR 44 HE2 TYR 44 3.230 2.558 7.763 341 HH TYR 44 HH TYR 44 5.893 0.709 8.917 342 H SER 45 HN SER 45 5.501 5.499 1.584 343 HA SER 45 HA SER 45 4.900 4.381 -0.927 344 HB2 SER 45 HB2 SER 45 5.619 7.168 -1.111 345 HB3 SER 45 HB1 SER 45 4.028 6.420 -1.251 346 HG SER 45 HG SER 45 5.287 7.567 0.955 347 H ALA 46 HN ALA 46 7.876 5.100 0.516 348 HA ALA 46 HA ALA 46 9.243 5.253 -2.077 349 HB1 ALA 46 HB1 ALA 46 9.922 7.028 -0.650 350 HB2 ALA 46 HB2 ALA 46 11.244 5.861 -0.670 351 HB3 ALA 46 HB3 ALA 46 10.150 5.933 0.713 352 H ALA 47 HN ALA 47 9.218 3.534 1.015 353 HA ALA 47 HA ALA 47 11.236 1.668 0.422 354 HB1 ALA 47 HB1 ALA 47 10.332 2.161 2.687 355 HB2 ALA 47 HB2 ALA 47 10.436 0.440 2.318 356 HB3 ALA 47 HB3 ALA 47 8.878 1.263 2.253 357 H ASP 48 HN ASP 48 7.684 1.276 0.327 358 HA ASP 48 HA ASP 48 7.677 -1.284 -0.810 359 HB2 ASP 48 HB2 ASP 48 5.658 0.949 -0.759 360 HB3 ASP 48 HB1 ASP 48 5.330 -0.536 -1.641 361 H HIS 49 HN HIS 49 7.534 1.918 -2.299 362 HA HIS 49 HA HIS 49 7.187 1.149 -4.958 363 HB2 HIS 49 HB2 HIS 49 7.163 3.507 -3.856 364 HB3 HIS 49 HB1 HIS 49 8.886 3.508 -4.213 365 HD1 HIS 49 HD1 HIS 49 5.700 4.413 -5.644 366 HD2 HIS 49 HD2 HIS 49 9.361 3.063 -7.128 367 HE1 HIS 49 HE1 HIS 49 5.706 4.990 -8.095 368 HE2 HIS 49 HE2 HIS 49 7.847 4.005 -9.000 369 H ARG 50 HN ARG 50 10.198 1.730 -3.146 370 HA ARG 50 HA ARG 50 11.912 1.097 -5.321 371 HB2 ARG 50 HB2 ARG 50 12.747 2.451 -3.518 372 HB3 ARG 50 HB1 ARG 50 12.394 1.195 -2.343 373 HG2 ARG 50 HG2 ARG 50 14.775 1.317 -2.808 374 HG3 ARG 50 HG1 ARG 50 14.111 -0.230 -3.329 375 HD2 ARG 50 HD2 ARG 50 14.050 0.550 -5.631 376 HD3 ARG 50 HD1 ARG 50 14.646 2.133 -5.131 377 HE ARG 50 HE ARG 50 16.525 0.353 -4.234 378 HH11 ARG 50 HH11 ARG 50 15.119 1.140 -7.351 379 HH12 ARG 50 HH12 ARG 50 16.553 0.714 -8.237 380 HH21 ARG 50 HH21 ARG 50 18.409 -0.211 -5.405 381 HH22 ARG 50 HH22 ARG 50 18.430 -0.034 -7.133 382 H LEU 51 HN LEU 51 10.612 -0.780 -2.626 383 HA LEU 51 HA LEU 51 12.104 -3.120 -3.006 384 HB2 LEU 51 HB2 LEU 51 10.654 -2.560 -1.032 385 HB3 LEU 51 HB1 LEU 51 9.258 -2.936 -2.022 386 HG LEU 51 HG LEU 51 9.938 -5.253 -2.194 387 HD11 LEU 51 HD11 LEU 51 12.394 -4.312 -0.753 388 HD12 LEU 51 HD12 LEU 51 12.275 -5.196 -2.277 389 HD13 LEU 51 HD13 LEU 51 11.893 -6.003 -0.757 390 HD21 LEU 51 HD21 LEU 51 8.606 -4.626 -0.262 391 HD22 LEU 51 HD22 LEU 51 10.069 -4.240 0.643 392 HD23 LEU 51 HD23 LEU 51 9.744 -5.905 0.161 393 H ALA 52 HN ALA 52 9.039 -2.069 -4.417 394 HA ALA 52 HA ALA 52 8.408 -4.437 -5.765 395 HB1 ALA 52 HB1 ALA 52 6.977 -3.024 -7.188 396 HB2 ALA 52 HB2 ALA 52 7.726 -1.596 -6.479 397 HB3 ALA 52 HB3 ALA 52 6.783 -2.688 -5.467 398 H GLU 53 HN GLU 53 10.062 -1.531 -7.002 399 HA GLU 53 HA GLU 53 10.569 -2.658 -9.556 400 HB2 GLU 53 HB2 GLU 53 12.062 -0.747 -9.902 401 HB3 GLU 53 HB1 GLU 53 10.518 -0.241 -9.234 402 HG2 GLU 53 HG2 GLU 53 11.502 0.043 -7.058 403 HG3 GLU 53 HG1 GLU 53 13.028 -0.634 -7.619 404 H LEU 54 HN LEU 54 12.292 -2.660 -6.526 405 HA LEU 54 HA LEU 54 14.791 -3.533 -7.539 406 HB2 LEU 54 HB2 LEU 54 14.280 -2.465 -5.281 407 HB3 LEU 54 HB1 LEU 54 13.732 -4.047 -4.768 408 HG LEU 54 HG LEU 54 15.959 -4.968 -5.137 409 HD11 LEU 54 HD11 LEU 54 17.827 -3.526 -5.709 410 HD12 LEU 54 HD12 LEU 54 16.733 -2.159 -5.904 411 HD13 LEU 54 HD13 LEU 54 16.629 -3.539 -6.997 412 HD21 LEU 54 HD21 LEU 54 15.363 -3.951 -2.965 413 HD22 LEU 54 HD22 LEU 54 16.079 -2.432 -3.510 414 HD23 LEU 54 HD23 LEU 54 17.090 -3.867 -3.319 415 H THR 55 HN THR 55 11.937 -5.216 -6.336 416 HA THR 55 HA THR 55 13.073 -7.804 -6.291 417 HB THR 55 HB THR 55 10.165 -7.064 -6.698 418 HG1 THR 55 HG1 THR 55 10.873 -6.166 -4.772 419 HG21 THR 55 HG21 THR 55 9.675 -9.269 -5.791 420 HG22 THR 55 HG22 THR 55 11.396 -9.596 -5.600 421 HG23 THR 55 HG23 THR 55 10.709 -9.426 -7.215 422 H MET 56 HN MET 56 11.397 -5.964 -8.788 423 HA MET 56 HA MET 56 11.529 -8.149 -10.682 424 HB2 MET 56 HB2 MET 56 10.557 -5.306 -10.825 425 HB3 MET 56 HB1 MET 56 10.710 -6.289 -12.271 426 HG2 MET 56 HG2 MET 56 9.138 -7.242 -9.911 427 HG3 MET 56 HG1 MET 56 8.431 -6.159 -11.107 428 HE1 MET 56 HE1 MET 56 8.334 -8.223 -14.329 429 HE2 MET 56 HE2 MET 56 9.216 -6.796 -13.776 430 HE3 MET 56 HE3 MET 56 7.494 -6.961 -13.427 431 H ASN 57 HN ASN 57 13.657 -5.919 -9.512 432 HA ASN 57 HA ASN 57 15.689 -5.123 -10.100 433 HB2 ASN 57 HB2 ASN 57 15.831 -7.692 -10.659 434 HB3 ASN 57 HB1 ASN 57 15.887 -7.121 -12.324 435 HD21 ASN 57 HD21 ASN 57 17.968 -7.660 -12.752 436 HD22 ASN 57 HD22 ASN 57 19.332 -6.932 -11.976 437 H LYS 58 HN LYS 58 13.335 -4.045 -11.335 438 HA LYS 58 HA LYS 58 14.582 -2.734 -13.623 439 HB2 LYS 58 HB2 LYS 58 12.424 -4.632 -13.839 440 HB3 LYS 58 HB1 LYS 58 11.850 -3.038 -14.305 441 HG2 LYS 58 HG2 LYS 58 12.601 -3.774 -16.315 442 HG3 LYS 58 HG1 LYS 58 14.083 -3.032 -15.711 443 HD2 LYS 58 HD2 LYS 58 14.522 -5.411 -14.725 444 HD3 LYS 58 HD1 LYS 58 13.366 -5.916 -15.959 445 HE2 LYS 58 HE2 LYS 58 15.881 -4.331 -16.469 446 HE3 LYS 58 HE1 LYS 58 15.694 -6.062 -16.740 447 HZ1 LYS 58 HZ1 LYS 58 15.357 -4.329 -18.659 448 HZ2 LYS 58 HZ2 LYS 58 13.788 -4.261 -18.036 449 HZ3 LYS 58 HZ3 LYS 58 14.417 -5.731 -18.575 450 H LEU 59 HN LEU 59 14.391 -0.603 -13.356 451 HA LEU 59 HA LEU 59 12.808 0.498 -11.263 452 HB2 LEU 59 HB2 LEU 59 14.680 1.553 -13.304 453 HB3 LEU 59 HB1 LEU 59 13.497 2.681 -12.677 454 HG LEU 59 HG LEU 59 14.305 2.289 -10.394 455 HD11 LEU 59 HD11 LEU 59 15.138 0.166 -10.216 456 HD12 LEU 59 HD12 LEU 59 16.640 1.079 -10.369 457 HD13 LEU 59 HD13 LEU 59 15.969 0.241 -11.768 458 HD21 LEU 59 HD21 LEU 59 15.273 4.115 -11.597 459 HD22 LEU 59 HD22 LEU 59 16.400 3.039 -12.422 460 HD23 LEU 59 HD23 LEU 59 16.554 3.313 -10.689 461 H TYR 60 HN TYR 60 10.842 1.417 -11.304 462 HA TYR 60 HA TYR 60 9.580 1.972 -13.891 463 HB2 TYR 60 HB2 TYR 60 8.549 0.101 -11.774 464 HB3 TYR 60 HB1 TYR 60 7.442 0.932 -12.860 465 HD1 TYR 60 HD1 TYR 60 8.106 0.721 -15.436 466 HD2 TYR 60 HD2 TYR 60 9.285 -2.004 -12.387 467 HE1 TYR 60 HE1 TYR 60 8.477 -1.015 -17.133 468 HE2 TYR 60 HE2 TYR 60 9.663 -3.745 -14.084 469 HH TYR 60 HH TYR 60 9.410 -4.314 -16.240 470 H ASP 61 HN ASP 61 8.595 3.882 -13.896 471 HA ASP 61 HA ASP 61 8.587 5.522 -11.591 472 HB2 ASP 61 HB2 ASP 61 7.460 7.185 -12.961 473 HB3 ASP 61 HB1 ASP 61 8.756 6.436 -13.881 474 H LYS 62 HN LYS 62 6.060 3.721 -13.272 475 HA LYS 62 HA LYS 62 4.299 4.170 -10.956 476 HB2 LYS 62 HB2 LYS 62 3.446 3.356 -13.739 477 HB3 LYS 62 HB1 LYS 62 2.402 3.830 -12.405 478 HG2 LYS 62 HG2 LYS 62 3.355 6.094 -12.494 479 HG3 LYS 62 HG1 LYS 62 4.336 5.609 -13.878 480 HD2 LYS 62 HD2 LYS 62 2.048 4.896 -14.900 481 HD3 LYS 62 HD1 LYS 62 1.372 5.985 -13.688 482 HE2 LYS 62 HE2 LYS 62 1.679 7.187 -15.749 483 HE3 LYS 62 HE1 LYS 62 2.828 7.789 -14.557 484 HZ1 LYS 62 HZ1 LYS 62 4.592 6.659 -15.602 485 HZ2 LYS 62 HZ2 LYS 62 3.710 7.384 -16.859 486 HZ3 LYS 62 HZ3 LYS 62 3.544 5.732 -16.560 487 H ILE 63 HN ILE 63 4.246 2.483 -9.671 488 HA ILE 63 HA ILE 63 5.194 -0.095 -10.487 489 HB ILE 63 HB ILE 63 4.003 0.870 -7.886 490 HG12 ILE 63 HG12 ILE 63 6.148 1.903 -8.432 491 HG13 ILE 63 HG11 ILE 63 6.330 0.788 -7.084 492 HG21 ILE 63 HG21 ILE 63 3.666 -1.542 -8.183 493 HG22 ILE 63 HG22 ILE 63 4.803 -1.184 -6.883 494 HG23 ILE 63 HG23 ILE 63 5.396 -1.743 -8.446 495 HD11 ILE 63 HD11 ILE 63 7.241 -0.891 -8.634 496 HD12 ILE 63 HD12 ILE 63 8.201 0.587 -8.586 497 HD13 ILE 63 HD13 ILE 63 7.119 0.282 -9.943 498 HA PRO 64 HA PRO 64 1.189 -1.697 -11.667 499 HB2 PRO 64 HB2 PRO 64 2.397 -4.360 -11.515 500 HB3 PRO 64 HB1 PRO 64 1.822 -3.481 -12.942 501 HG2 PRO 64 HG2 PRO 64 4.432 -3.964 -12.488 502 HG3 PRO 64 HG1 PRO 64 3.846 -2.530 -13.355 503 HD2 PRO 64 HD2 PRO 64 4.788 -2.774 -10.533 504 HD3 PRO 64 HD1 PRO 64 5.055 -1.472 -11.710 505 H SER 65 HN SER 65 -0.524 -2.421 -10.525 506 HA SER 65 HA SER 65 -0.264 -2.856 -7.733 507 HB2 SER 65 HB2 SER 65 -2.791 -3.487 -9.186 508 HB3 SER 65 HB1 SER 65 -2.549 -2.595 -7.680 509 HG SER 65 HG SER 65 -1.753 -0.855 -8.895 510 H SER 66 H SER 66 0.534 -5.022 -10.010 511 HA SER 66 HA SER 66 -0.587 -7.284 -8.436 512 HB2 SER 66 3HB SER 66 -0.495 -8.680 -10.500 513 HB3 SER 66 2HB SER 66 -1.552 -7.300 -10.746 514 HG SER 66 HG SER 66 0.208 -6.260 -11.838 515 H VAL 67 HN VAL 67 2.183 -5.593 -9.091 516 HA VAL 67 HA VAL 67 4.023 -7.775 -9.311 517 HB VAL 67 HB VAL 67 4.424 -5.374 -10.081 518 HG11 VAL 67 HG11 VAL 67 5.083 -5.018 -7.159 519 HG12 VAL 67 HG12 VAL 67 3.779 -4.222 -8.040 520 HG13 VAL 67 HG13 VAL 67 5.460 -3.868 -8.440 521 HG21 VAL 67 HG21 VAL 67 6.234 -6.842 -10.280 522 HG22 VAL 67 HG22 VAL 67 6.426 -6.981 -8.531 523 HG23 VAL 67 HG23 VAL 67 6.878 -5.488 -9.351 524 H TRP 68 HN TRP 68 2.410 -6.250 -6.714 525 HA TRP 68 HA TRP 68 4.258 -6.712 -4.638 526 HB2 TRP 68 HB2 TRP 68 1.249 -6.551 -4.405 527 HB3 TRP 68 HB1 TRP 68 2.426 -6.241 -3.135 528 HD1 TRP 68 HD1 TRP 68 0.494 -4.495 -5.799 529 HE1 TRP 68 HE1 TRP 68 1.289 -2.042 -6.027 530 HE3 TRP 68 HE3 TRP 68 4.764 -4.765 -3.000 531 HZ2 TRP 68 HZ2 TRP 68 3.431 -0.461 -5.129 532 HZ3 TRP 68 HZ3 TRP 68 6.124 -2.738 -2.735 533 HH2 TRP 68 HH2 TRP 68 5.472 -0.629 -3.778 534 H LYS 69 HN LYS 69 2.281 -8.844 -6.398 535 HA LYS 69 HA LYS 69 1.923 -10.849 -4.394 536 HB2 LYS 69 HB2 LYS 69 0.429 -10.720 -6.322 537 HB3 LYS 69 HB1 LYS 69 1.776 -11.001 -7.416 538 HG2 LYS 69 HG2 LYS 69 0.776 -13.068 -7.325 539 HG3 LYS 69 HG1 LYS 69 2.047 -13.224 -6.116 540 HD2 LYS 69 HD2 LYS 69 0.290 -14.055 -4.916 541 HD3 LYS 69 HD1 LYS 69 0.125 -12.341 -4.520 542 HE2 LYS 69 HE2 LYS 69 -2.001 -13.547 -5.216 543 HE3 LYS 69 HE1 LYS 69 -1.634 -12.050 -6.068 544 HZ1 LYS 69 HZ1 LYS 69 -0.749 -14.626 -7.178 545 HZ2 LYS 69 HZ2 LYS 69 -1.060 -13.167 -7.987 546 HZ3 LYS 69 HZ3 LYS 69 -2.344 -14.121 -7.412 547 H PHE 70 HN PHE 70 4.555 -9.887 -6.350 548 HA PHE 70 HA PHE 70 5.876 -12.494 -6.082 549 HB2 PHE 70 HB2 PHE 70 6.645 -10.036 -7.672 550 HB3 PHE 70 HB1 PHE 70 7.596 -11.515 -7.605 551 HD1 PHE 70 HD1 PHE 70 6.381 -13.685 -8.336 552 HD2 PHE 70 HD2 PHE 70 5.073 -9.764 -9.339 553 HE1 PHE 70 HE1 PHE 70 5.118 -14.600 -10.234 554 HE2 PHE 70 HE2 PHE 70 3.802 -10.669 -11.241 555 HZ PHE 70 HZ PHE 70 3.824 -13.089 -11.691 556 H ILE 71 HN ILE 71 5.470 -10.070 -4.078 557 HA ILE 71 HA ILE 71 8.277 -10.035 -3.169 558 HB ILE 71 HB ILE 71 6.299 -7.827 -2.628 559 HG12 ILE 71 HG12 ILE 71 8.477 -7.727 -4.714 560 HG13 ILE 71 HG11 ILE 71 6.825 -8.190 -5.105 561 HG21 ILE 71 HG21 ILE 71 8.201 -6.568 -1.945 562 HG22 ILE 71 HG22 ILE 71 9.312 -7.807 -2.525 563 HG23 ILE 71 HG23 ILE 71 8.279 -8.131 -1.131 564 HD11 ILE 71 HD11 ILE 71 7.782 -5.553 -4.033 565 HD12 ILE 71 HD12 ILE 71 6.082 -6.002 -4.170 566 HD13 ILE 71 HD13 ILE 71 7.081 -5.892 -5.616 567 H ARG 72 HN ARG 72 8.649 -10.487 -1.041 568 HA ARG 72 HA ARG 72 6.305 -11.225 0.570 569 HB2 ARG 72 HB2 ARG 72 9.152 -12.140 0.973 570 HB3 ARG 72 HB1 ARG 72 7.710 -12.782 1.743 571 HG2 ARG 72 HG2 ARG 72 7.001 -13.301 -0.725 572 HG3 ARG 72 HG1 ARG 72 8.739 -13.211 -1.013 573 HD2 ARG 72 HD2 ARG 72 8.327 -15.473 -0.552 574 HD3 ARG 72 HD1 ARG 72 8.977 -14.820 0.948 575 HE ARG 72 HE ARG 72 6.776 -14.864 1.873 576 HH11 ARG 72 HH11 ARG 72 7.025 -16.361 -1.290 577 HH12 ARG 72 HH12 ARG 72 5.587 -17.313 -1.090 578 HH21 ARG 72 HH21 ARG 72 4.884 -16.115 2.126 579 HH22 ARG 72 HH22 ARG 72 4.362 -17.159 0.846 580 H GLU 3 HN GLU 3 -5.603 7.664 10.966 581 HA GLU 3 HA GLU 3 -2.767 6.958 10.753 582 HB2 GLU 3 HB2 GLU 3 -3.105 5.653 12.779 583 HB3 GLU 3 HB1 GLU 3 -3.673 7.296 13.011 584 HG2 GLU 3 HG2 GLU 3 -5.475 4.970 12.373 585 HG3 GLU 3 HG1 GLU 3 -5.128 5.542 14.003 586 H ALA 4 HN ALA 4 -5.967 5.759 10.088 587 HA ALA 4 HA ALA 4 -5.353 3.048 9.690 588 HB1 ALA 4 HB1 ALA 4 -7.509 4.764 8.479 589 HB2 ALA 4 HB2 ALA 4 -7.635 3.707 9.888 590 HB3 ALA 4 HB3 ALA 4 -7.413 3.016 8.280 591 H LEU 5 HN LEU 5 -5.122 5.818 7.550 592 HA LEU 5 HA LEU 5 -4.558 4.288 5.202 593 HB2 LEU 5 HB2 LEU 5 -4.401 7.200 5.897 594 HB3 LEU 5 HB1 LEU 5 -3.746 6.609 4.383 595 HG LEU 5 HG LEU 5 -6.063 5.634 3.927 596 HD11 LEU 5 HD11 LEU 5 -7.934 6.619 5.087 597 HD12 LEU 5 HD12 LEU 5 -6.847 7.557 6.109 598 HD13 LEU 5 HD13 LEU 5 -6.884 5.800 6.245 599 HD21 LEU 5 HD21 LEU 5 -5.604 8.602 4.072 600 HD22 LEU 5 HD22 LEU 5 -6.961 7.858 3.228 601 HD23 LEU 5 HD23 LEU 5 -5.308 7.534 2.704 602 H LYS 6 HN LYS 6 -2.721 5.105 7.911 603 HA LYS 6 HA LYS 6 -0.171 5.479 6.719 604 HB2 LYS 6 HB2 LYS 6 -0.523 6.216 8.978 605 HB3 LYS 6 HB1 LYS 6 -0.991 4.601 9.492 606 HG2 LYS 6 HG2 LYS 6 1.374 3.891 8.849 607 HG3 LYS 6 HG1 LYS 6 1.739 5.614 8.765 608 HD2 LYS 6 HD2 LYS 6 2.366 4.947 10.937 609 HD3 LYS 6 HD1 LYS 6 0.819 5.772 11.130 610 HE2 LYS 6 HE2 LYS 6 -0.336 3.775 11.495 611 HE3 LYS 6 HE1 LYS 6 0.941 2.800 10.774 612 HZ1 LYS 6 HZ1 LYS 6 1.045 4.192 13.409 613 HZ2 LYS 6 HZ2 LYS 6 2.348 3.377 12.694 614 HZ3 LYS 6 HZ3 LYS 6 0.961 2.522 13.139 615 H ILE 7 HN ILE 7 -1.882 2.645 7.951 616 HA ILE 7 HA ILE 7 0.358 0.922 7.257 617 HB ILE 7 HB ILE 7 -1.092 -0.908 8.160 618 HG12 ILE 7 HG12 ILE 7 -2.886 1.403 8.945 619 HG13 ILE 7 HG11 ILE 7 -3.274 0.163 7.759 620 HG21 ILE 7 HG21 ILE 7 -0.673 -0.355 10.444 621 HG22 ILE 7 HG22 ILE 7 -0.718 1.369 10.097 622 HG23 ILE 7 HG23 ILE 7 0.607 0.386 9.484 623 HD11 ILE 7 HD11 ILE 7 -4.370 -0.228 9.902 624 HD12 ILE 7 HD12 ILE 7 -2.794 -0.317 10.688 625 HD13 ILE 7 HD13 ILE 7 -3.253 -1.530 9.493 626 H LEU 8 HN LEU 8 -2.274 2.208 5.665 627 HA LEU 8 HA LEU 8 -2.882 -0.113 4.038 628 HB2 LEU 8 HB2 LEU 8 -4.465 1.847 4.760 629 HB3 LEU 8 HB1 LEU 8 -3.755 2.679 3.390 630 HG LEU 8 HG LEU 8 -4.474 0.687 1.978 631 HD11 LEU 8 HD11 LEU 8 -4.845 -0.864 3.852 632 HD12 LEU 8 HD12 LEU 8 -6.265 -0.693 2.827 633 HD13 LEU 8 HD13 LEU 8 -6.199 0.131 4.386 634 HD21 LEU 8 HD21 LEU 8 -5.614 2.842 1.917 635 HD22 LEU 8 HD22 LEU 8 -6.606 2.363 3.292 636 HD23 LEU 8 HD23 LEU 8 -6.757 1.511 1.757 637 H ASN 9 HN ASN 9 -0.439 2.099 4.157 638 HA ASN 9 HA ASN 9 -0.068 2.296 1.272 639 HB2 ASN 9 HB2 ASN 9 0.235 4.262 2.863 640 HB3 ASN 9 HB1 ASN 9 1.706 3.467 3.410 641 HD21 ASN 9 HD21 ASN 9 2.743 5.413 2.705 642 HD22 ASN 9 HD22 ASN 9 3.153 5.617 1.035 643 H ASN 10 HN ASN 10 0.735 0.158 3.678 644 HA ASN 10 HA ASN 10 3.074 -0.773 2.151 645 HB2 ASN 10 HB2 ASN 10 3.952 0.142 4.184 646 HB3 ASN 10 HB1 ASN 10 2.745 -0.698 5.151 647 HD21 ASN 10 HD21 ASN 10 5.435 -1.273 2.911 648 HD22 ASN 10 HD22 ASN 10 5.976 -2.725 3.694 649 H ILE 11 HN ILE 11 2.799 -2.702 1.313 650 HA ILE 11 HA ILE 11 0.493 -4.262 1.751 651 HB ILE 11 HB ILE 11 1.768 -6.051 0.479 652 HG12 ILE 11 HG12 ILE 11 3.740 -3.933 -0.265 653 HG13 ILE 11 HG11 ILE 11 4.014 -4.829 1.224 654 HG21 ILE 11 HG21 ILE 11 0.253 -4.765 -0.730 655 HG22 ILE 11 HG22 ILE 11 1.756 -4.624 -1.638 656 HG23 ILE 11 HG23 ILE 11 1.234 -3.308 -0.591 657 HD11 ILE 11 HD11 ILE 11 5.216 -5.817 -0.644 658 HD12 ILE 11 HD12 ILE 11 3.700 -6.036 -1.515 659 HD13 ILE 11 HD13 ILE 11 3.993 -6.921 -0.020 660 H ARG 12 HN ARG 12 3.750 -4.553 3.074 661 HA ARG 12 HA ARG 12 3.497 -7.157 4.093 662 HB2 ARG 12 HB2 ARG 12 5.247 -4.864 4.972 663 HB3 ARG 12 HB1 ARG 12 5.404 -6.507 5.579 664 HG2 ARG 12 HG2 ARG 12 5.869 -7.305 3.324 665 HG3 ARG 12 HG1 ARG 12 5.678 -5.668 2.701 666 HD2 ARG 12 HD2 ARG 12 7.729 -5.063 3.344 667 HD3 ARG 12 HD1 ARG 12 7.572 -5.861 4.908 668 HE ARG 12 HE ARG 12 7.898 -7.785 2.847 669 HH11 ARG 12 HH11 ARG 12 9.679 -5.363 4.647 670 HH12 ARG 12 HH12 ARG 12 11.204 -6.192 4.527 671 HH21 ARG 12 HH21 ARG 12 9.898 -8.888 2.687 672 HH22 ARG 12 HH22 ARG 12 11.331 -8.186 3.417 673 H THR 13 HN THR 13 2.865 -4.014 5.618 674 HA THR 13 HA THR 13 2.116 -5.215 8.109 675 HB THR 13 HB THR 13 1.523 -2.405 7.161 676 HG1 THR 13 HG1 THR 13 3.728 -2.637 7.050 677 HG21 THR 13 HG21 THR 13 1.577 -1.900 9.592 678 HG22 THR 13 HG22 THR 13 1.716 -3.627 9.918 679 HG23 THR 13 HG23 THR 13 0.265 -2.991 9.141 680 H LEU 14 HN LEU 14 0.401 -3.945 5.302 681 HA LEU 14 HA LEU 14 -2.206 -4.095 6.328 682 HB2 LEU 14 HB2 LEU 14 -1.583 -2.852 4.309 683 HB3 LEU 14 HB1 LEU 14 -1.250 -4.361 3.481 684 HG LEU 14 HG LEU 14 -3.590 -4.970 3.533 685 HD11 LEU 14 HD11 LEU 14 -3.964 -2.419 5.106 686 HD12 LEU 14 HD12 LEU 14 -4.248 -4.064 5.671 687 HD13 LEU 14 HD13 LEU 14 -5.278 -3.371 4.416 688 HD21 LEU 14 HD21 LEU 14 -3.196 -2.117 2.634 689 HD22 LEU 14 HD22 LEU 14 -4.491 -3.191 2.113 690 HD23 LEU 14 HD23 LEU 14 -2.818 -3.559 1.694 691 H ARG 15 HN ARG 15 -0.157 -6.472 4.740 692 HA ARG 15 HA ARG 15 -1.976 -8.472 4.157 693 HB2 ARG 15 HB2 ARG 15 0.919 -8.400 4.811 694 HB3 ARG 15 HB1 ARG 15 0.125 -9.965 4.906 695 HG2 ARG 15 HG2 ARG 15 -0.651 -9.650 2.571 696 HG3 ARG 15 HG1 ARG 15 0.300 -8.163 2.501 697 HD2 ARG 15 HD2 ARG 15 2.327 -9.464 3.025 698 HD3 ARG 15 HD1 ARG 15 1.364 -10.942 3.023 699 HE ARG 15 HE ARG 15 0.826 -10.204 0.600 700 HH11 ARG 15 HH11 ARG 15 3.902 -9.738 2.234 701 HH12 ARG 15 HH12 ARG 15 4.829 -9.778 0.769 702 HH21 ARG 15 HH21 ARG 15 2.032 -10.285 -1.315 703 HH22 ARG 15 HH22 ARG 15 3.767 -10.088 -1.261 704 H ALA 16 HN ALA 16 -0.235 -7.909 7.195 705 HA ALA 16 HA ALA 16 -1.152 -10.148 8.594 706 HB1 ALA 16 HB1 ALA 16 0.724 -8.931 9.403 707 HB2 ALA 16 HB2 ALA 16 -0.543 -8.834 10.626 708 HB3 ALA 16 HB3 ALA 16 -0.231 -7.459 9.568 709 H GLN 17 HN GLN 17 -2.506 -6.889 8.376 710 HA GLN 17 HA GLN 17 -4.592 -7.410 10.246 711 HB2 GLN 17 HB2 GLN 17 -3.862 -5.193 8.417 712 HB3 GLN 17 HB1 GLN 17 -5.541 -5.284 8.931 713 HG2 GLN 17 HG2 GLN 17 -4.156 -3.817 10.348 714 HG3 GLN 17 HG1 GLN 17 -4.914 -5.133 11.238 715 HE21 GLN 17 HE21 GLN 17 -3.610 -6.834 12.014 716 HE22 GLN 17 HE22 GLN 17 -1.897 -6.655 12.171 717 H ALA 18 HN ALA 18 -4.206 -7.940 6.855 718 HA ALA 18 HA ALA 18 -7.017 -8.209 6.304 719 HB1 ALA 18 HB1 ALA 18 -4.623 -9.036 4.667 720 HB2 ALA 18 HB2 ALA 18 -5.484 -7.499 4.556 721 HB3 ALA 18 HB3 ALA 18 -6.296 -8.999 4.105 722 H ARG 19 HN ARG 19 -4.800 -10.152 7.894 723 HA ARG 19 HA ARG 19 -5.771 -12.691 6.940 724 HB2 ARG 19 HB2 ARG 19 -4.176 -12.174 9.451 725 HB3 ARG 19 HB1 ARG 19 -4.356 -13.705 8.607 726 HG2 ARG 19 HG2 ARG 19 -2.837 -11.271 7.723 727 HG3 ARG 19 HG1 ARG 19 -2.199 -12.866 8.119 728 HD2 ARG 19 HD2 ARG 19 -4.026 -12.259 5.798 729 HD3 ARG 19 HD1 ARG 19 -2.275 -12.413 5.696 730 HE ARG 19 HE ARG 19 -3.551 -14.712 6.849 731 HH11 ARG 19 HH11 ARG 19 -2.597 -13.155 3.863 732 HH12 ARG 19 HH12 ARG 19 -2.602 -14.635 2.944 733 HH21 ARG 19 HH21 ARG 19 -3.538 -16.647 5.652 734 HH22 ARG 19 HH22 ARG 19 -3.114 -16.611 3.960 735 H GLU 20 HN GLU 20 -6.972 -10.364 9.087 736 HA GLU 20 HA GLU 20 -8.356 -12.347 10.726 737 HB2 GLU 20 HB2 GLU 20 -8.876 -10.639 12.230 738 HB3 GLU 20 HB1 GLU 20 -7.269 -10.220 11.658 739 HG2 GLU 20 HG2 GLU 20 -7.971 -8.340 10.647 740 HG3 GLU 20 HG1 GLU 20 -9.511 -9.046 10.162 741 H CYS 21 H CYS 21 -8.848 -10.931 7.799 742 HA CYS 21 HA CYS 21 -11.803 -11.095 8.110 743 HB2 CYS 21 3HB CYS 21 -11.018 -8.760 7.589 744 HB3 CYS 21 2HB CYS 21 -10.125 -9.337 6.176 745 HG CYS 21 HG CYS 21 -11.929 -9.445 4.630 746 H THR 22 HN THR 22 -12.979 -12.167 6.559 747 HA THR 22 HA THR 22 -11.537 -14.254 5.197 748 HB THR 22 HB THR 22 -14.380 -14.025 4.551 749 HG1 THR 22 HG1 THR 22 -15.181 -13.947 6.542 750 HG21 THR 22 HG21 THR 22 -12.855 -16.040 4.351 751 HG22 THR 22 HG22 THR 22 -14.399 -16.325 5.153 752 HG23 THR 22 HG23 THR 22 -12.929 -16.158 6.108 753 H LEU 23 HN LEU 23 -12.277 -14.781 2.880 754 HA LEU 23 HA LEU 23 -11.359 -12.827 1.146 755 HB2 LEU 23 HB2 LEU 23 -11.445 -15.230 0.643 756 HB3 LEU 23 HB1 LEU 23 -13.191 -15.143 0.523 757 HG LEU 23 HG LEU 23 -13.032 -13.737 -1.443 758 HD11 LEU 23 HD11 LEU 23 -10.040 -13.938 -1.097 759 HD12 LEU 23 HD12 LEU 23 -11.014 -12.496 -0.804 760 HD13 LEU 23 HD13 LEU 23 -10.884 -13.160 -2.430 761 HD21 LEU 23 HD21 LEU 23 -12.165 -15.339 -2.980 762 HD22 LEU 23 HD22 LEU 23 -12.849 -16.241 -1.625 763 HD23 LEU 23 HD23 LEU 23 -11.103 -16.028 -1.758 764 H GLU 24 HN GLU 24 -14.716 -13.671 1.938 765 HA GLU 24 HA GLU 24 -15.986 -11.972 0.118 766 HB2 GLU 24 HB2 GLU 24 -16.872 -12.972 2.825 767 HB3 GLU 24 HB1 GLU 24 -17.917 -12.073 1.735 768 HG2 GLU 24 HG2 GLU 24 -17.465 -13.858 0.023 769 HG3 GLU 24 HG1 GLU 24 -16.701 -14.780 1.317 770 H THR 25 HN THR 25 -15.091 -11.375 3.508 771 HA THR 25 HA THR 25 -16.120 -8.779 3.687 772 HB THR 25 HB THR 25 -13.666 -9.318 5.217 773 HG1 THR 25 HG1 THR 25 -15.947 -10.947 5.726 774 HG21 THR 25 HG21 THR 25 -15.083 -7.526 5.910 775 HG22 THR 25 HG22 THR 25 -15.232 -8.808 7.115 776 HG23 THR 25 HG23 THR 25 -16.504 -8.572 5.915 777 H LEU 26 HN LEU 26 -12.913 -9.947 2.748 778 HA LEU 26 HA LEU 26 -11.703 -7.405 2.534 779 HB2 LEU 26 HB2 LEU 26 -11.041 -10.048 1.252 780 HB3 LEU 26 HB1 LEU 26 -10.032 -8.624 1.107 781 HG LEU 26 HG LEU 26 -10.742 -9.880 3.754 782 HD11 LEU 26 HD11 LEU 26 -8.592 -10.511 1.805 783 HD12 LEU 26 HD12 LEU 26 -9.478 -11.570 2.901 784 HD13 LEU 26 HD13 LEU 26 -8.200 -10.529 3.524 785 HD21 LEU 26 HD21 LEU 26 -8.867 -8.567 4.579 786 HD22 LEU 26 HD22 LEU 26 -10.087 -7.527 3.843 787 HD23 LEU 26 HD23 LEU 26 -8.604 -7.907 2.964 788 H GLU 27 HN GLU 27 -13.286 -9.499 0.146 789 HA GLU 27 HA GLU 27 -12.799 -7.854 -2.089 790 HB2 GLU 27 HB2 GLU 27 -14.583 -10.135 -1.464 791 HB3 GLU 27 HB1 GLU 27 -15.078 -9.109 -2.803 792 HG2 GLU 27 HG2 GLU 27 -12.648 -9.432 -3.626 793 HG3 GLU 27 HG1 GLU 27 -12.646 -10.814 -2.531 794 H GLU 28 HN GLU 28 -15.536 -8.044 0.156 795 HA GLU 28 HA GLU 28 -17.262 -6.281 -1.129 796 HB2 GLU 28 HB2 GLU 28 -17.537 -7.784 1.019 797 HB3 GLU 28 HB1 GLU 28 -17.113 -6.294 1.852 798 HG2 GLU 28 HG2 GLU 28 -18.964 -5.211 0.462 799 HG3 GLU 28 HG1 GLU 28 -19.491 -6.860 0.120 800 H MET 29 HN MET 29 -14.806 -5.570 1.356 801 HA MET 29 HA MET 29 -15.371 -2.769 1.327 802 HB2 MET 29 HB2 MET 29 -13.469 -2.516 2.791 803 HB3 MET 29 HB1 MET 29 -14.437 -3.888 3.308 804 HG2 MET 29 HG2 MET 29 -12.568 -5.076 3.346 805 HG3 MET 29 HG1 MET 29 -12.539 -4.971 1.588 806 HE1 MET 29 HE1 MET 29 -10.349 -1.962 4.325 807 HE2 MET 29 HE2 MET 29 -11.143 -3.404 4.961 808 HE3 MET 29 HE3 MET 29 -12.100 -2.123 4.218 809 H LEU 30 HN LEU 30 -13.161 -4.844 -0.423 810 HA LEU 30 HA LEU 30 -11.400 -2.870 -1.373 811 HB2 LEU 30 HB2 LEU 30 -10.897 -5.237 -1.595 812 HB3 LEU 30 HB1 LEU 30 -12.281 -5.463 -2.648 813 HG LEU 30 HG LEU 30 -11.204 -3.975 -4.324 814 HD11 LEU 30 HD11 LEU 30 -9.794 -2.657 -2.887 815 HD12 LEU 30 HD12 LEU 30 -8.794 -3.502 -4.067 816 HD13 LEU 30 HD13 LEU 30 -8.884 -4.090 -2.407 817 HD21 LEU 30 HD21 LEU 30 -10.999 -6.393 -4.508 818 HD22 LEU 30 HD22 LEU 30 -9.566 -6.362 -3.477 819 HD23 LEU 30 HD23 LEU 30 -9.531 -5.590 -5.066 820 H GLU 31 HN GLU 31 -14.420 -4.150 -2.708 821 HA GLU 31 HA GLU 31 -14.375 -2.583 -5.057 822 HB2 GLU 31 HB2 GLU 31 -16.816 -3.701 -3.681 823 HB3 GLU 31 HB1 GLU 31 -16.651 -3.284 -5.380 824 HG2 GLU 31 HG2 GLU 31 -14.789 -5.040 -5.433 825 HG3 GLU 31 HG1 GLU 31 -15.448 -5.584 -3.894 826 H LYS 32 HN LYS 32 -15.531 -1.979 -1.806 827 HA LYS 32 HA LYS 32 -17.028 0.354 -2.454 828 HB2 LYS 32 HB2 LYS 32 -15.835 -0.579 0.158 829 HB3 LYS 32 HB1 LYS 32 -16.869 0.833 0.003 830 HG2 LYS 32 HG2 LYS 32 -18.680 -0.601 -0.828 831 HG3 LYS 32 HG1 LYS 32 -17.639 -2.010 -0.614 832 HD2 LYS 32 HD2 LYS 32 -17.437 -0.963 1.833 833 HD3 LYS 32 HD1 LYS 32 -19.037 -0.355 1.401 834 HE2 LYS 32 HE2 LYS 32 -19.658 -2.694 0.765 835 HE3 LYS 32 HE1 LYS 32 -18.114 -3.222 1.427 836 HZ1 LYS 32 HZ1 LYS 32 -18.878 -2.073 3.544 837 HZ2 LYS 32 HZ2 LYS 32 -19.613 -3.546 3.135 838 HZ3 LYS 32 HZ3 LYS 32 -20.429 -2.085 2.853 839 H LEU 33 HN LEU 33 -13.686 -0.231 -1.483 840 HA LEU 33 HA LEU 33 -13.048 2.526 -1.179 841 HB2 LEU 33 HB2 LEU 33 -11.730 0.777 -0.105 842 HB3 LEU 33 HB1 LEU 33 -11.248 0.157 -1.672 843 HG LEU 33 HG LEU 33 -10.127 2.371 -2.110 844 HD11 LEU 33 HD11 LEU 33 -11.283 3.781 -0.548 845 HD12 LEU 33 HD12 LEU 33 -9.579 3.724 -0.094 846 HD13 LEU 33 HD13 LEU 33 -10.765 2.777 0.807 847 HD21 LEU 33 HD21 LEU 33 -8.171 1.866 -0.750 848 HD22 LEU 33 HD22 LEU 33 -8.870 0.394 -1.420 849 HD23 LEU 33 HD23 LEU 33 -9.142 0.806 0.272 850 H GLU 34 HN GLU 34 -12.840 0.230 -3.850 851 HA GLU 34 HA GLU 34 -11.323 1.865 -5.567 852 HB2 GLU 34 HB2 GLU 34 -11.635 0.269 -7.193 853 HB3 GLU 34 HB1 GLU 34 -11.923 -0.669 -5.737 854 HG2 GLU 34 HG2 GLU 34 -14.017 -1.125 -6.323 855 HG3 GLU 34 HG1 GLU 34 -14.348 0.549 -6.763 856 H VAL 35 HN VAL 35 -14.813 1.702 -4.977 857 HA VAL 35 HA VAL 35 -15.473 3.318 -7.215 858 HB VAL 35 HB VAL 35 -17.678 3.566 -6.331 859 HG11 VAL 35 HG11 VAL 35 -16.658 0.808 -5.697 860 HG12 VAL 35 HG12 VAL 35 -17.114 1.404 -7.291 861 HG13 VAL 35 HG13 VAL 35 -18.334 1.248 -6.027 862 HG21 VAL 35 HG21 VAL 35 -16.551 2.581 -3.721 863 HG22 VAL 35 HG22 VAL 35 -18.279 2.654 -4.075 864 HG23 VAL 35 HG23 VAL 35 -17.317 4.131 -4.056 865 H VAL 36 HN VAL 36 -14.562 4.019 -3.901 866 HA VAL 36 HA VAL 36 -15.228 6.783 -3.959 867 HB VAL 36 HB VAL 36 -13.220 5.309 -2.234 868 HG11 VAL 36 HG11 VAL 36 -14.390 8.064 -1.844 869 HG12 VAL 36 HG12 VAL 36 -12.748 7.730 -2.391 870 HG13 VAL 36 HG13 VAL 36 -13.256 7.243 -0.775 871 HG21 VAL 36 HG21 VAL 36 -16.067 6.176 -1.729 872 HG22 VAL 36 HG22 VAL 36 -14.990 5.481 -0.517 873 HG23 VAL 36 HG23 VAL 36 -15.488 4.517 -1.909 874 H VAL 37 HN VAL 37 -12.288 4.940 -4.640 875 HA VAL 37 HA VAL 37 -10.633 7.163 -5.184 876 HB VAL 37 HB VAL 37 -10.441 4.364 -6.326 877 HG11 VAL 37 HG11 VAL 37 -8.369 6.555 -6.157 878 HG12 VAL 37 HG12 VAL 37 -9.127 5.942 -7.628 879 HG13 VAL 37 HG13 VAL 37 -8.067 4.897 -6.683 880 HG21 VAL 37 HG21 VAL 37 -8.611 4.221 -4.523 881 HG22 VAL 37 HG22 VAL 37 -10.295 4.097 -4.016 882 HG23 VAL 37 HG23 VAL 37 -9.419 5.610 -3.798 883 H ASN 38 HN ASN 38 -12.853 5.258 -7.115 884 HA ASN 38 HA ASN 38 -12.278 6.428 -9.622 885 HB2 ASN 38 HB2 ASN 38 -13.512 4.543 -9.989 886 HB3 ASN 38 HB1 ASN 38 -14.401 4.710 -8.481 887 HD21 ASN 38 HD21 ASN 38 -16.348 5.705 -8.470 888 HD22 ASN 38 HD22 ASN 38 -17.163 6.249 -9.898 889 H GLU 39 HN GLU 39 -14.473 7.275 -7.001 890 HA GLU 39 HA GLU 39 -15.881 9.331 -8.318 891 HB2 GLU 39 HB2 GLU 39 -15.282 8.861 -5.395 892 HB3 GLU 39 HB1 GLU 39 -16.313 10.168 -5.965 893 HG2 GLU 39 HG2 GLU 39 -17.947 8.693 -6.750 894 HG3 GLU 39 HG1 GLU 39 -16.853 7.311 -6.694 895 H ARG 40 HN ARG 40 -13.012 9.390 -6.235 896 HA ARG 40 HA ARG 40 -12.544 12.157 -6.379 897 HB2 ARG 40 HB2 ARG 40 -10.830 9.780 -5.755 898 HB3 ARG 40 HB1 ARG 40 -10.086 11.361 -5.939 899 HG2 ARG 40 HG2 ARG 40 -12.324 10.766 -4.023 900 HG3 ARG 40 HG1 ARG 40 -10.612 10.747 -3.596 901 HD2 ARG 40 HD2 ARG 40 -12.182 13.112 -4.621 902 HD3 ARG 40 HD1 ARG 40 -11.597 12.872 -2.976 903 HE ARG 40 HE ARG 40 -10.015 13.629 -5.323 904 HH11 ARG 40 HH11 ARG 40 -10.058 12.698 -1.935 905 HH12 ARG 40 HH12 ARG 40 -8.468 13.301 -1.610 906 HH21 ARG 40 HH21 ARG 40 -7.926 14.412 -4.922 907 HH22 ARG 40 HH22 ARG 40 -7.272 14.333 -3.311 908 H ARG 41 HN ARG 41 -11.397 9.466 -8.374 909 HA ARG 41 HA ARG 41 -9.636 10.841 -10.036 910 HB2 ARG 41 HB2 ARG 41 -11.332 8.408 -10.339 911 HB3 ARG 41 HB1 ARG 41 -10.592 9.079 -11.780 912 HG2 ARG 41 HG2 ARG 41 -8.401 8.740 -10.910 913 HG3 ARG 41 HG1 ARG 41 -9.040 8.312 -9.319 914 HD2 ARG 41 HD2 ARG 41 -10.063 6.322 -10.222 915 HD3 ARG 41 HD1 ARG 41 -9.575 6.773 -11.856 916 HE ARG 41 HE ARG 41 -7.400 6.474 -9.965 917 HH11 ARG 41 HH11 ARG 41 -9.423 4.910 -12.354 918 HH12 ARG 41 HH12 ARG 41 -8.265 3.663 -12.704 919 HH21 ARG 41 HH21 ARG 41 -5.886 4.830 -10.391 920 HH22 ARG 41 HH22 ARG 41 -6.247 3.625 -11.597 921 H GLU 42 HN GLU 42 -13.131 10.445 -10.250 922 HA GLU 42 HA GLU 42 -13.470 11.728 -12.746 923 HB2 GLU 42 HB2 GLU 42 -15.073 10.238 -11.246 924 HB3 GLU 42 HB1 GLU 42 -15.613 11.811 -10.671 925 HG2 GLU 42 HG2 GLU 42 -17.049 11.091 -12.433 926 HG3 GLU 42 HG1 GLU 42 -16.094 12.454 -13.007 927 H GLU 43 HN GLU 43 -13.573 12.891 -9.406 928 HA GLU 43 HA GLU 43 -14.415 15.520 -10.010 929 HB2 GLU 43 HB2 GLU 43 -12.838 14.461 -7.660 930 HB3 GLU 43 HB1 GLU 43 -13.521 16.077 -7.751 931 HG2 GLU 43 HG2 GLU 43 -15.763 14.861 -8.126 932 HG3 GLU 43 HG1 GLU 43 -14.922 13.449 -7.488 933 H GLU 44 HN GLU 44 -11.203 14.133 -9.448 934 HA GLU 44 HA GLU 44 -9.785 16.552 -9.779 935 HB2 GLU 44 HB2 GLU 44 -9.163 13.773 -9.290 936 HB3 GLU 44 HB1 GLU 44 -8.021 14.492 -10.419 937 HG2 GLU 44 HG2 GLU 44 -6.947 15.339 -8.689 938 HG3 GLU 44 HG1 GLU 44 -8.330 16.392 -8.411 939 H SER 45 HN SER 45 -10.797 14.129 -12.128 940 HA SER 45 HA SER 45 -9.062 15.132 -14.178 941 HB2 SER 45 HB2 SER 45 -10.576 13.729 -15.695 942 HB3 SER 45 HB1 SER 45 -9.668 12.870 -14.453 943 HG SER 45 HG SER 45 -11.501 12.629 -13.263 944 H ALA 46 HN ALA 46 -12.438 15.633 -13.287 945 HA ALA 46 HA ALA 46 -12.811 17.480 -15.517 946 HB1 ALA 46 HB1 ALA 46 -14.610 15.956 -15.109 947 HB2 ALA 46 HB2 ALA 46 -15.155 17.583 -14.687 948 HB3 ALA 46 HB3 ALA 46 -14.698 16.443 -13.414 949 H GLU 3 HN GLU 3 -9.895 -2.539 14.842 950 HA GLU 3 HA GLU 3 -12.440 -1.133 14.981 951 HB2 GLU 3 HB2 GLU 3 -10.140 0.565 15.346 952 HB3 GLU 3 HB1 GLU 3 -11.398 0.149 16.496 953 HG2 GLU 3 HG2 GLU 3 -9.481 -0.563 17.567 954 HG3 GLU 3 HG1 GLU 3 -10.071 -2.043 16.814 955 H ALA 4 HN ALA 4 -9.285 -0.623 13.420 956 HA ALA 4 HA ALA 4 -10.110 1.455 11.714 957 HB1 ALA 4 HB1 ALA 4 -7.878 -0.468 11.109 958 HB2 ALA 4 HB2 ALA 4 -7.750 0.794 12.336 959 HB3 ALA 4 HB3 ALA 4 -8.019 1.230 10.650 960 H LEU 5 HN LEU 5 -10.119 -2.038 11.262 961 HA LEU 5 HA LEU 5 -10.739 -1.933 8.474 962 HB2 LEU 5 HB2 LEU 5 -10.599 -4.057 10.556 963 HB3 LEU 5 HB1 LEU 5 -11.510 -4.398 9.100 964 HG LEU 5 HG LEU 5 -9.234 -5.266 8.957 965 HD11 LEU 5 HD11 LEU 5 -10.371 -4.548 6.913 966 HD12 LEU 5 HD12 LEU 5 -8.625 -4.323 6.803 967 HD13 LEU 5 HD13 LEU 5 -9.676 -2.939 7.094 968 HD21 LEU 5 HD21 LEU 5 -7.300 -3.967 9.079 969 HD22 LEU 5 HD22 LEU 5 -8.288 -3.385 10.420 970 HD23 LEU 5 HD23 LEU 5 -8.196 -2.456 8.923 971 H LYS 6 HN LYS 6 -12.583 -1.463 11.286 972 HA LYS 6 HA LYS 6 -15.074 -2.428 10.191 973 HB2 LYS 6 HB2 LYS 6 -14.529 -2.457 12.634 974 HB3 LYS 6 HB1 LYS 6 -14.635 -0.704 12.631 975 HG2 LYS 6 HG2 LYS 6 -16.692 -1.466 13.442 976 HG3 LYS 6 HG1 LYS 6 -16.995 -0.980 11.774 977 HD2 LYS 6 HD2 LYS 6 -17.097 -3.210 11.040 978 HD3 LYS 6 HD1 LYS 6 -16.343 -3.820 12.516 979 HE2 LYS 6 HE2 LYS 6 -19.053 -2.501 12.376 980 HE3 LYS 6 HE1 LYS 6 -18.787 -4.243 12.389 981 HZ1 LYS 6 HZ1 LYS 6 -17.870 -4.119 14.564 982 HZ2 LYS 6 HZ2 LYS 6 -19.327 -3.266 14.592 983 HZ3 LYS 6 HZ3 LYS 6 -17.864 -2.425 14.543 984 H ILE 7 HN ILE 7 -13.696 0.763 10.968 985 HA ILE 7 HA ILE 7 -15.904 2.242 10.010 986 HB ILE 7 HB ILE 7 -14.309 4.176 9.919 987 HG12 ILE 7 HG12 ILE 7 -12.282 2.378 11.219 988 HG13 ILE 7 HG11 ILE 7 -12.329 2.533 9.466 989 HG21 ILE 7 HG21 ILE 7 -15.464 4.000 11.921 990 HG22 ILE 7 HG22 ILE 7 -13.782 4.006 12.448 991 HG23 ILE 7 HG23 ILE 7 -14.673 2.488 12.362 992 HD11 ILE 7 HD11 ILE 7 -12.158 5.031 9.836 993 HD12 ILE 7 HD12 ILE 7 -10.724 4.071 10.199 994 HD13 ILE 7 HD13 ILE 7 -11.754 4.649 11.509 995 H LEU 8 HN LEU 8 -13.184 0.810 8.409 996 HA LEU 8 HA LEU 8 -13.421 2.355 5.997 997 HB2 LEU 8 HB2 LEU 8 -11.657 0.298 7.060 998 HB3 LEU 8 HB1 LEU 8 -12.023 0.044 5.367 999 HG LEU 8 HG LEU 8 -11.181 2.257 4.812 1000 HD11 LEU 8 HD11 LEU 8 -10.555 2.514 7.751 1001 HD12 LEU 8 HD12 LEU 8 -11.793 3.415 6.875 1002 HD13 LEU 8 HD13 LEU 8 -10.089 3.652 6.484 1003 HD21 LEU 8 HD21 LEU 8 -9.172 0.874 6.568 1004 HD22 LEU 8 HD22 LEU 8 -8.876 1.824 5.112 1005 HD23 LEU 8 HD23 LEU 8 -9.669 0.252 4.996 1006 H ASN 9 HN ASN 9 -15.258 -0.105 7.289 1007 HA ASN 9 HA ASN 9 -15.875 -1.388 4.753 1008 HB2 ASN 9 HB2 ASN 9 -15.801 -2.496 7.131 1009 HB3 ASN 9 HB1 ASN 9 -17.435 -1.856 7.272 1010 HD21 ASN 9 HD21 ASN 9 -17.059 -4.522 7.406 1011 HD22 ASN 9 HD22 ASN 9 -17.667 -5.289 5.982 1012 H ASN 10 HN ASN 10 -16.811 1.346 6.417 1013 HA ASN 10 HA ASN 10 -19.521 1.332 5.292 1014 HB2 ASN 10 HB2 ASN 10 -18.205 2.852 7.520 1015 HB3 ASN 10 HB1 ASN 10 -19.637 3.514 6.740 1016 HD21 ASN 10 HD21 ASN 10 -20.895 0.988 6.242 1017 HD22 ASN 10 HD22 ASN 10 -21.425 0.369 7.766 1018 H ILE 11 HN ILE 11 -19.940 2.453 3.530 1019 HA ILE 11 HA ILE 11 -17.952 3.766 2.061 1020 HB ILE 11 HB ILE 11 -19.988 2.720 1.097 1021 HG12 ILE 11 HG12 ILE 11 -20.413 4.540 -0.610 1022 HG13 ILE 11 HG11 ILE 11 -19.378 5.583 0.361 1023 HG21 ILE 11 HG21 ILE 11 -22.106 3.634 1.206 1024 HG22 ILE 11 HG22 ILE 11 -21.509 5.224 1.678 1025 HG23 ILE 11 HG23 ILE 11 -21.498 3.898 2.840 1026 HD11 ILE 11 HD11 ILE 11 -17.494 4.160 -0.020 1027 HD12 ILE 11 HD12 ILE 11 -18.248 4.518 -1.574 1028 HD13 ILE 11 HD13 ILE 11 -18.507 2.951 -0.808 1029 H ARG 12 HN ARG 12 -20.180 4.967 4.463 1030 HA ARG 12 HA ARG 12 -20.087 7.707 3.794 1031 HB2 ARG 12 HB2 ARG 12 -20.562 6.357 6.455 1032 HB3 ARG 12 HB1 ARG 12 -20.799 8.074 6.160 1033 HG2 ARG 12 HG2 ARG 12 -22.216 5.986 4.544 1034 HG3 ARG 12 HG1 ARG 12 -22.845 6.558 6.091 1035 HD2 ARG 12 HD2 ARG 12 -22.715 8.890 5.159 1036 HD3 ARG 12 HD1 ARG 12 -22.336 8.169 3.595 1037 HE ARG 12 HE ARG 12 -24.714 7.069 4.716 1038 HH11 ARG 12 HH11 ARG 12 -23.463 9.850 2.999 1039 HH12 ARG 12 HH12 ARG 12 -24.984 10.256 2.275 1040 HH21 ARG 12 HH21 ARG 12 -26.726 7.597 3.785 1041 HH22 ARG 12 HH22 ARG 12 -26.851 8.963 2.724 1042 H THR 13 HN THR 13 -18.274 5.913 6.298 1043 HA THR 13 HA THR 13 -16.597 8.112 6.939 1044 HB THR 13 HB THR 13 -15.225 5.849 7.744 1045 HG1 THR 13 HG1 THR 13 -16.599 4.252 7.735 1046 HG21 THR 13 HG21 THR 13 -17.442 6.981 9.405 1047 HG22 THR 13 HG22 THR 13 -16.055 7.981 8.986 1048 HG23 THR 13 HG23 THR 13 -15.822 6.490 9.895 1049 H LEU 14 HN LEU 14 -16.332 5.401 4.736 1050 HA LEU 14 HA LEU 14 -13.595 5.489 4.192 1051 HB2 LEU 14 HB2 LEU 14 -15.438 3.817 3.455 1052 HB3 LEU 14 HB1 LEU 14 -15.642 4.888 2.083 1053 HG LEU 14 HG LEU 14 -13.310 4.515 1.421 1054 HD11 LEU 14 HD11 LEU 14 -12.090 2.620 2.577 1055 HD12 LEU 14 HD12 LEU 14 -13.259 2.789 3.887 1056 HD13 LEU 14 HD13 LEU 14 -12.193 4.136 3.475 1057 HD21 LEU 14 HD21 LEU 14 -14.909 3.065 0.427 1058 HD22 LEU 14 HD22 LEU 14 -14.995 2.066 1.878 1059 HD23 LEU 14 HD23 LEU 14 -13.531 2.069 0.896 1060 H ARG 15 HN ARG 15 -16.277 7.093 2.498 1061 HA ARG 15 HA ARG 15 -14.625 8.508 0.683 1062 HB2 ARG 15 HB2 ARG 15 -17.048 8.015 0.342 1063 HB3 ARG 15 HB1 ARG 15 -17.427 9.203 1.577 1064 HG2 ARG 15 HG2 ARG 15 -16.426 10.956 0.211 1065 HG3 ARG 15 HG1 ARG 15 -16.019 9.764 -1.024 1066 HD2 ARG 15 HD2 ARG 15 -18.820 10.335 -0.072 1067 HD3 ARG 15 HD1 ARG 15 -18.091 11.077 -1.491 1068 HE ARG 15 HE ARG 15 -17.916 8.821 -2.448 1069 HH11 ARG 15 HH11 ARG 15 -20.153 9.317 0.228 1070 HH12 ARG 15 HH12 ARG 15 -21.171 7.986 -0.215 1071 HH21 ARG 15 HH21 ARG 15 -19.262 7.083 -3.030 1072 HH22 ARG 15 HH22 ARG 15 -20.670 6.711 -2.070 1073 H ALA 16 HN ALA 16 -15.591 9.077 3.953 1074 HA ALA 16 HA ALA 16 -15.101 11.896 3.961 1075 HB1 ALA 16 HB1 ALA 16 -15.320 11.715 6.398 1076 HB2 ALA 16 HB2 ALA 16 -15.338 9.956 6.255 1077 HB3 ALA 16 HB3 ALA 16 -16.642 10.912 5.552 1078 H GLN 17 HN GLN 17 -13.255 9.054 5.052 1079 HA GLN 17 HA GLN 17 -11.039 10.613 5.955 1080 HB2 GLN 17 HB2 GLN 17 -11.403 7.680 5.403 1081 HB3 GLN 17 HB1 GLN 17 -9.850 8.345 5.887 1082 HG2 GLN 17 HG2 GLN 17 -11.229 9.370 7.851 1083 HG3 GLN 17 HG1 GLN 17 -12.377 8.096 7.449 1084 HE21 GLN 17 HE21 GLN 17 -10.815 8.456 9.858 1085 HE22 GLN 17 HE22 GLN 17 -9.847 7.038 10.038 1086 H ALA 18 HN ALA 18 -11.968 9.220 2.907 1087 HA ALA 18 HA ALA 18 -9.406 9.299 1.682 1088 HB1 ALA 18 HB1 ALA 18 -11.323 7.927 0.901 1089 HB2 ALA 18 HB2 ALA 18 -10.550 8.870 -0.372 1090 HB3 ALA 18 HB3 ALA 18 -12.084 9.405 0.315 1091 H ARG 19 HN ARG 19 -11.410 11.766 2.677 1092 HA ARG 19 HA ARG 19 -10.765 13.598 0.521 1093 HB2 ARG 19 HB2 ARG 19 -12.964 13.519 1.877 1094 HB3 ARG 19 HB1 ARG 19 -12.057 14.365 3.123 1095 HG2 ARG 19 HG2 ARG 19 -11.611 16.194 1.590 1096 HG3 ARG 19 HG1 ARG 19 -12.443 15.330 0.295 1097 HD2 ARG 19 HD2 ARG 19 -13.753 16.132 2.886 1098 HD3 ARG 19 HD1 ARG 19 -13.799 17.116 1.427 1099 HE ARG 19 HE ARG 19 -15.366 14.798 1.991 1100 HH11 ARG 19 HH11 ARG 19 -13.881 16.591 -0.619 1101 HH12 ARG 19 HH12 ARG 19 -15.030 16.064 -1.808 1102 HH21 ARG 19 HH21 ARG 19 -16.894 14.109 0.412 1103 HH22 ARG 19 HH22 ARG 19 -16.731 14.664 -1.227 1104 H GLU 20 HN GLU 20 -9.291 12.480 3.308 1105 HA GLU 20 HA GLU 20 -7.984 14.914 4.105 1106 HB2 GLU 20 HB2 GLU 20 -7.528 12.021 4.833 1107 HB3 GLU 20 HB1 GLU 20 -6.588 13.346 5.506 1108 HG2 GLU 20 HG2 GLU 20 -8.636 14.320 6.422 1109 HG3 GLU 20 HG1 GLU 20 -9.560 12.965 5.774 1110 H CYS 21 H CYS 21 -7.173 12.083 2.180 1111 HA CYS 21 HA CYS 21 -4.537 13.279 1.550 1112 HB2 CYS 21 3HB CYS 21 -5.598 10.386 1.226 1113 HB3 CYS 21 2HB CYS 21 -3.985 10.907 0.721 1114 HG CYS 21 HG CYS 21 -2.920 10.890 2.847 1115 H THR 22 HN THR 22 -3.772 13.004 -0.650 1116 HA THR 22 HA THR 22 -5.823 13.870 -2.509 1117 HB THR 22 HB THR 22 -3.621 14.017 -3.985 1118 HG1 THR 22 HG1 THR 22 -1.798 14.359 -2.684 1119 HG21 THR 22 HG21 THR 22 -4.810 15.991 -3.502 1120 HG22 THR 22 HG22 THR 22 -3.189 16.284 -2.873 1121 HG23 THR 22 HG23 THR 22 -4.496 15.856 -1.770 1122 H LEU 23 HN LEU 23 -5.555 13.031 -4.843 1123 HA LEU 23 HA LEU 23 -6.125 10.287 -4.917 1124 HB2 LEU 23 HB2 LEU 23 -6.884 11.847 -6.640 1125 HB3 LEU 23 HB1 LEU 23 -5.229 12.118 -7.146 1126 HG LEU 23 HG LEU 23 -5.116 9.683 -7.787 1127 HD11 LEU 23 HD11 LEU 23 -7.089 9.052 -6.333 1128 HD12 LEU 23 HD12 LEU 23 -7.081 8.386 -7.965 1129 HD13 LEU 23 HD13 LEU 23 -8.117 9.762 -7.579 1130 HD21 LEU 23 HD21 LEU 23 -6.379 10.013 -9.867 1131 HD22 LEU 23 HD22 LEU 23 -5.429 11.433 -9.439 1132 HD23 LEU 23 HD23 LEU 23 -7.166 11.418 -9.156 1133 H GLU 24 HN GLU 24 -3.164 12.064 -5.215 1134 HA GLU 24 HA GLU 24 -1.447 10.215 -6.350 1135 HB2 GLU 24 HB2 GLU 24 -0.554 12.344 -6.023 1136 HB3 GLU 24 HB1 GLU 24 -1.114 12.437 -4.361 1137 HG2 GLU 24 HG2 GLU 24 1.168 12.222 -4.127 1138 HG3 GLU 24 HG1 GLU 24 0.600 10.568 -3.916 1139 H THR 25 HN THR 25 -2.052 10.715 -2.858 1140 HA THR 25 HA THR 25 -0.574 8.434 -2.056 1141 HB THR 25 HB THR 25 -2.633 9.256 -0.174 1142 HG1 THR 25 HG1 THR 25 -0.854 11.347 -0.577 1143 HG21 THR 25 HG21 THR 25 0.235 8.717 -0.278 1144 HG22 THR 25 HG22 THR 25 -0.911 8.469 1.041 1145 HG23 THR 25 HG23 THR 25 -0.178 10.055 0.791 1146 H LEU 26 HN LEU 26 -3.998 9.034 -2.663 1147 HA LEU 26 HA LEU 26 -5.020 6.632 -1.635 1148 HB2 LEU 26 HB2 LEU 26 -6.067 8.418 -3.830 1149 HB3 LEU 26 HB1 LEU 26 -6.961 7.061 -3.165 1150 HG LEU 26 HG LEU 26 -6.032 9.438 -1.549 1151 HD11 LEU 26 HD11 LEU 26 -8.750 8.824 -2.697 1152 HD12 LEU 26 HD12 LEU 26 -7.676 10.132 -3.195 1153 HD13 LEU 26 HD13 LEU 26 -8.377 10.134 -1.578 1154 HD21 LEU 26 HD21 LEU 26 -6.336 7.357 -0.269 1155 HD22 LEU 26 HD22 LEU 26 -7.980 7.233 -0.890 1156 HD23 LEU 26 HD23 LEU 26 -7.530 8.581 0.153 1157 H GLU 27 HN GLU 27 -3.874 7.443 -4.886 1158 HA GLU 27 HA GLU 27 -4.591 4.988 -6.075 1159 HB2 GLU 27 HB2 GLU 27 -4.071 7.031 -7.355 1160 HB3 GLU 27 HB1 GLU 27 -2.386 6.895 -6.873 1161 HG2 GLU 27 HG2 GLU 27 -2.046 5.707 -8.710 1162 HG3 GLU 27 HG1 GLU 27 -3.006 4.423 -7.980 1163 H GLU 28 HN GLU 28 -1.543 6.072 -4.569 1164 HA GLU 28 HA GLU 28 -0.183 3.634 -5.220 1165 HB2 GLU 28 HB2 GLU 28 0.850 5.969 -4.772 1166 HB3 GLU 28 HB1 GLU 28 0.750 5.525 -3.074 1167 HG2 GLU 28 HG2 GLU 28 2.189 3.647 -3.408 1168 HG3 GLU 28 HG1 GLU 28 2.137 3.854 -5.154 1169 H MET 29 HN MET 29 -2.496 4.335 -2.870 1170 HA MET 29 HA MET 29 -1.461 2.189 -1.146 1171 HB2 MET 29 HB2 MET 29 -2.803 2.988 0.639 1172 HB3 MET 29 HB1 MET 29 -2.026 4.392 -0.071 1173 HG2 MET 29 HG2 MET 29 -4.079 4.959 -1.236 1174 HG3 MET 29 HG1 MET 29 -4.865 3.532 -0.568 1175 HE1 MET 29 HE1 MET 29 -2.957 6.815 0.372 1176 HE2 MET 29 HE2 MET 29 -2.314 5.684 1.568 1177 HE3 MET 29 HE3 MET 29 -3.364 7.010 2.076 1178 H LEU 30 HN LEU 30 -4.051 3.081 -3.275 1179 HA LEU 30 HA LEU 30 -5.936 1.117 -2.564 1180 HB2 LEU 30 HB2 LEU 30 -6.555 2.937 -4.023 1181 HB3 LEU 30 HB1 LEU 30 -5.359 2.456 -5.208 1182 HG LEU 30 HG LEU 30 -6.676 0.317 -5.511 1183 HD11 LEU 30 HD11 LEU 30 -9.118 0.572 -4.869 1184 HD12 LEU 30 HD12 LEU 30 -8.579 1.829 -3.754 1185 HD13 LEU 30 HD13 LEU 30 -7.985 0.179 -3.575 1186 HD21 LEU 30 HD21 LEU 30 -8.256 1.330 -7.016 1187 HD22 LEU 30 HD22 LEU 30 -6.749 2.243 -7.067 1188 HD23 LEU 30 HD23 LEU 30 -8.129 2.870 -6.169 1189 H GLU 31 HN GLU 31 -3.184 1.094 -4.749 1190 HA GLU 31 HA GLU 31 -3.614 -1.451 -5.862 1191 HB2 GLU 31 HB2 GLU 31 -1.233 -1.335 -6.519 1192 HB3 GLU 31 HB1 GLU 31 -2.131 0.116 -6.933 1193 HG2 GLU 31 HG2 GLU 31 -1.158 1.322 -5.128 1194 HG3 GLU 31 HG1 GLU 31 -0.426 -0.144 -4.475 1195 H LYS 32 HN LYS 32 -2.167 -0.406 -2.883 1196 HA LYS 32 HA LYS 32 -0.759 -2.801 -2.287 1197 HB2 LYS 32 HB2 LYS 32 -1.837 -0.799 -0.296 1198 HB3 LYS 32 HB1 LYS 32 -0.492 -1.905 -0.071 1199 HG2 LYS 32 HG2 LYS 32 -0.374 0.138 -2.240 1200 HG3 LYS 32 HG1 LYS 32 -0.055 0.607 -0.571 1201 HD2 LYS 32 HD2 LYS 32 1.763 -0.937 -0.410 1202 HD3 LYS 32 HD1 LYS 32 1.358 -1.660 -1.967 1203 HE2 LYS 32 HE2 LYS 32 3.300 -0.113 -2.056 1204 HE3 LYS 32 HE1 LYS 32 1.981 0.344 -3.130 1205 HZ1 LYS 32 HZ1 LYS 32 2.999 2.203 -1.851 1206 HZ2 LYS 32 HZ2 LYS 32 2.373 1.522 -0.433 1207 HZ3 LYS 32 HZ3 LYS 32 1.323 2.057 -1.654 1208 H LEU 33 HN LEU 33 -4.043 -1.685 -1.742 1209 HA LEU 33 HA LEU 33 -4.666 -3.890 0.008 1210 HB2 LEU 33 HB2 LEU 33 -5.718 -1.725 0.364 1211 HB3 LEU 33 HB1 LEU 33 -6.433 -1.787 -1.234 1212 HG LEU 33 HG LEU 33 -7.769 -3.756 -0.532 1213 HD11 LEU 33 HD11 LEU 33 -7.892 -4.387 1.791 1214 HD12 LEU 33 HD12 LEU 33 -6.692 -3.167 2.225 1215 HD13 LEU 33 HD13 LEU 33 -6.226 -4.545 1.226 1216 HD21 LEU 33 HD21 LEU 33 -8.024 -1.241 1.100 1217 HD22 LEU 33 HD22 LEU 33 -9.253 -2.503 1.035 1218 HD23 LEU 33 HD23 LEU 33 -8.816 -1.615 -0.428 1219 H GLU 34 HN GLU 34 -5.499 -2.962 -3.342 1220 HA GLU 34 HA GLU 34 -7.265 -5.094 -3.790 1221 HB2 GLU 34 HB2 GLU 34 -7.114 -4.615 -6.118 1222 HB3 GLU 34 HB1 GLU 34 -7.032 -3.086 -5.257 1223 HG2 GLU 34 HG2 GLU 34 -4.730 -2.865 -5.674 1224 HG3 GLU 34 HG1 GLU 34 -4.586 -4.535 -6.217 1225 H VAL 35 HN VAL 35 -3.761 -4.968 -3.973 1226 HA VAL 35 HA VAL 35 -3.533 -7.477 -5.304 1227 HB VAL 35 HB VAL 35 -1.740 -5.708 -5.305 1228 HG11 VAL 35 HG11 VAL 35 -1.866 -5.360 -2.791 1229 HG12 VAL 35 HG12 VAL 35 -0.254 -5.441 -3.503 1230 HG13 VAL 35 HG13 VAL 35 -0.911 -6.839 -2.648 1231 HG21 VAL 35 HG21 VAL 35 -0.046 -7.253 -5.644 1232 HG22 VAL 35 HG22 VAL 35 -1.507 -8.216 -5.863 1233 HG23 VAL 35 HG23 VAL 35 -0.608 -8.306 -4.347 1234 H VAL 36 HN VAL 36 -3.479 -6.465 -1.907 1235 HA VAL 36 HA VAL 36 -2.714 -8.929 -0.797 1236 HB VAL 36 HB VAL 36 -4.310 -6.631 0.338 1237 HG11 VAL 36 HG11 VAL 36 -4.911 -8.855 1.394 1238 HG12 VAL 36 HG12 VAL 36 -4.295 -7.618 2.487 1239 HG13 VAL 36 HG13 VAL 36 -3.245 -8.931 1.961 1240 HG21 VAL 36 HG21 VAL 36 -2.212 -6.393 1.716 1241 HG22 VAL 36 HG22 VAL 36 -2.027 -6.073 -0.008 1242 HG23 VAL 36 HG23 VAL 36 -1.482 -7.607 0.667 1243 H VAL 37 HN VAL 37 -5.901 -7.584 -1.575 1244 HA VAL 37 HA VAL 37 -7.404 -9.732 -0.534 1245 HB VAL 37 HB VAL 37 -8.157 -7.940 -2.852 1246 HG11 VAL 37 HG11 VAL 37 -9.827 -9.616 -0.981 1247 HG12 VAL 37 HG12 VAL 37 -9.630 -9.835 -2.721 1248 HG13 VAL 37 HG13 VAL 37 -10.479 -8.419 -2.099 1249 HG21 VAL 37 HG21 VAL 37 -9.439 -6.733 -0.964 1250 HG22 VAL 37 HG22 VAL 37 -7.711 -6.432 -1.142 1251 HG23 VAL 37 HG23 VAL 37 -8.289 -7.526 0.114 1252 H ASN 38 HN ASN 38 -5.903 -9.144 -3.657 1253 HA ASN 38 HA ASN 38 -6.993 -11.360 -5.019 1254 HB2 ASN 38 HB2 ASN 38 -5.051 -9.292 -5.558 1255 HB3 ASN 38 HB1 ASN 38 -4.463 -10.850 -6.133 1256 HD21 ASN 38 HD21 ASN 38 -5.425 -8.433 -7.559 1257 HD22 ASN 38 HD22 ASN 38 -6.663 -9.010 -8.618 1258 H GLU 39 HN GLU 39 -4.218 -10.981 -2.893 1259 HA GLU 39 HA GLU 39 -3.014 -13.491 -3.457 1260 HB2 GLU 39 HB2 GLU 39 -2.911 -11.975 -0.843 1261 HB3 GLU 39 HB1 GLU 39 -1.757 -13.172 -1.414 1262 HG2 GLU 39 HG2 GLU 39 -1.246 -11.602 -3.309 1263 HG3 GLU 39 HG1 GLU 39 -2.221 -10.400 -2.467 1264 H ARG 40 HN ARG 40 -5.322 -12.376 -1.048 1265 HA ARG 40 HA ARG 40 -5.637 -14.809 0.329 1266 HB2 ARG 40 HB2 ARG 40 -7.443 -12.408 0.019 1267 HB3 ARG 40 HB1 ARG 40 -7.829 -13.767 1.065 1268 HG2 ARG 40 HG2 ARG 40 -5.229 -12.301 1.350 1269 HG3 ARG 40 HG1 ARG 40 -6.709 -11.698 2.100 1270 HD2 ARG 40 HD2 ARG 40 -5.567 -14.463 2.526 1271 HD3 ARG 40 HD1 ARG 40 -5.323 -13.100 3.618 1272 HE ARG 40 HE ARG 40 -7.630 -13.176 4.179 1273 HH11 ARG 40 HH11 ARG 40 -6.582 -15.832 2.157 1274 HH12 ARG 40 HH12 ARG 40 -7.971 -16.826 2.505 1275 HH21 ARG 40 HH21 ARG 40 -9.456 -14.482 4.651 1276 HH22 ARG 40 HH22 ARG 40 -9.616 -16.047 3.891 1277 H ARG 41 HN ARG 41 -7.059 -13.515 -2.572 1278 HA ARG 41 HA ARG 41 -9.272 -15.149 -2.926 1279 HB2 ARG 41 HB2 ARG 41 -7.351 -13.887 -4.863 1280 HB3 ARG 41 HB1 ARG 41 -8.688 -14.871 -5.427 1281 HG2 ARG 41 HG2 ARG 41 -9.279 -12.645 -3.554 1282 HG3 ARG 41 HG1 ARG 41 -8.877 -12.256 -5.226 1283 HD2 ARG 41 HD2 ARG 41 -11.083 -14.091 -4.295 1284 HD3 ARG 41 HD1 ARG 41 -11.284 -12.475 -4.964 1285 HE ARG 41 HE ARG 41 -9.885 -14.286 -6.714 1286 HH11 ARG 41 HH11 ARG 41 -13.044 -13.099 -5.727 1287 HH12 ARG 41 HH12 ARG 41 -13.824 -13.629 -7.192 1288 HH21 ARG 41 HH21 ARG 41 -10.916 -14.973 -8.630 1289 HH22 ARG 41 HH22 ARG 41 -12.615 -14.691 -8.841 1290 H GLU 42 HN GLU 42 -5.974 -15.631 -4.150 1291 HA GLU 42 HA GLU 42 -6.458 -18.217 -5.178 1292 HB2 GLU 42 HB2 GLU 42 -3.845 -16.887 -4.441 1293 HB3 GLU 42 HB1 GLU 42 -4.005 -18.342 -5.417 1294 HG2 GLU 42 HG2 GLU 42 -5.160 -17.125 -7.134 1295 HG3 GLU 42 HG1 GLU 42 -5.192 -15.674 -6.139 1296 H GLU 43 HN GLU 43 -5.170 -17.069 -2.092 1297 HA GLU 43 HA GLU 43 -4.307 -19.515 -1.050 1298 HB2 GLU 43 HB2 GLU 43 -5.306 -16.978 0.207 1299 HB3 GLU 43 HB1 GLU 43 -4.960 -18.377 1.211 1300 HG2 GLU 43 HG2 GLU 43 -2.659 -18.391 0.222 1301 HG3 GLU 43 HG1 GLU 43 -3.054 -16.845 -0.528 1302 H GLU 44 HN GLU 44 -7.479 -17.964 -0.942 1303 HA GLU 44 HA GLU 44 -8.708 -19.971 0.666 1304 HB2 GLU 44 HB2 GLU 44 -9.362 -17.417 -0.179 1305 HB3 GLU 44 HB1 GLU 44 -10.512 -18.433 -1.038 1306 HG2 GLU 44 HG2 GLU 44 -11.619 -17.896 0.918 1307 HG3 GLU 44 HG1 GLU 44 -10.973 -19.502 1.251 1308 H SER 45 HN SER 45 -8.581 -19.365 -2.817 1309 HA SER 45 HA SER 45 -10.441 -21.409 -3.492 1310 HB2 SER 45 HB2 SER 45 -8.322 -20.211 -5.285 1311 HB3 SER 45 HB1 SER 45 -9.827 -20.988 -5.778 1312 HG SER 45 HG SER 45 -9.463 -18.491 -4.491 1313 H ALA 46 HN ALA 46 -6.972 -21.365 -2.993 1314 HA ALA 46 HA ALA 46 -6.591 -23.983 -4.166 1315 HB1 ALA 46 HB1 ALA 46 -4.869 -22.187 -4.266 1316 HB2 ALA 46 HB2 ALA 46 -4.274 -23.724 -3.640 1317 HB3 ALA 46 HB3 ALA 46 -4.621 -22.394 -2.533 Start of MODEL 3 1 H LEU 6 HT1 LEU 6 9.049 14.647 4.732 2 HA LEU 6 HA LEU 6 10.817 16.076 2.834 3 HB2 LEU 6 HB2 LEU 6 10.975 13.429 4.215 4 HB3 LEU 6 HB1 LEU 6 11.596 13.563 2.585 5 HG LEU 6 HG LEU 6 12.762 15.711 3.877 6 HD11 LEU 6 HD11 LEU 6 12.991 13.329 5.697 7 HD12 LEU 6 HD12 LEU 6 11.904 14.683 6.016 8 HD13 LEU 6 HD13 LEU 6 13.643 14.950 5.933 9 HD21 LEU 6 HD21 LEU 6 14.805 14.411 3.665 10 HD22 LEU 6 HD22 LEU 6 13.787 14.192 2.244 11 HD23 LEU 6 HD23 LEU 6 13.865 12.932 3.473 12 H THR 7 HN THR 7 10.858 14.945 0.702 13 HA THR 7 HA THR 7 8.127 14.389 -0.116 14 HB THR 7 HB THR 7 10.380 14.276 -2.061 15 HG1 THR 7 HG1 THR 7 11.096 16.061 -1.025 16 HG21 THR 7 HG21 THR 7 7.679 15.630 -2.092 17 HG22 THR 7 HG22 THR 7 8.064 14.065 -2.810 18 HG23 THR 7 HG23 THR 7 8.798 15.534 -3.451 19 H LYS 8 HN LYS 8 7.537 12.538 -1.309 20 HA LYS 8 HA LYS 8 8.503 10.086 -0.354 21 HB2 LYS 8 HB2 LYS 8 6.229 10.530 -1.294 22 HB3 LYS 8 HB1 LYS 8 6.942 10.609 -2.896 23 HG2 LYS 8 HG2 LYS 8 7.509 8.305 -2.852 24 HG3 LYS 8 HG1 LYS 8 7.119 8.179 -1.135 25 HD2 LYS 8 HD2 LYS 8 4.974 7.782 -1.586 26 HD3 LYS 8 HD1 LYS 8 4.872 9.222 -2.598 27 HE2 LYS 8 HE2 LYS 8 5.903 7.896 -4.449 28 HE3 LYS 8 HE1 LYS 8 5.756 6.464 -3.432 29 HZ1 LYS 8 HZ1 LYS 8 3.386 6.695 -3.424 30 HZ2 LYS 8 HZ2 LYS 8 3.916 6.741 -5.026 31 HZ3 LYS 8 HZ3 LYS 8 3.466 8.179 -4.253 32 H THR 9 HN THR 9 9.365 12.033 -3.107 33 HA THR 9 HA THR 9 10.855 10.067 -4.520 34 HB THR 9 HB THR 9 11.708 12.838 -4.894 35 HG1 THR 9 HG1 THR 9 9.356 12.974 -5.945 36 HG21 THR 9 HG21 THR 9 10.383 10.803 -6.692 37 HG22 THR 9 HG22 THR 9 12.117 11.083 -6.539 38 HG23 THR 9 HG23 THR 9 11.080 12.334 -7.220 39 H ASP 10 HN ASP 10 11.623 12.388 -1.992 40 HA ASP 10 HA ASP 10 14.421 12.399 -2.239 41 HB2 ASP 10 HB2 ASP 10 12.658 12.884 0.162 42 HB3 ASP 10 HB1 ASP 10 14.409 13.069 0.201 43 H TYR 11 HN TYR 11 12.342 10.493 -0.067 44 HA TYR 11 HA TYR 11 14.486 8.951 0.971 45 HB2 TYR 11 HB2 TYR 11 11.497 8.674 1.018 46 HB3 TYR 11 HB1 TYR 11 12.515 7.376 1.633 47 HD1 TYR 11 HD1 TYR 11 14.542 8.481 3.180 48 HD2 TYR 11 HD2 TYR 11 10.598 9.989 2.671 49 HE1 TYR 11 HE1 TYR 11 14.708 9.627 5.349 50 HE2 TYR 11 HE2 TYR 11 10.753 11.144 4.838 51 HH TYR 11 HH TYR 11 13.728 11.408 6.575 52 H LEU 12 HN LEU 12 12.320 8.595 -1.760 53 HA LEU 12 HA LEU 12 12.798 5.905 -2.372 54 HB2 LEU 12 HB2 LEU 12 11.031 7.320 -3.410 55 HB3 LEU 12 HB1 LEU 12 12.277 8.159 -4.315 56 HG LEU 12 HG LEU 12 12.876 5.821 -5.246 57 HD11 LEU 12 HD11 LEU 12 11.559 4.496 -3.722 58 HD12 LEU 12 HD12 LEU 12 10.960 4.290 -5.365 59 HD13 LEU 12 HD13 LEU 12 10.086 5.320 -4.229 60 HD21 LEU 12 HD21 LEU 12 10.260 7.086 -6.042 61 HD22 LEU 12 HD22 LEU 12 11.307 6.092 -7.053 62 HD23 LEU 12 HD23 LEU 12 11.848 7.683 -6.519 63 H MET 13 HN MET 13 14.410 8.846 -3.581 64 HA MET 13 HA MET 13 16.305 7.544 -5.194 65 HB2 MET 13 HB2 MET 13 15.672 10.186 -4.523 66 HB3 MET 13 HB1 MET 13 17.344 9.979 -4.025 67 HG2 MET 13 HG2 MET 13 17.146 10.834 -6.310 68 HG3 MET 13 HG1 MET 13 17.966 9.275 -6.241 69 HE1 MET 13 HE1 MET 13 15.900 9.444 -9.651 70 HE2 MET 13 HE2 MET 13 17.502 9.118 -8.999 71 HE3 MET 13 HE3 MET 13 16.774 10.710 -8.791 72 H ARG 14 HN ARG 14 16.350 8.466 -1.797 73 HA ARG 14 HA ARG 14 19.043 7.904 -1.234 74 HB2 ARG 14 HB2 ARG 14 17.543 9.168 0.273 75 HB3 ARG 14 HB1 ARG 14 16.636 7.699 0.593 76 HG2 ARG 14 HG2 ARG 14 19.549 7.647 1.143 77 HG3 ARG 14 HG1 ARG 14 18.523 8.592 2.223 78 HD2 ARG 14 HD2 ARG 14 17.181 6.662 2.721 79 HD3 ARG 14 HD1 ARG 14 18.040 5.697 1.519 80 HE ARG 14 HE ARG 14 18.930 6.395 4.190 81 HH11 ARG 14 HH11 ARG 14 19.879 5.205 1.026 82 HH12 ARG 14 HH12 ARG 14 21.312 4.427 1.615 83 HH21 ARG 14 HH21 ARG 14 20.810 5.362 4.964 84 HH22 ARG 14 HH22 ARG 14 21.839 4.507 3.854 85 H LEU 15 HN LEU 15 16.165 5.857 -1.207 86 HA LEU 15 HA LEU 15 17.654 3.563 -0.275 87 HB2 LEU 15 HB2 LEU 15 14.802 3.807 -1.225 88 HB3 LEU 15 HB1 LEU 15 15.506 2.381 -0.485 89 HG LEU 15 HG LEU 15 15.218 5.056 0.879 90 HD11 LEU 15 HD11 LEU 15 13.564 2.549 1.051 91 HD12 LEU 15 HD12 LEU 15 13.043 4.146 0.505 92 HD13 LEU 15 HD13 LEU 15 13.467 3.888 2.201 93 HD21 LEU 15 HD21 LEU 15 17.080 3.774 1.747 94 HD22 LEU 15 HD22 LEU 15 16.057 2.348 1.910 95 HD23 LEU 15 HD23 LEU 15 15.756 3.768 2.909 96 H ARG 16 HN ARG 16 17.064 5.013 -3.267 97 HA ARG 16 HA ARG 16 17.046 2.612 -4.846 98 HB2 ARG 16 HB2 ARG 16 17.024 5.526 -5.391 99 HB3 ARG 16 HB1 ARG 16 17.719 4.505 -6.643 100 HG2 ARG 16 HG2 ARG 16 15.621 3.153 -6.592 101 HG3 ARG 16 HG1 ARG 16 14.935 4.363 -5.507 102 HD2 ARG 16 HD2 ARG 16 14.970 6.017 -7.149 103 HD3 ARG 16 HD1 ARG 16 16.121 5.130 -8.149 104 HE ARG 16 HE ARG 16 13.910 3.510 -8.036 105 HH11 ARG 16 HH11 ARG 16 14.496 6.829 -9.000 106 HH12 ARG 16 HH12 ARG 16 13.267 6.833 -10.221 107 HH21 ARG 16 HH21 ARG 16 12.285 3.500 -9.633 108 HH22 ARG 16 HH22 ARG 16 12.013 4.930 -10.594 109 H ARG 17 HN ARG 17 19.426 4.411 -3.269 110 HA ARG 17 HA ARG 17 21.575 3.705 -5.070 111 HB2 ARG 17 HB2 ARG 17 21.584 4.994 -2.332 112 HB3 ARG 17 HB1 ARG 17 23.027 4.716 -3.300 113 HG2 ARG 17 HG2 ARG 17 21.978 6.102 -5.101 114 HG3 ARG 17 HG1 ARG 17 20.708 6.518 -3.952 115 HD2 ARG 17 HD2 ARG 17 23.655 7.025 -3.569 116 HD3 ARG 17 HD1 ARG 17 22.473 8.230 -4.067 117 HE ARG 17 HE ARG 17 22.789 7.076 -1.406 118 HH11 ARG 17 HH11 ARG 17 20.916 9.132 -3.541 119 HH12 ARG 17 HH12 ARG 17 20.212 10.047 -2.243 120 HH21 ARG 17 HH21 ARG 17 21.852 8.278 0.298 121 HH22 ARG 17 HH22 ARG 17 20.734 9.554 -0.064 122 H CYS 18 HN CYS 18 19.803 2.144 -2.758 123 HA CYS 18 HA CYS 18 21.991 0.333 -2.031 124 HB2 CYS 18 HB2 CYS 18 19.249 0.584 -0.778 125 HB3 CYS 18 HB1 CYS 18 20.585 -0.400 -0.185 126 HG CYS 18 HG CYS 18 22.099 2.256 -0.122 127 H GLN 19 HN GLN 19 22.014 -1.701 -2.816 128 HA GLN 19 HA GLN 19 19.603 -2.638 -4.249 129 HB2 GLN 19 HB2 GLN 19 22.434 -3.429 -4.928 130 HB3 GLN 19 HB1 GLN 19 20.985 -3.675 -5.892 131 HG2 GLN 19 HG2 GLN 19 21.801 -0.888 -5.246 132 HG3 GLN 19 HG1 GLN 19 22.722 -1.783 -6.454 133 HE21 GLN 19 HE21 GLN 19 22.053 -0.427 -8.102 134 HE22 GLN 19 HE22 GLN 19 20.441 -0.468 -8.739 135 H THR 20 HN THR 20 20.645 -5.200 -4.791 136 HA THR 20 HA THR 20 20.941 -7.289 -3.986 137 HB THR 20 HB THR 20 21.678 -6.228 -1.271 138 HG1 THR 20 HG1 THR 20 23.725 -5.791 -2.045 139 HG21 THR 20 HG21 THR 20 23.208 -8.150 -1.300 140 HG22 THR 20 HG22 THR 20 22.641 -8.574 -2.915 141 HG23 THR 20 HG23 THR 20 21.536 -8.655 -1.541 142 H ILE 21 HN ILE 21 18.745 -5.129 -2.615 143 HA ILE 21 HA ILE 21 16.655 -5.416 -1.748 144 HB ILE 21 HB ILE 21 17.199 -8.369 -2.088 145 HG12 ILE 21 HG12 ILE 21 15.322 -6.652 -3.705 146 HG13 ILE 21 HG11 ILE 21 17.025 -6.805 -4.129 147 HG21 ILE 21 HG21 ILE 21 14.620 -6.958 -1.392 148 HG22 ILE 21 HG22 ILE 21 15.543 -8.036 -0.345 149 HG23 ILE 21 HG23 ILE 21 14.775 -8.667 -1.797 150 HD11 ILE 21 HD11 ILE 21 16.708 -9.253 -4.288 151 HD12 ILE 21 HD12 ILE 21 15.740 -8.338 -5.442 152 HD13 ILE 21 HD13 ILE 21 14.988 -9.010 -3.995 153 H ASP 22 HN ASP 22 18.709 -8.006 -0.432 154 HA ASP 22 HA ASP 22 17.689 -8.016 2.163 155 HB2 ASP 22 HB2 ASP 22 19.106 -9.814 1.413 156 HB3 ASP 22 HB1 ASP 22 20.449 -8.709 1.139 157 H THR 23 HN THR 23 20.388 -6.185 0.789 158 HA THR 23 HA THR 23 21.279 -4.920 3.112 159 HB THR 23 HB THR 23 21.277 -3.616 0.393 160 HG1 THR 23 HG1 THR 23 23.371 -4.890 0.271 161 HG21 THR 23 HG21 THR 23 23.399 -2.697 1.120 162 HG22 THR 23 HG22 THR 23 23.333 -3.640 2.609 163 HG23 THR 23 HG23 THR 23 22.166 -2.343 2.335 164 H LEU 24 HN LEU 24 18.692 -4.054 0.864 165 HA LEU 24 HA LEU 24 18.112 -1.515 1.973 166 HB2 LEU 24 HB2 LEU 24 17.338 -2.140 -0.255 167 HB3 LEU 24 HB1 LEU 24 16.339 -3.409 0.429 168 HG LEU 24 HG LEU 24 15.147 -1.510 1.705 169 HD11 LEU 24 HD11 LEU 24 15.235 0.664 0.657 170 HD12 LEU 24 HD12 LEU 24 16.432 0.087 -0.502 171 HD13 LEU 24 HD13 LEU 24 16.844 0.200 1.209 172 HD21 LEU 24 HD21 LEU 24 13.715 -1.032 -0.268 173 HD22 LEU 24 HD22 LEU 24 14.056 -2.747 -0.041 174 HD23 LEU 24 HD23 LEU 24 14.912 -1.836 -1.283 175 H GLU 25 HN GLU 25 16.793 -4.753 2.515 176 HA GLU 25 HA GLU 25 14.784 -4.079 4.345 177 HB2 GLU 25 HB2 GLU 25 15.004 -6.276 3.237 178 HB3 GLU 25 HB1 GLU 25 16.432 -6.611 4.207 179 HG2 GLU 25 HG2 GLU 25 14.798 -7.744 5.350 180 HG3 GLU 25 HG1 GLU 25 14.854 -6.210 6.214 181 H ARG 26 HN ARG 26 18.226 -4.477 4.729 182 HA ARG 26 HA ARG 26 18.110 -4.546 7.615 183 HB2 ARG 26 HB2 ARG 26 20.455 -4.325 5.729 184 HB3 ARG 26 HB1 ARG 26 20.581 -4.510 7.473 185 HG2 ARG 26 HG2 ARG 26 19.500 -6.668 7.357 186 HG3 ARG 26 HG1 ARG 26 19.259 -6.485 5.620 187 HD2 ARG 26 HD2 ARG 26 21.154 -7.853 5.838 188 HD3 ARG 26 HD1 ARG 26 21.779 -6.250 5.454 189 HE ARG 26 HE ARG 26 21.626 -6.803 8.273 190 HH11 ARG 26 HH11 ARG 26 23.585 -7.061 5.385 191 HH12 ARG 26 HH12 ARG 26 25.078 -7.179 6.257 192 HH21 ARG 26 HH21 ARG 26 23.609 -6.975 9.418 193 HH22 ARG 26 HH22 ARG 26 25.092 -7.115 8.535 194 H VAL 27 HN VAL 27 18.812 -2.122 5.124 195 HA VAL 27 HA VAL 27 19.758 -0.197 7.016 196 HB VAL 27 HB VAL 27 20.390 -0.149 4.597 197 HG11 VAL 27 HG11 VAL 27 18.059 -0.549 3.757 198 HG12 VAL 27 HG12 VAL 27 18.957 0.729 2.937 199 HG13 VAL 27 HG13 VAL 27 17.719 1.142 4.124 200 HG21 VAL 27 HG21 VAL 27 20.821 1.756 6.013 201 HG22 VAL 27 HG22 VAL 27 19.185 2.362 5.751 202 HG23 VAL 27 HG23 VAL 27 20.330 2.310 4.411 203 H ILE 28 HN ILE 28 16.615 -0.884 5.550 204 HA ILE 28 HA ILE 28 15.362 1.440 6.641 205 HB ILE 28 HB ILE 28 13.238 0.422 6.002 206 HG12 ILE 28 HG12 ILE 28 14.848 -2.018 5.221 207 HG13 ILE 28 HG11 ILE 28 13.812 -1.911 6.639 208 HG21 ILE 28 HG21 ILE 28 14.342 1.576 4.258 209 HG22 ILE 28 HG22 ILE 28 13.738 0.077 3.553 210 HG23 ILE 28 HG23 ILE 28 15.443 0.232 3.965 211 HD11 ILE 28 HD11 ILE 28 12.971 -1.809 3.757 212 HD12 ILE 28 HD12 ILE 28 11.893 -1.472 5.113 213 HD13 ILE 28 HD13 ILE 28 12.622 -3.069 4.941 214 H GLU 29 HN GLU 29 15.989 -1.790 7.733 215 HA GLU 29 HA GLU 29 14.164 -1.940 9.859 216 HB2 GLU 29 HB2 GLU 29 15.632 -3.776 8.814 217 HB3 GLU 29 HB1 GLU 29 16.896 -3.207 9.894 218 HG2 GLU 29 HG2 GLU 29 15.679 -5.147 10.776 219 HG3 GLU 29 HG1 GLU 29 15.563 -3.731 11.818 220 H LYS 30 HN LYS 30 17.595 -1.006 9.825 221 HA LYS 30 HA LYS 30 17.730 -0.259 12.550 222 HB2 LYS 30 HB2 LYS 30 19.432 0.026 10.152 223 HB3 LYS 30 HB1 LYS 30 19.667 1.259 11.383 224 HG2 LYS 30 HG2 LYS 30 19.990 -0.581 13.045 225 HG3 LYS 30 HG1 LYS 30 19.966 -1.715 11.694 226 HD2 LYS 30 HD2 LYS 30 21.878 -0.579 10.690 227 HD3 LYS 30 HD1 LYS 30 21.890 0.594 12.006 228 HE2 LYS 30 HE2 LYS 30 23.581 -0.990 12.498 229 HE3 LYS 30 HE1 LYS 30 22.237 -1.348 13.580 230 HZ1 LYS 30 HZ1 LYS 30 21.586 -3.163 12.186 231 HZ2 LYS 30 HZ2 LYS 30 23.230 -3.338 12.548 232 HZ3 LYS 30 HZ3 LYS 30 22.753 -2.772 11.028 233 H ASN 31 HN ASN 31 17.039 1.528 9.604 234 HA ASN 31 HA ASN 31 17.091 4.128 10.605 235 HB2 ASN 31 HB2 ASN 31 16.717 3.094 8.163 236 HB3 ASN 31 HB1 ASN 31 15.043 3.468 8.561 237 HD21 ASN 31 HD21 ASN 31 14.403 5.588 8.754 238 HD22 ASN 31 HD22 ASN 31 15.394 6.909 8.256 239 H LYS 32 HN LYS 32 14.509 1.725 10.670 240 HA LYS 32 HA LYS 32 12.424 3.451 11.475 241 HB2 LYS 32 HB2 LYS 32 12.865 0.492 11.763 242 HB3 LYS 32 HB1 LYS 32 11.432 1.270 12.415 243 HG2 LYS 32 HG2 LYS 32 10.822 2.045 10.187 244 HG3 LYS 32 HG1 LYS 32 12.276 1.294 9.524 245 HD2 LYS 32 HD2 LYS 32 10.150 -0.234 11.015 246 HD3 LYS 32 HD1 LYS 32 10.158 -0.036 9.260 247 HE2 LYS 32 HE2 LYS 32 12.146 -1.256 9.020 248 HE3 LYS 32 HE1 LYS 32 12.536 -1.126 10.733 249 HZ1 LYS 32 HZ1 LYS 32 11.753 -3.337 10.142 250 HZ2 LYS 32 HZ2 LYS 32 10.285 -2.690 9.607 251 HZ3 LYS 32 HZ3 LYS 32 10.702 -2.590 11.242 252 H TYR 33 HN TYR 33 14.990 1.890 13.259 253 HA TYR 33 HA TYR 33 13.757 2.323 15.832 254 HB2 TYR 33 HB2 TYR 33 16.662 1.700 15.279 255 HB3 TYR 33 HB1 TYR 33 15.783 1.438 16.775 256 HD1 TYR 33 HD1 TYR 33 13.290 0.170 15.526 257 HD2 TYR 33 HD2 TYR 33 17.449 -0.483 14.903 258 HE1 TYR 33 HE1 TYR 33 12.823 -2.145 14.851 259 HE2 TYR 33 HE2 TYR 33 16.991 -2.802 14.222 260 HH TYR 33 HH TYR 33 14.073 -3.931 13.328 261 H GLU 34 HN GLU 34 15.590 4.164 13.639 262 HA GLU 34 HA GLU 34 16.565 5.994 15.696 263 HB2 GLU 34 HB2 GLU 34 17.093 5.801 12.733 264 HB3 GLU 34 HB1 GLU 34 17.752 7.068 13.763 265 HG2 GLU 34 HG2 GLU 34 18.976 5.458 15.053 266 HG3 GLU 34 HG1 GLU 34 18.214 4.127 14.184 267 H LEU 35 HN LEU 35 14.188 5.818 13.155 268 HA LEU 35 HA LEU 35 13.714 8.571 12.823 269 HB2 LEU 35 HB2 LEU 35 11.911 6.192 12.415 270 HB3 LEU 35 HB1 LEU 35 11.467 7.830 11.968 271 HG LEU 35 HG LEU 35 13.799 6.284 10.834 272 HD11 LEU 35 HD11 LEU 35 11.657 5.385 10.119 273 HD12 LEU 35 HD12 LEU 35 12.460 6.217 8.791 274 HD13 LEU 35 HD13 LEU 35 11.126 6.992 9.639 275 HD21 LEU 35 HD21 LEU 35 14.102 8.753 10.947 276 HD22 LEU 35 HD22 LEU 35 12.648 8.930 9.965 277 HD23 LEU 35 HD23 LEU 35 14.063 8.110 9.309 278 H SER 36 HN SER 36 11.782 9.773 13.430 279 HA SER 36 HA SER 36 11.309 9.492 16.281 280 HB2 SER 36 HB2 SER 36 10.335 11.659 14.410 281 HB3 SER 36 HB1 SER 36 10.420 11.724 16.172 282 HG SER 36 HG SER 36 12.813 11.247 15.671 283 H ASP 37 H ASP 37 9.948 8.182 13.636 284 HA ASP 37 HA ASP 37 8.111 6.837 13.387 285 HB2 ASP 37 3HB ASP 37 7.315 8.035 16.125 286 HB3 ASP 37 2HB ASP 37 6.264 6.938 15.237 287 H ASN 38 HN ASN 38 7.820 10.268 13.996 288 HA ASN 38 HA ASN 38 5.180 10.502 12.907 289 HB2 ASN 38 HB2 ASN 38 5.511 12.890 13.030 290 HB3 ASN 38 HB1 ASN 38 6.155 12.155 14.494 291 HD21 ASN 38 HD21 ASN 38 6.870 13.925 11.632 292 HD22 ASN 38 HD22 ASN 38 8.542 14.215 11.973 293 H GLU 39 HN GLU 39 8.352 10.313 11.551 294 HA GLU 39 HA GLU 39 7.313 11.238 8.952 295 HB2 GLU 39 HB2 GLU 39 9.567 11.620 8.271 296 HB3 GLU 39 HB1 GLU 39 9.398 12.313 9.876 297 HG2 GLU 39 HG2 GLU 39 10.552 9.587 9.350 298 HG3 GLU 39 HG1 GLU 39 11.519 11.055 9.453 299 H LEU 40 HN LEU 40 7.695 8.505 10.672 300 HA LEU 40 HA LEU 40 8.932 6.657 8.993 301 HB2 LEU 40 HB2 LEU 40 8.344 6.173 11.308 302 HB3 LEU 40 HB1 LEU 40 6.639 6.273 10.921 303 HG LEU 40 HG LEU 40 6.968 4.304 9.383 304 HD11 LEU 40 HD11 LEU 40 9.346 4.415 9.048 305 HD12 LEU 40 HD12 LEU 40 8.945 2.891 9.839 306 HD13 LEU 40 HD13 LEU 40 9.637 4.217 10.777 307 HD21 LEU 40 HD21 LEU 40 5.890 3.822 11.387 308 HD22 LEU 40 HD22 LEU 40 7.328 4.157 12.352 309 HD23 LEU 40 HD23 LEU 40 7.245 2.693 11.376 310 H ALA 41 HN ALA 41 5.687 7.975 8.927 311 HA ALA 41 HA ALA 41 4.474 6.127 7.200 312 HB1 ALA 41 HB1 ALA 41 3.897 9.075 7.418 313 HB2 ALA 41 HB2 ALA 41 3.265 7.837 8.503 314 HB3 ALA 41 HB3 ALA 41 2.812 7.832 6.798 315 H VAL 42 HN VAL 42 6.386 9.023 6.535 316 HA VAL 42 HA VAL 42 5.985 8.961 3.703 317 HB VAL 42 HB VAL 42 8.338 10.286 5.030 318 HG11 VAL 42 HG11 VAL 42 8.386 10.396 2.665 319 HG12 VAL 42 HG12 VAL 42 7.854 11.979 3.229 320 HG13 VAL 42 HG13 VAL 42 6.682 10.836 2.578 321 HG21 VAL 42 HG21 VAL 42 6.997 12.222 5.537 322 HG22 VAL 42 HG22 VAL 42 6.292 10.815 6.334 323 HG23 VAL 42 HG23 VAL 42 5.561 11.453 4.862 324 H PHE 43 HN PHE 43 8.509 7.885 5.910 325 HA PHE 43 HA PHE 43 10.381 7.013 4.005 326 HB2 PHE 43 HB2 PHE 43 10.857 7.359 6.429 327 HB3 PHE 43 HB1 PHE 43 9.916 5.918 6.788 328 HD1 PHE 43 HD1 PHE 43 12.785 6.999 4.680 329 HD2 PHE 43 HD2 PHE 43 11.023 3.918 7.025 330 HE1 PHE 43 HE1 PHE 43 14.805 5.622 4.382 331 HE2 PHE 43 HE2 PHE 43 13.035 2.535 6.730 332 HZ PHE 43 HZ PHE 43 14.929 3.389 5.408 333 H TYR 44 HN TYR 44 7.745 5.323 5.662 334 HA TYR 44 HA TYR 44 8.224 2.752 4.661 335 HB2 TYR 44 HB2 TYR 44 6.242 4.044 6.222 336 HB3 TYR 44 HB1 TYR 44 5.403 3.200 4.928 337 HD1 TYR 44 HD1 TYR 44 5.516 0.754 4.756 338 HD2 TYR 44 HD2 TYR 44 7.402 2.830 7.961 339 HE1 TYR 44 HE1 TYR 44 5.695 -1.351 6.005 340 HE2 TYR 44 HE2 TYR 44 7.585 0.722 9.222 341 HH TYR 44 HH TYR 44 6.542 -1.462 9.316 342 H SER 45 HN SER 45 6.318 5.424 3.368 343 HA SER 45 HA SER 45 5.118 4.072 1.229 344 HB2 SER 45 HB2 SER 45 5.879 6.995 1.390 345 HB3 SER 45 HB1 SER 45 4.674 6.292 0.312 346 HG SER 45 HG SER 45 4.590 6.518 3.139 347 H ALA 46 HN ALA 46 8.193 5.814 1.444 348 HA ALA 46 HA ALA 46 8.819 5.542 -1.324 349 HB1 ALA 46 HB1 ALA 46 9.781 7.320 0.023 350 HB2 ALA 46 HB2 ALA 46 11.051 6.311 -0.662 351 HB3 ALA 46 HB3 ALA 46 10.603 6.134 1.033 352 H ALA 47 HN ALA 47 9.741 3.777 1.612 353 HA ALA 47 HA ALA 47 11.576 2.018 0.441 354 HB1 ALA 47 HB1 ALA 47 11.244 2.395 2.886 355 HB2 ALA 47 HB2 ALA 47 11.369 0.699 2.420 356 HB3 ALA 47 HB3 ALA 47 9.792 1.398 2.787 357 H ASP 48 HN ASP 48 8.097 1.730 0.937 358 HA ASP 48 HA ASP 48 7.739 -0.888 0.027 359 HB2 ASP 48 HB2 ASP 48 6.064 0.607 1.223 360 HB3 ASP 48 HB1 ASP 48 5.777 1.382 -0.329 361 H HIS 49 HN HIS 49 7.616 2.192 -1.727 362 HA HIS 49 HA HIS 49 6.989 1.056 -4.254 363 HB2 HIS 49 HB2 HIS 49 6.704 3.496 -3.507 364 HB3 HIS 49 HB1 HIS 49 8.418 3.686 -3.843 365 HD1 HIS 49 HD1 HIS 49 5.115 3.749 -5.437 366 HD2 HIS 49 HD2 HIS 49 9.084 3.287 -6.650 367 HE1 HIS 49 HE1 HIS 49 5.125 4.145 -7.923 368 HE2 HIS 49 HE2 HIS 49 7.557 4.068 -8.593 369 H ARG 50 HN ARG 50 10.015 1.812 -2.616 370 HA ARG 50 HA ARG 50 11.692 1.374 -4.883 371 HB2 ARG 50 HB2 ARG 50 12.569 2.738 -3.159 372 HB3 ARG 50 HB1 ARG 50 12.204 1.548 -1.920 373 HG2 ARG 50 HG2 ARG 50 14.582 1.626 -2.332 374 HG3 ARG 50 HG1 ARG 50 13.925 0.072 -2.842 375 HD2 ARG 50 HD2 ARG 50 13.905 0.842 -5.167 376 HD3 ARG 50 HD1 ARG 50 14.567 2.396 -4.657 377 HE ARG 50 HE ARG 50 16.429 0.789 -3.715 378 HH11 ARG 50 HH11 ARG 50 14.840 0.766 -6.849 379 HH12 ARG 50 HH12 ARG 50 16.159 -0.045 -7.632 380 HH21 ARG 50 HH21 ARG 50 18.166 -0.237 -4.762 381 HH22 ARG 50 HH22 ARG 50 18.048 -0.623 -6.450 382 H LEU 51 HN LEU 51 10.644 -0.643 -2.170 383 HA LEU 51 HA LEU 51 12.293 -2.852 -2.685 384 HB2 LEU 51 HB2 LEU 51 11.001 -2.528 -0.601 385 HB3 LEU 51 HB1 LEU 51 9.520 -2.839 -1.483 386 HG LEU 51 HG LEU 51 10.466 -5.139 -2.018 387 HD11 LEU 51 HD11 LEU 51 12.335 -4.553 0.266 388 HD12 LEU 51 HD12 LEU 51 12.825 -4.441 -1.426 389 HD13 LEU 51 HD13 LEU 51 12.281 -5.984 -0.766 390 HD21 LEU 51 HD21 LEU 51 8.737 -4.734 -0.321 391 HD22 LEU 51 HD22 LEU 51 9.997 -4.464 0.881 392 HD23 LEU 51 HD23 LEU 51 9.817 -6.051 0.135 393 H ALA 52 HN ALA 52 9.265 -1.833 -4.098 394 HA ALA 52 HA ALA 52 8.504 -4.207 -5.360 395 HB1 ALA 52 HB1 ALA 52 7.159 -2.772 -6.838 396 HB2 ALA 52 HB2 ALA 52 8.014 -1.359 -6.223 397 HB3 ALA 52 HB3 ALA 52 7.001 -2.314 -5.143 398 H GLU 53 HN GLU 53 10.215 -1.424 -6.796 399 HA GLU 53 HA GLU 53 10.751 -2.741 -9.245 400 HB2 GLU 53 HB2 GLU 53 12.397 -0.845 -9.584 401 HB3 GLU 53 HB1 GLU 53 10.729 -0.372 -9.295 402 HG2 GLU 53 HG2 GLU 53 11.201 0.278 -7.072 403 HG3 GLU 53 HG1 GLU 53 12.801 -0.462 -7.126 404 H LEU 54 HN LEU 54 12.476 -2.544 -6.212 405 HA LEU 54 HA LEU 54 14.996 -3.417 -7.144 406 HB2 LEU 54 HB2 LEU 54 14.482 -2.323 -4.925 407 HB3 LEU 54 HB1 LEU 54 13.837 -3.863 -4.394 408 HG LEU 54 HG LEU 54 15.965 -4.888 -4.412 409 HD11 LEU 54 HD11 LEU 54 17.993 -3.731 -5.268 410 HD12 LEU 54 HD12 LEU 54 16.944 -2.479 -5.937 411 HD13 LEU 54 HD13 LEU 54 16.822 -4.137 -6.522 412 HD21 LEU 54 HD21 LEU 54 15.708 -3.524 -2.486 413 HD22 LEU 54 HD22 LEU 54 16.145 -2.068 -3.379 414 HD23 LEU 54 HD23 LEU 54 17.363 -3.303 -3.059 415 H THR 55 HN THR 55 12.194 -5.149 -5.824 416 HA THR 55 HA THR 55 13.407 -7.720 -5.926 417 HB THR 55 HB THR 55 10.447 -7.121 -5.962 418 HG1 THR 55 HG1 THR 55 11.262 -6.028 -4.199 419 HG21 THR 55 HG21 THR 55 10.229 -9.264 -4.850 420 HG22 THR 55 HG22 THR 55 11.980 -9.462 -4.827 421 HG23 THR 55 HG23 THR 55 11.117 -9.474 -6.362 422 H MET 56 HN MET 56 11.554 -5.783 -8.172 423 HA MET 56 HA MET 56 11.132 -7.922 -10.042 424 HB2 MET 56 HB2 MET 56 10.642 -4.963 -10.104 425 HB3 MET 56 HB1 MET 56 10.465 -5.940 -11.555 426 HG2 MET 56 HG2 MET 56 8.978 -6.336 -8.968 427 HG3 MET 56 HG1 MET 56 8.334 -5.596 -10.433 428 HE1 MET 56 HE1 MET 56 8.846 -7.196 -12.881 429 HE2 MET 56 HE2 MET 56 7.238 -6.809 -12.283 430 HE3 MET 56 HE3 MET 56 7.614 -8.453 -12.794 431 H ASN 57 HN ASN 57 13.794 -6.154 -9.234 432 HA ASN 57 HA ASN 57 15.838 -5.816 -10.134 433 HB2 ASN 57 HB2 ASN 57 15.495 -8.303 -10.576 434 HB3 ASN 57 HB1 ASN 57 15.121 -7.852 -12.236 435 HD21 ASN 57 HD21 ASN 57 16.876 -8.882 -13.109 436 HD22 ASN 57 HD22 ASN 57 18.500 -8.328 -12.880 437 H LYS 58 HN LYS 58 13.767 -4.084 -10.998 438 HA LYS 58 HA LYS 58 15.071 -2.894 -13.244 439 HB2 LYS 58 HB2 LYS 58 13.655 -4.616 -14.375 440 HB3 LYS 58 HB1 LYS 58 12.233 -3.855 -13.676 441 HG2 LYS 58 HG2 LYS 58 12.325 -3.005 -15.842 442 HG3 LYS 58 HG1 LYS 58 13.029 -1.722 -14.853 443 HD2 LYS 58 HD2 LYS 58 14.499 -1.890 -16.654 444 HD3 LYS 58 HD1 LYS 58 15.290 -2.846 -15.400 445 HE2 LYS 58 HE2 LYS 58 15.432 -4.122 -17.384 446 HE3 LYS 58 HE1 LYS 58 14.171 -4.872 -16.403 447 HZ1 LYS 58 HZ1 LYS 58 12.568 -3.478 -17.752 448 HZ2 LYS 58 HZ2 LYS 58 13.311 -4.757 -18.562 449 HZ3 LYS 58 HZ3 LYS 58 13.851 -3.174 -18.811 450 H LEU 59 HN LEU 59 14.839 -0.754 -13.097 451 HA LEU 59 HA LEU 59 13.272 0.329 -10.972 452 HB2 LEU 59 HB2 LEU 59 15.223 1.368 -12.942 453 HB3 LEU 59 HB1 LEU 59 14.079 2.525 -12.292 454 HG LEU 59 HG LEU 59 14.833 1.921 -9.998 455 HD11 LEU 59 HD11 LEU 59 17.040 0.742 -9.838 456 HD12 LEU 59 HD12 LEU 59 16.815 0.242 -11.515 457 HD13 LEU 59 HD13 LEU 59 15.672 -0.280 -10.277 458 HD21 LEU 59 HD21 LEU 59 15.740 3.873 -11.111 459 HD22 LEU 59 HD22 LEU 59 16.958 2.880 -11.908 460 HD23 LEU 59 HD23 LEU 59 16.999 3.089 -10.159 461 H TYR 60 HN TYR 60 11.329 1.219 -11.012 462 HA TYR 60 HA TYR 60 10.097 1.891 -13.609 463 HB2 TYR 60 HB2 TYR 60 8.738 0.452 -11.320 464 HB3 TYR 60 HB1 TYR 60 7.941 1.004 -12.782 465 HD1 TYR 60 HD1 TYR 60 9.365 0.070 -15.011 466 HD2 TYR 60 HD2 TYR 60 9.002 -1.799 -11.200 467 HE1 TYR 60 HE1 TYR 60 9.778 -2.129 -16.051 468 HE2 TYR 60 HE2 TYR 60 9.418 -3.993 -12.220 469 HH TYR 60 HH TYR 60 9.043 -4.953 -14.707 470 H ASP 61 HN ASP 61 9.124 3.868 -13.605 471 HA ASP 61 HA ASP 61 9.369 5.577 -11.356 472 HB2 ASP 61 HB2 ASP 61 7.898 5.798 -13.980 473 HB3 ASP 61 HB1 ASP 61 7.716 7.031 -12.737 474 H LYS 62 HN LYS 62 6.601 4.048 -12.921 475 HA LYS 62 HA LYS 62 5.104 4.262 -10.392 476 HB2 LYS 62 HB2 LYS 62 3.049 4.073 -11.751 477 HB3 LYS 62 HB1 LYS 62 3.995 5.484 -12.207 478 HG2 LYS 62 HG2 LYS 62 4.400 4.705 -14.277 479 HG3 LYS 62 HG1 LYS 62 4.538 3.033 -13.739 480 HD2 LYS 62 HD2 LYS 62 2.058 3.006 -13.443 481 HD3 LYS 62 HD1 LYS 62 2.004 4.595 -14.200 482 HE2 LYS 62 HE2 LYS 62 3.174 3.593 -16.168 483 HE3 LYS 62 HE1 LYS 62 2.943 2.017 -15.421 484 HZ1 LYS 62 HZ1 LYS 62 0.640 2.172 -15.633 485 HZ2 LYS 62 HZ2 LYS 62 1.225 2.759 -17.110 486 HZ3 LYS 62 HZ3 LYS 62 0.676 3.835 -15.930 487 H ILE 63 HN ILE 63 4.114 2.358 -9.623 488 HA ILE 63 HA ILE 63 5.214 -0.082 -10.822 489 HB ILE 63 HB ILE 63 4.072 0.311 -8.053 490 HG12 ILE 63 HG12 ILE 63 6.211 1.515 -8.434 491 HG13 ILE 63 HG11 ILE 63 6.361 0.222 -7.250 492 HG21 ILE 63 HG21 ILE 63 3.837 -1.980 -8.948 493 HG22 ILE 63 HG22 ILE 63 4.917 -1.897 -7.556 494 HG23 ILE 63 HG23 ILE 63 5.582 -2.042 -9.183 495 HD11 ILE 63 HD11 ILE 63 7.428 -1.191 -8.872 496 HD12 ILE 63 HD12 ILE 63 8.262 0.359 -8.807 497 HD13 ILE 63 HD13 ILE 63 7.164 0.004 -10.140 498 HA PRO 64 HA PRO 64 1.078 -0.827 -12.393 499 HB2 PRO 64 HB2 PRO 64 2.238 -3.507 -12.914 500 HB3 PRO 64 HB1 PRO 64 1.465 -2.376 -14.038 501 HG2 PRO 64 HG2 PRO 64 4.085 -2.769 -14.080 502 HG3 PRO 64 HG1 PRO 64 3.381 -1.166 -14.371 503 HD2 PRO 64 HD2 PRO 64 4.722 -2.223 -11.922 504 HD3 PRO 64 HD1 PRO 64 4.804 -0.606 -12.650 505 H SER 65 HN SER 65 -0.718 -1.826 -11.665 506 HA SER 65 HA SER 65 -0.981 -2.608 -9.070 507 HB2 SER 65 HB2 SER 65 -2.871 -3.842 -10.991 508 HB3 SER 65 HB1 SER 65 -3.187 -2.874 -9.545 509 HG SER 65 HG SER 65 -2.561 -1.013 -10.721 510 H SER 66 H SER 66 -0.722 -4.858 -11.853 511 HA SER 66 HA SER 66 -0.982 -7.186 -10.150 512 HB2 SER 66 3HB SER 66 -0.561 -8.500 -12.191 513 HB3 SER 66 2HB SER 66 -1.709 -7.229 -12.576 514 HG SER 66 HG SER 66 0.063 -6.019 -13.455 515 H VAL 67 HN VAL 67 1.585 -5.078 -10.580 516 HA VAL 67 HA VAL 67 3.656 -7.092 -10.481 517 HB VAL 67 HB VAL 67 3.706 -4.083 -10.419 518 HG11 VAL 67 HG11 VAL 67 6.116 -5.892 -10.239 519 HG12 VAL 67 HG12 VAL 67 5.476 -4.929 -8.908 520 HG13 VAL 67 HG13 VAL 67 6.125 -4.132 -10.340 521 HG21 VAL 67 HG21 VAL 67 3.333 -5.215 -12.570 522 HG22 VAL 67 HG22 VAL 67 4.845 -6.094 -12.355 523 HG23 VAL 67 HG23 VAL 67 4.863 -4.341 -12.537 524 H TRP 68 HN TRP 68 1.846 -5.136 -8.238 525 HA TRP 68 HA TRP 68 3.556 -5.219 -6.020 526 HB2 TRP 68 HB2 TRP 68 0.530 -5.206 -6.092 527 HB3 TRP 68 HB1 TRP 68 1.502 -4.890 -4.660 528 HD1 TRP 68 HD1 TRP 68 -0.063 -3.175 -7.554 529 HE1 TRP 68 HE1 TRP 68 0.624 -0.688 -7.615 530 HE3 TRP 68 HE3 TRP 68 3.746 -3.318 -4.143 531 HZ2 TRP 68 HZ2 TRP 68 2.534 0.976 -6.375 532 HZ3 TRP 68 HZ3 TRP 68 4.952 -1.237 -3.643 533 HH2 TRP 68 HH2 TRP 68 4.355 0.867 -4.736 534 H LYS 69 HN LYS 69 1.720 -7.671 -7.513 535 HA LYS 69 HA LYS 69 1.276 -9.444 -5.379 536 HB2 LYS 69 HB2 LYS 69 0.104 -9.737 -7.455 537 HB3 LYS 69 HB1 LYS 69 1.611 -9.895 -8.345 538 HG2 LYS 69 HG2 LYS 69 0.783 -12.072 -8.194 539 HG3 LYS 69 HG1 LYS 69 2.029 -11.987 -6.947 540 HD2 LYS 69 HD2 LYS 69 0.223 -13.074 -5.909 541 HD3 LYS 69 HD1 LYS 69 0.125 -11.406 -5.341 542 HE2 LYS 69 HE2 LYS 69 -2.073 -12.227 -5.948 543 HE3 LYS 69 HE1 LYS 69 -1.574 -10.933 -7.033 544 HZ1 LYS 69 HZ1 LYS 69 -1.332 -12.370 -8.793 545 HZ2 LYS 69 HZ2 LYS 69 -2.628 -13.100 -7.964 546 HZ3 LYS 69 HZ3 LYS 69 -1.062 -13.719 -7.798 547 H PHE 70 HN PHE 70 4.142 -8.732 -7.226 548 HA PHE 70 HA PHE 70 5.478 -11.171 -6.373 549 HB2 PHE 70 HB2 PHE 70 6.611 -8.845 -7.932 550 HB3 PHE 70 HB1 PHE 70 7.310 -10.453 -7.773 551 HD1 PHE 70 HD1 PHE 70 5.541 -12.383 -8.457 552 HD2 PHE 70 HD2 PHE 70 5.590 -8.392 -9.932 553 HE1 PHE 70 HE1 PHE 70 4.314 -13.111 -10.455 554 HE2 PHE 70 HE2 PHE 70 4.362 -9.118 -11.937 555 HZ PHE 70 HZ PHE 70 3.718 -11.481 -12.198 556 H ILE 71 HN ILE 71 4.715 -8.525 -4.768 557 HA ILE 71 HA ILE 71 7.338 -8.135 -3.513 558 HB ILE 71 HB ILE 71 4.835 -6.487 -3.577 559 HG12 ILE 71 HG12 ILE 71 6.554 -4.685 -4.002 560 HG13 ILE 71 HG11 ILE 71 7.775 -5.950 -4.036 561 HG21 ILE 71 HG21 ILE 71 5.971 -5.004 -1.839 562 HG22 ILE 71 HG22 ILE 71 6.944 -6.417 -1.437 563 HG23 ILE 71 HG23 ILE 71 5.189 -6.473 -1.250 564 HD11 ILE 71 HD11 ILE 71 6.402 -7.002 -5.901 565 HD12 ILE 71 HD12 ILE 71 7.256 -5.505 -6.276 566 HD13 ILE 71 HD13 ILE 71 5.524 -5.474 -5.955 567 H ARG 72 HN ARG 72 7.773 -8.906 -1.544 568 HA ARG 72 HA ARG 72 5.609 -10.300 -0.135 569 HB2 ARG 72 HB2 ARG 72 8.580 -10.722 0.207 570 HB3 ARG 72 HB1 ARG 72 7.279 -11.751 0.792 571 HG2 ARG 72 HG2 ARG 72 6.669 -12.254 -1.542 572 HG3 ARG 72 HG1 ARG 72 8.040 -11.290 -2.082 573 HD2 ARG 72 HD2 ARG 72 8.812 -13.499 -2.127 574 HD3 ARG 72 HD1 ARG 72 9.471 -12.820 -0.640 575 HE ARG 72 HE ARG 72 6.977 -14.104 -0.181 576 HH11 ARG 72 HH11 ARG 72 10.381 -14.719 -0.693 577 HH12 ARG 72 HH12 ARG 72 10.370 -16.235 0.151 578 HH21 ARG 72 HH21 ARG 72 6.947 -16.093 0.950 579 HH22 ARG 72 HH22 ARG 72 8.410 -17.018 1.088 580 H GLU 3 HN GLU 3 -5.604 7.325 10.313 581 HA GLU 3 HA GLU 3 -3.038 6.089 10.943 582 HB2 GLU 3 HB2 GLU 3 -4.160 4.992 12.755 583 HB3 GLU 3 HB1 GLU 3 -4.648 6.679 12.770 584 HG2 GLU 3 HG2 GLU 3 -6.303 4.483 11.547 585 HG3 GLU 3 HG1 GLU 3 -6.468 5.011 13.221 586 H ALA 4 HN ALA 4 -6.133 5.393 9.443 587 HA ALA 4 HA ALA 4 -5.629 2.620 9.008 588 HB1 ALA 4 HB1 ALA 4 -7.572 4.416 7.557 589 HB2 ALA 4 HB2 ALA 4 -7.901 3.601 9.087 590 HB3 ALA 4 HB3 ALA 4 -7.608 2.654 7.625 591 H LEU 5 HN LEU 5 -5.338 5.526 7.030 592 HA LEU 5 HA LEU 5 -4.505 4.167 4.674 593 HB2 LEU 5 HB2 LEU 5 -4.632 6.990 5.593 594 HB3 LEU 5 HB1 LEU 5 -3.587 6.629 4.235 595 HG LEU 5 HG LEU 5 -5.495 5.725 2.996 596 HD11 LEU 5 HD11 LEU 5 -7.787 6.155 3.898 597 HD12 LEU 5 HD12 LEU 5 -7.038 6.451 5.467 598 HD13 LEU 5 HD13 LEU 5 -6.891 4.869 4.704 599 HD21 LEU 5 HD21 LEU 5 -5.860 8.496 4.110 600 HD22 LEU 5 HD22 LEU 5 -6.748 7.858 2.729 601 HD23 LEU 5 HD23 LEU 5 -4.997 8.030 2.644 602 H LYS 6 HN LYS 6 -2.950 4.774 7.586 603 HA LYS 6 HA LYS 6 -0.287 5.208 6.639 604 HB2 LYS 6 HB2 LYS 6 -0.847 5.968 8.843 605 HB3 LYS 6 HB1 LYS 6 -1.417 4.375 9.308 606 HG2 LYS 6 HG2 LYS 6 0.938 3.554 9.017 607 HG3 LYS 6 HG1 LYS 6 1.422 5.239 8.830 608 HD2 LYS 6 HD2 LYS 6 1.762 4.527 11.124 609 HD3 LYS 6 HD1 LYS 6 0.484 5.736 11.055 610 HE2 LYS 6 HE2 LYS 6 -1.205 3.994 11.233 611 HE3 LYS 6 HE1 LYS 6 0.045 2.751 11.180 612 HZ1 LYS 6 HZ1 LYS 6 0.891 3.516 13.270 613 HZ2 LYS 6 HZ2 LYS 6 -0.762 3.219 13.437 614 HZ3 LYS 6 HZ3 LYS 6 -0.199 4.809 13.309 615 H ILE 7 HN ILE 7 -2.114 2.401 7.783 616 HA ILE 7 HA ILE 7 0.148 0.640 7.251 617 HB ILE 7 HB ILE 7 -1.401 -1.155 8.108 618 HG12 ILE 7 HG12 ILE 7 -3.116 1.241 8.814 619 HG13 ILE 7 HG11 ILE 7 -3.527 -0.004 7.635 620 HG21 ILE 7 HG21 ILE 7 -1.150 -0.464 10.447 621 HG22 ILE 7 HG22 ILE 7 -0.808 1.184 9.921 622 HG23 ILE 7 HG23 ILE 7 0.298 -0.124 9.502 623 HD11 ILE 7 HD11 ILE 7 -4.713 -0.342 9.723 624 HD12 ILE 7 HD12 ILE 7 -3.185 -0.413 10.598 625 HD13 ILE 7 HD13 ILE 7 -3.588 -1.668 9.425 626 H LEU 8 HN LEU 8 -2.670 1.753 5.710 627 HA LEU 8 HA LEU 8 -3.168 -0.516 4.046 628 HB2 LEU 8 HB2 LEU 8 -4.376 2.008 4.563 629 HB3 LEU 8 HB1 LEU 8 -4.111 1.889 2.833 630 HG LEU 8 HG LEU 8 -5.315 -0.315 2.881 631 HD11 LEU 8 HD11 LEU 8 -4.952 -0.675 5.347 632 HD12 LEU 8 HD12 LEU 8 -6.604 -0.939 4.787 633 HD13 LEU 8 HD13 LEU 8 -6.188 0.551 5.633 634 HD21 LEU 8 HD21 LEU 8 -6.385 1.789 2.187 635 HD22 LEU 8 HD22 LEU 8 -6.873 2.078 3.855 636 HD23 LEU 8 HD23 LEU 8 -7.519 0.693 2.972 637 H ASN 9 HN ASN 9 -0.805 1.930 4.003 638 HA ASN 9 HA ASN 9 -0.442 1.798 1.119 639 HB2 ASN 9 HB2 ASN 9 -0.181 3.927 2.571 640 HB3 ASN 9 HB1 ASN 9 1.401 3.268 2.981 641 HD21 ASN 9 HD21 ASN 9 2.343 5.097 1.939 642 HD22 ASN 9 HD22 ASN 9 2.452 5.162 0.216 643 H ASN 10 HN ASN 10 0.205 -0.392 3.267 644 HA ASN 10 HA ASN 10 2.691 -1.186 1.947 645 HB2 ASN 10 HB2 ASN 10 3.448 -0.204 4.038 646 HB3 ASN 10 HB1 ASN 10 2.303 -1.182 4.950 647 HD21 ASN 10 HD21 ASN 10 4.676 -1.858 2.365 648 HD22 ASN 10 HD22 ASN 10 5.463 -3.144 3.226 649 H ILE 11 HN ILE 11 2.528 -3.157 1.202 650 HA ILE 11 HA ILE 11 0.233 -4.749 1.529 651 HB ILE 11 HB ILE 11 2.931 -5.601 0.487 652 HG12 ILE 11 HG12 ILE 11 0.566 -4.618 -1.103 653 HG13 ILE 11 HG11 ILE 11 1.860 -3.545 -0.572 654 HG21 ILE 11 HG21 ILE 11 1.603 -7.534 0.881 655 HG22 ILE 11 HG22 ILE 11 1.528 -7.210 -0.851 656 HG23 ILE 11 HG23 ILE 11 0.170 -6.775 0.189 657 HD11 ILE 11 HD11 ILE 11 2.190 -4.235 -2.860 658 HD12 ILE 11 HD12 ILE 11 2.151 -5.933 -2.382 659 HD13 ILE 11 HD13 ILE 11 3.467 -4.890 -1.836 660 H ARG 12 HN ARG 12 3.388 -4.888 3.107 661 HA ARG 12 HA ARG 12 3.174 -7.446 4.227 662 HB2 ARG 12 HB2 ARG 12 4.680 -5.005 5.149 663 HB3 ARG 12 HB1 ARG 12 4.806 -6.565 5.949 664 HG2 ARG 12 HG2 ARG 12 5.507 -7.542 3.764 665 HG3 ARG 12 HG1 ARG 12 5.561 -5.902 3.117 666 HD2 ARG 12 HD2 ARG 12 7.297 -5.283 4.602 667 HD3 ARG 12 HD1 ARG 12 7.095 -6.748 5.560 668 HE ARG 12 HE ARG 12 7.718 -7.574 2.986 669 HH11 ARG 12 HH11 ARG 12 9.261 -5.662 5.499 670 HH12 ARG 12 HH12 ARG 12 10.874 -6.128 5.033 671 HH21 ARG 12 HH21 ARG 12 9.821 -8.168 2.391 672 HH22 ARG 12 HH22 ARG 12 11.196 -7.534 3.269 673 H THR 13 HN THR 13 2.347 -4.291 5.720 674 HA THR 13 HA THR 13 1.314 -5.464 8.085 675 HB THR 13 HB THR 13 0.021 -3.119 8.058 676 HG1 THR 13 HG1 THR 13 0.546 -2.115 6.252 677 HG21 THR 13 HG21 THR 13 2.036 -2.115 9.099 678 HG22 THR 13 HG22 THR 13 2.977 -3.496 8.538 679 HG23 THR 13 HG23 THR 13 1.682 -3.729 9.709 680 H LEU 14 HN LEU 14 -0.148 -4.412 5.056 681 HA LEU 14 HA LEU 14 -2.837 -4.674 5.730 682 HB2 LEU 14 HB2 LEU 14 -1.792 -3.668 3.640 683 HB3 LEU 14 HB1 LEU 14 -1.682 -5.303 3.020 684 HG LEU 14 HG LEU 14 -4.057 -5.527 2.944 685 HD11 LEU 14 HD11 LEU 14 -4.026 -3.099 4.666 686 HD12 LEU 14 HD12 LEU 14 -4.973 -4.579 4.817 687 HD13 LEU 14 HD13 LEU 14 -5.402 -3.377 3.600 688 HD21 LEU 14 HD21 LEU 14 -3.070 -2.889 1.901 689 HD22 LEU 14 HD22 LEU 14 -4.675 -3.517 1.537 690 HD23 LEU 14 HD23 LEU 14 -3.241 -4.413 1.032 691 H ARG 15 HN ARG 15 -0.580 -7.084 4.439 692 HA ARG 15 HA ARG 15 -2.396 -9.186 4.092 693 HB2 ARG 15 HB2 ARG 15 0.556 -9.015 4.516 694 HB3 ARG 15 HB1 ARG 15 -0.215 -10.587 4.668 695 HG2 ARG 15 HG2 ARG 15 -1.207 -10.124 2.362 696 HG3 ARG 15 HG1 ARG 15 -0.026 -8.815 2.257 697 HD2 ARG 15 HD2 ARG 15 1.737 -10.526 2.822 698 HD3 ARG 15 HD1 ARG 15 0.505 -11.761 2.586 699 HE ARG 15 HE ARG 15 0.390 -11.146 0.268 700 HH11 ARG 15 HH11 ARG 15 3.067 -9.764 2.074 701 HH12 ARG 15 HH12 ARG 15 3.995 -9.376 0.663 702 HH21 ARG 15 HH21 ARG 15 1.626 -10.676 -1.601 703 HH22 ARG 15 HH22 ARG 15 3.175 -9.881 -1.430 704 H ALA 16 HN ALA 16 -0.693 -8.064 6.951 705 HA ALA 16 HA ALA 16 -1.384 -10.324 8.572 706 HB1 ALA 16 HB1 ALA 16 0.627 -9.117 9.075 707 HB2 ALA 16 HB2 ALA 16 -0.489 -8.948 10.433 708 HB3 ALA 16 HB3 ALA 16 -0.279 -7.618 9.295 709 H GLN 17 HN GLN 17 -2.573 -6.954 8.393 710 HA GLN 17 HA GLN 17 -4.478 -7.319 10.468 711 HB2 GLN 17 HB2 GLN 17 -4.019 -5.222 8.392 712 HB3 GLN 17 HB1 GLN 17 -5.537 -5.222 9.280 713 HG2 GLN 17 HG2 GLN 17 -4.200 -3.782 10.502 714 HG3 GLN 17 HG1 GLN 17 -4.072 -5.299 11.387 715 HE21 GLN 17 HE21 GLN 17 -2.121 -6.425 11.369 716 HE22 GLN 17 HE22 GLN 17 -0.644 -5.705 10.828 717 H ALA 18 HN ALA 18 -4.531 -7.957 7.052 718 HA ALA 18 HA ALA 18 -7.365 -8.152 6.808 719 HB1 ALA 18 HB1 ALA 18 -5.124 -9.184 5.085 720 HB2 ALA 18 HB2 ALA 18 -6.110 -7.746 4.830 721 HB3 ALA 18 HB3 ALA 18 -6.828 -9.348 4.670 722 H ARG 19 HN ARG 19 -5.165 -10.088 8.404 723 HA ARG 19 HA ARG 19 -6.309 -12.649 7.804 724 HB2 ARG 19 HB2 ARG 19 -4.520 -11.806 10.096 725 HB3 ARG 19 HB1 ARG 19 -4.937 -13.464 9.693 726 HG2 ARG 19 HG2 ARG 19 -3.549 -11.650 7.756 727 HG3 ARG 19 HG1 ARG 19 -2.676 -12.633 8.930 728 HD2 ARG 19 HD2 ARG 19 -4.644 -13.745 6.940 729 HD3 ARG 19 HD1 ARG 19 -2.909 -13.646 6.645 730 HE ARG 19 HE ARG 19 -3.300 -14.973 9.077 731 HH11 ARG 19 HH11 ARG 19 -3.884 -15.478 5.669 732 HH12 ARG 19 HH12 ARG 19 -3.806 -17.202 5.774 733 HH21 ARG 19 HH21 ARG 19 -3.181 -17.240 9.238 734 HH22 ARG 19 HH22 ARG 19 -3.396 -18.216 7.816 735 H GLU 20 HN GLU 20 -7.151 -10.040 9.888 736 HA GLU 20 HA GLU 20 -8.578 -11.710 11.756 737 HB2 GLU 20 HB2 GLU 20 -9.083 -9.786 12.963 738 HB3 GLU 20 HB1 GLU 20 -7.515 -9.423 12.260 739 HG2 GLU 20 HG2 GLU 20 -8.355 -7.825 10.864 740 HG3 GLU 20 HG1 GLU 20 -9.947 -8.573 10.781 741 H CYS 21 H CYS 21 -9.184 -10.614 8.676 742 HA CYS 21 HA CYS 21 -12.115 -10.936 9.057 743 HB2 CYS 21 3HB CYS 21 -12.401 -9.389 7.098 744 HB3 CYS 21 2HB CYS 21 -11.456 -8.590 8.362 745 HG CYS 21 HG CYS 21 -9.433 -8.276 7.151 746 H THR 22 HN THR 22 -13.222 -11.699 7.043 747 HA THR 22 HA THR 22 -11.732 -14.008 6.025 748 HB THR 22 HB THR 22 -14.063 -14.702 5.205 749 HG1 THR 22 HG1 THR 22 -15.335 -13.270 7.129 750 HG21 THR 22 HG21 THR 22 -13.061 -15.784 7.107 751 HG22 THR 22 HG22 THR 22 -14.749 -15.446 7.488 752 HG23 THR 22 HG23 THR 22 -13.473 -14.425 8.153 753 H LEU 23 HN LEU 23 -12.579 -14.656 3.709 754 HA LEU 23 HA LEU 23 -11.579 -12.766 1.895 755 HB2 LEU 23 HB2 LEU 23 -11.539 -15.094 1.312 756 HB3 LEU 23 HB1 LEU 23 -13.278 -15.229 1.481 757 HG LEU 23 HG LEU 23 -13.598 -13.825 -0.503 758 HD11 LEU 23 HD11 LEU 23 -10.587 -13.834 -0.687 759 HD12 LEU 23 HD12 LEU 23 -11.608 -12.438 -0.362 760 HD13 LEU 23 HD13 LEU 23 -11.688 -13.244 -1.929 761 HD21 LEU 23 HD21 LEU 23 -11.653 -16.029 -1.118 762 HD22 LEU 23 HD22 LEU 23 -12.984 -15.443 -2.117 763 HD23 LEU 23 HD23 LEU 23 -13.319 -16.317 -0.624 764 H GLU 24 HN GLU 24 -14.850 -13.581 2.880 765 HA GLU 24 HA GLU 24 -16.246 -12.033 1.019 766 HB2 GLU 24 HB2 GLU 24 -17.274 -13.742 2.465 767 HB3 GLU 24 HB1 GLU 24 -17.038 -12.695 3.857 768 HG2 GLU 24 HG2 GLU 24 -18.501 -11.018 2.807 769 HG3 GLU 24 HG1 GLU 24 -18.776 -12.135 1.470 770 H THR 25 HN THR 25 -15.063 -11.179 4.281 771 HA THR 25 HA THR 25 -16.104 -8.556 4.303 772 HB THR 25 HB THR 25 -13.536 -8.953 5.695 773 HG1 THR 25 HG1 THR 25 -15.802 -10.617 6.179 774 HG21 THR 25 HG21 THR 25 -15.062 -7.058 6.120 775 HG22 THR 25 HG22 THR 25 -14.787 -8.028 7.568 776 HG23 THR 25 HG23 THR 25 -16.296 -8.193 6.666 777 H LEU 26 HN LEU 26 -13.036 -9.902 3.168 778 HA LEU 26 HA LEU 26 -11.769 -7.445 2.606 779 HB2 LEU 26 HB2 LEU 26 -11.376 -10.208 1.471 780 HB3 LEU 26 HB1 LEU 26 -10.353 -8.848 1.051 781 HG LEU 26 HG LEU 26 -10.660 -10.117 3.771 782 HD11 LEU 26 HD11 LEU 26 -8.428 -10.008 1.759 783 HD12 LEU 26 HD12 LEU 26 -9.240 -11.430 2.419 784 HD13 LEU 26 HD13 LEU 26 -8.184 -10.460 3.448 785 HD21 LEU 26 HD21 LEU 26 -8.816 -8.491 4.383 786 HD22 LEU 26 HD22 LEU 26 -10.438 -7.821 4.226 787 HD23 LEU 26 HD23 LEU 26 -9.261 -7.596 2.932 788 H GLU 27 HN GLU 27 -13.625 -9.670 0.530 789 HA GLU 27 HA GLU 27 -13.451 -8.101 -1.804 790 HB2 GLU 27 HB2 GLU 27 -15.186 -10.339 -0.881 791 HB3 GLU 27 HB1 GLU 27 -15.758 -9.388 -2.248 792 HG2 GLU 27 HG2 GLU 27 -13.414 -9.818 -3.229 793 HG3 GLU 27 HG1 GLU 27 -13.322 -11.101 -2.019 794 H GLU 28 HN GLU 28 -15.721 -8.146 0.865 795 HA GLU 28 HA GLU 28 -17.684 -6.453 -0.164 796 HB2 GLU 28 HB2 GLU 28 -17.123 -7.735 2.268 797 HB3 GLU 28 HB1 GLU 28 -17.261 -6.030 2.665 798 HG2 GLU 28 HG2 GLU 28 -19.378 -6.965 0.900 799 HG3 GLU 28 HG1 GLU 28 -19.330 -7.810 2.446 800 H MET 29 HN MET 29 -14.800 -5.670 1.775 801 HA MET 29 HA MET 29 -15.343 -2.856 1.696 802 HB2 MET 29 HB2 MET 29 -13.187 -2.587 2.814 803 HB3 MET 29 HB1 MET 29 -14.163 -3.822 3.591 804 HG2 MET 29 HG2 MET 29 -12.326 -5.066 3.530 805 HG3 MET 29 HG1 MET 29 -12.697 -5.295 1.824 806 HE1 MET 29 HE1 MET 29 -9.473 -2.557 3.611 807 HE2 MET 29 HE2 MET 29 -10.386 -3.802 4.469 808 HE3 MET 29 HE3 MET 29 -11.178 -2.302 3.981 809 H LEU 30 HN LEU 30 -13.506 -5.052 -0.295 810 HA LEU 30 HA LEU 30 -11.799 -3.218 -1.548 811 HB2 LEU 30 HB2 LEU 30 -11.518 -5.615 -1.801 812 HB3 LEU 30 HB1 LEU 30 -13.056 -5.739 -2.631 813 HG LEU 30 HG LEU 30 -12.093 -4.300 -4.459 814 HD11 LEU 30 HD11 LEU 30 -10.292 -3.306 -3.086 815 HD12 LEU 30 HD12 LEU 30 -9.704 -4.019 -4.589 816 HD13 LEU 30 HD13 LEU 30 -9.485 -4.874 -3.061 817 HD21 LEU 30 HD21 LEU 30 -12.268 -6.742 -4.630 818 HD22 LEU 30 HD22 LEU 30 -10.667 -6.897 -3.905 819 HD23 LEU 30 HD23 LEU 30 -10.852 -6.119 -5.477 820 H GLU 31 HN GLU 31 -15.088 -4.257 -2.393 821 HA GLU 31 HA GLU 31 -15.300 -2.734 -4.761 822 HB2 GLU 31 HB2 GLU 31 -17.575 -3.543 -2.936 823 HB3 GLU 31 HB1 GLU 31 -17.666 -3.188 -4.657 824 HG2 GLU 31 HG2 GLU 31 -16.045 -5.156 -4.941 825 HG3 GLU 31 HG1 GLU 31 -16.493 -5.580 -3.291 826 H LYS 32 HN LYS 32 -15.920 -1.992 -1.390 827 HA LYS 32 HA LYS 32 -17.280 0.450 -1.796 828 HB2 LYS 32 HB2 LYS 32 -15.610 -0.379 0.583 829 HB3 LYS 32 HB1 LYS 32 -16.812 0.904 0.553 830 HG2 LYS 32 HG2 LYS 32 -18.562 -0.751 0.114 831 HG3 LYS 32 HG1 LYS 32 -17.351 -2.031 0.167 832 HD2 LYS 32 HD2 LYS 32 -16.799 -1.129 2.506 833 HD3 LYS 32 HD1 LYS 32 -18.344 -0.287 2.391 834 HE2 LYS 32 HE2 LYS 32 -17.882 -3.260 2.194 835 HE3 LYS 32 HE1 LYS 32 -18.657 -2.397 3.522 836 HZ1 LYS 32 HZ1 LYS 32 -20.504 -1.890 2.176 837 HZ2 LYS 32 HZ2 LYS 32 -20.178 -3.527 1.888 838 HZ3 LYS 32 HZ3 LYS 32 -19.718 -2.356 0.755 839 H LEU 33 HN LEU 33 -13.847 -0.290 -1.216 840 HA LEU 33 HA LEU 33 -13.079 2.452 -1.292 841 HB2 LEU 33 HB2 LEU 33 -11.782 0.563 -0.214 842 HB3 LEU 33 HB1 LEU 33 -11.292 0.086 -1.831 843 HG LEU 33 HG LEU 33 -10.188 2.261 -2.150 844 HD11 LEU 33 HD11 LEU 33 -11.112 2.792 0.670 845 HD12 LEU 33 HD12 LEU 33 -11.502 3.714 -0.780 846 HD13 LEU 33 HD13 LEU 33 -9.859 3.724 -0.146 847 HD21 LEU 33 HD21 LEU 33 -8.370 1.940 -0.498 848 HD22 LEU 33 HD22 LEU 33 -8.849 0.452 -1.318 849 HD23 LEU 33 HD23 LEU 33 -9.385 0.761 0.334 850 H GLU 34 HN GLU 34 -13.325 -0.124 -3.659 851 HA GLU 34 HA GLU 34 -11.952 1.047 -5.780 852 HB2 GLU 34 HB2 GLU 34 -12.526 -1.219 -6.029 853 HB3 GLU 34 HB1 GLU 34 -14.222 -0.927 -5.669 854 HG2 GLU 34 HG2 GLU 34 -14.707 -0.487 -7.800 855 HG3 GLU 34 HG1 GLU 34 -13.280 0.526 -8.004 856 H VAL 35 HN VAL 35 -15.433 1.230 -4.998 857 HA VAL 35 HA VAL 35 -16.077 2.937 -7.141 858 HB VAL 35 HB VAL 35 -18.160 3.471 -5.964 859 HG11 VAL 35 HG11 VAL 35 -17.382 0.563 -5.875 860 HG12 VAL 35 HG12 VAL 35 -18.063 1.436 -7.248 861 HG13 VAL 35 HG13 VAL 35 -19.036 1.173 -5.798 862 HG21 VAL 35 HG21 VAL 35 -17.109 1.802 -3.689 863 HG22 VAL 35 HG22 VAL 35 -18.680 2.604 -3.793 864 HG23 VAL 35 HG23 VAL 35 -17.204 3.564 -3.677 865 H VAL 36 HN VAL 36 -14.896 3.623 -3.900 866 HA VAL 36 HA VAL 36 -15.381 6.412 -3.984 867 HB VAL 36 HB VAL 36 -13.363 4.834 -2.382 868 HG11 VAL 36 HG11 VAL 36 -14.167 7.733 -2.136 869 HG12 VAL 36 HG12 VAL 36 -12.572 7.111 -2.549 870 HG13 VAL 36 HG13 VAL 36 -13.230 6.848 -0.938 871 HG21 VAL 36 HG21 VAL 36 -14.906 4.938 -0.600 872 HG22 VAL 36 HG22 VAL 36 -15.831 4.444 -2.021 873 HG23 VAL 36 HG23 VAL 36 -15.918 6.109 -1.445 874 H VAL 37 HN VAL 37 -12.577 4.404 -4.844 875 HA VAL 37 HA VAL 37 -10.876 6.557 -5.520 876 HB VAL 37 HB VAL 37 -10.831 3.729 -6.602 877 HG11 VAL 37 HG11 VAL 37 -8.797 5.947 -6.710 878 HG12 VAL 37 HG12 VAL 37 -9.556 5.115 -8.065 879 HG13 VAL 37 HG13 VAL 37 -8.414 4.256 -7.033 880 HG21 VAL 37 HG21 VAL 37 -9.081 3.353 -4.918 881 HG22 VAL 37 HG22 VAL 37 -10.626 3.784 -4.182 882 HG23 VAL 37 HG23 VAL 37 -9.339 4.985 -4.298 883 H ASN 38 HN ASN 38 -13.209 4.659 -7.381 884 HA ASN 38 HA ASN 38 -12.652 5.812 -9.896 885 HB2 ASN 38 HB2 ASN 38 -14.015 3.733 -9.529 886 HB3 ASN 38 HB1 ASN 38 -15.324 4.750 -8.938 887 HD21 ASN 38 HD21 ASN 38 -16.768 4.288 -10.530 888 HD22 ASN 38 HD22 ASN 38 -16.554 4.763 -12.176 889 H GLU 39 HN GLU 39 -14.933 6.647 -7.323 890 HA GLU 39 HA GLU 39 -16.189 8.810 -8.577 891 HB2 GLU 39 HB2 GLU 39 -15.745 8.040 -5.713 892 HB3 GLU 39 HB1 GLU 39 -16.482 9.589 -6.107 893 HG2 GLU 39 HG2 GLU 39 -18.320 8.552 -7.159 894 HG3 GLU 39 HG1 GLU 39 -17.527 6.979 -7.161 895 H ARG 40 HN ARG 40 -13.226 8.636 -6.649 896 HA ARG 40 HA ARG 40 -12.749 11.440 -6.649 897 HB2 ARG 40 HB2 ARG 40 -11.250 9.012 -5.877 898 HB3 ARG 40 HB1 ARG 40 -10.261 10.389 -6.337 899 HG2 ARG 40 HG2 ARG 40 -12.364 10.348 -4.187 900 HG3 ARG 40 HG1 ARG 40 -10.618 10.336 -3.947 901 HD2 ARG 40 HD2 ARG 40 -12.300 12.553 -5.102 902 HD3 ARG 40 HD1 ARG 40 -11.395 12.561 -3.590 903 HE ARG 40 HE ARG 40 -10.277 12.773 -6.299 904 HH11 ARG 40 HH11 ARG 40 -9.757 12.719 -2.828 905 HH12 ARG 40 HH12 ARG 40 -8.210 13.488 -2.917 906 HH21 ARG 40 HH21 ARG 40 -8.262 13.783 -6.434 907 HH22 ARG 40 HH22 ARG 40 -7.356 14.118 -4.982 908 H ARG 41 HN ARG 41 -11.696 8.766 -8.693 909 HA ARG 41 HA ARG 41 -9.922 10.157 -10.347 910 HB2 ARG 41 HB2 ARG 41 -11.646 7.729 -10.747 911 HB3 ARG 41 HB1 ARG 41 -10.744 8.398 -12.098 912 HG2 ARG 41 HG2 ARG 41 -8.658 8.075 -10.889 913 HG3 ARG 41 HG1 ARG 41 -9.546 7.448 -9.500 914 HD2 ARG 41 HD2 ARG 41 -10.320 5.563 -10.778 915 HD3 ARG 41 HD1 ARG 41 -9.626 6.227 -12.254 916 HE ARG 41 HE ARG 41 -7.502 5.958 -10.529 917 HH11 ARG 41 HH11 ARG 41 -9.916 3.803 -11.890 918 HH12 ARG 41 HH12 ARG 41 -8.869 2.420 -11.862 919 HH21 ARG 41 HH21 ARG 41 -6.127 4.161 -10.508 920 HH22 ARG 41 HH22 ARG 41 -6.704 2.621 -11.087 921 H GLU 42 HN GLU 42 -13.418 9.679 -10.530 922 HA GLU 42 HA GLU 42 -13.979 10.919 -12.952 923 HB2 GLU 42 HB2 GLU 42 -15.691 9.691 -11.787 924 HB3 GLU 42 HB1 GLU 42 -15.565 10.743 -10.387 925 HG2 GLU 42 HG2 GLU 42 -17.569 11.274 -11.552 926 HG3 GLU 42 HG1 GLU 42 -16.435 12.605 -11.768 927 H GLU 43 HN GLU 43 -13.804 12.342 -9.691 928 HA GLU 43 HA GLU 43 -14.377 14.990 -10.467 929 HB2 GLU 43 HB2 GLU 43 -12.842 13.923 -8.098 930 HB3 GLU 43 HB1 GLU 43 -13.298 15.609 -8.298 931 HG2 GLU 43 HG2 GLU 43 -15.682 14.345 -8.646 932 HG3 GLU 43 HG1 GLU 43 -14.896 13.322 -7.440 933 H GLU 44 HN GLU 44 -11.410 13.154 -10.306 934 HA GLU 44 HA GLU 44 -9.625 15.322 -10.680 935 HB2 GLU 44 HB2 GLU 44 -9.408 12.583 -10.181 936 HB3 GLU 44 HB1 GLU 44 -8.653 12.806 -11.751 937 HG2 GLU 44 HG2 GLU 44 -6.939 13.004 -10.149 938 HG3 GLU 44 HG1 GLU 44 -7.284 14.639 -10.713 939 H SER 45 HN SER 45 -11.060 12.970 -12.948 940 HA SER 45 HA SER 45 -9.757 14.122 -15.216 941 HB2 SER 45 HB2 SER 45 -11.566 12.681 -16.438 942 HB3 SER 45 HB1 SER 45 -10.264 11.882 -15.561 943 HG SER 45 HG SER 45 -12.982 12.132 -14.904 944 H ALA 46 HN ALA 46 -12.627 14.878 -13.491 945 HA ALA 46 HA ALA 46 -13.982 16.164 -15.657 946 HB1 ALA 46 HB1 ALA 46 -14.986 15.230 -13.478 947 HB2 ALA 46 HB2 ALA 46 -15.639 16.730 -14.132 948 HB3 ALA 46 HB3 ALA 46 -14.513 16.776 -12.776 949 H GLU 3 HN GLU 3 -10.066 -2.464 15.116 950 HA GLU 3 HA GLU 3 -11.727 -0.278 15.342 951 HB2 GLU 3 HB2 GLU 3 -9.134 0.781 15.066 952 HB3 GLU 3 HB1 GLU 3 -9.988 0.414 16.554 953 HG2 GLU 3 HG2 GLU 3 -7.849 -0.630 16.638 954 HG3 GLU 3 HG1 GLU 3 -9.059 -1.896 16.441 955 H ALA 4 HN ALA 4 -9.031 -0.442 13.007 956 HA ALA 4 HA ALA 4 -10.078 1.775 11.503 957 HB1 ALA 4 HB1 ALA 4 -7.751 -0.082 11.067 958 HB2 ALA 4 HB2 ALA 4 -7.717 1.597 11.615 959 HB3 ALA 4 HB3 ALA 4 -8.173 1.217 9.953 960 H LEU 5 HN LEU 5 -10.740 -1.526 11.516 961 HA LEU 5 HA LEU 5 -11.287 -1.796 8.693 962 HB2 LEU 5 HB2 LEU 5 -11.437 -3.542 11.088 963 HB3 LEU 5 HB1 LEU 5 -12.490 -3.941 9.750 964 HG LEU 5 HG LEU 5 -10.359 -5.208 9.744 965 HD11 LEU 5 HD11 LEU 5 -9.781 -4.742 7.363 966 HD12 LEU 5 HD12 LEU 5 -10.854 -3.345 7.430 967 HD13 LEU 5 HD13 LEU 5 -11.504 -4.966 7.664 968 HD21 LEU 5 HD21 LEU 5 -8.292 -4.053 9.086 969 HD22 LEU 5 HD22 LEU 5 -8.874 -3.527 10.665 970 HD23 LEU 5 HD23 LEU 5 -9.120 -2.505 9.249 971 H LYS 6 HN LYS 6 -13.092 -1.181 11.631 972 HA LYS 6 HA LYS 6 -15.686 -1.618 10.658 973 HB2 LYS 6 HB2 LYS 6 -14.858 -1.262 13.071 974 HB3 LYS 6 HB1 LYS 6 -15.010 0.453 12.729 975 HG2 LYS 6 HG2 LYS 6 -16.973 -0.469 13.888 976 HG3 LYS 6 HG1 LYS 6 -17.364 0.222 12.313 977 HD2 LYS 6 HD2 LYS 6 -18.079 -1.747 11.514 978 HD3 LYS 6 HD1 LYS 6 -16.698 -2.613 12.184 979 HE2 LYS 6 HE2 LYS 6 -19.008 -1.695 13.868 980 HE3 LYS 6 HE1 LYS 6 -18.979 -3.267 13.071 981 HZ1 LYS 6 HZ1 LYS 6 -16.722 -3.508 14.264 982 HZ2 LYS 6 HZ2 LYS 6 -18.143 -3.729 15.153 983 HZ3 LYS 6 HZ3 LYS 6 -17.289 -2.275 15.270 984 H ILE 7 HN ILE 7 -13.643 1.252 10.560 985 HA ILE 7 HA ILE 7 -15.756 2.901 9.505 986 HB ILE 7 HB ILE 7 -14.001 4.623 9.217 987 HG12 ILE 7 HG12 ILE 7 -12.148 2.611 10.505 988 HG13 ILE 7 HG11 ILE 7 -12.143 2.978 8.783 989 HG21 ILE 7 HG21 ILE 7 -15.151 4.662 11.260 990 HG22 ILE 7 HG22 ILE 7 -13.444 4.791 11.681 991 HG23 ILE 7 HG23 ILE 7 -14.286 3.252 11.867 992 HD11 ILE 7 HD11 ILE 7 -11.666 5.014 10.948 993 HD12 ILE 7 HD12 ILE 7 -11.489 5.241 9.206 994 HD13 ILE 7 HD13 ILE 7 -10.394 4.161 10.072 995 H LEU 8 HN LEU 8 -13.354 0.808 8.211 996 HA LEU 8 HA LEU 8 -13.269 2.018 5.601 997 HB2 LEU 8 HB2 LEU 8 -11.817 0.001 7.005 998 HB3 LEU 8 HB1 LEU 8 -12.392 -0.684 5.499 999 HG LEU 8 HG LEU 8 -10.939 1.943 5.546 1000 HD11 LEU 8 HD11 LEU 8 -9.730 -0.811 5.353 1001 HD12 LEU 8 HD12 LEU 8 -9.507 0.334 6.678 1002 HD13 LEU 8 HD13 LEU 8 -8.883 0.709 5.075 1003 HD21 LEU 8 HD21 LEU 8 -11.361 -0.192 3.460 1004 HD22 LEU 8 HD22 LEU 8 -10.377 1.257 3.242 1005 HD23 LEU 8 HD23 LEU 8 -12.116 1.401 3.505 1006 H ASN 9 HN ASN 9 -15.268 -0.229 7.247 1007 HA ASN 9 HA ASN 9 -16.375 -1.325 4.788 1008 HB2 ASN 9 HB2 ASN 9 -16.038 -2.714 6.875 1009 HB3 ASN 9 HB1 ASN 9 -17.328 -1.781 7.623 1010 HD21 ASN 9 HD21 ASN 9 -16.572 -3.926 4.936 1011 HD22 ASN 9 HD22 ASN 9 -18.175 -4.550 4.737 1012 H ASN 10 HN ASN 10 -16.618 1.524 6.192 1013 HA ASN 10 HA ASN 10 -19.511 1.789 5.688 1014 HB2 ASN 10 HB2 ASN 10 -17.794 2.806 7.843 1015 HB3 ASN 10 HB1 ASN 10 -18.826 4.035 7.119 1016 HD21 ASN 10 HD21 ASN 10 -19.739 0.666 7.233 1017 HD22 ASN 10 HD22 ASN 10 -21.014 0.853 8.399 1018 H ILE 11 HN ILE 11 -19.724 2.535 3.675 1019 HA ILE 11 HA ILE 11 -17.872 4.002 2.206 1020 HB ILE 11 HB ILE 11 -19.818 2.822 1.225 1021 HG12 ILE 11 HG12 ILE 11 -20.524 4.912 -0.271 1022 HG13 ILE 11 HG11 ILE 11 -19.154 5.640 0.556 1023 HG21 ILE 11 HG21 ILE 11 -22.013 3.944 1.169 1024 HG22 ILE 11 HG22 ILE 11 -21.408 5.128 2.325 1025 HG23 ILE 11 HG23 ILE 11 -21.540 3.434 2.789 1026 HD11 ILE 11 HD11 ILE 11 -19.066 3.096 -1.038 1027 HD12 ILE 11 HD12 ILE 11 -17.697 3.888 -0.262 1028 HD13 ILE 11 HD13 ILE 11 -18.533 4.678 -1.597 1029 H ARG 12 HN ARG 12 -20.221 5.092 4.547 1030 HA ARG 12 HA ARG 12 -20.326 7.822 3.868 1031 HB2 ARG 12 HB2 ARG 12 -20.691 6.421 6.521 1032 HB3 ARG 12 HB1 ARG 12 -21.030 8.125 6.261 1033 HG2 ARG 12 HG2 ARG 12 -22.341 5.995 4.610 1034 HG3 ARG 12 HG1 ARG 12 -22.982 6.487 6.177 1035 HD2 ARG 12 HD2 ARG 12 -23.126 8.800 5.373 1036 HD3 ARG 12 HD1 ARG 12 -22.514 8.287 3.801 1037 HE ARG 12 HE ARG 12 -24.680 6.704 4.178 1038 HH11 ARG 12 HH11 ARG 12 -24.183 10.165 4.325 1039 HH12 ARG 12 HH12 ARG 12 -25.807 10.541 3.846 1040 HH21 ARG 12 HH21 ARG 12 -26.842 7.218 3.558 1041 HH22 ARG 12 HH22 ARG 12 -27.298 8.887 3.410 1042 H THR 13 HN THR 13 -18.413 6.179 6.386 1043 HA THR 13 HA THR 13 -16.867 8.451 7.047 1044 HB THR 13 HB THR 13 -15.746 5.742 7.531 1045 HG1 THR 13 HG1 THR 13 -17.905 6.484 9.160 1046 HG21 THR 13 HG21 THR 13 -16.328 8.110 9.321 1047 HG22 THR 13 HG22 THR 13 -14.775 7.741 8.566 1048 HG23 THR 13 HG23 THR 13 -15.443 6.656 9.786 1049 H LEU 14 HN LEU 14 -16.476 5.795 4.796 1050 HA LEU 14 HA LEU 14 -13.766 6.163 4.166 1051 HB2 LEU 14 HB2 LEU 14 -15.369 4.230 3.571 1052 HB3 LEU 14 HB1 LEU 14 -15.813 5.209 2.188 1053 HG LEU 14 HG LEU 14 -13.554 5.137 1.331 1054 HD11 LEU 14 HD11 LEU 14 -11.871 3.669 2.507 1055 HD12 LEU 14 HD12 LEU 14 -12.929 3.729 3.916 1056 HD13 LEU 14 HD13 LEU 14 -12.218 5.214 3.284 1057 HD21 LEU 14 HD21 LEU 14 -15.050 3.272 0.793 1058 HD22 LEU 14 HD22 LEU 14 -14.446 2.392 2.197 1059 HD23 LEU 14 HD23 LEU 14 -13.362 2.764 0.858 1060 H ARG 15 HN ARG 15 -16.708 7.487 2.666 1061 HA ARG 15 HA ARG 15 -15.373 8.930 0.627 1062 HB2 ARG 15 HB2 ARG 15 -18.103 8.901 1.785 1063 HB3 ARG 15 HB1 ARG 15 -17.641 10.343 0.897 1064 HG2 ARG 15 HG2 ARG 15 -17.193 9.032 -1.082 1065 HG3 ARG 15 HG1 ARG 15 -17.509 7.539 -0.195 1066 HD2 ARG 15 HD2 ARG 15 -19.809 8.116 0.101 1067 HD3 ARG 15 HD1 ARG 15 -19.545 9.736 -0.531 1068 HE ARG 15 HE ARG 15 -18.814 8.019 -2.563 1069 HH11 ARG 15 HH11 ARG 15 -21.709 8.629 -0.683 1070 HH12 ARG 15 HH12 ARG 15 -22.786 8.203 -1.973 1071 HH21 ARG 15 HH21 ARG 15 -20.223 7.446 -4.255 1072 HH22 ARG 15 HH22 ARG 15 -21.944 7.545 -4.010 1073 H ALA 16 HN ALA 16 -15.577 9.473 3.971 1074 HA ALA 16 HA ALA 16 -15.260 12.359 3.763 1075 HB1 ALA 16 HB1 ALA 16 -15.292 12.341 6.203 1076 HB2 ALA 16 HB2 ALA 16 -15.280 10.579 6.196 1077 HB3 ALA 16 HB3 ALA 16 -16.665 11.450 5.549 1078 H GLN 17 HN GLN 17 -13.410 9.624 5.157 1079 HA GLN 17 HA GLN 17 -11.104 11.240 5.611 1080 HB2 GLN 17 HB2 GLN 17 -11.759 9.084 6.830 1081 HB3 GLN 17 HB1 GLN 17 -11.073 8.231 5.455 1082 HG2 GLN 17 HG2 GLN 17 -8.912 9.103 5.875 1083 HG3 GLN 17 HG1 GLN 17 -9.534 10.266 7.041 1084 HE21 GLN 17 HE21 GLN 17 -8.164 9.568 8.645 1085 HE22 GLN 17 HE22 GLN 17 -8.384 8.052 9.466 1086 H ALA 18 HN ALA 18 -12.300 9.681 2.813 1087 HA ALA 18 HA ALA 18 -9.846 9.140 1.499 1088 HB1 ALA 18 HB1 ALA 18 -12.026 8.181 0.814 1089 HB2 ALA 18 HB2 ALA 18 -11.149 8.928 -0.521 1090 HB3 ALA 18 HB3 ALA 18 -12.508 9.770 0.223 1091 H ARG 19 HN ARG 19 -11.350 12.045 2.316 1092 HA ARG 19 HA ARG 19 -10.135 13.547 0.120 1093 HB2 ARG 19 HB2 ARG 19 -11.854 14.582 2.388 1094 HB3 ARG 19 HB1 ARG 19 -11.429 15.433 0.906 1095 HG2 ARG 19 HG2 ARG 19 -12.753 13.940 -0.410 1096 HG3 ARG 19 HG1 ARG 19 -13.050 12.897 0.981 1097 HD2 ARG 19 HD2 ARG 19 -14.104 14.959 2.068 1098 HD3 ARG 19 HD1 ARG 19 -14.097 15.660 0.451 1099 HE ARG 19 HE ARG 19 -15.416 13.091 1.018 1100 HH11 ARG 19 HH11 ARG 19 -15.531 16.375 -0.213 1101 HH12 ARG 19 HH12 ARG 19 -17.095 16.179 -0.936 1102 HH21 ARG 19 HH21 ARG 19 -17.474 12.847 0.068 1103 HH22 ARG 19 HH22 ARG 19 -18.194 14.177 -0.782 1104 H GLU 20 HN GLU 20 -9.105 12.290 2.898 1105 HA GLU 20 HA GLU 20 -7.688 14.595 3.957 1106 HB2 GLU 20 HB2 GLU 20 -8.645 12.677 5.352 1107 HB3 GLU 20 HB1 GLU 20 -7.305 11.707 4.757 1108 HG2 GLU 20 HG2 GLU 20 -5.802 13.554 5.677 1109 HG3 GLU 20 HG1 GLU 20 -7.231 14.113 6.541 1110 H CYS 21 H CYS 21 -7.260 12.518 1.425 1111 HA CYS 21 HA CYS 21 -4.403 13.202 1.243 1112 HB2 CYS 21 3HB CYS 21 -5.529 10.326 0.992 1113 HB3 CYS 21 2HB CYS 21 -3.875 10.779 0.562 1114 HG CYS 21 HG CYS 21 -2.937 10.835 2.746 1115 H THR 22 HN THR 22 -3.547 12.597 -0.958 1116 HA THR 22 HA THR 22 -5.392 13.664 -2.911 1117 HB THR 22 HB THR 22 -3.156 13.258 -4.339 1118 HG1 THR 22 HG1 THR 22 -1.459 13.834 -2.623 1119 HG21 THR 22 HG21 THR 22 -4.268 15.420 -3.871 1120 HG22 THR 22 HG22 THR 22 -2.510 15.534 -3.783 1121 HG23 THR 22 HG23 THR 22 -3.464 15.466 -2.303 1122 H LEU 23 HN LEU 23 -5.198 12.660 -5.192 1123 HA LEU 23 HA LEU 23 -6.365 10.105 -5.136 1124 HB2 LEU 23 HB2 LEU 23 -6.763 11.716 -6.922 1125 HB3 LEU 23 HB1 LEU 23 -5.090 11.586 -7.432 1126 HG LEU 23 HG LEU 23 -5.566 9.115 -7.870 1127 HD11 LEU 23 HD11 LEU 23 -8.378 10.141 -7.536 1128 HD12 LEU 23 HD12 LEU 23 -7.600 8.823 -6.659 1129 HD13 LEU 23 HD13 LEU 23 -7.968 8.646 -8.373 1130 HD21 LEU 23 HD21 LEU 23 -6.257 9.551 -10.068 1131 HD22 LEU 23 HD22 LEU 23 -5.406 11.012 -9.564 1132 HD23 LEU 23 HD23 LEU 23 -7.168 10.981 -9.586 1133 H GLU 24 HN GLU 24 -3.034 11.106 -5.808 1134 HA GLU 24 HA GLU 24 -2.027 8.721 -6.801 1135 HB2 GLU 24 HB2 GLU 24 -0.783 10.877 -6.707 1136 HB3 GLU 24 HB1 GLU 24 -0.550 10.626 -4.983 1137 HG2 GLU 24 HG2 GLU 24 0.496 8.363 -5.719 1138 HG3 GLU 24 HG1 GLU 24 0.647 9.153 -7.288 1139 H THR 25 HN THR 25 -2.111 9.789 -3.395 1140 HA THR 25 HA THR 25 -0.949 7.497 -2.296 1141 HB THR 25 HB THR 25 -3.010 8.817 -0.661 1142 HG1 THR 25 HG1 THR 25 -0.781 10.426 -1.136 1143 HG21 THR 25 HG21 THR 25 -1.422 7.458 0.461 1144 HG22 THR 25 HG22 THR 25 -0.954 9.120 0.815 1145 HG23 THR 25 HG23 THR 25 -0.072 8.194 -0.399 1146 H LEU 26 HN LEU 26 -4.357 8.345 -2.847 1147 HA LEU 26 HA LEU 26 -5.499 6.061 -1.666 1148 HB2 LEU 26 HB2 LEU 26 -6.536 7.815 -3.892 1149 HB3 LEU 26 HB1 LEU 26 -7.495 6.614 -3.045 1150 HG LEU 26 HG LEU 26 -6.221 9.019 -1.734 1151 HD11 LEU 26 HD11 LEU 26 -8.988 8.550 -2.804 1152 HD12 LEU 26 HD12 LEU 26 -7.886 9.884 -3.153 1153 HD13 LEU 26 HD13 LEU 26 -8.644 9.756 -1.565 1154 HD21 LEU 26 HD21 LEU 26 -6.513 7.283 -0.133 1155 HD22 LEU 26 HD22 LEU 26 -8.126 6.913 -0.736 1156 HD23 LEU 26 HD23 LEU 26 -7.825 8.436 0.098 1157 H GLU 27 HN GLU 27 -4.387 6.709 -4.941 1158 HA GLU 27 HA GLU 27 -5.385 4.289 -6.050 1159 HB2 GLU 27 HB2 GLU 27 -4.893 6.329 -7.380 1160 HB3 GLU 27 HB1 GLU 27 -3.178 6.070 -7.088 1161 HG2 GLU 27 HG2 GLU 27 -3.081 4.221 -8.459 1162 HG3 GLU 27 HG1 GLU 27 -4.812 3.910 -8.338 1163 H GLU 28 HN GLU 28 -2.101 5.312 -5.055 1164 HA GLU 28 HA GLU 28 -0.776 2.947 -5.730 1165 HB2 GLU 28 HB2 GLU 28 0.244 5.169 -5.016 1166 HB3 GLU 28 HB1 GLU 28 -0.053 4.669 -3.358 1167 HG2 GLU 28 HG2 GLU 28 1.423 2.804 -3.585 1168 HG3 GLU 28 HG1 GLU 28 1.587 3.081 -5.317 1169 H MET 29 HN MET 29 -2.458 3.816 -2.716 1170 HA MET 29 HA MET 29 -1.713 1.349 -1.455 1171 HB2 MET 29 HB2 MET 29 -3.010 2.031 0.412 1172 HB3 MET 29 HB1 MET 29 -2.196 3.462 -0.201 1173 HG2 MET 29 HG2 MET 29 -4.238 4.192 -1.278 1174 HG3 MET 29 HG1 MET 29 -5.062 2.729 -0.739 1175 HE1 MET 29 HE1 MET 29 -3.392 6.149 0.461 1176 HE2 MET 29 HE2 MET 29 -2.434 4.853 1.175 1177 HE3 MET 29 HE3 MET 29 -3.422 5.884 2.206 1178 H LEU 30 HN LEU 30 -4.367 2.386 -3.455 1179 HA LEU 30 HA LEU 30 -6.208 0.356 -2.764 1180 HB2 LEU 30 HB2 LEU 30 -7.081 2.165 -3.994 1181 HB3 LEU 30 HB1 LEU 30 -5.845 2.033 -5.232 1182 HG LEU 30 HG LEU 30 -6.914 -0.254 -5.767 1183 HD11 LEU 30 HD11 LEU 30 -9.290 -0.419 -5.238 1184 HD12 LEU 30 HD12 LEU 30 -9.180 1.045 -4.264 1185 HD13 LEU 30 HD13 LEU 30 -8.310 -0.408 -3.773 1186 HD21 LEU 30 HD21 LEU 30 -8.821 1.011 -7.009 1187 HD22 LEU 30 HD22 LEU 30 -7.137 1.312 -7.430 1188 HD23 LEU 30 HD23 LEU 30 -8.002 2.448 -6.397 1189 H GLU 31 HN GLU 31 -3.665 0.565 -5.196 1190 HA GLU 31 HA GLU 31 -4.115 -1.895 -6.458 1191 HB2 GLU 31 HB2 GLU 31 -1.452 -0.524 -6.055 1192 HB3 GLU 31 HB1 GLU 31 -1.839 -1.718 -7.281 1193 HG2 GLU 31 HG2 GLU 31 -3.627 -0.028 -8.040 1194 HG3 GLU 31 HG1 GLU 31 -2.698 1.135 -7.099 1195 H LYS 32 HN LYS 32 -2.329 -1.028 -3.568 1196 HA LYS 32 HA LYS 32 -1.143 -3.590 -3.197 1197 HB2 LYS 32 HB2 LYS 32 -1.619 -1.353 -1.218 1198 HB3 LYS 32 HB1 LYS 32 -0.596 -2.756 -0.935 1199 HG2 LYS 32 HG2 LYS 32 0.913 -2.085 -2.671 1200 HG3 LYS 32 HG1 LYS 32 -0.152 -0.764 -3.147 1201 HD2 LYS 32 HD2 LYS 32 0.172 -0.086 -0.607 1202 HD3 LYS 32 HD1 LYS 32 1.672 -0.999 -0.815 1203 HE2 LYS 32 HE2 LYS 32 1.852 0.442 -3.008 1204 HE3 LYS 32 HE1 LYS 32 0.773 1.523 -2.121 1205 HZ1 LYS 32 HZ1 LYS 32 3.474 0.602 -1.318 1206 HZ2 LYS 32 HZ2 LYS 32 2.422 1.428 -0.274 1207 HZ3 LYS 32 HZ3 LYS 32 2.986 2.184 -1.679 1208 H LEU 33 HN LEU 33 -4.242 -2.250 -2.516 1209 HA LEU 33 HA LEU 33 -4.923 -4.237 -0.525 1210 HB2 LEU 33 HB2 LEU 33 -5.909 -2.006 -0.376 1211 HB3 LEU 33 HB1 LEU 33 -6.648 -2.207 -1.955 1212 HG LEU 33 HG LEU 33 -7.913 -4.184 -0.958 1213 HD11 LEU 33 HD11 LEU 33 -8.186 -4.171 1.477 1214 HD12 LEU 33 HD12 LEU 33 -6.956 -2.912 1.606 1215 HD13 LEU 33 HD13 LEU 33 -6.519 -4.515 1.015 1216 HD21 LEU 33 HD21 LEU 33 -8.447 -1.437 0.161 1217 HD22 LEU 33 HD22 LEU 33 -9.614 -2.752 0.024 1218 HD23 LEU 33 HD23 LEU 33 -8.940 -2.012 -1.430 1219 H GLU 34 HN GLU 34 -5.742 -3.547 -3.912 1220 HA GLU 34 HA GLU 34 -7.559 -5.654 -4.239 1221 HB2 GLU 34 HB2 GLU 34 -7.405 -5.301 -6.597 1222 HB3 GLU 34 HB1 GLU 34 -7.315 -3.732 -5.814 1223 HG2 GLU 34 HG2 GLU 34 -4.899 -3.712 -6.132 1224 HG3 GLU 34 HG1 GLU 34 -4.985 -5.293 -6.904 1225 H VAL 35 HN VAL 35 -4.029 -5.613 -4.442 1226 HA VAL 35 HA VAL 35 -3.884 -8.218 -5.611 1227 HB VAL 35 HB VAL 35 -1.492 -8.210 -4.999 1228 HG11 VAL 35 HG11 VAL 35 -2.475 -7.095 -7.058 1229 HG12 VAL 35 HG12 VAL 35 -0.851 -6.604 -6.587 1230 HG13 VAL 35 HG13 VAL 35 -2.227 -5.565 -6.215 1231 HG21 VAL 35 HG21 VAL 35 -2.101 -5.522 -3.771 1232 HG22 VAL 35 HG22 VAL 35 -0.492 -6.194 -4.023 1233 HG23 VAL 35 HG23 VAL 35 -1.606 -6.974 -2.901 1234 H VAL 36 HN VAL 36 -4.020 -7.003 -2.316 1235 HA VAL 36 HA VAL 36 -3.265 -9.460 -1.081 1236 HB VAL 36 HB VAL 36 -4.872 -7.142 0.025 1237 HG11 VAL 36 HG11 VAL 36 -5.379 -9.223 1.229 1238 HG12 VAL 36 HG12 VAL 36 -4.492 -8.078 2.235 1239 HG13 VAL 36 HG13 VAL 36 -3.657 -9.461 1.525 1240 HG21 VAL 36 HG21 VAL 36 -2.708 -6.789 1.305 1241 HG22 VAL 36 HG22 VAL 36 -2.690 -6.403 -0.415 1242 HG23 VAL 36 HG23 VAL 36 -1.973 -7.911 0.160 1243 H VAL 37 HN VAL 37 -6.341 -7.957 -1.946 1244 HA VAL 37 HA VAL 37 -8.002 -10.024 -0.949 1245 HB VAL 37 HB VAL 37 -8.634 -8.160 -3.253 1246 HG11 VAL 37 HG11 VAL 37 -10.411 -9.687 -1.346 1247 HG12 VAL 37 HG12 VAL 37 -10.202 -9.999 -3.071 1248 HG13 VAL 37 HG13 VAL 37 -10.972 -8.507 -2.533 1249 HG21 VAL 37 HG21 VAL 37 -9.586 -6.643 -1.630 1250 HG22 VAL 37 HG22 VAL 37 -7.891 -6.932 -1.238 1251 HG23 VAL 37 HG23 VAL 37 -9.158 -7.735 -0.313 1252 H ASN 38 HN ASN 38 -6.375 -9.445 -4.009 1253 HA ASN 38 HA ASN 38 -7.555 -11.562 -5.460 1254 HB2 ASN 38 HB2 ASN 38 -5.702 -9.532 -6.014 1255 HB3 ASN 38 HB1 ASN 38 -4.845 -11.041 -6.318 1256 HD21 ASN 38 HD21 ASN 38 -5.567 -12.427 -7.922 1257 HD22 ASN 38 HD22 ASN 38 -6.688 -11.911 -9.140 1258 H GLU 39 HN GLU 39 -4.573 -11.328 -3.544 1259 HA GLU 39 HA GLU 39 -3.539 -13.873 -4.010 1260 HB2 GLU 39 HB2 GLU 39 -3.381 -11.944 -1.732 1261 HB3 GLU 39 HB1 GLU 39 -2.796 -13.580 -1.471 1262 HG2 GLU 39 HG2 GLU 39 -1.350 -13.239 -3.520 1263 HG3 GLU 39 HG1 GLU 39 -1.792 -11.536 -3.421 1264 H ARG 40 HN ARG 40 -5.836 -12.745 -1.599 1265 HA ARG 40 HA ARG 40 -6.326 -15.178 -0.304 1266 HB2 ARG 40 HB2 ARG 40 -7.386 -12.511 -0.319 1267 HB3 ARG 40 HB1 ARG 40 -8.716 -13.658 -0.337 1268 HG2 ARG 40 HG2 ARG 40 -6.537 -14.147 1.603 1269 HG3 ARG 40 HG1 ARG 40 -7.606 -12.778 1.905 1270 HD2 ARG 40 HD2 ARG 40 -9.516 -14.459 1.499 1271 HD3 ARG 40 HD1 ARG 40 -8.283 -15.694 1.727 1272 HE ARG 40 HE ARG 40 -8.460 -13.697 3.821 1273 HH11 ARG 40 HH11 ARG 40 -9.449 -16.857 2.687 1274 HH12 ARG 40 HH12 ARG 40 -9.870 -17.433 4.278 1275 HH21 ARG 40 HH21 ARG 40 -9.027 -14.442 5.919 1276 HH22 ARG 40 HH22 ARG 40 -9.618 -16.062 6.115 1277 H ARG 41 HN ARG 41 -7.918 -13.628 -3.055 1278 HA ARG 41 HA ARG 41 -9.975 -15.461 -3.473 1279 HB2 ARG 41 HB2 ARG 41 -8.503 -13.533 -5.228 1280 HB3 ARG 41 HB1 ARG 41 -9.659 -14.649 -5.940 1281 HG2 ARG 41 HG2 ARG 41 -10.375 -12.842 -3.655 1282 HG3 ARG 41 HG1 ARG 41 -10.516 -12.351 -5.344 1283 HD2 ARG 41 HD2 ARG 41 -11.865 -14.721 -4.059 1284 HD3 ARG 41 HD1 ARG 41 -12.636 -13.196 -4.490 1285 HE ARG 41 HE ARG 41 -11.412 -14.948 -6.526 1286 HH11 ARG 41 HH11 ARG 41 -14.133 -13.105 -5.295 1287 HH12 ARG 41 HH12 ARG 41 -15.085 -13.328 -6.733 1288 HH21 ARG 41 HH21 ARG 41 -12.683 -15.267 -8.399 1289 HH22 ARG 41 HH22 ARG 41 -14.262 -14.559 -8.494 1290 H GLU 42 HN GLU 42 -6.788 -15.295 -5.014 1291 HA GLU 42 HA GLU 42 -7.019 -17.580 -6.604 1292 HB2 GLU 42 HB2 GLU 42 -4.560 -16.302 -5.397 1293 HB3 GLU 42 HB1 GLU 42 -4.528 -17.530 -6.656 1294 HG2 GLU 42 HG2 GLU 42 -5.303 -16.101 -8.268 1295 HG3 GLU 42 HG1 GLU 42 -6.114 -15.054 -7.102 1296 H GLU 43 HN GLU 43 -5.659 -17.193 -3.342 1297 HA GLU 43 HA GLU 43 -4.835 -19.869 -3.030 1298 HB2 GLU 43 HB2 GLU 43 -5.503 -17.669 -1.092 1299 HB3 GLU 43 HB1 GLU 43 -5.043 -19.270 -0.536 1300 HG2 GLU 43 HG2 GLU 43 -3.343 -17.631 -2.393 1301 HG3 GLU 43 HG1 GLU 43 -3.208 -17.557 -0.637 1302 H GLU 44 HN GLU 44 -7.845 -18.221 -2.142 1303 HA GLU 44 HA GLU 44 -9.064 -20.419 -0.873 1304 HB2 GLU 44 HB2 GLU 44 -9.732 -17.752 -1.423 1305 HB3 GLU 44 HB1 GLU 44 -10.975 -18.707 -2.218 1306 HG2 GLU 44 HG2 GLU 44 -11.781 -18.224 -0.058 1307 HG3 GLU 44 HG1 GLU 44 -11.292 -19.917 -0.038 1308 H SER 45 HN SER 45 -9.060 -19.317 -4.226 1309 HA SER 45 HA SER 45 -10.952 -21.240 -5.145 1310 HB2 SER 45 HB2 SER 45 -8.915 -19.600 -6.663 1311 HB3 SER 45 HB1 SER 45 -10.233 -20.510 -7.395 1312 HG SER 45 HG SER 45 -10.383 -18.242 -5.702 1313 H ALA 46 HN ALA 46 -7.655 -21.459 -4.327 1314 HA ALA 46 HA ALA 46 -6.933 -23.544 -6.160 1315 HB1 ALA 46 HB1 ALA 46 -5.234 -22.070 -5.198 1316 HB2 ALA 46 HB2 ALA 46 -4.914 -23.758 -4.799 1317 HB3 ALA 46 HB3 ALA 46 -5.611 -22.683 -3.587 Start of MODEL 4 1 H LEU 6 HT1 LEU 6 9.154 14.474 5.846 2 HA LEU 6 HA LEU 6 10.583 15.908 3.688 3 HB2 LEU 6 HB2 LEU 6 11.196 13.559 5.332 4 HB3 LEU 6 HB1 LEU 6 11.311 13.254 3.611 5 HG LEU 6 HG LEU 6 12.786 15.379 3.555 6 HD11 LEU 6 HD11 LEU 6 12.274 16.113 5.838 7 HD12 LEU 6 HD12 LEU 6 13.996 15.815 5.624 8 HD13 LEU 6 HD13 LEU 6 12.997 14.637 6.472 9 HD21 LEU 6 HD21 LEU 6 14.763 13.972 4.300 10 HD22 LEU 6 HD22 LEU 6 13.741 13.290 3.035 11 HD23 LEU 6 HD23 LEU 6 13.587 12.720 4.695 12 H THR 7 HN THR 7 10.213 15.152 1.597 13 HA THR 7 HA THR 7 7.547 14.184 1.159 14 HB THR 7 HB THR 7 9.321 14.386 -1.175 15 HG1 THR 7 HG1 THR 7 10.339 16.042 -0.198 16 HG21 THR 7 HG21 THR 7 6.653 15.487 -0.319 17 HG22 THR 7 HG22 THR 7 7.011 14.352 -1.619 18 HG23 THR 7 HG23 THR 7 7.453 16.052 -1.787 19 H LYS 8 HN LYS 8 6.991 12.372 -0.126 20 HA LYS 8 HA LYS 8 8.242 9.966 0.538 21 HB2 LYS 8 HB2 LYS 8 5.917 10.035 -0.055 22 HB3 LYS 8 HB1 LYS 8 6.285 10.677 -1.646 23 HG2 LYS 8 HG2 LYS 8 7.288 8.571 -2.298 24 HG3 LYS 8 HG1 LYS 8 7.004 7.912 -0.682 25 HD2 LYS 8 HD2 LYS 8 4.639 8.013 -0.972 26 HD3 LYS 8 HD1 LYS 8 4.800 8.959 -2.451 27 HE2 LYS 8 HE2 LYS 8 5.879 7.027 -3.538 28 HE3 LYS 8 HE1 LYS 8 5.645 6.091 -2.063 29 HZ1 LYS 8 HZ1 LYS 8 3.269 6.337 -2.304 30 HZ2 LYS 8 HZ2 LYS 8 3.915 5.645 -3.706 31 HZ3 LYS 8 HZ3 LYS 8 3.467 7.285 -3.697 32 H THR 9 HN THR 9 8.487 11.969 -2.343 33 HA THR 9 HA THR 9 10.033 10.204 -3.902 34 HB THR 9 HB THR 9 10.715 12.727 -4.769 35 HG1 THR 9 HG1 THR 9 9.206 14.115 -4.143 36 HG21 THR 9 HG21 THR 9 8.132 11.323 -5.453 37 HG22 THR 9 HG22 THR 9 9.709 10.772 -6.019 38 HG23 THR 9 HG23 THR 9 9.105 12.358 -6.495 39 H ASP 10 HN ASP 10 10.862 12.523 -1.421 40 HA ASP 10 HA ASP 10 13.613 12.763 -2.015 41 HB2 ASP 10 HB2 ASP 10 11.987 13.258 0.470 42 HB3 ASP 10 HB1 ASP 10 13.740 13.432 0.479 43 H TYR 11 HN TYR 11 11.811 10.662 0.205 44 HA TYR 11 HA TYR 11 14.079 9.286 1.205 45 HB2 TYR 11 HB2 TYR 11 11.163 8.526 1.038 46 HB3 TYR 11 HB1 TYR 11 12.371 7.502 1.799 47 HD1 TYR 11 HD1 TYR 11 13.811 8.713 3.671 48 HD2 TYR 11 HD2 TYR 11 9.975 9.995 2.356 49 HE1 TYR 11 HE1 TYR 11 13.474 9.890 5.807 50 HE2 TYR 11 HE2 TYR 11 9.630 11.176 4.481 51 HH TYR 11 HH TYR 11 10.467 11.054 6.809 52 H LEU 12 HN LEU 12 11.862 8.755 -1.454 53 HA LEU 12 HA LEU 12 12.645 6.233 -2.304 54 HB2 LEU 12 HB2 LEU 12 10.671 7.421 -3.136 55 HB3 LEU 12 HB1 LEU 12 11.705 8.581 -3.945 56 HG LEU 12 HG LEU 12 12.544 6.800 -5.427 57 HD11 LEU 12 HD11 LEU 12 12.322 4.869 -4.043 58 HD12 LEU 12 HD12 LEU 12 11.309 4.641 -5.471 59 HD13 LEU 12 HD13 LEU 12 10.575 5.085 -3.930 60 HD21 LEU 12 HD21 LEU 12 9.539 6.953 -5.379 61 HD22 LEU 12 HD22 LEU 12 10.559 6.587 -6.769 62 HD23 LEU 12 HD23 LEU 12 10.604 8.193 -6.039 63 H MET 13 HN MET 13 13.923 9.414 -3.257 64 HA MET 13 HA MET 13 15.794 8.449 -5.129 65 HB2 MET 13 HB2 MET 13 15.698 11.000 -3.526 66 HB3 MET 13 HB1 MET 13 16.949 10.674 -4.717 67 HG2 MET 13 HG2 MET 13 13.996 10.974 -5.182 68 HG3 MET 13 HG1 MET 13 15.300 12.007 -5.765 69 HE1 MET 13 HE1 MET 13 16.972 11.366 -7.670 70 HE2 MET 13 HE2 MET 13 17.008 9.802 -8.479 71 HE3 MET 13 HE3 MET 13 17.483 9.930 -6.787 72 H ARG 14 HN ARG 14 15.999 9.007 -1.663 73 HA ARG 14 HA ARG 14 18.789 8.586 -1.421 74 HB2 ARG 14 HB2 ARG 14 17.448 9.732 0.296 75 HB3 ARG 14 HB1 ARG 14 16.603 8.232 0.639 76 HG2 ARG 14 HG2 ARG 14 19.519 8.054 0.848 77 HG3 ARG 14 HG1 ARG 14 18.756 9.152 1.996 78 HD2 ARG 14 HD2 ARG 14 17.256 7.374 2.726 79 HD3 ARG 14 HD1 ARG 14 17.973 6.275 1.551 80 HE ARG 14 HE ARG 14 19.149 7.173 4.063 81 HH11 ARG 14 HH11 ARG 14 19.614 5.478 1.029 82 HH12 ARG 14 HH12 ARG 14 20.940 4.528 1.627 83 HH21 ARG 14 HH21 ARG 14 20.888 5.914 4.843 84 HH22 ARG 14 HH22 ARG 14 21.675 4.790 3.778 85 H LEU 15 HN LEU 15 16.075 6.458 -1.672 86 HA LEU 15 HA LEU 15 17.654 4.156 -0.835 87 HB2 LEU 15 HB2 LEU 15 14.767 4.387 -1.673 88 HB3 LEU 15 HB1 LEU 15 15.535 2.913 -1.121 89 HG LEU 15 HG LEU 15 15.240 5.402 0.554 90 HD11 LEU 15 HD11 LEU 15 13.587 2.894 0.407 91 HD12 LEU 15 HD12 LEU 15 13.056 4.564 0.212 92 HD13 LEU 15 HD13 LEU 15 13.570 3.982 1.794 93 HD21 LEU 15 HD21 LEU 15 17.105 4.162 1.317 94 HD22 LEU 15 HD22 LEU 15 16.251 2.630 1.134 95 HD23 LEU 15 HD23 LEU 15 15.768 3.761 2.396 96 H ARG 16 HN ARG 16 17.048 5.845 -3.660 97 HA ARG 16 HA ARG 16 16.806 3.712 -5.526 98 HB2 ARG 16 HB2 ARG 16 16.816 6.544 -5.627 99 HB3 ARG 16 HB1 ARG 16 18.093 5.996 -6.707 100 HG2 ARG 16 HG2 ARG 16 16.255 6.093 -8.101 101 HG3 ARG 16 HG1 ARG 16 16.292 4.390 -7.640 102 HD2 ARG 16 HD2 ARG 16 14.649 4.923 -5.839 103 HD3 ARG 16 HD1 ARG 16 14.530 6.553 -6.496 104 HE ARG 16 HE ARG 16 13.562 4.073 -7.747 105 HH11 ARG 16 HH11 ARG 16 13.902 7.576 -7.865 106 HH12 ARG 16 HH12 ARG 16 12.646 7.779 -9.045 107 HH21 ARG 16 HH21 ARG 16 11.919 4.336 -9.287 108 HH22 ARG 16 HH22 ARG 16 11.516 5.940 -9.855 109 H ARG 17 HN ARG 17 19.448 5.132 -3.842 110 HA ARG 17 HA ARG 17 21.489 4.227 -5.636 111 HB2 ARG 17 HB2 ARG 17 21.771 5.039 -2.743 112 HB3 ARG 17 HB1 ARG 17 23.052 4.954 -3.942 113 HG2 ARG 17 HG2 ARG 17 21.912 6.754 -5.216 114 HG3 ARG 17 HG1 ARG 17 20.749 6.889 -3.895 115 HD2 ARG 17 HD2 ARG 17 23.728 7.292 -3.676 116 HD3 ARG 17 HD1 ARG 17 22.523 8.573 -3.716 117 HE ARG 17 HE ARG 17 22.975 6.671 -1.521 118 HH11 ARG 17 HH11 ARG 17 21.356 9.526 -2.769 119 HH12 ARG 17 HH12 ARG 17 20.929 10.122 -1.193 120 HH21 ARG 17 HH21 ARG 17 22.380 7.430 0.540 121 HH22 ARG 17 HH22 ARG 17 21.508 8.926 0.691 122 H CYS 18 HN CYS 18 19.747 2.936 -2.958 123 HA CYS 18 HA CYS 18 21.611 0.800 -2.465 124 HB2 CYS 18 HB2 CYS 18 18.796 1.018 -1.424 125 HB3 CYS 18 HB1 CYS 18 20.152 0.150 -0.711 126 HG CYS 18 HG CYS 18 21.493 2.846 -0.532 127 H GLN 19 HN GLN 19 21.693 -1.017 -3.561 128 HA GLN 19 HA GLN 19 19.269 -1.994 -4.914 129 HB2 GLN 19 HB2 GLN 19 22.121 -2.137 -5.931 130 HB3 GLN 19 HB1 GLN 19 20.726 -2.860 -6.714 131 HG2 GLN 19 HG2 GLN 19 20.171 -0.114 -6.283 132 HG3 GLN 19 HG1 GLN 19 21.771 -0.253 -7.014 133 HE21 GLN 19 HE21 GLN 19 21.264 -2.630 -8.496 134 HE22 GLN 19 HE22 GLN 19 20.184 -2.217 -9.782 135 H THR 20 HN THR 20 20.308 -4.433 -5.771 136 HA THR 20 HA THR 20 20.895 -6.536 -5.134 137 HB THR 20 HB THR 20 21.977 -5.447 -2.535 138 HG1 THR 20 HG1 THR 20 23.776 -5.831 -4.591 139 HG21 THR 20 HG21 THR 20 22.616 -7.878 -4.210 140 HG22 THR 20 HG22 THR 20 21.918 -7.848 -2.590 141 HG23 THR 20 HG23 THR 20 23.588 -7.341 -2.842 142 H ILE 21 HN ILE 21 18.945 -4.524 -3.157 143 HA ILE 21 HA ILE 21 17.016 -4.917 -2.013 144 HB ILE 21 HB ILE 21 17.431 -7.828 -2.702 145 HG12 ILE 21 HG12 ILE 21 15.469 -5.858 -3.890 146 HG13 ILE 21 HG11 ILE 21 17.043 -6.193 -4.606 147 HG21 ILE 21 HG21 ILE 21 15.088 -6.401 -1.456 148 HG22 ILE 21 HG22 ILE 21 16.080 -7.665 -0.731 149 HG23 ILE 21 HG23 ILE 21 15.028 -8.043 -2.094 150 HD11 ILE 21 HD11 ILE 21 14.845 -8.195 -4.162 151 HD12 ILE 21 HD12 ILE 21 16.420 -8.532 -4.877 152 HD13 ILE 21 HD13 ILE 21 15.288 -7.459 -5.700 153 H ASP 22 HN ASP 22 19.470 -7.374 -1.378 154 HA ASP 22 HA ASP 22 18.933 -7.997 1.249 155 HB2 ASP 22 HB2 ASP 22 20.550 -9.215 -0.062 156 HB3 ASP 22 HB1 ASP 22 21.565 -7.790 -0.218 157 H THR 23 HN THR 23 21.093 -5.420 0.063 158 HA THR 23 HA THR 23 21.646 -4.408 2.665 159 HB THR 23 HB THR 23 22.127 -2.400 0.734 160 HG1 THR 23 HG1 THR 23 22.857 -3.465 -0.996 161 HG21 THR 23 HG21 THR 23 23.752 -4.367 2.299 162 HG22 THR 23 HG22 THR 23 23.697 -2.607 2.420 163 HG23 THR 23 HG23 THR 23 24.538 -3.372 1.072 164 H LEU 24 HN LEU 24 19.173 -3.841 0.310 165 HA LEU 24 HA LEU 24 18.354 -1.272 1.186 166 HB2 LEU 24 HB2 LEU 24 17.757 -2.154 -1.010 167 HB3 LEU 24 HB1 LEU 24 16.818 -3.431 -0.263 168 HG LEU 24 HG LEU 24 15.319 -1.651 0.698 169 HD11 LEU 24 HD11 LEU 24 15.377 0.560 -0.336 170 HD12 LEU 24 HD12 LEU 24 16.845 0.118 -1.207 171 HD13 LEU 24 HD13 LEU 24 16.863 0.229 0.552 172 HD21 LEU 24 HD21 LEU 24 14.583 -2.889 -1.198 173 HD22 LEU 24 HD22 LEU 24 15.593 -1.936 -2.286 174 HD23 LEU 24 HD23 LEU 24 14.203 -1.191 -1.491 175 H GLU 25 HN GLU 25 17.426 -4.555 2.090 176 HA GLU 25 HA GLU 25 15.314 -3.714 3.818 177 HB2 GLU 25 HB2 GLU 25 16.675 -6.303 3.233 178 HB3 GLU 25 HB1 GLU 25 15.707 -6.175 4.695 179 HG2 GLU 25 HG2 GLU 25 13.944 -5.171 2.975 180 HG3 GLU 25 HG1 GLU 25 14.866 -6.173 1.853 181 H ARG 26 HN ARG 26 18.622 -3.500 4.106 182 HA ARG 26 HA ARG 26 18.659 -3.932 6.987 183 HB2 ARG 26 HB2 ARG 26 20.845 -3.161 5.055 184 HB3 ARG 26 HB1 ARG 26 21.084 -3.361 6.785 185 HG2 ARG 26 HG2 ARG 26 19.834 -5.703 6.002 186 HG3 ARG 26 HG1 ARG 26 20.957 -5.344 4.692 187 HD2 ARG 26 HD2 ARG 26 22.789 -5.181 6.270 188 HD3 ARG 26 HD1 ARG 26 21.681 -5.462 7.613 189 HE ARG 26 HE ARG 26 21.823 -7.684 7.186 190 HH11 ARG 26 HH11 ARG 26 22.886 -5.955 4.350 191 HH12 ARG 26 HH12 ARG 26 23.101 -7.383 3.384 192 HH21 ARG 26 HH21 ARG 26 22.165 -9.582 5.940 193 HH22 ARG 26 HH22 ARG 26 22.708 -9.437 4.301 194 H VAL 27 HN VAL 27 18.956 -1.274 4.665 195 HA VAL 27 HA VAL 27 19.534 0.696 6.629 196 HB VAL 27 HB VAL 27 20.051 1.093 4.272 197 HG11 VAL 27 HG11 VAL 27 18.119 -0.003 3.255 198 HG12 VAL 27 HG12 VAL 27 18.352 1.632 2.641 199 HG13 VAL 27 HG13 VAL 27 17.082 1.307 3.824 200 HG21 VAL 27 HG21 VAL 27 19.870 3.023 5.661 201 HG22 VAL 27 HG22 VAL 27 18.115 3.049 5.491 202 HG23 VAL 27 HG23 VAL 27 19.142 3.404 4.099 203 H ILE 28 HN ILE 28 16.535 -0.527 5.219 204 HA ILE 28 HA ILE 28 14.842 1.376 6.499 205 HB ILE 28 HB ILE 28 12.981 -0.118 5.933 206 HG12 ILE 28 HG12 ILE 28 15.064 -2.021 4.845 207 HG13 ILE 28 HG11 ILE 28 14.252 -2.250 6.389 208 HG21 ILE 28 HG21 ILE 28 13.510 1.303 4.175 209 HG22 ILE 28 HG22 ILE 28 13.521 -0.289 3.414 210 HG23 ILE 28 HG23 ILE 28 15.038 0.488 3.854 211 HD11 ILE 28 HD11 ILE 28 12.902 -2.135 3.703 212 HD12 ILE 28 HD12 ILE 28 12.111 -2.411 5.256 213 HD13 ILE 28 HD13 ILE 28 13.253 -3.598 4.623 214 H GLU 29 HN GLU 29 16.304 -1.616 7.435 215 HA GLU 29 HA GLU 29 14.670 -2.194 9.684 216 HB2 GLU 29 HB2 GLU 29 16.117 -3.878 8.596 217 HB3 GLU 29 HB1 GLU 29 17.535 -2.970 9.088 218 HG2 GLU 29 HG2 GLU 29 17.196 -4.889 10.522 219 HG3 GLU 29 HG1 GLU 29 17.008 -3.390 11.429 220 H LYS 30 HN LYS 30 17.716 -0.481 9.195 221 HA LYS 30 HA LYS 30 18.197 0.138 11.914 222 HB2 LYS 30 HB2 LYS 30 19.704 0.278 9.742 223 HB3 LYS 30 HB1 LYS 30 19.118 1.934 9.717 224 HG2 LYS 30 HG2 LYS 30 19.954 2.202 12.040 225 HG3 LYS 30 HG1 LYS 30 20.679 0.598 11.912 226 HD2 LYS 30 HD2 LYS 30 21.582 1.797 9.636 227 HD3 LYS 30 HD1 LYS 30 21.537 3.155 10.759 228 HE2 LYS 30 HE2 LYS 30 23.715 2.076 10.795 229 HE3 LYS 30 HE1 LYS 30 22.898 1.883 12.345 230 HZ1 LYS 30 HZ1 LYS 30 22.296 -0.349 11.741 231 HZ2 LYS 30 HZ2 LYS 30 23.967 -0.165 11.570 232 HZ3 LYS 30 HZ3 LYS 30 22.976 -0.166 10.202 233 H ASN 31 HN ASN 31 16.782 1.982 9.247 234 HA ASN 31 HA ASN 31 16.271 4.349 10.643 235 HB2 ASN 31 HB2 ASN 31 15.430 3.151 8.085 236 HB3 ASN 31 HB1 ASN 31 14.300 4.322 8.756 237 HD21 ASN 31 HD21 ASN 31 16.053 6.073 9.973 238 HD22 ASN 31 HD22 ASN 31 17.005 6.862 8.764 239 H LYS 32 HN LYS 32 14.526 1.341 10.525 240 HA LYS 32 HA LYS 32 11.994 2.090 11.340 241 HB2 LYS 32 HB2 LYS 32 12.572 -0.187 10.692 242 HB3 LYS 32 HB1 LYS 32 13.578 -0.364 12.124 243 HG2 LYS 32 HG2 LYS 32 11.360 0.174 13.392 244 HG3 LYS 32 HG1 LYS 32 10.611 -0.355 11.881 245 HD2 LYS 32 HD2 LYS 32 12.548 -1.943 13.568 246 HD3 LYS 32 HD1 LYS 32 10.813 -2.220 13.432 247 HE2 LYS 32 HE2 LYS 32 11.028 -2.802 11.114 248 HE3 LYS 32 HE1 LYS 32 12.729 -2.349 11.110 249 HZ1 LYS 32 HZ1 LYS 32 12.553 -4.708 11.246 250 HZ2 LYS 32 HZ2 LYS 32 11.503 -4.618 12.571 251 HZ3 LYS 32 HZ3 LYS 32 13.119 -4.144 12.735 252 H TYR 33 HN TYR 33 14.879 1.580 13.328 253 HA TYR 33 HA TYR 33 13.374 2.199 15.748 254 HB2 TYR 33 HB2 TYR 33 16.328 1.617 15.509 255 HB3 TYR 33 HB1 TYR 33 15.335 1.540 16.962 256 HD1 TYR 33 HD1 TYR 33 13.415 -0.192 16.967 257 HD2 TYR 33 HD2 TYR 33 16.675 -0.285 14.242 258 HE1 TYR 33 HE1 TYR 33 12.973 -2.575 16.531 259 HE2 TYR 33 HE2 TYR 33 16.245 -2.661 13.794 260 HH TYR 33 HH TYR 33 14.803 -4.340 14.049 261 H GLU 34 HN GLU 34 15.469 3.756 13.499 262 HA GLU 34 HA GLU 34 16.293 5.855 15.271 263 HB2 GLU 34 HB2 GLU 34 16.457 5.618 12.269 264 HB3 GLU 34 HB1 GLU 34 17.163 6.927 13.199 265 HG2 GLU 34 HG2 GLU 34 18.366 5.008 14.473 266 HG3 GLU 34 HG1 GLU 34 17.977 4.071 13.034 267 H LEU 35 HN LEU 35 13.760 5.415 12.873 268 HA LEU 35 HA LEU 35 12.960 8.126 12.709 269 HB2 LEU 35 HB2 LEU 35 11.398 5.596 12.180 270 HB3 LEU 35 HB1 LEU 35 10.854 7.206 11.758 271 HG LEU 35 HG LEU 35 13.282 5.811 10.627 272 HD11 LEU 35 HD11 LEU 35 11.233 4.849 9.797 273 HD12 LEU 35 HD12 LEU 35 11.978 5.833 8.532 274 HD13 LEU 35 HD13 LEU 35 10.590 6.451 9.431 275 HD21 LEU 35 HD21 LEU 35 12.440 8.602 10.617 276 HD22 LEU 35 HD22 LEU 35 12.698 7.948 9.000 277 HD23 LEU 35 HD23 LEU 35 13.995 7.890 10.195 278 H SER 36 HN SER 36 10.775 8.916 13.393 279 HA SER 36 HA SER 36 10.429 8.319 16.231 280 HB2 SER 36 HB2 SER 36 9.434 10.584 14.495 281 HB3 SER 36 HB1 SER 36 9.005 10.393 16.194 282 HG SER 36 HG SER 36 11.125 10.674 16.767 283 H ASP 37 H ASP 37 9.304 6.957 13.601 284 HA ASP 37 HA ASP 37 7.630 5.458 13.209 285 HB2 ASP 37 3HB ASP 37 6.717 6.348 16.026 286 HB3 ASP 37 2HB ASP 37 5.808 5.187 15.066 287 H ASN 38 HN ASN 38 7.103 8.816 13.689 288 HA ASN 38 HA ASN 38 4.362 8.732 12.725 289 HB2 ASN 38 HB2 ASN 38 4.274 11.069 13.078 290 HB3 ASN 38 HB1 ASN 38 5.239 10.443 14.407 291 HD21 ASN 38 HD21 ASN 38 5.235 12.367 11.533 292 HD22 ASN 38 HD22 ASN 38 6.817 13.030 11.728 293 H GLU 39 HN GLU 39 7.571 9.261 11.458 294 HA GLU 39 HA GLU 39 6.489 10.139 8.881 295 HB2 GLU 39 HB2 GLU 39 8.756 10.655 8.256 296 HB3 GLU 39 HB1 GLU 39 8.485 11.285 9.876 297 HG2 GLU 39 HG2 GLU 39 9.768 8.616 9.400 298 HG3 GLU 39 HG1 GLU 39 10.694 10.113 9.430 299 H LEU 40 HN LEU 40 7.036 7.327 10.434 300 HA LEU 40 HA LEU 40 8.334 5.682 8.592 301 HB2 LEU 40 HB2 LEU 40 7.786 5.127 10.957 302 HB3 LEU 40 HB1 LEU 40 6.111 4.923 10.488 303 HG LEU 40 HG LEU 40 6.832 3.078 8.961 304 HD11 LEU 40 HD11 LEU 40 9.157 3.727 8.667 305 HD12 LEU 40 HD12 LEU 40 9.041 2.092 9.317 306 HD13 LEU 40 HD13 LEU 40 9.470 3.434 10.378 307 HD21 LEU 40 HD21 LEU 40 5.878 2.491 11.063 308 HD22 LEU 40 HD22 LEU 40 7.380 2.859 11.913 309 HD23 LEU 40 HD23 LEU 40 7.299 1.471 10.828 310 H ALA 41 HN ALA 41 5.142 6.997 8.600 311 HA ALA 41 HA ALA 41 3.817 5.167 6.939 312 HB1 ALA 41 HB1 ALA 41 3.347 8.139 7.182 313 HB2 ALA 41 HB2 ALA 41 2.676 6.904 8.251 314 HB3 ALA 41 HB3 ALA 41 2.207 6.947 6.550 315 H VAL 42 HN VAL 42 5.389 8.262 6.083 316 HA VAL 42 HA VAL 42 5.059 7.820 3.283 317 HB VAL 42 HB VAL 42 6.679 9.763 3.057 318 HG11 VAL 42 HG11 VAL 42 4.311 10.109 2.884 319 HG12 VAL 42 HG12 VAL 42 4.999 11.409 3.854 320 HG13 VAL 42 HG13 VAL 42 4.136 10.085 4.640 321 HG21 VAL 42 HG21 VAL 42 7.000 11.126 5.116 322 HG22 VAL 42 HG22 VAL 42 7.873 9.592 5.137 323 HG23 VAL 42 HG23 VAL 42 6.381 9.770 6.060 324 H PHE 43 HN PHE 43 7.529 7.114 5.620 325 HA PHE 43 HA PHE 43 9.665 6.669 3.820 326 HB2 PHE 43 HB2 PHE 43 10.005 6.987 6.244 327 HB3 PHE 43 HB1 PHE 43 9.191 5.458 6.556 328 HD1 PHE 43 HD1 PHE 43 12.089 6.870 4.693 329 HD2 PHE 43 HD2 PHE 43 10.442 3.512 6.727 330 HE1 PHE 43 HE1 PHE 43 14.235 5.682 4.471 331 HE2 PHE 43 HE2 PHE 43 12.580 2.321 6.506 332 HZ PHE 43 HZ PHE 43 14.483 3.408 5.377 333 H TYR 44 HN TYR 44 7.155 4.584 5.173 334 HA TYR 44 HA TYR 44 8.107 2.169 4.065 335 HB2 TYR 44 HB2 TYR 44 5.705 3.062 5.453 336 HB3 TYR 44 HB1 TYR 44 5.344 1.880 4.201 337 HD1 TYR 44 HD1 TYR 44 7.729 0.161 4.305 338 HD2 TYR 44 HD2 TYR 44 5.459 1.899 7.447 339 HE1 TYR 44 HE1 TYR 44 8.435 -1.653 5.803 340 HE2 TYR 44 HE2 TYR 44 6.153 0.086 8.960 341 HH TYR 44 HH TYR 44 8.686 -2.060 8.194 342 H SER 45 HN SER 45 5.901 4.641 2.861 343 HA SER 45 HA SER 45 5.047 3.319 0.535 344 HB2 SER 45 HB2 SER 45 4.349 5.625 1.686 345 HB3 SER 45 HB1 SER 45 5.454 6.280 0.476 346 HG SER 45 HG SER 45 3.219 4.588 -0.031 347 H ALA 46 HN ALA 46 7.944 5.159 1.278 348 HA ALA 46 HA ALA 46 8.882 5.332 -1.419 349 HB1 ALA 46 HB1 ALA 46 9.627 6.932 0.241 350 HB2 ALA 46 HB2 ALA 46 11.009 6.041 -0.396 351 HB3 ALA 46 HB3 ALA 46 10.359 5.642 1.194 352 H ALA 47 HN ALA 47 9.630 3.257 1.353 353 HA ALA 47 HA ALA 47 11.584 1.677 0.100 354 HB1 ALA 47 HB1 ALA 47 11.207 1.740 2.543 355 HB2 ALA 47 HB2 ALA 47 11.253 0.098 1.900 356 HB3 ALA 47 HB3 ALA 47 9.709 0.840 2.310 357 H ASP 48 HN ASP 48 8.104 1.228 0.486 358 HA ASP 48 HA ASP 48 7.752 -1.226 -0.761 359 HB2 ASP 48 HB2 ASP 48 6.094 1.158 -0.221 360 HB3 ASP 48 HB1 ASP 48 5.531 0.164 -1.558 361 H HIS 49 HN HIS 49 7.627 2.014 -2.164 362 HA HIS 49 HA HIS 49 7.175 1.248 -4.826 363 HB2 HIS 49 HB2 HIS 49 7.082 3.578 -3.584 364 HB3 HIS 49 HB1 HIS 49 8.730 3.718 -4.182 365 HD1 HIS 49 HD1 HIS 49 5.187 3.973 -5.221 366 HD2 HIS 49 HD2 HIS 49 8.939 3.799 -7.038 367 HE1 HIS 49 HE1 HIS 49 4.834 4.723 -7.593 368 HE2 HIS 49 HE2 HIS 49 7.141 4.804 -8.606 369 H ARG 50 HN ARG 50 10.190 1.946 -3.087 370 HA ARG 50 HA ARG 50 11.896 1.662 -5.335 371 HB2 ARG 50 HB2 ARG 50 12.648 2.882 -3.411 372 HB3 ARG 50 HB1 ARG 50 12.417 1.487 -2.369 373 HG2 ARG 50 HG2 ARG 50 14.767 1.835 -2.823 374 HG3 ARG 50 HG1 ARG 50 14.222 0.317 -3.534 375 HD2 ARG 50 HD2 ARG 50 14.007 1.464 -5.715 376 HD3 ARG 50 HD1 ARG 50 14.653 2.929 -4.977 377 HE ARG 50 HE ARG 50 16.617 1.297 -4.418 378 HH11 ARG 50 HH11 ARG 50 14.776 1.528 -7.410 379 HH12 ARG 50 HH12 ARG 50 16.083 0.923 -8.387 380 HH21 ARG 50 HH21 ARG 50 18.307 0.509 -5.694 381 HH22 ARG 50 HH22 ARG 50 18.104 0.352 -7.416 382 H LEU 51 HN LEU 51 10.834 -0.616 -2.831 383 HA LEU 51 HA LEU 51 12.541 -2.726 -3.654 384 HB2 LEU 51 HB2 LEU 51 11.478 -2.645 -1.436 385 HB3 LEU 51 HB1 LEU 51 9.908 -2.862 -2.189 386 HG LEU 51 HG LEU 51 10.662 -5.085 -3.020 387 HD11 LEU 51 HD11 LEU 51 12.980 -4.801 -1.128 388 HD12 LEU 51 HD12 LEU 51 13.124 -4.476 -2.853 389 HD13 LEU 51 HD13 LEU 51 12.662 -6.081 -2.298 390 HD21 LEU 51 HD21 LEU 51 9.338 -4.807 -0.952 391 HD22 LEU 51 HD22 LEU 51 10.838 -4.737 -0.030 392 HD23 LEU 51 HD23 LEU 51 10.405 -6.211 -0.895 393 H ALA 52 HN ALA 52 9.271 -1.778 -4.542 394 HA ALA 52 HA ALA 52 8.554 -4.047 -6.016 395 HB1 ALA 52 HB1 ALA 52 6.926 -2.557 -7.126 396 HB2 ALA 52 HB2 ALA 52 7.714 -1.178 -6.357 397 HB3 ALA 52 HB3 ALA 52 6.926 -2.408 -5.371 398 H GLU 53 HN GLU 53 10.070 -1.007 -7.153 399 HA GLU 53 HA GLU 53 10.250 -1.876 -9.856 400 HB2 GLU 53 HB2 GLU 53 11.896 0.037 -10.072 401 HB3 GLU 53 HB1 GLU 53 10.287 0.465 -9.509 402 HG2 GLU 53 HG2 GLU 53 11.045 0.713 -7.274 403 HG3 GLU 53 HG1 GLU 53 12.616 0.020 -7.669 404 H LEU 54 HN LEU 54 12.357 -2.160 -7.073 405 HA LEU 54 HA LEU 54 14.649 -3.008 -8.536 406 HB2 LEU 54 HB2 LEU 54 14.540 -2.064 -6.150 407 HB3 LEU 54 HB1 LEU 54 14.081 -3.683 -5.661 408 HG LEU 54 HG LEU 54 16.195 -4.575 -6.411 409 HD11 LEU 54 HD11 LEU 54 17.969 -2.879 -7.134 410 HD12 LEU 54 HD12 LEU 54 16.607 -1.818 -7.512 411 HD13 LEU 54 HD13 LEU 54 16.767 -3.376 -8.325 412 HD21 LEU 54 HD21 LEU 54 16.010 -3.526 -4.160 413 HD22 LEU 54 HD22 LEU 54 16.711 -2.058 -4.844 414 HD23 LEU 54 HD23 LEU 54 17.647 -3.552 -4.814 415 H THR 55 HN THR 55 11.896 -4.628 -7.083 416 HA THR 55 HA THR 55 12.882 -7.277 -7.343 417 HB THR 55 HB THR 55 10.010 -6.310 -7.225 418 HG1 THR 55 HG1 THR 55 11.173 -5.736 -5.361 419 HG21 THR 55 HG21 THR 55 9.538 -8.606 -6.392 420 HG22 THR 55 HG22 THR 55 11.197 -9.056 -6.795 421 HG23 THR 55 HG23 THR 55 10.078 -8.573 -8.073 422 H MET 56 HN MET 56 11.078 -5.113 -9.439 423 HA MET 56 HA MET 56 10.725 -7.108 -11.505 424 HB2 MET 56 HB2 MET 56 10.107 -4.163 -11.323 425 HB3 MET 56 HB1 MET 56 9.915 -5.061 -12.820 426 HG2 MET 56 HG2 MET 56 8.495 -5.591 -10.223 427 HG3 MET 56 HG1 MET 56 7.801 -4.864 -11.670 428 HE1 MET 56 HE1 MET 56 9.442 -6.987 -13.851 429 HE2 MET 56 HE2 MET 56 7.919 -6.110 -14.009 430 HE3 MET 56 HE3 MET 56 7.949 -7.864 -14.190 431 H ASN 57 HN ASN 57 13.241 -5.285 -10.447 432 HA ASN 57 HA ASN 57 15.242 -4.603 -11.251 433 HB2 ASN 57 HB2 ASN 57 15.095 -7.119 -11.931 434 HB3 ASN 57 HB1 ASN 57 14.943 -6.488 -13.569 435 HD21 ASN 57 HD21 ASN 57 16.738 -5.851 -14.617 436 HD22 ASN 57 HD22 ASN 57 18.317 -5.782 -13.921 437 H LYS 58 HN LYS 58 13.271 -2.916 -11.912 438 HA LYS 58 HA LYS 58 14.347 -1.556 -14.180 439 HB2 LYS 58 HB2 LYS 58 12.934 -3.108 -15.420 440 HB3 LYS 58 HB1 LYS 58 11.561 -2.732 -14.388 441 HG2 LYS 58 HG2 LYS 58 11.188 -1.560 -16.380 442 HG3 LYS 58 HG1 LYS 58 11.762 -0.351 -15.232 443 HD2 LYS 58 HD2 LYS 58 13.025 0.167 -17.081 444 HD3 LYS 58 HD1 LYS 58 14.105 -0.945 -16.240 445 HE2 LYS 58 HE2 LYS 58 14.006 -1.478 -18.611 446 HE3 LYS 58 HE1 LYS 58 13.309 -2.778 -17.655 447 HZ1 LYS 58 HZ1 LYS 58 11.457 -2.592 -18.824 448 HZ2 LYS 58 HZ2 LYS 58 12.122 -1.329 -19.732 449 HZ3 LYS 58 HZ3 LYS 58 11.264 -0.987 -18.320 450 H LEU 59 HN LEU 59 14.167 0.565 -13.708 451 HA LEU 59 HA LEU 59 12.753 1.410 -11.396 452 HB2 LEU 59 HB2 LEU 59 14.480 2.673 -13.424 453 HB3 LEU 59 HB1 LEU 59 13.316 3.743 -12.664 454 HG LEU 59 HG LEU 59 14.207 3.083 -10.438 455 HD11 LEU 59 HD11 LEU 59 15.110 0.910 -10.921 456 HD12 LEU 59 HD12 LEU 59 16.418 1.958 -10.371 457 HD13 LEU 59 HD13 LEU 59 16.244 1.595 -12.085 458 HD21 LEU 59 HD21 LEU 59 14.984 5.116 -11.464 459 HD22 LEU 59 HD22 LEU 59 16.184 4.225 -12.397 460 HD23 LEU 59 HD23 LEU 59 16.327 4.324 -10.642 461 H TYR 60 HN TYR 60 10.771 2.090 -11.148 462 HA TYR 60 HA TYR 60 9.208 2.817 -13.546 463 HB2 TYR 60 HB2 TYR 60 8.524 0.992 -11.268 464 HB3 TYR 60 HB1 TYR 60 7.248 1.865 -12.101 465 HD1 TYR 60 HD1 TYR 60 7.525 1.650 -14.820 466 HD2 TYR 60 HD2 TYR 60 8.851 -1.164 -11.917 467 HE1 TYR 60 HE1 TYR 60 7.408 -0.139 -16.507 468 HE2 TYR 60 HE2 TYR 60 8.749 -2.956 -13.597 469 HH TYR 60 HH TYR 60 7.489 -3.394 -15.743 470 H ASP 61 HN ASP 61 8.262 4.764 -13.417 471 HA ASP 61 HA ASP 61 8.509 6.392 -11.106 472 HB2 ASP 61 HB2 ASP 61 8.281 7.250 -13.479 473 HB3 ASP 61 HB1 ASP 61 6.581 6.800 -13.404 474 H LYS 62 HN LYS 62 5.871 4.672 -12.651 475 HA LYS 62 HA LYS 62 4.327 4.755 -10.148 476 HB2 LYS 62 HB2 LYS 62 3.036 5.912 -11.757 477 HB3 LYS 62 HB1 LYS 62 3.469 4.791 -13.037 478 HG2 LYS 62 HG2 LYS 62 1.171 4.469 -12.417 479 HG3 LYS 62 HG1 LYS 62 2.112 3.052 -11.941 480 HD2 LYS 62 HD2 LYS 62 2.216 3.940 -9.639 481 HD3 LYS 62 HD1 LYS 62 1.198 5.295 -10.139 482 HE2 LYS 62 HE2 LYS 62 -0.504 3.595 -10.872 483 HE3 LYS 62 HE1 LYS 62 0.487 2.371 -10.077 484 HZ1 LYS 62 HZ1 LYS 62 -0.691 2.850 -8.274 485 HZ2 LYS 62 HZ2 LYS 62 -1.319 4.284 -8.945 486 HZ3 LYS 62 HZ3 LYS 62 0.198 4.293 -8.188 487 H ILE 63 HN ILE 63 4.127 2.832 -9.182 488 HA ILE 63 HA ILE 63 5.151 0.463 -10.486 489 HB ILE 63 HB ILE 63 3.989 0.805 -7.719 490 HG12 ILE 63 HG12 ILE 63 6.051 2.109 -8.090 491 HG13 ILE 63 HG11 ILE 63 6.297 0.803 -6.938 492 HG21 ILE 63 HG21 ILE 63 3.879 -1.508 -8.632 493 HG22 ILE 63 HG22 ILE 63 4.874 -1.348 -7.190 494 HG23 ILE 63 HG23 ILE 63 5.636 -1.487 -8.773 495 HD11 ILE 63 HD11 ILE 63 7.387 -0.523 -8.669 496 HD12 ILE 63 HD12 ILE 63 8.183 1.034 -8.452 497 HD13 ILE 63 HD13 ILE 63 7.118 0.774 -9.831 498 HA PRO 64 HA PRO 64 1.118 -0.823 -11.974 499 HB2 PRO 64 HB2 PRO 64 2.505 -3.440 -12.193 500 HB3 PRO 64 HB1 PRO 64 1.642 -2.521 -13.438 501 HG2 PRO 64 HG2 PRO 64 4.289 -2.688 -13.453 502 HG3 PRO 64 HG1 PRO 64 3.449 -1.198 -13.928 503 HD2 PRO 64 HD2 PRO 64 4.890 -1.822 -11.391 504 HD3 PRO 64 HD1 PRO 64 4.790 -0.297 -12.295 505 H SER 65 HN SER 65 -0.583 -1.803 -11.006 506 HA SER 65 HA SER 65 -0.536 -2.372 -8.301 507 HB2 SER 65 HB2 SER 65 -2.644 -3.646 -9.974 508 HB3 SER 65 HB1 SER 65 -2.801 -2.661 -8.518 509 HG SER 65 HG SER 65 -2.101 -0.844 -9.890 510 H SER 66 H SER 66 -0.161 -4.589 -11.008 511 HA SER 66 HA SER 66 -0.571 -6.979 -9.412 512 HB2 SER 66 3HB SER 66 0.049 -8.216 -11.450 513 HB3 SER 66 2HB SER 66 -1.072 -6.939 -11.894 514 HG SER 66 HG SER 66 0.762 -5.688 -12.564 515 H VAL 67 HN VAL 67 2.016 -4.838 -9.499 516 HA VAL 67 HA VAL 67 4.085 -6.848 -9.270 517 HB VAL 67 HB VAL 67 4.179 -3.853 -8.866 518 HG11 VAL 67 HG11 VAL 67 6.309 -5.948 -8.638 519 HG12 VAL 67 HG12 VAL 67 5.974 -4.579 -7.581 520 HG13 VAL 67 HG13 VAL 67 6.712 -4.314 -9.158 521 HG21 VAL 67 HG21 VAL 67 3.740 -4.627 -11.173 522 HG22 VAL 67 HG22 VAL 67 5.247 -5.544 -11.123 523 HG23 VAL 67 HG23 VAL 67 5.278 -3.785 -11.006 524 H TRP 68 HN TRP 68 2.045 -5.007 -7.144 525 HA TRP 68 HA TRP 68 3.554 -5.147 -4.785 526 HB2 TRP 68 HB2 TRP 68 0.564 -5.046 -5.175 527 HB3 TRP 68 HB1 TRP 68 1.380 -4.764 -3.643 528 HD1 TRP 68 HD1 TRP 68 -0.125 -2.870 -6.284 529 HE1 TRP 68 HE1 TRP 68 0.824 -0.483 -6.465 530 HE3 TRP 68 HE3 TRP 68 4.088 -3.469 -3.460 531 HZ2 TRP 68 HZ2 TRP 68 3.062 0.951 -5.527 532 HZ3 TRP 68 HZ3 TRP 68 5.578 -1.540 -3.148 533 HH2 TRP 68 HH2 TRP 68 5.077 0.625 -4.158 534 H LYS 69 HN LYS 69 1.847 -7.606 -6.456 535 HA LYS 69 HA LYS 69 1.241 -9.305 -4.270 536 HB2 LYS 69 HB2 LYS 69 0.359 -9.377 -6.698 537 HB3 LYS 69 HB1 LYS 69 1.823 -10.285 -7.052 538 HG2 LYS 69 HG2 LYS 69 -0.021 -11.795 -6.684 539 HG3 LYS 69 HG1 LYS 69 1.153 -11.963 -5.376 540 HD2 LYS 69 HD2 LYS 69 -0.221 -10.868 -3.840 541 HD3 LYS 69 HD1 LYS 69 -1.178 -10.103 -5.108 542 HE2 LYS 69 HE2 LYS 69 -2.443 -11.859 -4.008 543 HE3 LYS 69 HE1 LYS 69 -2.148 -12.264 -5.696 544 HZ1 LYS 69 HZ1 LYS 69 -0.350 -13.715 -4.985 545 HZ2 LYS 69 HZ2 LYS 69 -1.815 -14.165 -4.271 546 HZ3 LYS 69 HZ3 LYS 69 -0.653 -13.327 -3.357 547 H PHE 70 HN PHE 70 4.164 -8.592 -5.944 548 HA PHE 70 HA PHE 70 5.453 -11.020 -4.922 549 HB2 PHE 70 HB2 PHE 70 6.536 -8.942 -6.830 550 HB3 PHE 70 HB1 PHE 70 7.334 -10.443 -6.371 551 HD1 PHE 70 HD1 PHE 70 6.171 -12.636 -6.947 552 HD2 PHE 70 HD2 PHE 70 5.065 -8.878 -8.627 553 HE1 PHE 70 HE1 PHE 70 5.046 -13.797 -8.809 554 HE2 PHE 70 HE2 PHE 70 3.943 -10.035 -10.487 555 HZ PHE 70 HZ PHE 70 3.936 -12.498 -10.578 556 H ILE 71 HN ILE 71 4.753 -8.231 -3.578 557 HA ILE 71 HA ILE 71 7.349 -7.373 -2.697 558 HB ILE 71 HB ILE 71 4.739 -6.277 -2.612 559 HG12 ILE 71 HG12 ILE 71 5.985 -4.257 -1.777 560 HG13 ILE 71 HG11 ILE 71 7.418 -5.270 -1.656 561 HG21 ILE 71 HG21 ILE 71 5.921 -6.552 0.147 562 HG22 ILE 71 HG22 ILE 71 4.369 -7.173 -0.413 563 HG23 ILE 71 HG23 ILE 71 4.628 -5.434 -0.283 564 HD11 ILE 71 HD11 ILE 71 5.895 -4.555 -4.144 565 HD12 ILE 71 HD12 ILE 71 7.196 -5.745 -4.088 566 HD13 ILE 71 HD13 ILE 71 7.527 -4.058 -3.697 567 H ARG 72 HN ARG 72 8.382 -7.837 -0.829 568 HA ARG 72 HA ARG 72 7.440 -10.168 0.621 569 HB2 ARG 72 HB2 ARG 72 9.921 -9.505 -0.212 570 HB3 ARG 72 HB1 ARG 72 9.971 -8.811 1.400 571 HG2 ARG 72 HG2 ARG 72 8.988 -11.593 1.162 572 HG3 ARG 72 HG1 ARG 72 10.705 -11.312 0.881 573 HD2 ARG 72 HD2 ARG 72 10.334 -11.855 3.213 574 HD3 ARG 72 HD1 ARG 72 10.857 -10.178 3.068 575 HE ARG 72 HE ARG 72 8.032 -10.346 3.083 576 HH11 ARG 72 HH11 ARG 72 10.797 -10.586 5.235 577 HH12 ARG 72 HH12 ARG 72 9.907 -10.042 6.621 578 HH21 ARG 72 HH21 ARG 72 6.887 -9.623 4.854 579 HH22 ARG 72 HH22 ARG 72 7.654 -9.503 6.408 580 H GLU 3 HN GLU 3 -5.092 7.290 10.425 581 HA GLU 3 HA GLU 3 -2.918 5.703 11.624 582 HB2 GLU 3 HB2 GLU 3 -4.502 4.786 13.207 583 HB3 GLU 3 HB1 GLU 3 -4.584 6.536 13.273 584 HG2 GLU 3 HG2 GLU 3 -6.536 4.767 11.808 585 HG3 GLU 3 HG1 GLU 3 -6.792 5.453 13.410 586 H ALA 4 HN ALA 4 -6.011 5.471 9.876 587 HA ALA 4 HA ALA 4 -5.698 2.686 9.302 588 HB1 ALA 4 HB1 ALA 4 -7.481 4.707 7.947 589 HB2 ALA 4 HB2 ALA 4 -7.895 3.790 9.393 590 HB3 ALA 4 HB3 ALA 4 -7.628 2.952 7.864 591 H LEU 5 HN LEU 5 -5.335 5.625 7.351 592 HA LEU 5 HA LEU 5 -4.495 4.328 4.988 593 HB2 LEU 5 HB2 LEU 5 -4.335 7.140 6.013 594 HB3 LEU 5 HB1 LEU 5 -3.511 6.702 4.531 595 HG LEU 5 HG LEU 5 -5.774 5.866 3.696 596 HD11 LEU 5 HD11 LEU 5 -7.742 6.761 4.727 597 HD12 LEU 5 HD12 LEU 5 -6.780 7.603 5.940 598 HD13 LEU 5 HD13 LEU 5 -6.847 5.841 5.934 599 HD21 LEU 5 HD21 LEU 5 -5.456 8.806 4.257 600 HD22 LEU 5 HD22 LEU 5 -6.439 8.084 2.984 601 HD23 LEU 5 HD23 LEU 5 -4.681 7.933 2.935 602 H LYS 6 HN LYS 6 -2.923 4.762 7.910 603 HA LYS 6 HA LYS 6 -0.243 5.028 6.890 604 HB2 LYS 6 HB2 LYS 6 -0.889 6.000 9.048 605 HB3 LYS 6 HB1 LYS 6 -1.278 4.400 9.657 606 HG2 LYS 6 HG2 LYS 6 1.002 3.746 9.643 607 HG3 LYS 6 HG1 LYS 6 1.474 5.194 8.755 608 HD2 LYS 6 HD2 LYS 6 0.779 6.580 10.653 609 HD3 LYS 6 HD1 LYS 6 0.316 5.131 11.540 610 HE2 LYS 6 HE2 LYS 6 2.643 4.354 11.449 611 HE3 LYS 6 HE1 LYS 6 3.091 5.831 10.597 612 HZ1 LYS 6 HZ1 LYS 6 2.159 7.044 12.577 613 HZ2 LYS 6 HZ2 LYS 6 3.601 6.198 12.843 614 HZ3 LYS 6 HZ3 LYS 6 2.131 5.556 13.382 615 H ILE 7 HN ILE 7 -2.156 2.465 8.455 616 HA ILE 7 HA ILE 7 -0.063 0.513 8.103 617 HB ILE 7 HB ILE 7 -1.755 -1.123 8.934 618 HG12 ILE 7 HG12 ILE 7 -3.536 1.283 9.377 619 HG13 ILE 7 HG11 ILE 7 -3.727 0.185 8.011 620 HG21 ILE 7 HG21 ILE 7 -1.913 -0.132 11.220 621 HG22 ILE 7 HG22 ILE 7 -1.294 1.375 10.552 622 HG23 ILE 7 HG23 ILE 7 -0.298 -0.079 10.516 623 HD11 ILE 7 HD11 ILE 7 -5.282 -0.425 9.718 624 HD12 ILE 7 HD12 ILE 7 -4.002 -0.481 10.930 625 HD13 ILE 7 HD13 ILE 7 -4.038 -1.672 9.631 626 H LEU 8 HN LEU 8 -2.813 1.601 6.330 627 HA LEU 8 HA LEU 8 -3.067 -0.718 4.669 628 HB2 LEU 8 HB2 LEU 8 -4.923 0.867 5.163 629 HB3 LEU 8 HB1 LEU 8 -4.093 2.086 4.216 630 HG LEU 8 HG LEU 8 -4.301 0.596 2.220 631 HD11 LEU 8 HD11 LEU 8 -6.142 -1.006 3.992 632 HD12 LEU 8 HD12 LEU 8 -4.550 -1.529 3.447 633 HD13 LEU 8 HD13 LEU 8 -5.839 -1.265 2.276 634 HD21 LEU 8 HD21 LEU 8 -5.858 2.426 2.598 635 HD22 LEU 8 HD22 LEU 8 -6.871 1.380 3.592 636 HD23 LEU 8 HD23 LEU 8 -6.684 1.049 1.871 637 H ASN 9 HN ASN 9 -0.872 1.835 4.782 638 HA ASN 9 HA ASN 9 -0.392 1.999 1.951 639 HB2 ASN 9 HB2 ASN 9 0.094 3.747 3.925 640 HB3 ASN 9 HB1 ASN 9 1.671 2.967 3.854 641 HD21 ASN 9 HD21 ASN 9 -0.502 5.126 2.356 642 HD22 ASN 9 HD22 ASN 9 0.502 5.567 1.021 643 H ASN 10 HN ASN 10 0.605 -0.080 4.476 644 HA ASN 10 HA ASN 10 2.767 -1.090 2.752 645 HB2 ASN 10 HB2 ASN 10 3.651 -0.162 4.855 646 HB3 ASN 10 HB1 ASN 10 2.626 -1.264 5.770 647 HD21 ASN 10 HD21 ASN 10 5.115 -1.269 3.230 648 HD22 ASN 10 HD22 ASN 10 5.870 -2.730 3.753 649 H ILE 11 HN ILE 11 2.773 -3.184 2.222 650 HA ILE 11 HA ILE 11 0.331 -4.623 2.555 651 HB ILE 11 HB ILE 11 2.833 -5.752 1.340 652 HG12 ILE 11 HG12 ILE 11 0.910 -3.717 0.214 653 HG13 ILE 11 HG11 ILE 11 2.661 -3.593 0.345 654 HG21 ILE 11 HG21 ILE 11 0.897 -7.243 1.638 655 HG22 ILE 11 HG22 ILE 11 1.273 -6.974 -0.063 656 HG23 ILE 11 HG23 ILE 11 -0.086 -6.134 0.685 657 HD11 ILE 11 HD11 ILE 11 1.180 -5.491 -1.455 658 HD12 ILE 11 HD12 ILE 11 2.928 -5.291 -1.353 659 HD13 ILE 11 HD13 ILE 11 1.924 -3.969 -1.946 660 H ARG 12 HN ARG 12 3.449 -4.776 4.149 661 HA ARG 12 HA ARG 12 3.278 -7.440 5.063 662 HB2 ARG 12 HB2 ARG 12 4.680 -5.095 6.358 663 HB3 ARG 12 HB1 ARG 12 4.932 -6.786 6.770 664 HG2 ARG 12 HG2 ARG 12 5.722 -7.192 4.467 665 HG3 ARG 12 HG1 ARG 12 5.544 -5.468 4.132 666 HD2 ARG 12 HD2 ARG 12 7.228 -4.903 5.710 667 HD3 ARG 12 HD1 ARG 12 7.271 -6.547 6.350 668 HE ARG 12 HE ARG 12 7.877 -6.539 3.574 669 HH11 ARG 12 HH11 ARG 12 9.278 -5.748 6.689 670 HH12 ARG 12 HH12 ARG 12 10.903 -6.067 6.168 671 HH21 ARG 12 HH21 ARG 12 9.980 -6.943 2.895 672 HH22 ARG 12 HH22 ARG 12 11.318 -6.763 4.000 673 H THR 13 HN THR 13 2.053 -4.411 6.376 674 HA THR 13 HA THR 13 1.062 -5.618 8.781 675 HB THR 13 HB THR 13 -0.317 -3.295 8.602 676 HG1 THR 13 HG1 THR 13 0.428 -2.231 6.916 677 HG21 THR 13 HG21 THR 13 1.403 -2.296 9.968 678 HG22 THR 13 HG22 THR 13 2.593 -3.458 9.382 679 HG23 THR 13 HG23 THR 13 1.256 -4.002 10.395 680 H LEU 14 HN LEU 14 -0.276 -4.581 5.694 681 HA LEU 14 HA LEU 14 -2.982 -5.013 6.276 682 HB2 LEU 14 HB2 LEU 14 -2.120 -3.692 4.379 683 HB3 LEU 14 HB1 LEU 14 -1.584 -5.173 3.613 684 HG LEU 14 HG LEU 14 -3.870 -5.922 3.340 685 HD11 LEU 14 HD11 LEU 14 -4.681 -3.359 4.710 686 HD12 LEU 14 HD12 LEU 14 -4.795 -4.972 5.409 687 HD13 LEU 14 HD13 LEU 14 -5.766 -4.552 3.999 688 HD21 LEU 14 HD21 LEU 14 -4.704 -4.059 1.882 689 HD22 LEU 14 HD22 LEU 14 -3.051 -4.583 1.558 690 HD23 LEU 14 HD23 LEU 14 -3.345 -3.093 2.458 691 H ARG 15 HN ARG 15 -0.524 -7.170 4.903 692 HA ARG 15 HA ARG 15 -2.192 -9.293 4.199 693 HB2 ARG 15 HB2 ARG 15 0.673 -8.906 4.633 694 HB3 ARG 15 HB1 ARG 15 0.131 -10.540 4.999 695 HG2 ARG 15 HG2 ARG 15 -0.767 -10.796 2.780 696 HG3 ARG 15 HG1 ARG 15 -0.397 -9.109 2.400 697 HD2 ARG 15 HD2 ARG 15 1.945 -9.520 2.498 698 HD3 ARG 15 HD1 ARG 15 1.702 -11.127 3.183 699 HE ARG 15 HE ARG 15 0.524 -11.548 0.909 700 HH11 ARG 15 HH11 ARG 15 3.391 -9.584 1.419 701 HH12 ARG 15 HH12 ARG 15 4.013 -9.842 -0.179 702 HH21 ARG 15 HH21 ARG 15 1.324 -11.890 -1.191 703 HH22 ARG 15 HH22 ARG 15 2.827 -11.154 -1.672 704 H ALA 16 HN ALA 16 -0.995 -8.324 7.320 705 HA ALA 16 HA ALA 16 -1.866 -10.808 8.557 706 HB1 ALA 16 HB1 ALA 16 0.234 -9.825 9.310 707 HB2 ALA 16 HB2 ALA 16 -0.944 -9.864 10.621 708 HB3 ALA 16 HB3 ALA 16 -0.614 -8.351 9.775 709 H GLN 17 HN GLN 17 -2.736 -7.395 8.456 710 HA GLN 17 HA GLN 17 -4.737 -7.466 10.431 711 HB2 GLN 17 HB2 GLN 17 -3.579 -5.455 9.277 712 HB3 GLN 17 HB1 GLN 17 -4.835 -5.621 8.059 713 HG2 GLN 17 HG2 GLN 17 -5.503 -3.949 9.624 714 HG3 GLN 17 HG1 GLN 17 -6.533 -5.360 9.850 715 HE21 GLN 17 HE21 GLN 17 -6.368 -6.558 11.733 716 HE22 GLN 17 HE22 GLN 17 -5.516 -5.980 13.122 717 H ALA 18 HN ALA 18 -4.793 -8.209 7.008 718 HA ALA 18 HA ALA 18 -7.663 -8.362 6.857 719 HB1 ALA 18 HB1 ALA 18 -5.524 -9.214 4.911 720 HB2 ALA 18 HB2 ALA 18 -6.416 -7.693 4.908 721 HB3 ALA 18 HB3 ALA 18 -7.255 -9.207 4.572 722 H ARG 19 HN ARG 19 -5.618 -10.330 8.427 723 HA ARG 19 HA ARG 19 -6.629 -12.865 7.447 724 HB2 ARG 19 HB2 ARG 19 -4.812 -12.194 9.760 725 HB3 ARG 19 HB1 ARG 19 -5.269 -13.831 9.314 726 HG2 ARG 19 HG2 ARG 19 -3.664 -11.878 7.681 727 HG3 ARG 19 HG1 ARG 19 -3.093 -13.360 8.442 728 HD2 ARG 19 HD2 ARG 19 -5.109 -13.187 6.205 729 HD3 ARG 19 HD1 ARG 19 -3.417 -13.639 6.031 730 HE ARG 19 HE ARG 19 -4.597 -15.346 7.915 731 HH11 ARG 19 HH11 ARG 19 -4.729 -14.666 4.482 732 HH12 ARG 19 HH12 ARG 19 -5.211 -16.283 4.053 733 HH21 ARG 19 HH21 ARG 19 -5.216 -17.459 7.353 734 HH22 ARG 19 HH22 ARG 19 -5.485 -17.869 5.685 735 H GLU 20 HN GLU 20 -7.598 -10.535 9.752 736 HA GLU 20 HA GLU 20 -9.098 -12.512 11.291 737 HB2 GLU 20 HB2 GLU 20 -9.591 -10.733 12.855 738 HB3 GLU 20 HB1 GLU 20 -7.866 -10.783 12.533 739 HG2 GLU 20 HG2 GLU 20 -8.118 -8.881 10.990 740 HG3 GLU 20 HG1 GLU 20 -9.835 -8.809 11.393 741 H CYS 21 H CYS 21 -9.551 -11.147 8.472 742 HA CYS 21 HA CYS 21 -12.494 -10.950 8.824 743 HB2 CYS 21 3HB CYS 21 -10.659 -9.167 7.078 744 HB3 CYS 21 2HB CYS 21 -12.423 -9.152 6.969 745 HG CYS 21 HG CYS 21 -12.891 -7.819 8.882 746 H THR 22 HN THR 22 -13.705 -12.007 7.388 747 HA THR 22 HA THR 22 -12.516 -14.051 5.839 748 HB THR 22 HB THR 22 -15.136 -13.750 4.916 749 HG1 THR 22 HG1 THR 22 -15.926 -12.387 6.381 750 HG21 THR 22 HG21 THR 22 -13.865 -15.797 5.707 751 HG22 THR 22 HG22 THR 22 -15.562 -15.722 6.176 752 HG23 THR 22 HG23 THR 22 -14.306 -15.327 7.349 753 H LEU 23 HN LEU 23 -12.896 -14.394 3.508 754 HA LEU 23 HA LEU 23 -11.835 -12.339 1.946 755 HB2 LEU 23 HB2 LEU 23 -11.616 -14.573 1.183 756 HB3 LEU 23 HB1 LEU 23 -13.346 -14.848 1.246 757 HG LEU 23 HG LEU 23 -13.526 -13.101 -0.613 758 HD11 LEU 23 HD11 LEU 23 -11.535 -12.844 -2.007 759 HD12 LEU 23 HD12 LEU 23 -10.583 -13.708 -0.800 760 HD13 LEU 23 HD13 LEU 23 -11.307 -12.150 -0.402 761 HD21 LEU 23 HD21 LEU 23 -13.186 -14.750 -2.305 762 HD22 LEU 23 HD22 LEU 23 -13.794 -15.562 -0.865 763 HD23 LEU 23 HD23 LEU 23 -12.081 -15.657 -1.274 764 H GLU 24 HN GLU 24 -15.163 -13.343 2.495 765 HA GLU 24 HA GLU 24 -16.498 -11.827 0.609 766 HB2 GLU 24 HB2 GLU 24 -17.486 -13.528 2.197 767 HB3 GLU 24 HB1 GLU 24 -17.449 -12.285 3.441 768 HG2 GLU 24 HG2 GLU 24 -18.778 -10.909 1.650 769 HG3 GLU 24 HG1 GLU 24 -19.176 -12.512 1.035 770 H THR 25 HN THR 25 -15.728 -10.890 3.961 771 HA THR 25 HA THR 25 -16.734 -8.270 3.793 772 HB THR 25 HB THR 25 -14.454 -8.857 5.614 773 HG1 THR 25 HG1 THR 25 -17.030 -10.073 5.924 774 HG21 THR 25 HG21 THR 25 -15.718 -6.764 5.794 775 HG22 THR 25 HG22 THR 25 -15.926 -7.751 7.239 776 HG23 THR 25 HG23 THR 25 -17.208 -7.672 6.028 777 H LEU 26 HN LEU 26 -13.543 -9.632 3.177 778 HA LEU 26 HA LEU 26 -12.149 -7.183 2.951 779 HB2 LEU 26 HB2 LEU 26 -11.564 -9.937 1.898 780 HB3 LEU 26 HB1 LEU 26 -10.472 -8.585 1.678 781 HG LEU 26 HG LEU 26 -11.358 -9.641 4.364 782 HD11 LEU 26 HD11 LEU 26 -8.677 -9.977 3.026 783 HD12 LEU 26 HD12 LEU 26 -9.938 -11.209 3.021 784 HD13 LEU 26 HD13 LEU 26 -9.225 -10.687 4.546 785 HD21 LEU 26 HD21 LEU 26 -9.475 -8.244 5.181 786 HD22 LEU 26 HD22 LEU 26 -10.783 -7.305 4.463 787 HD23 LEU 26 HD23 LEU 26 -9.299 -7.586 3.553 788 H GLU 27 HN GLU 27 -13.496 -9.341 0.448 789 HA GLU 27 HA GLU 27 -12.762 -7.673 -1.716 790 HB2 GLU 27 HB2 GLU 27 -13.430 -10.122 -1.822 791 HB3 GLU 27 HB1 GLU 27 -15.098 -9.585 -1.674 792 HG2 GLU 27 HG2 GLU 27 -15.013 -8.454 -3.747 793 HG3 GLU 27 HG1 GLU 27 -13.260 -8.616 -3.844 794 H GLU 28 HN GLU 28 -15.629 -7.877 0.301 795 HA GLU 28 HA GLU 28 -17.287 -6.144 -1.145 796 HB2 GLU 28 HB2 GLU 28 -17.755 -7.701 0.911 797 HB3 GLU 28 HB1 GLU 28 -17.375 -6.259 1.845 798 HG2 GLU 28 HG2 GLU 28 -19.332 -5.987 -0.357 799 HG3 GLU 28 HG1 GLU 28 -19.839 -6.858 1.087 800 H MET 29 HN MET 29 -14.995 -5.486 1.509 801 HA MET 29 HA MET 29 -15.527 -2.675 1.493 802 HB2 MET 29 HB2 MET 29 -13.867 -2.452 3.133 803 HB3 MET 29 HB1 MET 29 -14.541 -4.048 3.422 804 HG2 MET 29 HG2 MET 29 -12.655 -5.081 2.318 805 HG3 MET 29 HG1 MET 29 -11.998 -3.497 1.912 806 HE1 MET 29 HE1 MET 29 -12.776 -6.085 4.660 807 HE2 MET 29 HE2 MET 29 -13.643 -4.726 5.372 808 HE3 MET 29 HE3 MET 29 -12.175 -5.334 6.138 809 H LEU 30 HN LEU 30 -13.333 -4.781 -0.193 810 HA LEU 30 HA LEU 30 -11.528 -2.865 -1.188 811 HB2 LEU 30 HB2 LEU 30 -10.910 -5.131 -1.385 812 HB3 LEU 30 HB1 LEU 30 -12.427 -5.568 -2.147 813 HG LEU 30 HG LEU 30 -11.670 -4.140 -4.122 814 HD11 LEU 30 HD11 LEU 30 -9.872 -2.969 -2.878 815 HD12 LEU 30 HD12 LEU 30 -9.322 -3.731 -4.368 816 HD13 LEU 30 HD13 LEU 30 -8.981 -4.489 -2.812 817 HD21 LEU 30 HD21 LEU 30 -10.118 -6.627 -3.425 818 HD22 LEU 30 HD22 LEU 30 -10.331 -5.962 -5.042 819 HD23 LEU 30 HD23 LEU 30 -11.722 -6.580 -4.151 820 H GLU 31 HN GLU 31 -14.539 -4.184 -2.509 821 HA GLU 31 HA GLU 31 -14.546 -2.781 -4.933 822 HB2 GLU 31 HB2 GLU 31 -16.796 -3.840 -3.228 823 HB3 GLU 31 HB1 GLU 31 -17.055 -3.128 -4.813 824 HG2 GLU 31 HG2 GLU 31 -15.021 -5.062 -5.098 825 HG3 GLU 31 HG1 GLU 31 -16.311 -5.791 -4.142 826 H LYS 32 HN LYS 32 -15.538 -1.854 -1.701 827 HA LYS 32 HA LYS 32 -16.914 0.507 -2.452 828 HB2 LYS 32 HB2 LYS 32 -16.247 -0.850 -0.016 829 HB3 LYS 32 HB1 LYS 32 -15.834 0.853 0.147 830 HG2 LYS 32 HG2 LYS 32 -18.048 1.533 -0.298 831 HG3 LYS 32 HG1 LYS 32 -18.508 -0.078 -0.851 832 HD2 LYS 32 HD2 LYS 32 -17.737 0.676 1.968 833 HD3 LYS 32 HD1 LYS 32 -19.376 0.371 1.389 834 HE2 LYS 32 HE2 LYS 32 -18.239 -1.914 0.613 835 HE3 LYS 32 HE1 LYS 32 -17.173 -1.530 1.963 836 HZ1 LYS 32 HZ1 LYS 32 -19.016 -2.918 2.666 837 HZ2 LYS 32 HZ2 LYS 32 -20.128 -1.775 2.105 838 HZ3 LYS 32 HZ3 LYS 32 -19.113 -1.391 3.408 839 H LEU 33 HN LEU 33 -13.554 -0.183 -1.576 840 HA LEU 33 HA LEU 33 -12.758 2.561 -1.636 841 HB2 LEU 33 HB2 LEU 33 -11.516 0.738 -0.425 842 HB3 LEU 33 HB1 LEU 33 -11.003 0.126 -1.984 843 HG LEU 33 HG LEU 33 -9.733 2.149 -2.419 844 HD11 LEU 33 HD11 LEU 33 -11.067 3.837 -1.423 845 HD12 LEU 33 HD12 LEU 33 -9.516 3.852 -0.584 846 HD13 LEU 33 HD13 LEU 33 -10.923 3.104 0.173 847 HD21 LEU 33 HD21 LEU 33 -8.051 1.959 -0.659 848 HD22 LEU 33 HD22 LEU 33 -8.636 0.371 -1.152 849 HD23 LEU 33 HD23 LEU 33 -9.203 1.090 0.354 850 H GLU 34 HN GLU 34 -12.909 -0.056 -3.953 851 HA GLU 34 HA GLU 34 -11.426 1.028 -6.041 852 HB2 GLU 34 HB2 GLU 34 -12.098 -1.236 -6.197 853 HB3 GLU 34 HB1 GLU 34 -13.792 -0.835 -5.974 854 HG2 GLU 34 HG2 GLU 34 -13.424 -1.461 -8.256 855 HG3 GLU 34 HG1 GLU 34 -13.786 0.261 -8.186 856 H VAL 35 HN VAL 35 -14.942 1.308 -5.437 857 HA VAL 35 HA VAL 35 -15.395 3.030 -7.634 858 HB VAL 35 HB VAL 35 -17.588 3.496 -6.680 859 HG11 VAL 35 HG11 VAL 35 -16.767 0.610 -6.374 860 HG12 VAL 35 HG12 VAL 35 -17.302 1.401 -7.853 861 HG13 VAL 35 HG13 VAL 35 -18.426 1.188 -6.512 862 HG21 VAL 35 HG21 VAL 35 -16.512 2.146 -4.210 863 HG22 VAL 35 HG22 VAL 35 -18.224 2.423 -4.506 864 HG23 VAL 35 HG23 VAL 35 -17.124 3.794 -4.354 865 H VAL 36 HN VAL 36 -14.409 3.653 -4.337 866 HA VAL 36 HA VAL 36 -14.938 6.451 -4.355 867 HB VAL 36 HB VAL 36 -13.145 4.750 -2.614 868 HG11 VAL 36 HG11 VAL 36 -13.619 7.728 -2.492 869 HG12 VAL 36 HG12 VAL 36 -12.074 6.894 -2.664 870 HG13 VAL 36 HG13 VAL 36 -12.975 6.785 -1.148 871 HG21 VAL 36 HG21 VAL 36 -14.821 5.327 -0.890 872 HG22 VAL 36 HG22 VAL 36 -15.521 4.452 -2.253 873 HG23 VAL 36 HG23 VAL 36 -15.749 6.194 -2.112 874 H VAL 37 HN VAL 37 -12.001 4.514 -4.910 875 HA VAL 37 HA VAL 37 -10.343 6.742 -5.482 876 HB VAL 37 HB VAL 37 -10.024 3.853 -6.335 877 HG11 VAL 37 HG11 VAL 37 -7.995 6.085 -6.296 878 HG12 VAL 37 HG12 VAL 37 -8.685 5.337 -7.738 879 HG13 VAL 37 HG13 VAL 37 -7.659 4.392 -6.659 880 HG21 VAL 37 HG21 VAL 37 -8.634 3.571 -4.430 881 HG22 VAL 37 HG22 VAL 37 -10.118 4.335 -3.866 882 HG23 VAL 37 HG23 VAL 37 -8.657 5.297 -4.075 883 H ASN 38 HN ASN 38 -12.403 4.675 -7.454 884 HA ASN 38 HA ASN 38 -11.598 5.573 -9.985 885 HB2 ASN 38 HB2 ASN 38 -13.068 3.617 -9.632 886 HB3 ASN 38 HB1 ASN 38 -14.366 4.695 -9.134 887 HD21 ASN 38 HD21 ASN 38 -12.416 3.596 -11.802 888 HD22 ASN 38 HD22 ASN 38 -13.434 4.218 -13.058 889 H GLU 39 HN GLU 39 -13.948 6.848 -7.684 890 HA GLU 39 HA GLU 39 -15.003 8.885 -9.323 891 HB2 GLU 39 HB2 GLU 39 -14.784 8.536 -6.342 892 HB3 GLU 39 HB1 GLU 39 -15.449 10.010 -7.034 893 HG2 GLU 39 HG2 GLU 39 -17.034 8.437 -8.313 894 HG3 GLU 39 HG1 GLU 39 -16.530 7.225 -7.134 895 H ARG 40 HN ARG 40 -12.400 8.916 -6.901 896 HA ARG 40 HA ARG 40 -11.659 11.594 -7.169 897 HB2 ARG 40 HB2 ARG 40 -10.192 9.130 -6.296 898 HB3 ARG 40 HB1 ARG 40 -9.335 10.658 -6.447 899 HG2 ARG 40 HG2 ARG 40 -11.802 10.301 -4.768 900 HG3 ARG 40 HG1 ARG 40 -10.162 10.113 -4.149 901 HD2 ARG 40 HD2 ARG 40 -11.461 12.595 -5.249 902 HD3 ARG 40 HD1 ARG 40 -10.845 12.322 -3.623 903 HE ARG 40 HE ARG 40 -9.230 12.774 -6.038 904 HH11 ARG 40 HH11 ARG 40 -9.404 12.434 -2.539 905 HH12 ARG 40 HH12 ARG 40 -7.832 13.122 -2.283 906 HH21 ARG 40 HH21 ARG 40 -7.195 13.675 -5.684 907 HH22 ARG 40 HH22 ARG 40 -6.600 13.861 -4.054 908 H ARG 41 HN ARG 41 -10.766 8.751 -9.024 909 HA ARG 41 HA ARG 41 -8.685 9.814 -10.561 910 HB2 ARG 41 HB2 ARG 41 -10.662 7.606 -10.952 911 HB3 ARG 41 HB1 ARG 41 -9.716 8.127 -12.337 912 HG2 ARG 41 HG2 ARG 41 -7.656 7.666 -11.098 913 HG3 ARG 41 HG1 ARG 41 -8.614 7.116 -9.718 914 HD2 ARG 41 HD2 ARG 41 -9.432 5.256 -10.897 915 HD3 ARG 41 HD1 ARG 41 -8.936 5.917 -12.453 916 HE ARG 41 HE ARG 41 -6.672 5.511 -10.810 917 HH11 ARG 41 HH11 ARG 41 -9.064 3.718 -12.650 918 HH12 ARG 41 HH12 ARG 41 -7.996 2.391 -12.970 919 HH21 ARG 41 HH21 ARG 41 -5.284 3.779 -11.224 920 HH22 ARG 41 HH22 ARG 41 -5.843 2.418 -12.158 921 H GLU 42 HN GLU 42 -12.172 9.770 -11.109 922 HA GLU 42 HA GLU 42 -12.075 11.153 -13.592 923 HB2 GLU 42 HB2 GLU 42 -13.958 9.693 -12.327 924 HB3 GLU 42 HB1 GLU 42 -14.533 11.307 -11.939 925 HG2 GLU 42 HG2 GLU 42 -15.142 11.752 -14.071 926 HG3 GLU 42 HG1 GLU 42 -13.829 10.798 -14.762 927 H GLU 43 HN GLU 43 -12.584 12.161 -10.234 928 HA GLU 43 HA GLU 43 -13.339 14.810 -10.681 929 HB2 GLU 43 HB2 GLU 43 -11.712 13.651 -8.415 930 HB3 GLU 43 HB1 GLU 43 -12.393 15.269 -8.424 931 HG2 GLU 43 HG2 GLU 43 -14.649 14.265 -8.630 932 HG3 GLU 43 HG1 GLU 43 -13.909 12.675 -8.441 933 H GLU 44 HN GLU 44 -10.131 13.369 -10.492 934 HA GLU 44 HA GLU 44 -8.770 15.879 -10.656 935 HB2 GLU 44 HB2 GLU 44 -8.051 13.072 -10.332 936 HB3 GLU 44 HB1 GLU 44 -6.921 13.953 -11.354 937 HG2 GLU 44 HG2 GLU 44 -6.005 14.242 -9.281 938 HG3 GLU 44 HG1 GLU 44 -6.963 15.709 -9.453 939 H SER 45 HN SER 45 -9.379 13.237 -12.968 940 HA SER 45 HA SER 45 -7.897 14.439 -15.073 941 HB2 SER 45 HB2 SER 45 -9.176 12.766 -16.505 942 HB3 SER 45 HB1 SER 45 -8.197 12.099 -15.202 943 HG SER 45 HG SER 45 -9.953 11.435 -14.202 944 H ALA 46 HN ALA 46 -11.300 14.554 -14.152 945 HA ALA 46 HA ALA 46 -12.023 16.020 -16.541 946 HB1 ALA 46 HB1 ALA 46 -13.570 14.392 -15.528 947 HB2 ALA 46 HB2 ALA 46 -14.272 16.002 -15.684 948 HB3 ALA 46 HB3 ALA 46 -13.702 15.435 -14.115 949 H GLU 3 HN GLU 3 -9.598 -1.871 14.841 950 HA GLU 3 HA GLU 3 -12.317 -0.861 14.606 951 HB2 GLU 3 HB2 GLU 3 -10.593 1.268 15.231 952 HB3 GLU 3 HB1 GLU 3 -11.651 0.399 16.330 953 HG2 GLU 3 HG2 GLU 3 -9.560 0.346 17.341 954 HG3 GLU 3 HG1 GLU 3 -9.743 -1.252 16.620 955 H ALA 4 HN ALA 4 -9.197 -0.606 13.066 956 HA ALA 4 HA ALA 4 -9.769 1.580 11.364 957 HB1 ALA 4 HB1 ALA 4 -7.826 -0.659 10.822 958 HB2 ALA 4 HB2 ALA 4 -7.488 0.696 11.899 959 HB3 ALA 4 HB3 ALA 4 -7.777 0.985 10.183 960 H LEU 5 HN LEU 5 -10.280 -1.893 11.087 961 HA LEU 5 HA LEU 5 -11.087 -1.756 8.327 962 HB2 LEU 5 HB2 LEU 5 -11.469 -3.991 10.321 963 HB3 LEU 5 HB1 LEU 5 -11.671 -4.117 8.587 964 HG LEU 5 HG LEU 5 -9.082 -3.651 10.073 965 HD11 LEU 5 HD11 LEU 5 -8.459 -5.819 9.243 966 HD12 LEU 5 HD12 LEU 5 -9.965 -5.950 8.332 967 HD13 LEU 5 HD13 LEU 5 -9.996 -5.954 10.096 968 HD21 LEU 5 HD21 LEU 5 -8.012 -3.779 7.857 969 HD22 LEU 5 HD22 LEU 5 -9.058 -2.368 8.015 970 HD23 LEU 5 HD23 LEU 5 -9.606 -3.774 7.101 971 H LYS 6 HN LYS 6 -12.581 -0.971 11.224 972 HA LYS 6 HA LYS 6 -15.240 -1.836 10.642 973 HB2 LYS 6 HB2 LYS 6 -14.683 -1.452 12.936 974 HB3 LYS 6 HB1 LYS 6 -14.122 0.177 12.593 975 HG2 LYS 6 HG2 LYS 6 -16.256 0.240 13.716 976 HG3 LYS 6 HG1 LYS 6 -16.423 0.847 12.068 977 HD2 LYS 6 HD2 LYS 6 -17.309 -1.312 11.354 978 HD3 LYS 6 HD1 LYS 6 -17.134 -1.935 12.997 979 HE2 LYS 6 HE2 LYS 6 -18.943 0.279 12.058 980 HE3 LYS 6 HE1 LYS 6 -19.420 -1.307 12.658 981 HZ1 LYS 6 HZ1 LYS 6 -18.271 -0.620 14.788 982 HZ2 LYS 6 HZ2 LYS 6 -19.731 0.147 14.436 983 HZ3 LYS 6 HZ3 LYS 6 -18.272 0.958 14.172 984 H ILE 7 HN ILE 7 -13.688 1.381 10.570 985 HA ILE 7 HA ILE 7 -15.937 2.554 9.229 986 HB ILE 7 HB ILE 7 -14.669 4.594 9.100 987 HG12 ILE 7 HG12 ILE 7 -12.460 3.172 8.652 988 HG13 ILE 7 HG11 ILE 7 -12.397 4.816 9.270 989 HG21 ILE 7 HG21 ILE 7 -15.697 4.120 11.211 990 HG22 ILE 7 HG22 ILE 7 -14.155 4.937 11.486 991 HG23 ILE 7 HG23 ILE 7 -14.289 3.197 11.739 992 HD11 ILE 7 HD11 ILE 7 -10.862 3.468 10.496 993 HD12 ILE 7 HD12 ILE 7 -12.107 2.264 10.832 994 HD13 ILE 7 HD13 ILE 7 -12.210 3.869 11.563 995 H LEU 8 HN LEU 8 -13.358 0.678 8.231 996 HA LEU 8 HA LEU 8 -12.878 1.791 5.654 997 HB2 LEU 8 HB2 LEU 8 -11.409 0.202 7.054 998 HB3 LEU 8 HB1 LEU 8 -12.427 -1.077 6.427 999 HG LEU 8 HG LEU 8 -11.709 -0.644 4.172 1000 HD11 LEU 8 HD11 LEU 8 -10.726 1.871 5.362 1001 HD12 LEU 8 HD12 LEU 8 -11.377 1.550 3.754 1002 HD13 LEU 8 HD13 LEU 8 -9.703 1.142 4.126 1003 HD21 LEU 8 HD21 LEU 8 -9.351 -0.630 6.057 1004 HD22 LEU 8 HD22 LEU 8 -9.321 -1.131 4.367 1005 HD23 LEU 8 HD23 LEU 8 -10.255 -2.054 5.541 1006 H ASN 9 HN ASN 9 -15.312 -0.239 7.003 1007 HA ASN 9 HA ASN 9 -16.171 -1.209 4.386 1008 HB2 ASN 9 HB2 ASN 9 -16.189 -2.625 6.537 1009 HB3 ASN 9 HB1 ASN 9 -17.608 -1.686 6.993 1010 HD21 ASN 9 HD21 ASN 9 -16.311 -3.981 4.715 1011 HD22 ASN 9 HD22 ASN 9 -17.835 -4.526 4.090 1012 H ASN 10 HN ASN 10 -16.555 1.523 6.193 1013 HA ASN 10 HA ASN 10 -19.342 1.989 5.470 1014 HB2 ASN 10 HB2 ASN 10 -17.345 3.547 7.106 1015 HB3 ASN 10 HB1 ASN 10 -18.905 4.216 6.648 1016 HD21 ASN 10 HD21 ASN 10 -18.552 4.184 9.196 1017 HD22 ASN 10 HD22 ASN 10 -19.371 2.882 9.987 1018 H ILE 11 HN ILE 11 -19.661 2.591 3.429 1019 HA ILE 11 HA ILE 11 -17.744 3.680 1.718 1020 HB ILE 11 HB ILE 11 -19.621 2.604 0.741 1021 HG12 ILE 11 HG12 ILE 11 -20.692 4.579 -0.610 1022 HG13 ILE 11 HG11 ILE 11 -19.476 5.544 0.217 1023 HG21 ILE 11 HG21 ILE 11 -21.912 3.319 0.973 1024 HG22 ILE 11 HG22 ILE 11 -21.412 4.663 2.000 1025 HG23 ILE 11 HG23 ILE 11 -21.213 3.003 2.562 1026 HD11 ILE 11 HD11 ILE 11 -18.976 3.188 -1.585 1027 HD12 ILE 11 HD12 ILE 11 -17.731 4.073 -0.699 1028 HD13 ILE 11 HD13 ILE 11 -18.672 4.887 -1.949 1029 H ARG 12 HN ARG 12 -20.055 5.256 3.864 1030 HA ARG 12 HA ARG 12 -19.668 7.878 2.796 1031 HB2 ARG 12 HB2 ARG 12 -20.798 6.925 5.434 1032 HB3 ARG 12 HB1 ARG 12 -20.737 8.617 4.963 1033 HG2 ARG 12 HG2 ARG 12 -22.199 6.437 3.491 1034 HG3 ARG 12 HG1 ARG 12 -22.928 7.650 4.544 1035 HD2 ARG 12 HD2 ARG 12 -22.071 9.413 3.031 1036 HD3 ARG 12 HD1 ARG 12 -21.468 8.155 1.956 1037 HE ARG 12 HE ARG 12 -23.751 7.498 1.539 1038 HH11 ARG 12 HH11 ARG 12 -23.320 10.564 3.192 1039 HH12 ARG 12 HH12 ARG 12 -24.877 11.173 2.743 1040 HH21 ARG 12 HH21 ARG 12 -25.813 8.330 0.931 1041 HH22 ARG 12 HH22 ARG 12 -26.293 9.905 1.479 1042 H THR 13 HN THR 13 -18.412 6.247 5.708 1043 HA THR 13 HA THR 13 -16.803 8.401 6.569 1044 HB THR 13 HB THR 13 -16.104 5.540 7.141 1045 HG1 THR 13 HG1 THR 13 -18.068 6.831 8.676 1046 HG21 THR 13 HG21 THR 13 -16.129 8.062 8.796 1047 HG22 THR 13 HG22 THR 13 -14.705 7.255 8.129 1048 HG23 THR 13 HG23 THR 13 -15.670 6.468 9.377 1049 H LEU 14 HN LEU 14 -16.141 5.570 4.569 1050 HA LEU 14 HA LEU 14 -13.367 5.904 4.290 1051 HB2 LEU 14 HB2 LEU 14 -14.581 3.856 3.703 1052 HB3 LEU 14 HB1 LEU 14 -15.353 4.689 2.368 1053 HG LEU 14 HG LEU 14 -13.183 4.943 1.256 1054 HD11 LEU 14 HD11 LEU 14 -11.242 3.668 2.171 1055 HD12 LEU 14 HD12 LEU 14 -12.149 3.474 3.671 1056 HD13 LEU 14 HD13 LEU 14 -11.693 5.085 3.119 1057 HD21 LEU 14 HD21 LEU 14 -14.550 2.962 0.802 1058 HD22 LEU 14 HD22 LEU 14 -13.754 2.112 2.127 1059 HD23 LEU 14 HD23 LEU 14 -12.827 2.590 0.705 1060 H ARG 15 HN ARG 15 -16.038 6.993 2.220 1061 HA ARG 15 HA ARG 15 -14.489 8.266 0.263 1062 HB2 ARG 15 HB2 ARG 15 -17.097 7.729 0.494 1063 HB3 ARG 15 HB1 ARG 15 -17.137 9.416 0.984 1064 HG2 ARG 15 HG2 ARG 15 -16.103 10.067 -1.124 1065 HG3 ARG 15 HG1 ARG 15 -16.040 8.370 -1.617 1066 HD2 ARG 15 HD2 ARG 15 -18.451 8.222 -1.559 1067 HD3 ARG 15 HD1 ARG 15 -18.565 9.863 -0.923 1068 HE ARG 15 HE ARG 15 -17.911 9.079 -3.677 1069 HH11 ARG 15 HH11 ARG 15 -18.411 11.634 -1.320 1070 HH12 ARG 15 HH12 ARG 15 -18.709 12.853 -2.514 1071 HH21 ARG 15 HH21 ARG 15 -18.309 10.701 -5.248 1072 HH22 ARG 15 HH22 ARG 15 -18.625 12.333 -4.729 1073 H ALA 16 HN ALA 16 -15.525 9.316 3.425 1074 HA ALA 16 HA ALA 16 -14.903 12.084 3.006 1075 HB1 ALA 16 HB1 ALA 16 -15.408 12.381 5.331 1076 HB2 ALA 16 HB2 ALA 16 -15.282 10.646 5.628 1077 HB3 ALA 16 HB3 ALA 16 -16.600 11.278 4.640 1078 H GLN 17 HN GLN 17 -13.283 9.381 4.700 1079 HA GLN 17 HA GLN 17 -11.072 11.030 5.480 1080 HB2 GLN 17 HB2 GLN 17 -12.019 8.532 6.241 1081 HB3 GLN 17 HB1 GLN 17 -10.478 8.189 5.465 1082 HG2 GLN 17 HG2 GLN 17 -9.507 10.019 6.933 1083 HG3 GLN 17 HG1 GLN 17 -11.015 9.944 7.838 1084 HE21 GLN 17 HE21 GLN 17 -8.320 9.372 8.723 1085 HE22 GLN 17 HE22 GLN 17 -8.321 7.737 9.290 1086 H ALA 18 HN ALA 18 -11.859 9.218 2.659 1087 HA ALA 18 HA ALA 18 -9.234 8.780 1.690 1088 HB1 ALA 18 HB1 ALA 18 -11.144 7.568 0.789 1089 HB2 ALA 18 HB2 ALA 18 -10.300 8.437 -0.492 1090 HB3 ALA 18 HB3 ALA 18 -11.815 9.072 0.152 1091 H ARG 19 HN ARG 19 -11.152 11.593 1.963 1092 HA ARG 19 HA ARG 19 -9.838 13.018 -0.182 1093 HB2 ARG 19 HB2 ARG 19 -11.857 13.838 1.898 1094 HB3 ARG 19 HB1 ARG 19 -11.136 14.985 0.773 1095 HG2 ARG 19 HG2 ARG 19 -12.019 13.716 -1.105 1096 HG3 ARG 19 HG1 ARG 19 -12.731 12.548 0.007 1097 HD2 ARG 19 HD2 ARG 19 -14.212 14.177 0.892 1098 HD3 ARG 19 HD1 ARG 19 -13.379 15.483 0.051 1099 HE ARG 19 HE ARG 19 -14.247 13.755 -1.920 1100 HH11 ARG 19 HH11 ARG 19 -15.723 15.626 0.640 1101 HH12 ARG 19 HH12 ARG 19 -17.179 15.938 -0.254 1102 HH21 ARG 19 HH21 ARG 19 -16.174 14.128 -3.090 1103 HH22 ARG 19 HH22 ARG 19 -17.434 15.090 -2.387 1104 H GLU 20 HN GLU 20 -8.714 12.005 2.634 1105 HA GLU 20 HA GLU 20 -7.473 14.461 3.548 1106 HB2 GLU 20 HB2 GLU 20 -7.477 11.622 4.504 1107 HB3 GLU 20 HB1 GLU 20 -6.256 12.741 5.091 1108 HG2 GLU 20 HG2 GLU 20 -8.519 14.187 5.449 1109 HG3 GLU 20 HG1 GLU 20 -9.105 12.547 5.723 1110 H CYS 21 H CYS 21 -6.776 12.036 1.264 1111 HA CYS 21 HA CYS 21 -3.995 13.050 1.087 1112 HB2 CYS 21 3HB CYS 21 -4.882 10.084 0.935 1113 HB3 CYS 21 2HB CYS 21 -3.251 10.648 0.550 1114 HG CYS 21 HG CYS 21 -2.417 10.880 2.765 1115 H THR 22 HN THR 22 -2.993 12.421 -1.009 1116 HA THR 22 HA THR 22 -4.662 13.378 -3.127 1117 HB THR 22 HB THR 22 -2.328 12.562 -4.318 1118 HG1 THR 22 HG1 THR 22 -0.708 12.636 -2.873 1119 HG21 THR 22 HG21 THR 22 -1.716 14.847 -4.316 1120 HG22 THR 22 HG22 THR 22 -2.566 15.148 -2.800 1121 HG23 THR 22 HG23 THR 22 -3.481 14.828 -4.273 1122 H LEU 23 HN LEU 23 -4.651 12.278 -5.284 1123 HA LEU 23 HA LEU 23 -5.834 9.741 -5.116 1124 HB2 LEU 23 HB2 LEU 23 -6.321 11.317 -6.900 1125 HB3 LEU 23 HB1 LEU 23 -4.674 11.207 -7.488 1126 HG LEU 23 HG LEU 23 -5.060 8.848 -8.097 1127 HD11 LEU 23 HD11 LEU 23 -6.721 8.188 -6.517 1128 HD12 LEU 23 HD12 LEU 23 -7.422 8.033 -8.125 1129 HD13 LEU 23 HD13 LEU 23 -7.850 9.408 -7.105 1130 HD21 LEU 23 HD21 LEU 23 -6.418 9.277 -10.027 1131 HD22 LEU 23 HD22 LEU 23 -5.454 10.715 -9.693 1132 HD23 LEU 23 HD23 LEU 23 -7.158 10.674 -9.249 1133 H GLU 24 HN GLU 24 -2.538 10.737 -5.739 1134 HA GLU 24 HA GLU 24 -1.473 8.401 -6.794 1135 HB2 GLU 24 HB2 GLU 24 -0.265 10.585 -6.572 1136 HB3 GLU 24 HB1 GLU 24 -0.074 10.254 -4.856 1137 HG2 GLU 24 HG2 GLU 24 0.927 7.980 -5.928 1138 HG3 GLU 24 HG1 GLU 24 1.359 9.159 -7.165 1139 H THR 25 HN THR 25 -1.564 9.397 -3.376 1140 HA THR 25 HA THR 25 -0.553 6.960 -2.382 1141 HB THR 25 HB THR 25 -2.090 8.141 -0.351 1142 HG1 THR 25 HG1 THR 25 -1.975 10.266 -0.667 1143 HG21 THR 25 HG21 THR 25 0.218 7.217 -0.207 1144 HG22 THR 25 HG22 THR 25 0.052 8.798 0.555 1145 HG23 THR 25 HG23 THR 25 0.810 8.659 -1.032 1146 H LEU 26 HN LEU 26 -3.840 8.200 -2.820 1147 HA LEU 26 HA LEU 26 -5.227 6.131 -1.535 1148 HB2 LEU 26 HB2 LEU 26 -6.020 7.863 -3.870 1149 HB3 LEU 26 HB1 LEU 26 -7.121 6.774 -3.051 1150 HG LEU 26 HG LEU 26 -5.730 9.127 -1.762 1151 HD11 LEU 26 HD11 LEU 26 -8.610 8.771 -2.599 1152 HD12 LEU 26 HD12 LEU 26 -7.425 9.802 -3.401 1153 HD13 LEU 26 HD13 LEU 26 -7.934 10.161 -1.752 1154 HD21 LEU 26 HD21 LEU 26 -6.120 7.473 -0.095 1155 HD22 LEU 26 HD22 LEU 26 -7.724 7.117 -0.738 1156 HD23 LEU 26 HD23 LEU 26 -7.419 8.658 0.054 1157 H GLU 27 HN GLU 27 -4.257 6.490 -4.919 1158 HA GLU 27 HA GLU 27 -5.401 4.059 -5.797 1159 HB2 GLU 27 HB2 GLU 27 -4.794 5.976 -7.267 1160 HB3 GLU 27 HB1 GLU 27 -3.099 5.592 -7.008 1161 HG2 GLU 27 HG2 GLU 27 -3.473 3.380 -8.009 1162 HG3 GLU 27 HG1 GLU 27 -5.149 3.834 -8.327 1163 H GLU 28 HN GLU 28 -2.049 4.939 -4.907 1164 HA GLU 28 HA GLU 28 -0.908 2.445 -5.418 1165 HB2 GLU 28 HB2 GLU 28 0.133 4.794 -4.633 1166 HB3 GLU 28 HB1 GLU 28 0.157 3.953 -3.090 1167 HG2 GLU 28 HG2 GLU 28 1.310 2.050 -4.388 1168 HG3 GLU 28 HG1 GLU 28 1.595 3.270 -5.625 1169 H MET 29 HN MET 29 -2.554 3.632 -2.498 1170 HA MET 29 HA MET 29 -1.939 1.258 -1.021 1171 HB2 MET 29 HB2 MET 29 -3.201 2.139 0.748 1172 HB3 MET 29 HB1 MET 29 -2.500 3.544 -0.035 1173 HG2 MET 29 HG2 MET 29 -4.608 3.982 -1.161 1174 HG3 MET 29 HG1 MET 29 -5.316 2.551 -0.415 1175 HE1 MET 29 HE1 MET 29 -3.603 6.003 0.298 1176 HE2 MET 29 HE2 MET 29 -2.794 4.946 1.452 1177 HE3 MET 29 HE3 MET 29 -3.887 6.200 2.028 1178 H LEU 30 HN LEU 30 -4.569 2.247 -3.124 1179 HA LEU 30 HA LEU 30 -6.375 0.178 -2.425 1180 HB2 LEU 30 HB2 LEU 30 -7.306 1.971 -3.641 1181 HB3 LEU 30 HB1 LEU 30 -6.048 1.912 -4.860 1182 HG LEU 30 HG LEU 30 -7.024 -0.385 -5.489 1183 HD11 LEU 30 HD11 LEU 30 -9.406 -0.660 -4.994 1184 HD12 LEU 30 HD12 LEU 30 -9.345 0.747 -3.933 1185 HD13 LEU 30 HD13 LEU 30 -8.423 -0.704 -3.531 1186 HD21 LEU 30 HD21 LEU 30 -8.757 0.666 -6.901 1187 HD22 LEU 30 HD22 LEU 30 -7.220 1.529 -6.939 1188 HD23 LEU 30 HD23 LEU 30 -8.563 2.159 -5.984 1189 H GLU 31 HN GLU 31 -3.789 0.486 -4.776 1190 HA GLU 31 HA GLU 31 -4.150 -1.954 -6.125 1191 HB2 GLU 31 HB2 GLU 31 -1.627 -0.355 -5.650 1192 HB3 GLU 31 HB1 GLU 31 -1.796 -1.650 -6.829 1193 HG2 GLU 31 HG2 GLU 31 -3.445 -0.382 -8.045 1194 HG3 GLU 31 HG1 GLU 31 -3.418 0.886 -6.824 1195 H LYS 32 HN LYS 32 -2.583 -1.124 -3.123 1196 HA LYS 32 HA LYS 32 -1.297 -3.690 -2.839 1197 HB2 LYS 32 HB2 LYS 32 -1.699 -1.467 -0.836 1198 HB3 LYS 32 HB1 LYS 32 -0.656 -2.864 -0.619 1199 HG2 LYS 32 HG2 LYS 32 0.721 -2.149 -2.494 1200 HG3 LYS 32 HG1 LYS 32 -0.340 -0.765 -2.754 1201 HD2 LYS 32 HD2 LYS 32 0.212 -0.049 -0.403 1202 HD3 LYS 32 HD1 LYS 32 1.455 -1.303 -0.400 1203 HE2 LYS 32 HE2 LYS 32 2.386 -0.237 -2.475 1204 HE3 LYS 32 HE1 LYS 32 1.260 1.094 -2.214 1205 HZ1 LYS 32 HZ1 LYS 32 3.261 1.758 -1.253 1206 HZ2 LYS 32 HZ2 LYS 32 3.528 0.250 -0.516 1207 HZ3 LYS 32 HZ3 LYS 32 2.308 1.270 0.063 1208 H LEU 33 HN LEU 33 -4.380 -2.394 -2.249 1209 HA LEU 33 HA LEU 33 -5.060 -4.283 -0.160 1210 HB2 LEU 33 HB2 LEU 33 -6.029 -2.034 -0.122 1211 HB3 LEU 33 HB1 LEU 33 -6.779 -2.325 -1.680 1212 HG LEU 33 HG LEU 33 -8.098 -4.180 -0.614 1213 HD11 LEU 33 HD11 LEU 33 -6.826 -4.736 1.288 1214 HD12 LEU 33 HD12 LEU 33 -8.292 -3.972 1.902 1215 HD13 LEU 33 HD13 LEU 33 -6.783 -3.066 1.846 1216 HD21 LEU 33 HD21 LEU 33 -8.555 -1.536 0.735 1217 HD22 LEU 33 HD22 LEU 33 -9.747 -2.744 0.268 1218 HD23 LEU 33 HD23 LEU 33 -8.909 -1.808 -0.970 1219 H GLU 34 HN GLU 34 -5.718 -3.795 -3.606 1220 HA GLU 34 HA GLU 34 -7.551 -5.940 -3.819 1221 HB2 GLU 34 HB2 GLU 34 -7.192 -5.769 -6.250 1222 HB3 GLU 34 HB1 GLU 34 -7.501 -4.210 -5.502 1223 HG2 GLU 34 HG2 GLU 34 -5.139 -3.669 -5.598 1224 HG3 GLU 34 HG1 GLU 34 -4.789 -5.256 -6.282 1225 H VAL 35 HN VAL 35 -4.055 -5.810 -3.916 1226 HA VAL 35 HA VAL 35 -3.754 -8.422 -5.026 1227 HB VAL 35 HB VAL 35 -1.387 -8.269 -4.360 1228 HG11 VAL 35 HG11 VAL 35 -2.087 -7.356 -6.484 1229 HG12 VAL 35 HG12 VAL 35 -0.816 -6.351 -5.792 1230 HG13 VAL 35 HG13 VAL 35 -2.496 -5.822 -5.723 1231 HG21 VAL 35 HG21 VAL 35 -2.237 -5.673 -3.087 1232 HG22 VAL 35 HG22 VAL 35 -0.563 -6.115 -3.420 1233 HG23 VAL 35 HG23 VAL 35 -1.518 -7.070 -2.287 1234 H VAL 36 HN VAL 36 -3.986 -7.158 -1.738 1235 HA VAL 36 HA VAL 36 -3.217 -9.623 -0.519 1236 HB VAL 36 HB VAL 36 -3.204 -7.298 0.588 1237 HG11 VAL 36 HG11 VAL 36 -5.465 -6.606 0.205 1238 HG12 VAL 36 HG12 VAL 36 -5.223 -6.798 1.940 1239 HG13 VAL 36 HG13 VAL 36 -6.091 -8.035 1.030 1240 HG21 VAL 36 HG21 VAL 36 -3.084 -8.271 2.662 1241 HG22 VAL 36 HG22 VAL 36 -2.924 -9.684 1.615 1242 HG23 VAL 36 HG23 VAL 36 -4.473 -9.315 2.372 1243 H VAL 37 HN VAL 37 -6.198 -8.244 -1.686 1244 HA VAL 37 HA VAL 37 -7.914 -10.200 -0.506 1245 HB VAL 37 HB VAL 37 -8.334 -8.342 -2.857 1246 HG11 VAL 37 HG11 VAL 37 -10.374 -10.058 -1.437 1247 HG12 VAL 37 HG12 VAL 37 -9.786 -10.300 -3.083 1248 HG13 VAL 37 HG13 VAL 37 -10.717 -8.855 -2.683 1249 HG21 VAL 37 HG21 VAL 37 -9.308 -6.854 -1.411 1250 HG22 VAL 37 HG22 VAL 37 -8.067 -7.548 -0.369 1251 HG23 VAL 37 HG23 VAL 37 -9.737 -8.100 -0.240 1252 H ASN 38 HN ASN 38 -6.174 -9.849 -3.526 1253 HA ASN 38 HA ASN 38 -7.229 -11.999 -4.961 1254 HB2 ASN 38 HB2 ASN 38 -5.493 -10.165 -5.651 1255 HB3 ASN 38 HB1 ASN 38 -4.305 -11.332 -5.080 1256 HD21 ASN 38 HD21 ASN 38 -4.240 -13.437 -6.130 1257 HD22 ASN 38 HD22 ASN 38 -4.778 -13.575 -7.773 1258 H GLU 39 HN GLU 39 -4.606 -11.804 -2.611 1259 HA GLU 39 HA GLU 39 -3.720 -14.466 -2.767 1260 HB2 GLU 39 HB2 GLU 39 -2.913 -12.250 -1.415 1261 HB3 GLU 39 HB1 GLU 39 -3.625 -13.189 -0.109 1262 HG2 GLU 39 HG2 GLU 39 -1.991 -14.739 -0.150 1263 HG3 GLU 39 HG1 GLU 39 -1.805 -14.651 -1.902 1264 H ARG 40 HN ARG 40 -6.323 -12.944 -0.980 1265 HA ARG 40 HA ARG 40 -6.958 -15.252 0.581 1266 HB2 ARG 40 HB2 ARG 40 -8.296 -12.630 0.028 1267 HB3 ARG 40 HB1 ARG 40 -9.216 -13.923 0.785 1268 HG2 ARG 40 HG2 ARG 40 -6.612 -12.857 1.854 1269 HG3 ARG 40 HG1 ARG 40 -8.205 -12.306 2.380 1270 HD2 ARG 40 HD2 ARG 40 -8.272 -15.107 2.511 1271 HD3 ARG 40 HD1 ARG 40 -6.716 -14.630 3.188 1272 HE ARG 40 HE ARG 40 -8.641 -12.981 4.333 1273 HH11 ARG 40 HH11 ARG 40 -7.835 -16.401 4.276 1274 HH12 ARG 40 HH12 ARG 40 -8.532 -16.708 5.843 1275 HH21 ARG 40 HH21 ARG 40 -9.549 -13.401 6.399 1276 HH22 ARG 40 HH22 ARG 40 -9.502 -15.016 7.041 1277 H ARG 41 HN ARG 41 -7.865 -14.030 -2.569 1278 HA ARG 41 HA ARG 41 -10.114 -15.704 -3.006 1279 HB2 ARG 41 HB2 ARG 41 -8.193 -14.388 -4.937 1280 HB3 ARG 41 HB1 ARG 41 -9.611 -15.285 -5.453 1281 HG2 ARG 41 HG2 ARG 41 -9.766 -12.923 -3.608 1282 HG3 ARG 41 HG1 ARG 41 -9.833 -12.776 -5.367 1283 HD2 ARG 41 HD2 ARG 41 -11.723 -14.395 -3.664 1284 HD3 ARG 41 HD1 ARG 41 -12.069 -12.812 -4.352 1285 HE ARG 41 HE ARG 41 -11.383 -15.035 -6.134 1286 HH11 ARG 41 HH11 ARG 41 -13.742 -12.705 -4.970 1287 HH12 ARG 41 HH12 ARG 41 -14.869 -13.040 -6.251 1288 HH21 ARG 41 HH21 ARG 41 -12.844 -15.435 -7.829 1289 HH22 ARG 41 HH22 ARG 41 -14.357 -14.586 -7.878 1290 H GLU 42 HN GLU 42 -6.679 -15.992 -3.827 1291 HA GLU 42 HA GLU 42 -6.827 -18.541 -5.037 1292 HB2 GLU 42 HB2 GLU 42 -4.424 -17.391 -3.607 1293 HB3 GLU 42 HB1 GLU 42 -4.431 -18.582 -4.900 1294 HG2 GLU 42 HG2 GLU 42 -4.918 -17.007 -6.527 1295 HG3 GLU 42 HG1 GLU 42 -5.519 -15.837 -5.353 1296 H GLU 43 HN GLU 43 -7.149 -17.586 -1.843 1297 HA GLU 43 HA GLU 43 -6.110 -20.008 -0.649 1298 HB2 GLU 43 HB2 GLU 43 -5.995 -17.620 0.301 1299 HB3 GLU 43 HB1 GLU 43 -7.686 -17.840 0.717 1300 HG2 GLU 43 HG2 GLU 43 -7.161 -19.638 2.192 1301 HG3 GLU 43 HG1 GLU 43 -5.484 -19.661 1.647 1302 H GLU 44 HN GLU 44 -9.276 -18.341 -0.736 1303 HA GLU 44 HA GLU 44 -10.616 -20.649 0.308 1304 HB2 GLU 44 HB2 GLU 44 -11.657 -18.041 -0.782 1305 HB3 GLU 44 HB1 GLU 44 -12.692 -19.305 -0.135 1306 HG2 GLU 44 HG2 GLU 44 -10.915 -19.018 1.893 1307 HG3 GLU 44 HG1 GLU 44 -10.975 -17.374 1.262 1308 H SER 45 HN SER 45 -10.173 -19.293 -2.921 1309 HA SER 45 HA SER 45 -12.142 -20.974 -4.130 1310 HB2 SER 45 HB2 SER 45 -9.874 -19.432 -5.406 1311 HB3 SER 45 HB1 SER 45 -11.214 -20.180 -6.275 1312 HG SER 45 HG SER 45 -12.572 -18.819 -4.829 1313 H ALA 46 HN ALA 46 -9.185 -21.670 -2.835 1314 HA ALA 46 HA ALA 46 -8.770 -23.941 -4.672 1315 HB1 ALA 46 HB1 ALA 46 -6.878 -22.372 -4.609 1316 HB2 ALA 46 HB2 ALA 46 -6.440 -23.954 -3.971 1317 HB3 ALA 46 HB3 ALA 46 -6.741 -22.614 -2.864 Start of MODEL 5 1 H LEU 6 HT1 LEU 6 8.473 15.965 5.491 2 HA LEU 6 HA LEU 6 11.016 16.086 3.996 3 HB2 LEU 6 HB2 LEU 6 11.256 15.174 6.278 4 HB3 LEU 6 HB1 LEU 6 9.984 14.016 5.935 5 HG LEU 6 HG LEU 6 11.396 12.970 4.214 6 HD11 LEU 6 HD11 LEU 6 13.495 14.924 5.143 7 HD12 LEU 6 HD12 LEU 6 12.719 14.912 3.562 8 HD13 LEU 6 HD13 LEU 6 13.759 13.573 4.044 9 HD21 LEU 6 HD21 LEU 6 13.017 11.960 5.737 10 HD22 LEU 6 HD22 LEU 6 11.431 12.116 6.487 11 HD23 LEU 6 HD23 LEU 6 12.718 13.242 6.912 12 H THR 7 HN THR 7 10.918 15.202 2.034 13 HA THR 7 HA THR 7 8.415 13.976 1.187 14 HB THR 7 HB THR 7 10.050 14.018 -1.024 15 HG1 THR 7 HG1 THR 7 11.724 15.157 -0.183 16 HG21 THR 7 HG21 THR 7 8.345 16.313 -0.053 17 HG22 THR 7 HG22 THR 7 7.716 14.853 -0.816 18 HG23 THR 7 HG23 THR 7 8.764 15.944 -1.723 19 H LYS 8 HN LYS 8 8.337 11.956 0.089 20 HA LYS 8 HA LYS 8 10.012 9.962 1.214 21 HB2 LYS 8 HB2 LYS 8 8.786 8.377 -0.213 22 HB3 LYS 8 HB1 LYS 8 7.700 9.443 0.660 23 HG2 LYS 8 HG2 LYS 8 7.471 10.807 -1.402 24 HG3 LYS 8 HG1 LYS 8 8.448 9.604 -2.252 25 HD2 LYS 8 HD2 LYS 8 6.795 7.880 -1.683 26 HD3 LYS 8 HD1 LYS 8 5.818 9.090 -0.850 27 HE2 LYS 8 HE2 LYS 8 5.520 10.291 -2.959 28 HE3 LYS 8 HE1 LYS 8 6.506 9.091 -3.791 29 HZ1 LYS 8 HZ1 LYS 8 4.716 7.844 -4.063 30 HZ2 LYS 8 HZ2 LYS 8 3.753 9.016 -3.308 31 HZ3 LYS 8 HZ3 LYS 8 4.459 7.767 -2.395 32 H THR 9 HN THR 9 10.245 11.920 -1.567 33 HA THR 9 HA THR 9 11.759 10.317 -3.290 34 HB THR 9 HB THR 9 12.495 13.152 -3.280 35 HG1 THR 9 HG1 THR 9 10.151 13.560 -4.026 36 HG21 THR 9 HG21 THR 9 10.956 11.556 -5.327 37 HG22 THR 9 HG22 THR 9 12.713 11.512 -5.181 38 HG23 THR 9 HG23 THR 9 11.897 13.023 -5.584 39 H ASP 10 HN ASP 10 12.688 12.386 -0.583 40 HA ASP 10 HA ASP 10 15.471 12.316 -0.969 41 HB2 ASP 10 HB2 ASP 10 13.895 12.630 1.593 42 HB3 ASP 10 HB1 ASP 10 15.609 12.988 1.408 43 H TYR 11 HN TYR 11 13.272 10.161 0.740 44 HA TYR 11 HA TYR 11 15.398 8.512 1.766 45 HB2 TYR 11 HB2 TYR 11 12.404 8.366 1.793 46 HB3 TYR 11 HB1 TYR 11 13.330 6.912 2.145 47 HD1 TYR 11 HD1 TYR 11 15.607 8.055 3.674 48 HD2 TYR 11 HD2 TYR 11 11.445 8.927 3.843 49 HE1 TYR 11 HE1 TYR 11 15.857 8.767 6.004 50 HE2 TYR 11 HE2 TYR 11 11.690 9.645 6.184 51 HH TYR 11 HH TYR 11 13.239 9.253 8.078 52 H LEU 12 HN LEU 12 13.156 8.479 -0.926 53 HA LEU 12 HA LEU 12 13.595 5.901 -1.889 54 HB2 LEU 12 HB2 LEU 12 11.803 7.282 -2.727 55 HB3 LEU 12 HB1 LEU 12 12.944 8.454 -3.358 56 HG LEU 12 HG LEU 12 13.780 6.645 -4.912 57 HD11 LEU 12 HD11 LEU 12 11.307 5.251 -3.897 58 HD12 LEU 12 HD12 LEU 12 12.975 4.695 -3.762 59 HD13 LEU 12 HD13 LEU 12 12.202 4.787 -5.345 60 HD21 LEU 12 HD21 LEU 12 10.900 7.502 -5.159 61 HD22 LEU 12 HD22 LEU 12 11.920 6.921 -6.474 62 HD23 LEU 12 HD23 LEU 12 12.307 8.438 -5.662 63 H MET 13 HN MET 13 15.228 8.941 -2.797 64 HA MET 13 HA MET 13 17.051 7.716 -4.583 65 HB2 MET 13 HB2 MET 13 16.414 10.306 -3.964 66 HB3 MET 13 HB1 MET 13 18.010 10.148 -3.239 67 HG2 MET 13 HG2 MET 13 17.990 10.996 -5.593 68 HG3 MET 13 HG1 MET 13 19.002 9.579 -5.312 69 HE1 MET 13 HE1 MET 13 18.142 10.547 -8.196 70 HE2 MET 13 HE2 MET 13 17.653 9.040 -8.971 71 HE3 MET 13 HE3 MET 13 19.095 9.082 -7.958 72 H ARG 14 HN ARG 14 17.078 8.265 -1.143 73 HA ARG 14 HA ARG 14 19.825 7.698 -0.699 74 HB2 ARG 14 HB2 ARG 14 18.458 8.895 0.940 75 HB3 ARG 14 HB1 ARG 14 17.434 7.483 1.144 76 HG2 ARG 14 HG2 ARG 14 20.290 7.033 1.655 77 HG3 ARG 14 HG1 ARG 14 19.489 8.142 2.765 78 HD2 ARG 14 HD2 ARG 14 17.815 6.482 3.277 79 HD3 ARG 14 HD1 ARG 14 18.500 5.378 2.087 80 HE ARG 14 HE ARG 14 19.542 5.986 4.733 81 HH11 ARG 14 HH11 ARG 14 20.076 4.463 1.623 82 HH12 ARG 14 HH12 ARG 14 21.336 3.425 2.210 83 HH21 ARG 14 HH21 ARG 14 21.197 4.607 5.509 84 HH22 ARG 14 HH22 ARG 14 21.968 3.503 4.417 85 H LEU 15 HN LEU 15 16.967 5.728 -1.062 86 HA LEU 15 HA LEU 15 18.386 3.314 -0.239 87 HB2 LEU 15 HB2 LEU 15 15.534 3.703 -1.148 88 HB3 LEU 15 HB1 LEU 15 16.217 2.194 -0.570 89 HG LEU 15 HG LEU 15 15.938 4.715 1.071 90 HD11 LEU 15 HD11 LEU 15 14.352 2.152 1.125 91 HD12 LEU 15 HD12 LEU 15 13.777 3.723 0.572 92 HD13 LEU 15 HD13 LEU 15 14.194 3.484 2.265 93 HD21 LEU 15 HD21 LEU 15 17.859 3.241 1.686 94 HD22 LEU 15 HD22 LEU 15 16.704 1.934 1.953 95 HD23 LEU 15 HD23 LEU 15 16.634 3.388 2.947 96 H ARG 16 HN ARG 16 18.124 5.091 -3.016 97 HA ARG 16 HA ARG 16 17.684 3.092 -4.972 98 HB2 ARG 16 HB2 ARG 16 18.212 5.878 -4.964 99 HB3 ARG 16 HB1 ARG 16 19.425 5.132 -5.994 100 HG2 ARG 16 HG2 ARG 16 17.718 5.608 -7.475 101 HG3 ARG 16 HG1 ARG 16 17.422 3.913 -7.080 102 HD2 ARG 16 HD2 ARG 16 15.811 4.724 -5.319 103 HD3 ARG 16 HD1 ARG 16 15.992 6.337 -6.006 104 HE ARG 16 HE ARG 16 14.678 4.025 -7.262 105 HH11 ARG 16 HH11 ARG 16 15.617 7.415 -7.440 106 HH12 ARG 16 HH12 ARG 16 14.476 7.791 -8.690 107 HH21 ARG 16 HH21 ARG 16 13.167 4.525 -8.887 108 HH22 ARG 16 HH22 ARG 16 13.065 6.158 -9.499 109 H ARG 17 HN ARG 17 20.412 3.949 -3.060 110 HA ARG 17 HA ARG 17 22.376 2.691 -4.743 111 HB2 ARG 17 HB2 ARG 17 22.380 3.828 -1.964 112 HB3 ARG 17 HB1 ARG 17 23.741 2.869 -2.526 113 HG2 ARG 17 HG2 ARG 17 23.908 4.441 -4.483 114 HG3 ARG 17 HG1 ARG 17 22.730 5.462 -3.663 115 HD2 ARG 17 HD2 ARG 17 25.386 4.610 -2.513 116 HD3 ARG 17 HD1 ARG 17 25.068 6.173 -3.263 117 HE ARG 17 HE ARG 17 24.207 5.270 -0.642 118 HH11 ARG 17 HH11 ARG 17 23.925 7.686 -3.167 119 HH12 ARG 17 HH12 ARG 17 23.255 8.891 -2.110 120 HH21 ARG 17 HH21 ARG 17 23.330 6.876 0.754 121 HH22 ARG 17 HH22 ARG 17 22.924 8.435 0.100 122 H CYS 18 HN CYS 18 20.113 1.667 -2.400 123 HA CYS 18 HA CYS 18 21.514 -0.715 -1.618 124 HB2 CYS 18 HB2 CYS 18 18.598 -0.027 -1.231 125 HB3 CYS 18 HB1 CYS 18 19.522 -1.237 -0.349 126 HG CYS 18 HG CYS 18 21.315 1.086 0.425 127 H GLN 19 HN GLN 19 21.919 -2.019 -3.303 128 HA GLN 19 HA GLN 19 19.733 -2.786 -5.099 129 HB2 GLN 19 HB2 GLN 19 22.718 -3.251 -5.191 130 HB3 GLN 19 HB1 GLN 19 21.598 -3.974 -6.333 131 HG2 GLN 19 HG2 GLN 19 21.718 -1.011 -5.935 132 HG3 GLN 19 HG1 GLN 19 22.835 -1.843 -7.013 133 HE21 GLN 19 HE21 GLN 19 22.011 -2.868 -8.880 134 HE22 GLN 19 HE22 GLN 19 20.464 -2.432 -9.531 135 H THR 20 HN THR 20 20.265 -5.240 -5.814 136 HA THR 20 HA THR 20 20.045 -7.425 -5.387 137 HB THR 20 HB THR 20 21.389 -8.504 -3.798 138 HG1 THR 20 HG1 THR 20 22.093 -7.599 -1.912 139 HG21 THR 20 HG21 THR 20 23.560 -7.289 -3.911 140 HG22 THR 20 HG22 THR 20 22.698 -5.904 -4.579 141 HG23 THR 20 HG23 THR 20 22.735 -7.431 -5.458 142 H ILE 21 HN ILE 21 18.524 -5.221 -3.394 143 HA ILE 21 HA ILE 21 16.553 -5.304 -2.248 144 HB ILE 21 HB ILE 21 16.544 -8.220 -3.039 145 HG12 ILE 21 HG12 ILE 21 14.886 -5.879 -4.011 146 HG13 ILE 21 HG11 ILE 21 16.252 -6.577 -4.872 147 HG21 ILE 21 HG21 ILE 21 14.588 -6.627 -1.420 148 HG22 ILE 21 HG22 ILE 21 15.263 -8.221 -1.087 149 HG23 ILE 21 HG23 ILE 21 14.069 -8.017 -2.370 150 HD11 ILE 21 HD11 ILE 21 13.991 -7.283 -5.673 151 HD12 ILE 21 HD12 ILE 21 13.796 -8.143 -4.145 152 HD13 ILE 21 HD13 ILE 21 15.087 -8.601 -5.256 153 H ASP 22 HN ASP 22 18.605 -8.123 -1.600 154 HA ASP 22 HA ASP 22 17.949 -8.610 1.044 155 HB2 ASP 22 HB2 ASP 22 19.299 -10.184 -0.127 156 HB3 ASP 22 HB1 ASP 22 20.517 -8.971 -0.496 157 H THR 23 HN THR 23 20.211 -6.267 -0.293 158 HA THR 23 HA THR 23 21.343 -5.425 2.157 159 HB THR 23 HB THR 23 21.041 -3.691 -0.294 160 HG1 THR 23 HG1 THR 23 21.914 -5.480 -1.190 161 HG21 THR 23 HG21 THR 23 23.314 -2.920 0.436 162 HG22 THR 23 HG22 THR 23 23.113 -3.890 1.894 163 HG23 THR 23 HG23 THR 23 22.021 -2.543 1.574 164 H LEU 24 HN LEU 24 18.571 -4.372 0.283 165 HA LEU 24 HA LEU 24 17.963 -2.034 1.744 166 HB2 LEU 24 HB2 LEU 24 17.143 -2.548 -0.539 167 HB3 LEU 24 HB1 LEU 24 16.122 -3.803 0.134 168 HG LEU 24 HG LEU 24 15.037 -1.941 1.526 169 HD11 LEU 24 HD11 LEU 24 16.458 -0.284 -0.547 170 HD12 LEU 24 HD12 LEU 24 16.683 -0.216 1.200 171 HD13 LEU 24 HD13 LEU 24 15.152 0.292 0.485 172 HD21 LEU 24 HD21 LEU 24 13.498 -1.411 -0.252 173 HD22 LEU 24 HD22 LEU 24 13.996 -3.097 -0.386 174 HD23 LEU 24 HD23 LEU 24 14.687 -1.885 -1.467 175 H GLU 25 HN GLU 25 16.917 -5.392 2.001 176 HA GLU 25 HA GLU 25 14.877 -5.140 3.867 177 HB2 GLU 25 HB2 GLU 25 15.643 -7.188 2.550 178 HB3 GLU 25 HB1 GLU 25 16.834 -7.433 3.815 179 HG2 GLU 25 HG2 GLU 25 14.980 -8.840 4.270 180 HG3 GLU 25 HG1 GLU 25 14.973 -7.536 5.460 181 H ARG 26 HN ARG 26 18.320 -4.916 4.343 182 HA ARG 26 HA ARG 26 18.089 -5.171 7.235 183 HB2 ARG 26 HB2 ARG 26 20.457 -4.757 5.415 184 HB3 ARG 26 HB1 ARG 26 20.582 -4.718 7.169 185 HG2 ARG 26 HG2 ARG 26 19.672 -7.007 7.249 186 HG3 ARG 26 HG1 ARG 26 19.689 -7.040 5.484 187 HD2 ARG 26 HD2 ARG 26 22.155 -6.502 5.632 188 HD3 ARG 26 HD1 ARG 26 22.029 -6.822 7.362 189 HE ARG 26 HE ARG 26 21.730 -9.088 6.912 190 HH11 ARG 26 HH11 ARG 26 22.052 -7.214 3.981 191 HH12 ARG 26 HH12 ARG 26 22.153 -8.601 2.940 192 HH21 ARG 26 HH21 ARG 26 21.928 -10.925 5.545 193 HH22 ARG 26 HH22 ARG 26 22.106 -10.697 3.834 194 H VAL 27 HN VAL 27 18.790 -2.661 4.833 195 HA VAL 27 HA VAL 27 19.463 -0.670 6.719 196 HB VAL 27 HB VAL 27 19.983 -0.618 4.238 197 HG11 VAL 27 HG11 VAL 27 17.707 -1.057 3.434 198 HG12 VAL 27 HG12 VAL 27 18.388 0.417 2.749 199 HG13 VAL 27 HG13 VAL 27 17.200 0.513 4.048 200 HG21 VAL 27 HG21 VAL 27 20.429 1.253 5.736 201 HG22 VAL 27 HG22 VAL 27 18.790 1.852 5.484 202 HG23 VAL 27 HG23 VAL 27 19.931 1.819 4.142 203 H ILE 28 HN ILE 28 16.367 -1.687 5.344 204 HA ILE 28 HA ILE 28 14.926 0.527 6.455 205 HB ILE 28 HB ILE 28 12.892 -0.694 5.881 206 HG12 ILE 28 HG12 ILE 28 14.681 -2.955 4.978 207 HG13 ILE 28 HG11 ILE 28 13.795 -2.961 6.499 208 HG21 ILE 28 HG21 ILE 28 13.850 0.548 4.099 209 HG22 ILE 28 HG22 ILE 28 13.348 -1.004 3.427 210 HG23 ILE 28 HG23 ILE 28 15.049 -0.706 3.782 211 HD11 ILE 28 HD11 ILE 28 12.632 -4.240 4.797 212 HD12 ILE 28 HD12 ILE 28 12.586 -2.824 3.746 213 HD13 ILE 28 HD13 ILE 28 11.687 -2.824 5.264 214 H GLU 29 HN GLU 29 16.079 -2.466 7.637 215 HA GLU 29 HA GLU 29 14.248 -2.698 9.845 216 HB2 GLU 29 HB2 GLU 29 15.493 -4.622 8.766 217 HB3 GLU 29 HB1 GLU 29 16.951 -4.015 9.540 218 HG2 GLU 29 HG2 GLU 29 16.065 -5.793 10.857 219 HG3 GLU 29 HG1 GLU 29 15.831 -4.280 11.737 220 H LYS 30 HN LYS 30 17.606 -1.684 9.382 221 HA LYS 30 HA LYS 30 18.112 -1.004 12.083 222 HB2 LYS 30 HB2 LYS 30 19.438 -0.099 9.518 223 HB3 LYS 30 HB1 LYS 30 20.055 0.260 11.127 224 HG2 LYS 30 HG2 LYS 30 20.578 -1.964 11.556 225 HG3 LYS 30 HG1 LYS 30 19.547 -2.559 10.253 226 HD2 LYS 30 HD2 LYS 30 21.794 -2.775 9.506 227 HD3 LYS 30 HD1 LYS 30 21.106 -1.396 8.650 228 HE2 LYS 30 HE2 LYS 30 23.392 -0.952 9.458 229 HE3 LYS 30 HE1 LYS 30 22.201 0.144 10.156 230 HZ1 LYS 30 HZ1 LYS 30 22.228 -1.121 12.187 231 HZ2 LYS 30 HZ2 LYS 30 23.813 -0.692 11.790 232 HZ3 LYS 30 HZ3 LYS 30 23.271 -2.270 11.518 233 H ASN 31 HN ASN 31 17.202 0.957 9.263 234 HA ASN 31 HA ASN 31 17.184 3.433 10.636 235 HB2 ASN 31 HB2 ASN 31 17.094 2.780 8.044 236 HB3 ASN 31 HB1 ASN 31 15.377 3.061 8.306 237 HD21 ASN 31 HD21 ASN 31 15.646 5.124 10.252 238 HD22 ASN 31 HD22 ASN 31 16.263 6.520 9.438 239 H LYS 32 HN LYS 32 14.872 0.880 10.396 240 HA LYS 32 HA LYS 32 12.472 2.188 10.899 241 HB2 LYS 32 HB2 LYS 32 12.686 -0.190 10.279 242 HB3 LYS 32 HB1 LYS 32 13.356 -0.543 11.864 243 HG2 LYS 32 HG2 LYS 32 11.168 0.353 12.814 244 HG3 LYS 32 HG1 LYS 32 10.550 0.266 11.163 245 HD2 LYS 32 HD2 LYS 32 11.718 -2.051 12.710 246 HD3 LYS 32 HD1 LYS 32 9.999 -1.743 12.489 247 HE2 LYS 32 HE2 LYS 32 10.179 -2.076 10.126 248 HE3 LYS 32 HE1 LYS 32 11.934 -2.153 10.219 249 HZ1 LYS 32 HZ1 LYS 32 11.844 -4.214 11.335 250 HZ2 LYS 32 HZ2 LYS 32 10.768 -4.346 10.027 251 HZ3 LYS 32 HZ3 LYS 32 10.173 -4.097 11.591 252 H TYR 33 HN TYR 33 15.037 1.265 13.111 253 HA TYR 33 HA TYR 33 13.424 2.124 15.399 254 HB2 TYR 33 HB2 TYR 33 16.073 0.683 15.236 255 HB3 TYR 33 HB1 TYR 33 15.340 1.209 16.749 256 HD1 TYR 33 HD2 TYR 33 14.960 -1.067 13.870 257 HD2 TYR 33 HD1 TYR 33 13.510 0.011 17.716 258 HE1 TYR 33 HE2 TYR 33 13.618 -3.119 13.929 259 HE2 TYR 33 HE1 TYR 33 12.165 -2.048 17.790 260 HH TYR 33 HH TYR 33 12.553 -4.591 15.533 261 H GLU 34 HN GLU 34 15.448 3.536 13.221 262 HA GLU 34 HA GLU 34 16.580 5.404 15.190 263 HB2 GLU 34 HB2 GLU 34 17.274 4.910 12.288 264 HB3 GLU 34 HB1 GLU 34 17.969 6.206 13.250 265 HG2 GLU 34 HG2 GLU 34 18.813 4.473 14.836 266 HG3 GLU 34 HG1 GLU 34 18.265 3.244 13.697 267 H LEU 35 HN LEU 35 13.820 5.110 13.708 268 HA LEU 35 HA LEU 35 13.603 7.890 12.767 269 HB2 LEU 35 HB2 LEU 35 11.841 5.483 12.330 270 HB3 LEU 35 HB1 LEU 35 11.385 7.104 11.851 271 HG LEU 35 HG LEU 35 13.840 5.685 10.828 272 HD11 LEU 35 HD11 LEU 35 11.779 4.525 10.158 273 HD12 LEU 35 HD12 LEU 35 12.599 5.285 8.793 274 HD13 LEU 35 HD13 LEU 35 11.166 6.038 9.491 275 HD21 LEU 35 HD21 LEU 35 14.003 8.105 10.725 276 HD22 LEU 35 HD22 LEU 35 12.431 8.194 9.933 277 HD23 LEU 35 HD23 LEU 35 13.790 7.436 9.107 278 H SER 36 HN SER 36 11.693 9.099 13.379 279 HA SER 36 HA SER 36 11.046 8.651 16.194 280 HB2 SER 36 HB2 SER 36 10.231 11.037 14.541 281 HB3 SER 36 HB1 SER 36 10.463 10.938 16.286 282 HG SER 36 HG SER 36 12.686 10.308 14.763 283 H ASP 37 H ASP 37 9.841 7.668 13.359 284 HA ASP 37 HA ASP 37 7.932 6.542 12.792 285 HB2 ASP 37 3HB ASP 37 6.931 7.551 15.542 286 HB3 ASP 37 2HB ASP 37 5.937 6.589 14.455 287 H ASN 38 HN ASN 38 8.128 9.896 13.432 288 HA ASN 38 HA ASN 38 5.575 10.523 12.220 289 HB2 ASN 38 HB2 ASN 38 6.043 12.787 12.654 290 HB3 ASN 38 HB1 ASN 38 6.781 11.936 14.004 291 HD21 ASN 38 HD21 ASN 38 7.289 13.943 11.285 292 HD22 ASN 38 HD22 ASN 38 8.991 14.164 11.491 293 H GLU 39 HN GLU 39 8.930 10.282 11.287 294 HA GLU 39 HA GLU 39 8.431 11.313 8.606 295 HB2 GLU 39 HB2 GLU 39 10.986 9.958 9.008 296 HB3 GLU 39 HB1 GLU 39 10.666 11.602 8.477 297 HG2 GLU 39 HG2 GLU 39 11.834 11.959 10.413 298 HG3 GLU 39 HG1 GLU 39 10.170 12.029 10.990 299 H LEU 40 HN LEU 40 8.317 8.436 10.331 300 HA LEU 40 HA LEU 40 8.975 6.500 8.424 301 HB2 LEU 40 HB2 LEU 40 8.643 6.068 10.833 302 HB3 LEU 40 HB1 LEU 40 6.928 6.362 10.636 303 HG LEU 40 HG LEU 40 6.900 4.390 9.031 304 HD11 LEU 40 HD11 LEU 40 9.326 4.314 8.619 305 HD12 LEU 40 HD12 LEU 40 8.699 2.780 9.217 306 HD13 LEU 40 HD13 LEU 40 9.583 3.853 10.302 307 HD21 LEU 40 HD21 LEU 40 5.949 4.135 11.184 308 HD22 LEU 40 HD22 LEU 40 7.531 4.074 11.955 309 HD23 LEU 40 HD23 LEU 40 6.995 2.740 10.932 310 H ALA 41 HN ALA 41 6.292 8.609 8.684 311 HA ALA 41 HA ALA 41 4.289 7.165 7.364 312 HB1 ALA 41 HB1 ALA 41 4.631 10.133 7.140 313 HB2 ALA 41 HB2 ALA 41 4.096 9.361 8.631 314 HB3 ALA 41 HB3 ALA 41 3.139 9.193 7.159 315 H VAL 42 HN VAL 42 6.896 9.204 6.104 316 HA VAL 42 HA VAL 42 5.989 8.697 3.382 317 HB VAL 42 HB VAL 42 7.761 10.243 2.667 318 HG11 VAL 42 HG11 VAL 42 5.537 11.087 3.229 319 HG12 VAL 42 HG12 VAL 42 6.791 12.275 3.590 320 HG13 VAL 42 HG13 VAL 42 6.055 11.342 4.896 321 HG21 VAL 42 HG21 VAL 42 9.005 11.539 4.372 322 HG22 VAL 42 HG22 VAL 42 9.437 9.829 4.361 323 HG23 VAL 42 HG23 VAL 42 8.369 10.461 5.613 324 H PHE 43 HN PHE 43 8.202 7.454 5.656 325 HA PHE 43 HA PHE 43 10.204 6.495 3.903 326 HB2 PHE 43 HB2 PHE 43 10.415 6.668 6.408 327 HB3 PHE 43 HB1 PHE 43 9.372 5.257 6.534 328 HD1 PHE 43 HD1 PHE 43 12.578 6.433 5.093 329 HD2 PHE 43 HD2 PHE 43 10.279 3.109 6.424 330 HE1 PHE 43 HE1 PHE 43 14.546 4.982 4.855 331 HE2 PHE 43 HE2 PHE 43 12.244 1.650 6.188 332 HZ PHE 43 HZ PHE 43 14.384 2.584 5.401 333 H TYR 44 HN TYR 44 7.082 5.273 4.888 334 HA TYR 44 HA TYR 44 7.285 2.618 4.045 335 HB2 TYR 44 HB2 TYR 44 4.949 4.518 4.186 336 HB3 TYR 44 HB1 TYR 44 4.759 2.861 3.630 337 HD1 TYR 44 HD1 TYR 44 6.252 1.225 5.393 338 HD2 TYR 44 HD2 TYR 44 4.118 4.796 6.301 339 HE1 TYR 44 HE1 TYR 44 5.982 0.470 7.722 340 HE2 TYR 44 HE2 TYR 44 3.849 4.053 8.629 341 HH TYR 44 HH TYR 44 5.486 1.259 9.878 342 H SER 45 HN SER 45 5.702 5.269 2.264 343 HA SER 45 HA SER 45 5.443 3.945 -0.162 344 HB2 SER 45 HB2 SER 45 4.280 6.056 0.517 345 HB3 SER 45 HB1 SER 45 5.782 6.928 0.231 346 HG SER 45 HG SER 45 4.136 5.572 -1.650 347 H ALA 46 HN ALA 46 8.213 5.579 1.200 348 HA ALA 46 HA ALA 46 9.692 5.894 -1.207 349 HB1 ALA 46 HB1 ALA 46 10.226 7.126 0.847 350 HB2 ALA 46 HB2 ALA 46 11.619 6.233 0.239 351 HB3 ALA 46 HB3 ALA 46 10.714 5.619 1.621 352 H ALA 47 HN ALA 47 9.918 3.475 1.407 353 HA ALA 47 HA ALA 47 11.772 1.818 0.028 354 HB1 ALA 47 HB1 ALA 47 11.602 1.753 2.444 355 HB2 ALA 47 HB2 ALA 47 11.260 0.158 1.770 356 HB3 ALA 47 HB3 ALA 47 9.937 1.178 2.335 357 H ASP 48 HN ASP 48 8.272 1.824 0.374 358 HA ASP 48 HA ASP 48 7.616 -0.601 -0.823 359 HB2 ASP 48 HB2 ASP 48 6.276 1.970 -0.310 360 HB3 ASP 48 HB1 ASP 48 5.614 1.087 -1.672 361 H HIS 49 HN HIS 49 8.176 2.566 -2.273 362 HA HIS 49 HA HIS 49 7.694 1.755 -4.957 363 HB2 HIS 49 HB2 HIS 49 7.583 4.118 -4.050 364 HB3 HIS 49 HB1 HIS 49 9.337 4.116 -4.024 365 HD1 HIS 49 HD1 HIS 49 6.662 5.233 -6.033 366 HD2 HIS 49 HD2 HIS 49 10.333 3.451 -6.850 367 HE1 HIS 49 HE1 HIS 49 7.158 5.772 -8.442 368 HE2 HIS 49 HE2 HIS 49 9.386 4.698 -8.918 369 H ARG 50 HN ARG 50 10.606 2.199 -3.001 370 HA ARG 50 HA ARG 50 12.510 1.770 -5.017 371 HB2 ARG 50 HB2 ARG 50 13.124 2.739 -2.900 372 HB3 ARG 50 HB1 ARG 50 12.643 1.286 -2.039 373 HG2 ARG 50 HG2 ARG 50 15.055 1.450 -2.222 374 HG3 ARG 50 HG1 ARG 50 14.445 0.042 -3.094 375 HD2 ARG 50 HD2 ARG 50 14.511 1.451 -5.186 376 HD3 ARG 50 HD1 ARG 50 15.377 2.671 -4.248 377 HE ARG 50 HE ARG 50 16.988 0.727 -3.797 378 HH11 ARG 50 HH11 ARG 50 15.279 1.316 -6.807 379 HH12 ARG 50 HH12 ARG 50 16.408 0.398 -7.759 380 HH21 ARG 50 HH21 ARG 50 18.452 -0.473 -5.028 381 HH22 ARG 50 HH22 ARG 50 18.241 -0.608 -6.747 382 H LEU 51 HN LEU 51 10.902 -0.532 -2.851 383 HA LEU 51 HA LEU 51 12.434 -2.764 -3.712 384 HB2 LEU 51 HB2 LEU 51 11.139 -2.564 -1.562 385 HB3 LEU 51 HB1 LEU 51 9.678 -2.819 -2.494 386 HG LEU 51 HG LEU 51 10.293 -5.060 -3.027 387 HD11 LEU 51 HD11 LEU 51 12.656 -4.723 -3.512 388 HD12 LEU 51 HD12 LEU 51 12.445 -6.043 -2.360 389 HD13 LEU 51 HD13 LEU 51 12.981 -4.461 -1.798 390 HD21 LEU 51 HD21 LEU 51 9.397 -4.715 -0.776 391 HD22 LEU 51 HD22 LEU 51 11.035 -4.527 -0.152 392 HD23 LEU 51 HD23 LEU 51 10.519 -6.074 -0.824 393 H ALA 52 HN ALA 52 9.376 -1.367 -4.736 394 HA ALA 52 HA ALA 52 8.464 -3.420 -6.394 395 HB1 ALA 52 HB1 ALA 52 7.062 -1.760 -7.444 396 HB2 ALA 52 HB2 ALA 52 8.077 -0.462 -6.818 397 HB3 ALA 52 HB3 ALA 52 7.133 -1.455 -5.706 398 H GLU 53 HN GLU 53 10.431 -0.577 -7.263 399 HA GLU 53 HA GLU 53 10.691 -1.300 -9.993 400 HB2 GLU 53 HB2 GLU 53 12.609 0.364 -9.948 401 HB3 GLU 53 HB1 GLU 53 11.027 0.976 -9.490 402 HG2 GLU 53 HG2 GLU 53 11.620 0.878 -7.155 403 HG3 GLU 53 HG1 GLU 53 13.170 0.139 -7.550 404 H LEU 54 HN LEU 54 12.553 -2.074 -7.128 405 HA LEU 54 HA LEU 54 14.816 -3.073 -8.544 406 HB2 LEU 54 HB2 LEU 54 14.730 -2.222 -6.146 407 HB3 LEU 54 HB1 LEU 54 14.041 -3.780 -5.730 408 HG LEU 54 HG LEU 54 16.044 -4.930 -6.344 409 HD11 LEU 54 HD11 LEU 54 18.035 -3.584 -7.161 410 HD12 LEU 54 HD12 LEU 54 16.888 -2.293 -7.519 411 HD13 LEU 54 HD13 LEU 54 16.738 -3.853 -8.319 412 HD21 LEU 54 HD21 LEU 54 16.007 -3.789 -4.143 413 HD22 LEU 54 HD22 LEU 54 16.839 -2.415 -4.877 414 HD23 LEU 54 HD23 LEU 54 17.634 -3.988 -4.793 415 H THR 55 HN THR 55 11.849 -4.516 -7.328 416 HA THR 55 HA THR 55 12.703 -7.215 -7.646 417 HB THR 55 HB THR 55 9.836 -6.262 -7.683 418 HG1 THR 55 HG1 THR 55 10.910 -5.425 -5.828 419 HG21 THR 55 HG21 THR 55 9.355 -8.458 -6.782 420 HG22 THR 55 HG22 THR 55 11.075 -8.840 -6.711 421 HG23 THR 55 HG23 THR 55 10.281 -8.633 -8.272 422 H MET 56 HN MET 56 11.052 -4.902 -9.740 423 HA MET 56 HA MET 56 10.729 -6.906 -11.827 424 HB2 MET 56 HB2 MET 56 9.963 -3.995 -11.635 425 HB3 MET 56 HB1 MET 56 9.803 -4.913 -13.127 426 HG2 MET 56 HG2 MET 56 8.461 -5.560 -10.515 427 HG3 MET 56 HG1 MET 56 7.703 -4.793 -11.906 428 HE1 MET 56 HE1 MET 56 8.649 -6.381 -14.456 429 HE2 MET 56 HE2 MET 56 7.004 -5.908 -14.027 430 HE3 MET 56 HE3 MET 56 7.355 -7.575 -14.496 431 H ASN 57 HN ASN 57 13.115 -4.866 -10.766 432 HA ASN 57 HA ASN 57 15.135 -4.204 -11.557 433 HB2 ASN 57 HB2 ASN 57 15.015 -6.652 -12.415 434 HB3 ASN 57 HB1 ASN 57 14.753 -5.919 -13.995 435 HD21 ASN 57 HD21 ASN 57 16.682 -6.705 -14.796 436 HD22 ASN 57 HD22 ASN 57 18.212 -6.052 -14.328 437 H LYS 58 HN LYS 58 12.666 -2.840 -12.333 438 HA LYS 58 HA LYS 58 13.777 -1.269 -14.523 439 HB2 LYS 58 HB2 LYS 58 12.094 -2.921 -15.457 440 HB3 LYS 58 HB1 LYS 58 10.867 -2.101 -14.499 441 HG2 LYS 58 HG2 LYS 58 11.092 -0.105 -15.736 442 HG3 LYS 58 HG1 LYS 58 12.586 -0.655 -16.497 443 HD2 LYS 58 HD2 LYS 58 11.237 -2.488 -17.569 444 HD3 LYS 58 HD1 LYS 58 9.788 -1.675 -16.971 445 HE2 LYS 58 HE2 LYS 58 10.141 -0.982 -19.229 446 HE3 LYS 58 HE1 LYS 58 10.539 0.379 -18.178 447 HZ1 LYS 58 HZ1 LYS 58 12.439 -1.453 -19.533 448 HZ2 LYS 58 HZ2 LYS 58 12.900 -0.308 -18.379 449 HZ3 LYS 58 HZ3 LYS 58 12.215 0.198 -19.835 450 H LEU 59 HN LEU 59 13.788 0.792 -13.955 451 HA LEU 59 HA LEU 59 12.504 1.647 -11.552 452 HB2 LEU 59 HB2 LEU 59 14.230 2.982 -13.606 453 HB3 LEU 59 HB1 LEU 59 13.403 3.942 -12.393 454 HG LEU 59 HG LEU 59 14.547 2.415 -10.665 455 HD11 LEU 59 HD11 LEU 59 15.259 0.706 -12.319 456 HD12 LEU 59 HD12 LEU 59 16.581 1.339 -11.338 457 HD13 LEU 59 HD13 LEU 59 16.376 1.890 -12.999 458 HD21 LEU 59 HD21 LEU 59 15.126 4.788 -11.138 459 HD22 LEU 59 HD22 LEU 59 16.308 4.216 -12.316 460 HD23 LEU 59 HD23 LEU 59 16.497 3.808 -10.612 461 H TYR 60 HN TYR 60 10.729 2.850 -11.273 462 HA TYR 60 HA TYR 60 9.279 3.774 -13.665 463 HB2 TYR 60 HB2 TYR 60 8.129 2.325 -11.270 464 HB3 TYR 60 HB1 TYR 60 7.160 3.143 -12.492 465 HD1 TYR 60 HD1 TYR 60 7.928 2.409 -14.999 466 HD2 TYR 60 HD2 TYR 60 8.239 0.032 -11.478 467 HE1 TYR 60 HE1 TYR 60 7.904 0.373 -16.377 468 HE2 TYR 60 HE2 TYR 60 8.215 -2.007 -12.851 469 HH TYR 60 HH TYR 60 7.499 -2.748 -15.042 470 H ASP 61 HN ASP 61 8.216 5.720 -13.449 471 HA ASP 61 HA ASP 61 9.044 7.429 -11.302 472 HB2 ASP 61 HB2 ASP 61 7.181 7.810 -13.650 473 HB3 ASP 61 HB1 ASP 61 7.434 9.069 -12.448 474 H LYS 62 HN LYS 62 6.032 5.903 -12.315 475 HA LYS 62 HA LYS 62 4.803 6.678 -9.766 476 HB2 LYS 62 HB2 LYS 62 2.665 6.329 -10.770 477 HB3 LYS 62 HB1 LYS 62 3.618 7.269 -11.905 478 HG2 LYS 62 HG2 LYS 62 3.649 5.629 -13.458 479 HG3 LYS 62 HG1 LYS 62 3.661 4.334 -12.256 480 HD2 LYS 62 HD2 LYS 62 1.264 4.924 -11.759 481 HD3 LYS 62 HD1 LYS 62 1.314 6.004 -13.155 482 HE2 LYS 62 HE2 LYS 62 1.855 4.104 -14.599 483 HE3 LYS 62 HE1 LYS 62 1.819 3.027 -13.204 484 HZ1 LYS 62 HZ1 LYS 62 -0.252 2.987 -14.498 485 HZ2 LYS 62 HZ2 LYS 62 -0.497 4.623 -14.163 486 HZ3 LYS 62 HZ3 LYS 62 -0.509 3.496 -12.906 487 H ILE 63 HN ILE 63 2.841 4.619 -9.721 488 HA ILE 63 HA ILE 63 4.540 2.262 -9.230 489 HB ILE 63 HB ILE 63 2.338 3.448 -7.573 490 HG12 ILE 63 HG12 ILE 63 4.649 4.096 -7.069 491 HG13 ILE 63 HG11 ILE 63 3.953 3.155 -5.756 492 HG21 ILE 63 HG21 ILE 63 3.377 0.648 -7.199 493 HG22 ILE 63 HG22 ILE 63 1.857 1.028 -8.011 494 HG23 ILE 63 HG23 ILE 63 2.079 1.453 -6.316 495 HD11 ILE 63 HD11 ILE 63 5.113 1.154 -6.936 496 HD12 ILE 63 HD12 ILE 63 6.053 2.259 -5.939 497 HD13 ILE 63 HD13 ILE 63 6.089 2.413 -7.694 498 HA PRO 64 HA PRO 64 1.467 0.291 -11.891 499 HB2 PRO 64 HB2 PRO 64 3.002 -2.139 -11.703 500 HB3 PRO 64 HB1 PRO 64 2.898 -1.024 -13.074 501 HG2 PRO 64 HG2 PRO 64 5.159 -1.435 -11.590 502 HG3 PRO 64 HG1 PRO 64 4.820 0.021 -12.543 503 HD2 PRO 64 HD2 PRO 64 4.566 -0.403 -9.598 504 HD3 PRO 64 HD1 PRO 64 5.090 1.034 -10.501 505 H SER 65 HN SER 65 -0.335 -0.736 -11.276 506 HA SER 65 HA SER 65 -0.840 -1.485 -8.648 507 HB2 SER 65 HB2 SER 65 -2.432 -2.625 -10.916 508 HB3 SER 65 HB1 SER 65 -2.987 -1.986 -9.368 509 HG SER 65 HG SER 65 -2.302 0.114 -10.119 510 H SER 66 H SER 66 -0.144 -3.606 -11.426 511 HA SER 66 HA SER 66 -0.478 -6.005 -9.785 512 HB2 SER 66 3HB SER 66 0.014 -7.254 -11.869 513 HB3 SER 66 2HB SER 66 -1.216 -6.043 -12.190 514 HG SER 66 HG SER 66 0.461 -4.700 -13.060 515 H VAL 67 HN VAL 67 1.769 -4.040 -9.153 516 HA VAL 67 HA VAL 67 4.039 -5.846 -9.631 517 HB VAL 67 HB VAL 67 4.122 -3.288 -10.095 518 HG11 VAL 67 HG11 VAL 67 4.700 -3.295 -7.134 519 HG12 VAL 67 HG12 VAL 67 3.288 -2.568 -7.903 520 HG13 VAL 67 HG13 VAL 67 4.898 -1.933 -8.231 521 HG21 VAL 67 HG21 VAL 67 6.043 -4.701 -10.340 522 HG22 VAL 67 HG22 VAL 67 6.279 -4.756 -8.593 523 HG23 VAL 67 HG23 VAL 67 6.526 -3.246 -9.470 524 H TRP 68 HN TRP 68 1.873 -4.833 -7.184 525 HA TRP 68 HA TRP 68 3.551 -5.245 -4.934 526 HB2 TRP 68 HB2 TRP 68 0.536 -5.241 -5.119 527 HB3 TRP 68 HB1 TRP 68 1.470 -5.137 -3.629 528 HD1 TRP 68 HD1 TRP 68 -0.163 -2.985 -6.106 529 HE1 TRP 68 HE1 TRP 68 0.628 -0.542 -5.890 530 HE3 TRP 68 HE3 TRP 68 3.889 -3.738 -3.098 531 HZ2 TRP 68 HZ2 TRP 68 2.728 0.870 -4.592 532 HZ3 TRP 68 HZ3 TRP 68 5.239 -1.802 -2.421 533 HH2 TRP 68 HH2 TRP 68 4.668 0.457 -3.154 534 H LYS 69 HN LYS 69 2.251 -7.452 -7.072 535 HA LYS 69 HA LYS 69 1.807 -9.573 -5.156 536 HB2 LYS 69 HB2 LYS 69 0.408 -9.612 -7.089 537 HB3 LYS 69 HB1 LYS 69 1.780 -9.459 -8.170 538 HG2 LYS 69 HG2 LYS 69 0.868 -11.699 -8.237 539 HG3 LYS 69 HG1 LYS 69 2.503 -11.713 -7.581 540 HD2 LYS 69 HD2 LYS 69 1.215 -13.192 -6.250 541 HD3 LYS 69 HD1 LYS 69 1.467 -11.739 -5.282 542 HE2 LYS 69 HE2 LYS 69 -0.737 -11.068 -5.489 543 HE3 LYS 69 HE1 LYS 69 -0.993 -12.012 -6.957 544 HZ1 LYS 69 HZ1 LYS 69 -2.129 -13.008 -5.079 545 HZ2 LYS 69 HZ2 LYS 69 -0.675 -13.111 -4.208 546 HZ3 LYS 69 HZ3 LYS 69 -0.894 -14.034 -5.612 547 H PHE 70 HN PHE 70 4.457 -8.236 -6.829 548 HA PHE 70 HA PHE 70 6.023 -10.696 -6.658 549 HB2 PHE 70 HB2 PHE 70 6.893 -7.993 -7.700 550 HB3 PHE 70 HB1 PHE 70 7.726 -9.526 -7.911 551 HD1 PHE 70 HD1 PHE 70 6.119 -11.415 -8.994 552 HD2 PHE 70 HD2 PHE 70 5.751 -7.204 -9.501 553 HE1 PHE 70 HE1 PHE 70 4.914 -11.778 -11.107 554 HE2 PHE 70 HE2 PHE 70 4.545 -7.560 -11.616 555 HZ PHE 70 HZ PHE 70 4.128 -9.850 -12.424 556 H ILE 71 HN ILE 71 5.208 -8.247 -4.640 557 HA ILE 71 HA ILE 71 7.808 -8.236 -3.268 558 HB ILE 71 HB ILE 71 5.515 -6.284 -3.037 559 HG12 ILE 71 HG12 ILE 71 8.258 -5.631 -4.055 560 HG13 ILE 71 HG11 ILE 71 7.089 -6.382 -5.135 561 HG21 ILE 71 HG21 ILE 71 7.002 -4.950 -1.645 562 HG22 ILE 71 HG22 ILE 71 8.246 -6.198 -1.757 563 HG23 ILE 71 HG23 ILE 71 6.729 -6.537 -0.923 564 HD11 ILE 71 HD11 ILE 71 6.526 -4.275 -5.596 565 HD12 ILE 71 HD12 ILE 71 7.229 -3.648 -4.104 566 HD13 ILE 71 HD13 ILE 71 5.618 -4.363 -4.087 567 H ARG 72 HN ARG 72 7.961 -8.895 -1.174 568 HA ARG 72 HA ARG 72 5.553 -10.119 -0.011 569 HB2 ARG 72 HB2 ARG 72 8.468 -10.795 0.430 570 HB3 ARG 72 HB1 ARG 72 7.116 -11.585 1.230 571 HG2 ARG 72 HG2 ARG 72 6.347 -12.523 -0.813 572 HG3 ARG 72 HG1 ARG 72 7.483 -11.555 -1.753 573 HD2 ARG 72 HD2 ARG 72 8.207 -13.899 -1.509 574 HD3 ARG 72 HD1 ARG 72 9.352 -12.758 -0.806 575 HE ARG 72 HE ARG 72 7.387 -14.213 0.845 576 HH11 ARG 72 HH11 ARG 72 10.694 -13.255 0.160 577 HH12 ARG 72 HH12 ARG 72 11.317 -13.884 1.649 578 HH21 ARG 72 HH21 ARG 72 8.229 -15.062 2.806 579 HH22 ARG 72 HH22 ARG 72 9.920 -14.901 3.148 580 H GLU 3 HN GLU 3 -4.832 7.324 11.457 581 HA GLU 3 HA GLU 3 -2.364 5.802 11.235 582 HB2 GLU 3 HB2 GLU 3 -3.107 4.595 13.199 583 HB3 GLU 3 HB1 GLU 3 -3.296 6.319 13.478 584 HG2 GLU 3 HG2 GLU 3 -5.557 4.542 12.601 585 HG3 GLU 3 HG1 GLU 3 -5.158 4.834 14.295 586 H ALA 4 HN ALA 4 -5.770 5.500 10.498 587 HA ALA 4 HA ALA 4 -5.796 2.730 9.910 588 HB1 ALA 4 HB1 ALA 4 -7.607 4.831 8.734 589 HB2 ALA 4 HB2 ALA 4 -7.811 4.168 10.353 590 HB3 ALA 4 HB3 ALA 4 -7.949 3.115 8.944 591 H LEU 5 HN LEU 5 -5.412 5.612 7.871 592 HA LEU 5 HA LEU 5 -5.077 4.085 5.471 593 HB2 LEU 5 HB2 LEU 5 -4.904 6.966 6.212 594 HB3 LEU 5 HB1 LEU 5 -4.180 6.444 4.702 595 HG LEU 5 HG LEU 5 -6.445 5.436 4.128 596 HD11 LEU 5 HD11 LEU 5 -8.376 6.445 5.262 597 HD12 LEU 5 HD12 LEU 5 -7.287 7.174 6.442 598 HD13 LEU 5 HD13 LEU 5 -7.426 5.419 6.339 599 HD21 LEU 5 HD21 LEU 5 -6.213 8.424 4.448 600 HD22 LEU 5 HD22 LEU 5 -7.336 7.583 3.382 601 HD23 LEU 5 HD23 LEU 5 -5.599 7.468 3.097 602 H LYS 6 HN LYS 6 -3.045 4.877 8.048 603 HA LYS 6 HA LYS 6 -0.578 5.087 6.629 604 HB2 LYS 6 HB2 LYS 6 -1.192 5.828 9.070 605 HB3 LYS 6 HB1 LYS 6 -0.745 4.179 9.481 606 HG2 LYS 6 HG2 LYS 6 1.485 4.528 8.600 607 HG3 LYS 6 HG1 LYS 6 1.050 6.159 8.079 608 HD2 LYS 6 HD2 LYS 6 0.468 6.583 10.538 609 HD3 LYS 6 HD1 LYS 6 1.353 5.095 10.873 610 HE2 LYS 6 HE2 LYS 6 3.365 6.011 9.917 611 HE3 LYS 6 HE1 LYS 6 2.502 7.454 9.386 612 HZ1 LYS 6 HZ1 LYS 6 2.979 6.632 12.197 613 HZ2 LYS 6 HZ2 LYS 6 2.078 7.985 11.732 614 HZ3 LYS 6 HZ3 LYS 6 3.734 7.908 11.390 615 H ILE 7 HN ILE 7 -2.134 2.469 8.487 616 HA ILE 7 HA ILE 7 -0.100 0.566 7.806 617 HB ILE 7 HB ILE 7 -1.629 -1.116 8.803 618 HG12 ILE 7 HG12 ILE 7 -3.426 1.227 9.473 619 HG13 ILE 7 HG11 ILE 7 -3.745 0.121 8.138 620 HG21 ILE 7 HG21 ILE 7 -1.507 -0.230 11.095 621 HG22 ILE 7 HG22 ILE 7 -1.126 1.364 10.441 622 HG23 ILE 7 HG23 ILE 7 -0.012 0.018 10.191 623 HD11 ILE 7 HD11 ILE 7 -5.039 -0.437 10.142 624 HD12 ILE 7 HD12 ILE 7 -3.536 -0.674 11.037 625 HD13 ILE 7 HD13 ILE 7 -3.932 -1.732 9.685 626 H LEU 8 HN LEU 8 -2.960 1.712 6.314 627 HA LEU 8 HA LEU 8 -3.485 -0.610 4.718 628 HB2 LEU 8 HB2 LEU 8 -5.101 1.309 5.401 629 HB3 LEU 8 HB1 LEU 8 -4.416 2.158 4.027 630 HG LEU 8 HG LEU 8 -5.068 -0.034 2.727 631 HD11 LEU 8 HD11 LEU 8 -5.754 -1.243 4.765 632 HD12 LEU 8 HD12 LEU 8 -7.053 -1.108 3.581 633 HD13 LEU 8 HD13 LEU 8 -7.043 -0.065 5.003 634 HD21 LEU 8 HD21 LEU 8 -5.952 2.291 2.419 635 HD22 LEU 8 HD22 LEU 8 -7.222 1.893 3.575 636 HD23 LEU 8 HD23 LEU 8 -7.103 1.004 2.056 637 H ASN 9 HN ASN 9 -1.308 2.042 4.501 638 HA ASN 9 HA ASN 9 -1.002 1.717 1.620 639 HB2 ASN 9 HB2 ASN 9 -0.996 3.994 2.872 640 HB3 ASN 9 HB1 ASN 9 0.671 3.584 3.273 641 HD21 ASN 9 HD21 ASN 9 1.720 5.064 2.018 642 HD22 ASN 9 HD22 ASN 9 1.644 5.069 0.287 643 H ASN 10 HN ASN 10 -0.172 -0.348 3.633 644 HA ASN 10 HA ASN 10 2.408 -0.838 2.404 645 HB2 ASN 10 HB2 ASN 10 3.041 0.326 4.470 646 HB3 ASN 10 HB1 ASN 10 2.106 -0.827 5.416 647 HD21 ASN 10 HD21 ASN 10 4.847 -0.553 3.194 648 HD22 ASN 10 HD22 ASN 10 5.716 -1.898 3.839 649 H ILE 11 HN ILE 11 2.381 -2.830 1.667 650 HA ILE 11 HA ILE 11 0.275 -4.617 2.176 651 HB ILE 11 HB ILE 11 1.859 -6.304 1.005 652 HG12 ILE 11 HG12 ILE 11 3.300 -3.690 0.491 653 HG13 ILE 11 HG11 ILE 11 3.937 -5.062 1.391 654 HG21 ILE 11 HG21 ILE 11 -0.106 -5.020 0.059 655 HG22 ILE 11 HG22 ILE 11 1.122 -5.529 -1.100 656 HG23 ILE 11 HG23 ILE 11 1.070 -3.855 -0.553 657 HD11 ILE 11 HD11 ILE 11 4.779 -4.863 -0.939 658 HD12 ILE 11 HD12 ILE 11 3.136 -5.169 -1.506 659 HD13 ILE 11 HD13 ILE 11 3.997 -6.402 -0.582 660 H ARG 12 HN ARG 12 3.491 -4.419 3.601 661 HA ARG 12 HA ARG 12 3.486 -7.018 4.697 662 HB2 ARG 12 HB2 ARG 12 4.996 -4.538 5.525 663 HB3 ARG 12 HB1 ARG 12 5.271 -6.130 6.222 664 HG2 ARG 12 HG2 ARG 12 5.635 -6.892 3.790 665 HG3 ARG 12 HG1 ARG 12 5.812 -5.175 3.439 666 HD2 ARG 12 HD2 ARG 12 7.738 -4.983 4.710 667 HD3 ARG 12 HD1 ARG 12 7.381 -6.431 5.649 668 HE ARG 12 HE ARG 12 7.706 -7.351 3.098 669 HH11 ARG 12 HH11 ARG 12 9.704 -5.438 5.265 670 HH12 ARG 12 HH12 ARG 12 11.202 -6.066 4.632 671 HH21 ARG 12 HH21 ARG 12 9.659 -8.169 2.286 672 HH22 ARG 12 HH22 ARG 12 11.181 -7.630 2.959 673 H THR 13 HN THR 13 2.359 -3.921 5.991 674 HA THR 13 HA THR 13 1.640 -5.079 8.528 675 HB THR 13 HB THR 13 0.351 -2.797 8.678 676 HG1 THR 13 HG1 THR 13 0.447 -1.908 6.711 677 HG21 THR 13 HG21 THR 13 2.474 -1.662 9.280 678 HG22 THR 13 HG22 THR 13 3.361 -3.008 8.568 679 HG23 THR 13 HG23 THR 13 2.332 -3.275 9.974 680 H LEU 14 HN LEU 14 -0.028 -4.135 5.575 681 HA LEU 14 HA LEU 14 -2.654 -4.531 6.540 682 HB2 LEU 14 HB2 LEU 14 -1.949 -3.192 4.529 683 HB3 LEU 14 HB1 LEU 14 -1.737 -4.706 3.675 684 HG LEU 14 HG LEU 14 -4.109 -5.203 3.888 685 HD11 LEU 14 HD11 LEU 14 -4.210 -2.621 5.443 686 HD12 LEU 14 HD12 LEU 14 -4.614 -4.239 6.016 687 HD13 LEU 14 HD13 LEU 14 -5.631 -3.454 4.810 688 HD21 LEU 14 HD21 LEU 14 -3.960 -2.351 2.981 689 HD22 LEU 14 HD22 LEU 14 -4.864 -3.699 2.288 690 HD23 LEU 14 HD23 LEU 14 -3.113 -3.623 2.100 691 H ARG 15 HN ARG 15 -0.338 -6.693 4.977 692 HA ARG 15 HA ARG 15 -2.067 -8.786 4.318 693 HB2 ARG 15 HB2 ARG 15 0.841 -8.540 4.827 694 HB3 ARG 15 HB1 ARG 15 0.169 -10.160 4.930 695 HG2 ARG 15 HG2 ARG 15 -0.612 -10.065 2.678 696 HG3 ARG 15 HG1 ARG 15 -0.228 -8.350 2.563 697 HD2 ARG 15 HD2 ARG 15 2.041 -8.729 2.404 698 HD3 ARG 15 HD1 ARG 15 1.944 -10.284 3.224 699 HE ARG 15 HE ARG 15 0.755 -11.013 1.072 700 HH11 ARG 15 HH11 ARG 15 3.373 -8.663 1.179 701 HH12 ARG 15 HH12 ARG 15 3.903 -9.003 -0.436 702 HH21 ARG 15 HH21 ARG 15 1.473 -11.480 -1.022 703 HH22 ARG 15 HH22 ARG 15 2.822 -10.600 -1.687 704 H ALA 16 HN ALA 16 -0.439 -8.059 7.364 705 HA ALA 16 HA ALA 16 -1.342 -10.447 8.672 706 HB1 ALA 16 HB1 ALA 16 0.731 -9.250 9.310 707 HB2 ALA 16 HB2 ALA 16 -0.368 -9.505 10.667 708 HB3 ALA 16 HB3 ALA 16 -0.259 -7.918 9.908 709 H GLN 17 HN GLN 17 -2.436 -7.124 8.437 710 HA GLN 17 HA GLN 17 -4.376 -7.239 10.498 711 HB2 GLN 17 HB2 GLN 17 -3.409 -5.158 9.489 712 HB3 GLN 17 HB1 GLN 17 -4.381 -5.464 8.058 713 HG2 GLN 17 HG2 GLN 17 -5.418 -3.808 9.485 714 HG3 GLN 17 HG1 GLN 17 -6.414 -5.256 9.370 715 HE21 GLN 17 HE21 GLN 17 -6.706 -6.535 11.180 716 HE22 GLN 17 HE22 GLN 17 -6.277 -6.009 12.770 717 H ALA 18 HN ALA 18 -4.455 -8.024 7.078 718 HA ALA 18 HA ALA 18 -7.312 -8.312 6.966 719 HB1 ALA 18 HB1 ALA 18 -5.190 -9.160 5.003 720 HB2 ALA 18 HB2 ALA 18 -6.065 -7.628 5.000 721 HB3 ALA 18 HB3 ALA 18 -6.927 -9.140 4.696 722 H ARG 19 HN ARG 19 -5.138 -10.210 8.513 723 HA ARG 19 HA ARG 19 -6.213 -12.757 7.610 724 HB2 ARG 19 HB2 ARG 19 -4.302 -12.226 9.892 725 HB3 ARG 19 HB1 ARG 19 -4.682 -13.793 9.200 726 HG2 ARG 19 HG2 ARG 19 -3.229 -11.530 7.847 727 HG3 ARG 19 HG1 ARG 19 -2.535 -13.052 8.410 728 HD2 ARG 19 HD2 ARG 19 -4.769 -13.065 6.424 729 HD3 ARG 19 HD1 ARG 19 -3.126 -12.733 5.890 730 HE ARG 19 HE ARG 19 -3.002 -15.042 7.407 731 HH11 ARG 19 HH11 ARG 19 -4.602 -13.987 4.491 732 HH12 ARG 19 HH12 ARG 19 -4.594 -15.559 3.744 733 HH21 ARG 19 HH21 ARG 19 -2.948 -17.124 6.401 734 HH22 ARG 19 HH22 ARG 19 -3.640 -17.314 4.813 735 H GLU 20 HN GLU 20 -7.125 -10.363 9.786 736 HA GLU 20 HA GLU 20 -8.445 -12.253 11.588 737 HB2 GLU 20 HB2 GLU 20 -8.819 -10.466 13.076 738 HB3 GLU 20 HB1 GLU 20 -7.193 -10.218 12.460 739 HG2 GLU 20 HG2 GLU 20 -7.803 -8.376 11.215 740 HG3 GLU 20 HG1 GLU 20 -9.503 -8.848 11.156 741 H CYS 21 H CYS 21 -9.087 -10.888 8.710 742 HA CYS 21 HA CYS 21 -12.016 -10.912 9.202 743 HB2 CYS 21 3HB CYS 21 -10.379 -9.067 7.327 744 HB3 CYS 21 2HB CYS 21 -12.145 -9.153 7.312 745 HG CYS 21 HG CYS 21 -12.588 -7.808 9.222 746 H THR 22 HN THR 22 -13.247 -12.036 7.834 747 HA THR 22 HA THR 22 -12.020 -14.038 6.244 748 HB THR 22 HB THR 22 -14.686 -14.010 5.510 749 HG1 THR 22 HG1 THR 22 -15.080 -13.705 8.170 750 HG21 THR 22 HG21 THR 22 -13.343 -15.936 6.307 751 HG22 THR 22 HG22 THR 22 -14.920 -15.843 7.087 752 HG23 THR 22 HG23 THR 22 -13.478 -15.320 7.953 753 H LEU 23 HN LEU 23 -12.621 -14.431 3.932 754 HA LEU 23 HA LEU 23 -11.771 -12.312 2.316 755 HB2 LEU 23 HB2 LEU 23 -11.516 -14.614 1.613 756 HB3 LEU 23 HB1 LEU 23 -13.256 -14.833 1.573 757 HG LEU 23 HG LEU 23 -13.327 -13.084 -0.248 758 HD11 LEU 23 HD11 LEU 23 -10.366 -13.587 -0.412 759 HD12 LEU 23 HD12 LEU 23 -11.077 -12.141 0.302 760 HD13 LEU 23 HD13 LEU 23 -11.337 -12.500 -1.405 761 HD21 LEU 23 HD21 LEU 23 -12.602 -14.644 -1.990 762 HD22 LEU 23 HD22 LEU 23 -13.526 -15.462 -0.728 763 HD23 LEU 23 HD23 LEU 23 -11.767 -15.609 -0.772 764 H GLU 24 HN GLU 24 -14.976 -13.326 3.280 765 HA GLU 24 HA GLU 24 -16.528 -12.027 1.365 766 HB2 GLU 24 HB2 GLU 24 -17.066 -12.566 4.284 767 HB3 GLU 24 HB1 GLU 24 -18.278 -11.929 3.182 768 HG2 GLU 24 HG2 GLU 24 -18.626 -14.273 3.374 769 HG3 GLU 24 HG1 GLU 24 -17.958 -13.960 1.776 770 H THR 25 HN THR 25 -15.307 -10.755 4.470 771 HA THR 25 HA THR 25 -16.444 -8.169 4.073 772 HB THR 25 HB THR 25 -14.090 -8.647 5.867 773 HG1 THR 25 HG1 THR 25 -16.635 -9.808 6.030 774 HG21 THR 25 HG21 THR 25 -14.884 -6.409 5.861 775 HG22 THR 25 HG22 THR 25 -15.483 -7.146 7.347 776 HG23 THR 25 HG23 THR 25 -16.569 -6.936 5.977 777 H LEU 26 HN LEU 26 -13.297 -9.630 3.466 778 HA LEU 26 HA LEU 26 -11.884 -7.268 2.851 779 HB2 LEU 26 HB2 LEU 26 -11.448 -10.109 1.915 780 HB3 LEU 26 HB1 LEU 26 -10.303 -8.802 1.688 781 HG LEU 26 HG LEU 26 -11.218 -9.858 4.366 782 HD11 LEU 26 HD11 LEU 26 -8.568 -10.172 2.972 783 HD12 LEU 26 HD12 LEU 26 -9.802 -11.427 3.070 784 HD13 LEU 26 HD13 LEU 26 -9.023 -10.839 4.539 785 HD21 LEU 26 HD21 LEU 26 -9.201 -8.486 5.119 786 HD22 LEU 26 HD22 LEU 26 -10.660 -7.596 4.680 787 HD23 LEU 26 HD23 LEU 26 -9.310 -7.687 3.551 788 H GLU 27 HN GLU 27 -13.660 -9.557 0.842 789 HA GLU 27 HA GLU 27 -13.102 -8.351 -1.639 790 HB2 GLU 27 HB2 GLU 27 -14.106 -10.670 -1.032 791 HB3 GLU 27 HB1 GLU 27 -15.646 -9.833 -1.053 792 HG2 GLU 27 HG2 GLU 27 -15.360 -9.257 -3.368 793 HG3 GLU 27 HG1 GLU 27 -13.722 -9.905 -3.361 794 H GLU 28 HN GLU 28 -15.771 -7.978 0.644 795 HA GLU 28 HA GLU 28 -17.346 -6.228 -0.873 796 HB2 GLU 28 HB2 GLU 28 -17.974 -7.488 1.255 797 HB3 GLU 28 HB1 GLU 28 -17.165 -6.197 2.136 798 HG2 GLU 28 HG2 GLU 28 -18.729 -4.655 0.724 799 HG3 GLU 28 HG1 GLU 28 -19.694 -6.119 0.560 800 H MET 29 HN MET 29 -14.845 -5.550 1.581 801 HA MET 29 HA MET 29 -15.120 -2.731 1.386 802 HB2 MET 29 HB2 MET 29 -13.281 -2.560 2.832 803 HB3 MET 29 HB1 MET 29 -14.058 -4.068 3.296 804 HG2 MET 29 HG2 MET 29 -12.390 -5.354 2.194 805 HG3 MET 29 HG1 MET 29 -11.702 -3.918 1.439 806 HE1 MET 29 HE1 MET 29 -11.345 -5.055 5.887 807 HE2 MET 29 HE2 MET 29 -12.351 -5.860 4.682 808 HE3 MET 29 HE3 MET 29 -12.821 -4.286 5.316 809 H LEU 30 HN LEU 30 -13.333 -5.099 -0.420 810 HA LEU 30 HA LEU 30 -11.449 -3.372 -1.610 811 HB2 LEU 30 HB2 LEU 30 -11.217 -5.811 -1.668 812 HB3 LEU 30 HB1 LEU 30 -12.651 -5.933 -2.670 813 HG LEU 30 HG LEU 30 -11.482 -4.677 -4.452 814 HD11 LEU 30 HD11 LEU 30 -9.927 -3.409 -3.126 815 HD12 LEU 30 HD12 LEU 30 -9.035 -4.415 -4.266 816 HD13 LEU 30 HD13 LEU 30 -9.142 -4.887 -2.572 817 HD21 LEU 30 HD21 LEU 30 -11.491 -7.065 -4.595 818 HD22 LEU 30 HD22 LEU 30 -10.168 -7.188 -3.437 819 HD23 LEU 30 HD23 LEU 30 -9.879 -6.498 -5.036 820 H GLU 31 HN GLU 31 -14.566 -4.619 -2.820 821 HA GLU 31 HA GLU 31 -14.615 -3.114 -5.187 822 HB2 GLU 31 HB2 GLU 31 -16.970 -4.076 -3.545 823 HB3 GLU 31 HB1 GLU 31 -17.025 -3.572 -5.227 824 HG2 GLU 31 HG2 GLU 31 -15.434 -5.428 -5.745 825 HG3 GLU 31 HG1 GLU 31 -15.658 -5.986 -4.086 826 H LYS 32 HN LYS 32 -15.695 -2.417 -1.933 827 HA LYS 32 HA LYS 32 -17.080 -0.032 -2.482 828 HB2 LYS 32 HB2 LYS 32 -16.705 -1.573 -0.269 829 HB3 LYS 32 HB1 LYS 32 -15.680 -0.192 0.107 830 HG2 LYS 32 HG2 LYS 32 -17.476 1.301 0.064 831 HG3 LYS 32 HG1 LYS 32 -18.514 0.164 -0.795 832 HD2 LYS 32 HD2 LYS 32 -17.529 -0.142 2.040 833 HD3 LYS 32 HD1 LYS 32 -19.149 0.376 1.562 834 HE2 LYS 32 HE2 LYS 32 -18.878 -1.953 0.167 835 HE3 LYS 32 HE1 LYS 32 -17.963 -2.310 1.633 836 HZ1 LYS 32 HZ1 LYS 32 -19.989 -1.408 2.851 837 HZ2 LYS 32 HZ2 LYS 32 -20.134 -2.939 2.133 838 HZ3 LYS 32 HZ3 LYS 32 -20.811 -1.577 1.382 839 H LEU 33 HN LEU 33 -13.694 -0.610 -1.505 840 HA LEU 33 HA LEU 33 -12.990 2.142 -1.539 841 HB2 LEU 33 HB2 LEU 33 -11.709 0.347 -0.367 842 HB3 LEU 33 HB1 LEU 33 -11.167 -0.233 -1.930 843 HG LEU 33 HG LEU 33 -10.032 1.922 -2.330 844 HD11 LEU 33 HD11 LEU 33 -11.056 3.599 -1.175 845 HD12 LEU 33 HD12 LEU 33 -9.733 3.249 -0.064 846 HD13 LEU 33 HD13 LEU 33 -11.342 2.597 0.249 847 HD21 LEU 33 HD21 LEU 33 -8.270 1.650 -0.589 848 HD22 LEU 33 HD22 LEU 33 -8.713 0.154 -1.410 849 HD23 LEU 33 HD23 LEU 33 -9.315 0.481 0.215 850 H GLU 34 HN GLU 34 -13.014 -0.404 -3.924 851 HA GLU 34 HA GLU 34 -11.526 0.838 -5.939 852 HB2 GLU 34 HB2 GLU 34 -12.117 -1.519 -6.038 853 HB3 GLU 34 HB1 GLU 34 -13.822 -1.118 -6.183 854 HG2 GLU 34 HG2 GLU 34 -13.503 -0.182 -8.339 855 HG3 GLU 34 HG1 GLU 34 -11.753 -0.270 -8.187 856 H VAL 35 HN VAL 35 -15.065 0.897 -5.350 857 HA VAL 35 HA VAL 35 -15.580 2.608 -7.561 858 HB VAL 35 HB VAL 35 -17.801 2.955 -6.671 859 HG11 VAL 35 HG11 VAL 35 -16.810 0.129 -6.409 860 HG12 VAL 35 HG12 VAL 35 -17.493 0.906 -7.835 861 HG13 VAL 35 HG13 VAL 35 -18.515 0.577 -6.434 862 HG21 VAL 35 HG21 VAL 35 -17.098 1.374 -4.217 863 HG22 VAL 35 HG22 VAL 35 -18.550 2.318 -4.542 864 HG23 VAL 35 HG23 VAL 35 -17.013 3.135 -4.248 865 H VAL 36 HN VAL 36 -14.628 3.167 -4.267 866 HA VAL 36 HA VAL 36 -15.279 5.935 -4.167 867 HB VAL 36 HB VAL 36 -13.410 4.198 -2.560 868 HG11 VAL 36 HG11 VAL 36 -13.931 7.124 -2.041 869 HG12 VAL 36 HG12 VAL 36 -12.444 6.482 -2.736 870 HG13 VAL 36 HG13 VAL 36 -12.909 6.036 -1.097 871 HG21 VAL 36 HG21 VAL 36 -15.005 4.499 -0.810 872 HG22 VAL 36 HG22 VAL 36 -15.892 4.060 -2.271 873 HG23 VAL 36 HG23 VAL 36 -15.859 5.739 -1.731 874 H VAL 37 HN VAL 37 -12.266 4.163 -4.841 875 HA VAL 37 HA VAL 37 -10.750 6.490 -5.423 876 HB VAL 37 HB VAL 37 -10.256 3.644 -6.325 877 HG11 VAL 37 HG11 VAL 37 -8.249 5.880 -6.116 878 HG12 VAL 37 HG12 VAL 37 -9.067 5.457 -7.623 879 HG13 VAL 37 HG13 VAL 37 -8.019 4.280 -6.823 880 HG21 VAL 37 HG21 VAL 37 -8.653 3.598 -4.442 881 HG22 VAL 37 HG22 VAL 37 -10.324 3.798 -3.918 882 HG23 VAL 37 HG23 VAL 37 -9.234 5.185 -3.936 883 H ASN 38 HN ASN 38 -12.658 4.274 -7.407 884 HA ASN 38 HA ASN 38 -11.961 5.314 -9.928 885 HB2 ASN 38 HB2 ASN 38 -13.180 3.191 -9.668 886 HB3 ASN 38 HB1 ASN 38 -14.580 4.072 -9.062 887 HD21 ASN 38 HD21 ASN 38 -16.013 4.886 -10.490 888 HD22 ASN 38 HD22 ASN 38 -15.817 4.850 -12.207 889 H GLU 39 HN GLU 39 -14.386 6.240 -7.559 890 HA GLU 39 HA GLU 39 -15.729 8.186 -9.075 891 HB2 GLU 39 HB2 GLU 39 -16.114 7.140 -6.633 892 HB3 GLU 39 HB1 GLU 39 -15.327 8.643 -6.163 893 HG2 GLU 39 HG2 GLU 39 -17.033 9.947 -6.983 894 HG3 GLU 39 HG1 GLU 39 -17.616 8.686 -8.072 895 H ARG 40 HN ARG 40 -12.944 8.344 -6.918 896 HA ARG 40 HA ARG 40 -12.447 11.110 -7.125 897 HB2 ARG 40 HB2 ARG 40 -10.742 8.737 -6.423 898 HB3 ARG 40 HB1 ARG 40 -10.020 10.334 -6.584 899 HG2 ARG 40 HG2 ARG 40 -12.311 9.695 -4.741 900 HG3 ARG 40 HG1 ARG 40 -10.615 9.679 -4.255 901 HD2 ARG 40 HD2 ARG 40 -12.268 12.021 -5.172 902 HD3 ARG 40 HD1 ARG 40 -11.473 11.790 -3.615 903 HE ARG 40 HE ARG 40 -10.162 12.461 -6.159 904 HH11 ARG 40 HH11 ARG 40 -9.956 12.043 -2.672 905 HH12 ARG 40 HH12 ARG 40 -8.447 12.887 -2.539 906 HH21 ARG 40 HH21 ARG 40 -8.199 13.538 -5.998 907 HH22 ARG 40 HH22 ARG 40 -7.471 13.783 -4.435 908 H ARG 41 HN ARG 41 -11.333 8.331 -8.992 909 HA ARG 41 HA ARG 41 -9.501 9.586 -10.672 910 HB2 ARG 41 HB2 ARG 41 -11.363 7.261 -11.146 911 HB3 ARG 41 HB1 ARG 41 -10.228 7.802 -12.372 912 HG2 ARG 41 HG2 ARG 41 -8.370 7.325 -10.855 913 HG3 ARG 41 HG1 ARG 41 -9.519 6.790 -9.625 914 HD2 ARG 41 HD2 ARG 41 -10.258 4.981 -11.000 915 HD3 ARG 41 HD1 ARG 41 -9.321 5.567 -12.373 916 HE ARG 41 HE ARG 41 -7.412 5.171 -10.511 917 HH11 ARG 41 HH11 ARG 41 -10.018 3.126 -11.677 918 HH12 ARG 41 HH12 ARG 41 -9.159 1.653 -11.375 919 HH21 ARG 41 HH21 ARG 41 -6.286 3.253 -10.138 920 HH22 ARG 41 HH22 ARG 41 -7.023 1.721 -10.506 921 H GLU 42 HN GLU 42 -13.005 9.198 -11.006 922 HA GLU 42 HA GLU 42 -13.285 10.421 -13.519 923 HB2 GLU 42 HB2 GLU 42 -15.005 9.051 -12.220 924 HB3 GLU 42 HB1 GLU 42 -15.347 10.527 -11.327 925 HG2 GLU 42 HG2 GLU 42 -16.956 10.507 -12.981 926 HG3 GLU 42 HG1 GLU 42 -15.722 11.592 -13.616 927 H GLU 43 HN GLU 43 -13.375 11.758 -10.228 928 HA GLU 43 HA GLU 43 -14.046 14.399 -11.022 929 HB2 GLU 43 HB2 GLU 43 -12.526 13.595 -8.537 930 HB3 GLU 43 HB1 GLU 43 -13.463 15.066 -8.782 931 HG2 GLU 43 HG2 GLU 43 -15.494 13.614 -9.012 932 HG3 GLU 43 HG1 GLU 43 -14.488 12.250 -8.524 933 H GLU 44 HN GLU 44 -11.019 12.711 -10.505 934 HA GLU 44 HA GLU 44 -9.312 14.961 -10.770 935 HB2 GLU 44 HB2 GLU 44 -9.049 12.204 -10.189 936 HB3 GLU 44 HB1 GLU 44 -8.020 12.527 -11.578 937 HG2 GLU 44 HG2 GLU 44 -6.700 12.798 -9.627 938 HG3 GLU 44 HG1 GLU 44 -6.998 14.396 -10.304 939 H SER 45 HN SER 45 -10.611 12.611 -13.080 940 HA SER 45 HA SER 45 -9.089 13.904 -15.229 941 HB2 SER 45 HB2 SER 45 -9.923 11.968 -16.621 942 HB3 SER 45 HB1 SER 45 -8.896 11.509 -15.256 943 HG SER 45 HG SER 45 -10.736 10.938 -14.107 944 H ALA 46 HN ALA 46 -11.569 14.974 -13.848 945 HA ALA 46 HA ALA 46 -13.593 14.933 -15.895 946 HB1 ALA 46 HB1 ALA 46 -14.204 15.076 -13.535 947 HB2 ALA 46 HB2 ALA 46 -14.808 16.466 -14.439 948 HB3 ALA 46 HB3 ALA 46 -13.381 16.631 -13.415 949 H GLU 3 HN GLU 3 -11.270 -1.386 15.624 950 HA GLU 3 HA GLU 3 -13.676 -0.369 14.593 951 HB2 GLU 3 HB2 GLU 3 -11.353 1.351 15.432 952 HB3 GLU 3 HB1 GLU 3 -13.069 1.678 15.610 953 HG2 GLU 3 HG2 GLU 3 -12.653 1.096 17.745 954 HG3 GLU 3 HG1 GLU 3 -12.891 -0.531 17.112 955 H ALA 4 HN ALA 4 -10.326 0.132 13.575 956 HA ALA 4 HA ALA 4 -10.743 2.018 11.582 957 HB1 ALA 4 HB1 ALA 4 -8.664 -0.163 11.706 958 HB2 ALA 4 HB2 ALA 4 -8.529 1.462 12.378 959 HB3 ALA 4 HB3 ALA 4 -8.611 1.235 10.632 960 H LEU 5 HN LEU 5 -10.871 -1.534 11.346 961 HA LEU 5 HA LEU 5 -11.282 -1.554 8.530 962 HB2 LEU 5 HB2 LEU 5 -11.809 -3.660 10.623 963 HB3 LEU 5 HB1 LEU 5 -11.908 -3.935 8.894 964 HG LEU 5 HG LEU 5 -9.414 -3.170 10.418 965 HD11 LEU 5 HD11 LEU 5 -8.704 -5.478 9.608 966 HD12 LEU 5 HD12 LEU 5 -10.415 -5.766 9.289 967 HD13 LEU 5 HD13 LEU 5 -9.871 -5.418 10.930 968 HD21 LEU 5 HD21 LEU 5 -8.274 -3.638 8.263 969 HD22 LEU 5 HD22 LEU 5 -9.328 -2.224 8.212 970 HD23 LEU 5 HD23 LEU 5 -9.858 -3.747 7.498 971 H LYS 6 HN LYS 6 -13.403 -1.351 11.301 972 HA LYS 6 HA LYS 6 -15.801 -2.075 9.979 973 HB2 LYS 6 HB2 LYS 6 -15.279 -1.814 12.524 974 HB3 LYS 6 HB1 LYS 6 -15.744 -0.138 12.268 975 HG2 LYS 6 HG2 LYS 6 -17.684 -1.216 13.016 976 HG3 LYS 6 HG1 LYS 6 -17.900 -1.027 11.273 977 HD2 LYS 6 HD2 LYS 6 -16.846 -3.414 11.175 978 HD3 LYS 6 HD1 LYS 6 -17.345 -3.500 12.866 979 HE2 LYS 6 HE2 LYS 6 -19.220 -2.746 10.629 980 HE3 LYS 6 HE1 LYS 6 -18.987 -4.405 11.172 981 HZ1 LYS 6 HZ1 LYS 6 -19.732 -3.754 13.372 982 HZ2 LYS 6 HZ2 LYS 6 -20.908 -3.385 12.216 983 HZ3 LYS 6 HZ3 LYS 6 -19.940 -2.155 12.858 984 H ILE 7 HN ILE 7 -14.098 0.962 10.387 985 HA ILE 7 HA ILE 7 -16.139 2.652 9.389 986 HB ILE 7 HB ILE 7 -13.152 3.123 9.361 987 HG12 ILE 7 HG12 ILE 7 -13.971 2.585 11.619 988 HG13 ILE 7 HG11 ILE 7 -13.472 4.267 11.495 989 HG21 ILE 7 HG21 ILE 7 -14.287 4.691 7.933 990 HG22 ILE 7 HG22 ILE 7 -13.794 5.515 9.411 991 HG23 ILE 7 HG23 ILE 7 -15.473 5.036 9.189 992 HD11 ILE 7 HD11 ILE 7 -16.275 3.189 11.570 993 HD12 ILE 7 HD12 ILE 7 -15.881 4.865 11.188 994 HD13 ILE 7 HD13 ILE 7 -15.466 4.200 12.769 995 H LEU 8 HN LEU 8 -13.639 0.754 7.866 996 HA LEU 8 HA LEU 8 -13.839 2.005 5.295 997 HB2 LEU 8 HB2 LEU 8 -12.354 -0.244 6.495 998 HB3 LEU 8 HB1 LEU 8 -12.690 -0.396 4.780 999 HG LEU 8 HG LEU 8 -11.625 1.880 4.480 1000 HD11 LEU 8 HD11 LEU 8 -10.708 1.354 7.301 1001 HD12 LEU 8 HD12 LEU 8 -11.784 2.651 6.781 1002 HD13 LEU 8 HD13 LEU 8 -10.104 2.626 6.240 1003 HD21 LEU 8 HD21 LEU 8 -9.936 -0.375 5.551 1004 HD22 LEU 8 HD22 LEU 8 -9.343 0.989 4.603 1005 HD23 LEU 8 HD23 LEU 8 -10.468 -0.161 3.883 1006 H ASN 9 HN ASN 9 -15.758 -0.266 6.943 1007 HA ASN 9 HA ASN 9 -16.657 -1.665 4.578 1008 HB2 ASN 9 HB2 ASN 9 -16.633 -2.787 6.796 1009 HB3 ASN 9 HB1 ASN 9 -17.856 -1.653 7.361 1010 HD21 ASN 9 HD21 ASN 9 -17.188 -4.305 5.191 1011 HD22 ASN 9 HD22 ASN 9 -18.834 -4.771 4.921 1012 H ASN 10 HN ASN 10 -17.424 1.244 6.207 1013 HA ASN 10 HA ASN 10 -20.073 1.382 4.987 1014 HB2 ASN 10 HB2 ASN 10 -18.691 2.953 7.133 1015 HB3 ASN 10 HB1 ASN 10 -20.056 3.663 6.279 1016 HD21 ASN 10 HD21 ASN 10 -21.389 1.065 5.938 1017 HD22 ASN 10 HD22 ASN 10 -22.028 0.663 7.490 1018 H ILE 11 HN ILE 11 -20.323 2.262 3.071 1019 HA ILE 11 HA ILE 11 -18.260 3.535 1.637 1020 HB ILE 11 HB ILE 11 -20.097 2.346 0.527 1021 HG12 ILE 11 HG12 ILE 11 -20.711 4.247 -1.139 1022 HG13 ILE 11 HG11 ILE 11 -19.630 5.233 -0.162 1023 HG21 ILE 11 HG21 ILE 11 -22.318 3.324 0.332 1024 HG22 ILE 11 HG22 ILE 11 -21.835 4.655 1.383 1025 HG23 ILE 11 HG23 ILE 11 -21.913 3.015 2.021 1026 HD11 ILE 11 HD11 ILE 11 -18.822 2.639 -1.442 1027 HD12 ILE 11 HD12 ILE 11 -17.774 3.829 -0.667 1028 HD13 ILE 11 HD13 ILE 11 -18.592 4.222 -2.182 1029 H ARG 12 HN ARG 12 -20.713 4.764 3.758 1030 HA ARG 12 HA ARG 12 -20.755 7.450 2.912 1031 HB2 ARG 12 HB2 ARG 12 -21.316 6.211 5.607 1032 HB3 ARG 12 HB1 ARG 12 -21.607 7.905 5.229 1033 HG2 ARG 12 HG2 ARG 12 -22.840 5.641 3.682 1034 HG3 ARG 12 HG1 ARG 12 -23.601 6.382 5.089 1035 HD2 ARG 12 HD2 ARG 12 -23.783 8.475 4.002 1036 HD3 ARG 12 HD1 ARG 12 -22.707 7.970 2.700 1037 HE ARG 12 HE ARG 12 -24.805 6.221 2.573 1038 HH11 ARG 12 HH11 ARG 12 -24.485 9.700 2.482 1039 HH12 ARG 12 HH12 ARG 12 -25.869 9.929 1.467 1040 HH21 ARG 12 HH21 ARG 12 -26.629 6.518 1.238 1041 HH22 ARG 12 HH22 ARG 12 -27.090 8.118 0.757 1042 H THR 13 HN THR 13 -18.832 5.846 5.452 1043 HA THR 13 HA THR 13 -17.431 8.250 6.106 1044 HB THR 13 HB THR 13 -15.890 6.331 7.193 1045 HG1 THR 13 HG1 THR 13 -16.819 4.453 6.873 1046 HG21 THR 13 HG21 THR 13 -18.593 7.190 8.238 1047 HG22 THR 13 HG22 THR 13 -17.088 8.090 8.423 1048 HG23 THR 13 HG23 THR 13 -17.277 6.521 9.204 1049 H LEU 14 HN LEU 14 -16.744 5.393 4.138 1050 HA LEU 14 HA LEU 14 -14.025 5.901 3.656 1051 HB2 LEU 14 HB2 LEU 14 -15.393 3.797 3.191 1052 HB3 LEU 14 HB1 LEU 14 -15.923 4.588 1.723 1053 HG LEU 14 HG LEU 14 -13.703 4.611 0.837 1054 HD11 LEU 14 HD11 LEU 14 -11.827 3.566 2.117 1055 HD12 LEU 14 HD12 LEU 14 -12.858 3.604 3.547 1056 HD13 LEU 14 HD13 LEU 14 -12.385 5.109 2.759 1057 HD21 LEU 14 HD21 LEU 14 -13.435 2.337 0.425 1058 HD22 LEU 14 HD22 LEU 14 -15.132 2.455 0.886 1059 HD23 LEU 14 HD23 LEU 14 -13.939 1.879 2.050 1060 H ARG 15 HN ARG 15 -16.949 6.918 1.945 1061 HA ARG 15 HA ARG 15 -15.577 8.264 -0.168 1062 HB2 ARG 15 HB2 ARG 15 -17.865 7.432 -0.433 1063 HB3 ARG 15 HB1 ARG 15 -18.428 8.527 0.821 1064 HG2 ARG 15 HG2 ARG 15 -17.830 10.440 -0.606 1065 HG3 ARG 15 HG1 ARG 15 -17.295 9.316 -1.857 1066 HD2 ARG 15 HD2 ARG 15 -20.029 8.940 -0.793 1067 HD3 ARG 15 HD1 ARG 15 -19.755 10.361 -1.803 1068 HE ARG 15 HE ARG 15 -18.900 8.779 -3.529 1069 HH11 ARG 15 HH11 ARG 15 -21.112 7.627 -1.051 1070 HH12 ARG 15 HH12 ARG 15 -21.707 6.319 -2.012 1071 HH21 ARG 15 HH21 ARG 15 -19.696 7.066 -4.797 1072 HH22 ARG 15 HH22 ARG 15 -20.896 5.989 -4.135 1073 H ALA 16 HN ALA 16 -15.901 8.984 3.057 1074 HA ALA 16 HA ALA 16 -15.847 11.889 2.647 1075 HB1 ALA 16 HB1 ALA 16 -16.050 11.949 5.163 1076 HB2 ALA 16 HB2 ALA 16 -16.300 10.204 5.101 1077 HB3 ALA 16 HB3 ALA 16 -17.436 11.290 4.295 1078 H GLN 17 HN GLN 17 -14.032 9.277 4.213 1079 HA GLN 17 HA GLN 17 -11.902 10.934 5.095 1080 HB2 GLN 17 HB2 GLN 17 -12.139 7.953 4.715 1081 HB3 GLN 17 HB1 GLN 17 -10.684 8.717 5.335 1082 HG2 GLN 17 HG2 GLN 17 -11.922 9.598 7.226 1083 HG3 GLN 17 HG1 GLN 17 -13.415 8.908 6.593 1084 HE21 GLN 17 HE21 GLN 17 -11.926 8.456 9.126 1085 HE22 GLN 17 HE22 GLN 17 -11.683 6.747 9.203 1086 H ALA 18 HN ALA 18 -12.523 9.184 2.127 1087 HA ALA 18 HA ALA 18 -9.874 9.282 1.120 1088 HB1 ALA 18 HB1 ALA 18 -11.596 7.693 0.350 1089 HB2 ALA 18 HB2 ALA 18 -10.809 8.564 -0.968 1090 HB3 ALA 18 HB3 ALA 18 -12.430 9.030 -0.444 1091 H ARG 19 HN ARG 19 -11.871 11.813 1.728 1092 HA ARG 19 HA ARG 19 -11.276 13.344 -0.665 1093 HB2 ARG 19 HB2 ARG 19 -12.628 14.210 1.899 1094 HB3 ARG 19 HB1 ARG 19 -12.543 15.139 0.406 1095 HG2 ARG 19 HG2 ARG 19 -13.806 13.365 -0.736 1096 HG3 ARG 19 HG1 ARG 19 -13.967 12.516 0.802 1097 HD2 ARG 19 HD2 ARG 19 -15.139 14.465 1.731 1098 HD3 ARG 19 HD1 ARG 19 -14.992 15.281 0.174 1099 HE ARG 19 HE ARG 19 -16.343 12.693 0.214 1100 HH11 ARG 19 HH11 ARG 19 -16.592 16.189 0.142 1101 HH12 ARG 19 HH12 ARG 19 -18.188 16.197 -0.534 1102 HH21 ARG 19 HH21 ARG 19 -18.468 12.707 -0.677 1103 HH22 ARG 19 HH22 ARG 19 -19.255 14.214 -1.002 1104 H GLU 20 HN GLU 20 -9.848 12.666 2.318 1105 HA GLU 20 HA GLU 20 -8.414 15.113 2.681 1106 HB2 GLU 20 HB2 GLU 20 -8.330 12.388 3.909 1107 HB3 GLU 20 HB1 GLU 20 -6.970 13.470 4.157 1108 HG2 GLU 20 HG2 GLU 20 -9.127 15.068 4.731 1109 HG3 GLU 20 HG1 GLU 20 -9.621 13.496 5.355 1110 H CYS 21 H CYS 21 -7.275 11.839 1.868 1111 HA CYS 21 HA CYS 21 -4.713 12.751 0.936 1112 HB2 CYS 21 3HB CYS 21 -6.175 10.030 0.699 1113 HB3 CYS 21 2HB CYS 21 -4.487 10.278 0.230 1114 HG CYS 21 HG CYS 21 -3.501 10.224 2.394 1115 H THR 22 HN THR 22 -3.870 12.491 -1.149 1116 HA THR 22 HA THR 22 -5.655 13.421 -3.212 1117 HB THR 22 HB THR 22 -2.820 12.727 -3.803 1118 HG1 THR 22 HG1 THR 22 -2.026 14.401 -2.590 1119 HG21 THR 22 HG21 THR 22 -4.301 13.853 -5.449 1120 HG22 THR 22 HG22 THR 22 -2.878 14.806 -5.036 1121 HG23 THR 22 HG23 THR 22 -4.449 15.218 -4.339 1122 H LEU 23 HN LEU 23 -5.426 12.418 -5.454 1123 HA LEU 23 HA LEU 23 -6.406 9.836 -5.469 1124 HB2 LEU 23 HB2 LEU 23 -6.654 11.449 -7.309 1125 HB3 LEU 23 HB1 LEU 23 -4.955 11.257 -7.698 1126 HG LEU 23 HG LEU 23 -5.499 8.776 -8.051 1127 HD11 LEU 23 HD11 LEU 23 -7.651 8.683 -7.004 1128 HD12 LEU 23 HD12 LEU 23 -7.847 8.356 -8.724 1129 HD13 LEU 23 HD13 LEU 23 -8.278 9.938 -8.072 1130 HD21 LEU 23 HD21 LEU 23 -6.093 9.150 -10.334 1131 HD22 LEU 23 HD22 LEU 23 -5.020 10.457 -9.831 1132 HD23 LEU 23 HD23 LEU 23 -6.758 10.736 -9.954 1133 H GLU 24 HN GLU 24 -3.083 10.936 -6.002 1134 HA GLU 24 HA GLU 24 -1.856 8.620 -6.798 1135 HB2 GLU 24 HB2 GLU 24 -0.587 10.627 -6.753 1136 HB3 GLU 24 HB1 GLU 24 -0.860 10.850 -5.031 1137 HG2 GLU 24 HG2 GLU 24 0.406 8.345 -5.390 1138 HG3 GLU 24 HG1 GLU 24 1.287 9.537 -6.341 1139 H THR 25 HN THR 25 -2.100 9.714 -3.418 1140 HA THR 25 HA THR 25 -1.042 7.394 -2.276 1141 HB THR 25 HB THR 25 -3.042 8.887 -0.700 1142 HG1 THR 25 HG1 THR 25 -0.782 10.108 -1.974 1143 HG21 THR 25 HG21 THR 25 -1.438 7.291 0.289 1144 HG22 THR 25 HG22 THR 25 -1.210 8.922 0.920 1145 HG23 THR 25 HG23 THR 25 -0.102 8.283 -0.295 1146 H LEU 26 HN LEU 26 -4.351 8.244 -3.125 1147 HA LEU 26 HA LEU 26 -5.625 6.117 -1.765 1148 HB2 LEU 26 HB2 LEU 26 -6.465 7.697 -4.193 1149 HB3 LEU 26 HB1 LEU 26 -7.500 6.541 -3.381 1150 HG LEU 26 HG LEU 26 -6.405 9.091 -2.184 1151 HD11 LEU 26 HD11 LEU 26 -9.120 8.273 -3.177 1152 HD12 LEU 26 HD12 LEU 26 -8.130 9.640 -3.695 1153 HD13 LEU 26 HD13 LEU 26 -8.866 9.640 -2.093 1154 HD21 LEU 26 HD21 LEU 26 -8.227 7.008 -0.982 1155 HD22 LEU 26 HD22 LEU 26 -7.854 8.574 -0.269 1156 HD23 LEU 26 HD23 LEU 26 -6.580 7.375 -0.470 1157 H GLU 27 HN GLU 27 -4.385 6.454 -5.059 1158 HA GLU 27 HA GLU 27 -5.263 3.907 -5.947 1159 HB2 GLU 27 HB2 GLU 27 -3.043 5.678 -6.979 1160 HB3 GLU 27 HB1 GLU 27 -3.635 4.241 -7.798 1161 HG2 GLU 27 HG2 GLU 27 -5.950 5.513 -7.540 1162 HG3 GLU 27 HG1 GLU 27 -4.877 6.911 -7.512 1163 H GLU 28 HN GLU 28 -2.142 5.099 -4.728 1164 HA GLU 28 HA GLU 28 -0.654 2.780 -4.998 1165 HB2 GLU 28 HB2 GLU 28 -0.020 5.182 -4.118 1166 HB3 GLU 28 HB1 GLU 28 -0.299 4.457 -2.539 1167 HG2 GLU 28 HG2 GLU 28 1.330 2.647 -3.247 1168 HG3 GLU 28 HG1 GLU 28 1.732 3.682 -4.616 1169 H MET 29 HN MET 29 -2.708 3.747 -2.248 1170 HA MET 29 HA MET 29 -2.148 1.335 -0.807 1171 HB2 MET 29 HB2 MET 29 -3.696 2.102 0.835 1172 HB3 MET 29 HB1 MET 29 -2.772 3.492 0.288 1173 HG2 MET 29 HG2 MET 29 -4.652 4.166 -1.132 1174 HG3 MET 29 HG1 MET 29 -5.574 2.781 -0.553 1175 HE1 MET 29 HE1 MET 29 -3.641 6.000 0.583 1176 HE2 MET 29 HE2 MET 29 -3.142 4.820 1.792 1177 HE3 MET 29 HE3 MET 29 -4.172 6.167 2.257 1178 H LEU 30 HN LEU 30 -4.631 2.332 -3.087 1179 HA LEU 30 HA LEU 30 -6.487 0.279 -2.542 1180 HB2 LEU 30 HB2 LEU 30 -7.203 2.114 -3.883 1181 HB3 LEU 30 HB1 LEU 30 -5.914 1.861 -5.043 1182 HG LEU 30 HG LEU 30 -7.034 -0.389 -5.546 1183 HD11 LEU 30 HD11 LEU 30 -9.452 -0.461 -5.107 1184 HD12 LEU 30 HD12 LEU 30 -9.291 0.966 -4.087 1185 HD13 LEU 30 HD13 LEU 30 -8.489 -0.536 -3.633 1186 HD21 LEU 30 HD21 LEU 30 -8.752 0.728 -7.003 1187 HD22 LEU 30 HD22 LEU 30 -7.103 1.325 -7.169 1188 HD23 LEU 30 HD23 LEU 30 -8.286 2.252 -6.247 1189 H GLU 31 HN GLU 31 -3.788 0.488 -4.804 1190 HA GLU 31 HA GLU 31 -4.122 -2.043 -5.983 1191 HB2 GLU 31 HB2 GLU 31 -1.542 -0.515 -5.614 1192 HB3 GLU 31 HB1 GLU 31 -1.867 -1.760 -6.816 1193 HG2 GLU 31 HG2 GLU 31 -3.393 -0.358 -7.979 1194 HG3 GLU 31 HG1 GLU 31 -3.385 0.833 -6.680 1195 H LYS 32 HN LYS 32 -2.546 -0.972 -3.056 1196 HA LYS 32 HA LYS 32 -1.170 -3.423 -2.556 1197 HB2 LYS 32 HB2 LYS 32 -1.845 -1.067 -0.794 1198 HB3 LYS 32 HB1 LYS 32 -0.911 -2.451 -0.236 1199 HG2 LYS 32 HG2 LYS 32 0.780 -2.020 -1.926 1200 HG3 LYS 32 HG1 LYS 32 -0.164 -0.664 -2.539 1201 HD2 LYS 32 HD2 LYS 32 0.040 -0.012 0.086 1202 HD3 LYS 32 HD1 LYS 32 1.577 -0.844 -0.177 1203 HE2 LYS 32 HE2 LYS 32 1.735 0.640 -2.289 1204 HE3 LYS 32 HE1 LYS 32 0.510 1.627 -1.493 1205 HZ1 LYS 32 HZ1 LYS 32 2.622 2.517 -0.945 1206 HZ2 LYS 32 HZ2 LYS 32 3.239 0.989 -0.514 1207 HZ3 LYS 32 HZ3 LYS 32 2.056 1.726 0.447 1208 H LEU 33 HN LEU 33 -4.327 -2.118 -1.728 1209 HA LEU 33 HA LEU 33 -4.923 -4.210 0.143 1210 HB2 LEU 33 HB2 LEU 33 -6.026 -2.044 0.344 1211 HB3 LEU 33 HB1 LEU 33 -6.746 -2.245 -1.243 1212 HG LEU 33 HG LEU 33 -8.027 -4.195 -0.373 1213 HD11 LEU 33 HD11 LEU 33 -8.168 -4.523 2.045 1214 HD12 LEU 33 HD12 LEU 33 -6.896 -3.325 2.285 1215 HD13 LEU 33 HD13 LEU 33 -6.538 -4.835 1.444 1216 HD21 LEU 33 HD21 LEU 33 -8.399 -1.596 1.108 1217 HD22 LEU 33 HD22 LEU 33 -9.606 -2.873 0.960 1218 HD23 LEU 33 HD23 LEU 33 -9.063 -2.006 -0.474 1219 H GLU 34 HN GLU 34 -5.694 -3.571 -3.254 1220 HA GLU 34 HA GLU 34 -7.442 -5.754 -3.580 1221 HB2 GLU 34 HB2 GLU 34 -7.391 -5.336 -5.890 1222 HB3 GLU 34 HB1 GLU 34 -7.125 -3.763 -5.159 1223 HG2 GLU 34 HG2 GLU 34 -4.808 -3.822 -5.687 1224 HG3 GLU 34 HG1 GLU 34 -4.901 -5.513 -6.167 1225 H VAL 35 HN VAL 35 -3.937 -5.507 -3.726 1226 HA VAL 35 HA VAL 35 -3.573 -8.080 -4.880 1227 HB VAL 35 HB VAL 35 -1.862 -6.157 -4.797 1228 HG11 VAL 35 HG11 VAL 35 -1.288 -7.456 -2.142 1229 HG12 VAL 35 HG12 VAL 35 -1.803 -5.793 -2.414 1230 HG13 VAL 35 HG13 VAL 35 -0.218 -6.329 -2.973 1231 HG21 VAL 35 HG21 VAL 35 -0.945 -8.961 -4.182 1232 HG22 VAL 35 HG22 VAL 35 -0.013 -7.707 -5.002 1233 HG23 VAL 35 HG23 VAL 35 -1.454 -8.376 -5.767 1234 H VAL 36 HN VAL 36 -3.911 -6.901 -1.586 1235 HA VAL 36 HA VAL 36 -3.092 -9.308 -0.307 1236 HB VAL 36 HB VAL 36 -4.904 -7.115 0.737 1237 HG11 VAL 36 HG11 VAL 36 -5.150 -9.248 1.960 1238 HG12 VAL 36 HG12 VAL 36 -4.421 -7.982 2.950 1239 HG13 VAL 36 HG13 VAL 36 -3.412 -9.250 2.260 1240 HG21 VAL 36 HG21 VAL 36 -2.984 -6.157 1.744 1241 HG22 VAL 36 HG22 VAL 36 -2.560 -6.473 0.062 1242 HG23 VAL 36 HG23 VAL 36 -1.988 -7.551 1.332 1243 H VAL 37 HN VAL 37 -6.236 -7.947 -1.224 1244 HA VAL 37 HA VAL 37 -7.810 -10.072 -0.240 1245 HB VAL 37 HB VAL 37 -8.411 -8.212 -2.558 1246 HG11 VAL 37 HG11 VAL 37 -10.209 -9.969 -0.894 1247 HG12 VAL 37 HG12 VAL 37 -9.891 -10.099 -2.624 1248 HG13 VAL 37 HG13 VAL 37 -10.783 -8.713 -1.992 1249 HG21 VAL 37 HG21 VAL 37 -8.032 -6.837 -0.682 1250 HG22 VAL 37 HG22 VAL 37 -8.854 -7.959 0.401 1251 HG23 VAL 37 HG23 VAL 37 -9.785 -7.029 -0.771 1252 H ASN 38 HN ASN 38 -6.161 -9.501 -3.301 1253 HA ASN 38 HA ASN 38 -7.194 -11.636 -4.776 1254 HB2 ASN 38 HB2 ASN 38 -5.883 -10.012 -5.932 1255 HB3 ASN 38 HB1 ASN 38 -4.508 -10.253 -4.858 1256 HD21 ASN 38 HD21 ASN 38 -6.284 -11.517 -7.569 1257 HD22 ASN 38 HD22 ASN 38 -5.107 -12.685 -8.052 1258 H GLU 39 HN GLU 39 -4.390 -11.490 -2.595 1259 HA GLU 39 HA GLU 39 -3.498 -14.128 -2.918 1260 HB2 GLU 39 HB2 GLU 39 -3.407 -12.479 -0.377 1261 HB3 GLU 39 HB1 GLU 39 -2.380 -13.849 -0.772 1262 HG2 GLU 39 HG2 GLU 39 -2.155 -11.930 -2.856 1263 HG3 GLU 39 HG1 GLU 39 -1.955 -11.112 -1.309 1264 H ARG 40 HN ARG 40 -5.904 -12.732 -0.763 1265 HA ARG 40 HA ARG 40 -6.477 -15.054 0.733 1266 HB2 ARG 40 HB2 ARG 40 -8.240 -12.675 0.111 1267 HB3 ARG 40 HB1 ARG 40 -8.553 -13.865 1.368 1268 HG2 ARG 40 HG2 ARG 40 -6.071 -12.172 1.300 1269 HG3 ARG 40 HG1 ARG 40 -7.548 -11.681 2.116 1270 HD2 ARG 40 HD2 ARG 40 -6.139 -14.267 2.701 1271 HD3 ARG 40 HD1 ARG 40 -5.796 -12.769 3.561 1272 HE ARG 40 HE ARG 40 -7.914 -12.879 4.573 1273 HH11 ARG 40 HH11 ARG 40 -7.241 -15.645 2.531 1274 HH12 ARG 40 HH12 ARG 40 -8.645 -16.539 3.061 1275 HH21 ARG 40 HH21 ARG 40 -9.665 -14.111 5.383 1276 HH22 ARG 40 HH22 ARG 40 -9.954 -15.699 4.746 1277 H ARG 41 HN ARG 41 -7.726 -13.773 -2.294 1278 HA ARG 41 HA ARG 41 -9.934 -15.492 -2.583 1279 HB2 ARG 41 HB2 ARG 41 -8.196 -14.142 -4.657 1280 HB3 ARG 41 HB1 ARG 41 -9.679 -15.006 -5.039 1281 HG2 ARG 41 HG2 ARG 41 -9.955 -12.971 -2.949 1282 HG3 ARG 41 HG1 ARG 41 -9.521 -12.349 -4.544 1283 HD2 ARG 41 HD2 ARG 41 -11.822 -14.222 -4.020 1284 HD3 ARG 41 HD1 ARG 41 -11.977 -12.469 -4.119 1285 HE ARG 41 HE ARG 41 -10.708 -13.646 -6.412 1286 HH11 ARG 41 HH11 ARG 41 -13.785 -12.817 -4.958 1287 HH12 ARG 41 HH12 ARG 41 -14.616 -12.727 -6.478 1288 HH21 ARG 41 HH21 ARG 41 -11.817 -13.558 -8.409 1289 HH22 ARG 41 HH22 ARG 41 -13.509 -13.172 -8.434 1290 H GLU 42 HN GLU 42 -6.532 -15.853 -3.419 1291 HA GLU 42 HA GLU 42 -6.819 -18.273 -4.867 1292 HB2 GLU 42 HB2 GLU 42 -4.302 -17.570 -3.402 1293 HB3 GLU 42 HB1 GLU 42 -4.487 -18.346 -4.964 1294 HG2 GLU 42 HG2 GLU 42 -5.443 -16.123 -5.767 1295 HG3 GLU 42 HG1 GLU 42 -4.792 -15.443 -4.282 1296 H GLU 43 HN GLU 43 -6.516 -17.523 -1.475 1297 HA GLU 43 HA GLU 43 -5.846 -20.166 -0.608 1298 HB2 GLU 43 HB2 GLU 43 -7.114 -17.882 0.931 1299 HB3 GLU 43 HB1 GLU 43 -6.463 -19.350 1.643 1300 HG2 GLU 43 HG2 GLU 43 -4.236 -18.758 0.902 1301 HG3 GLU 43 HG1 GLU 43 -4.871 -17.321 0.099 1302 H GLU 44 HN GLU 44 -8.819 -18.252 -0.475 1303 HA GLU 44 HA GLU 44 -10.503 -20.270 0.469 1304 HB2 GLU 44 HB2 GLU 44 -10.790 -17.604 -0.720 1305 HB3 GLU 44 HB1 GLU 44 -12.164 -18.664 -1.008 1306 HG2 GLU 44 HG2 GLU 44 -12.235 -17.159 1.040 1307 HG3 GLU 44 HG1 GLU 44 -12.647 -18.854 1.261 1308 H SER 45 HN SER 45 -9.627 -19.409 -2.863 1309 HA SER 45 HA SER 45 -11.512 -21.306 -3.962 1310 HB2 SER 45 HB2 SER 45 -9.443 -19.503 -5.211 1311 HB3 SER 45 HB1 SER 45 -10.404 -20.643 -6.152 1312 HG SER 45 HG SER 45 -12.267 -19.576 -5.489 1313 H ALA 46 HN ALA 46 -8.705 -21.828 -2.424 1314 HA ALA 46 HA ALA 46 -7.692 -23.839 -4.294 1315 HB1 ALA 46 HB1 ALA 46 -6.020 -22.414 -3.279 1316 HB2 ALA 46 HB2 ALA 46 -5.816 -24.070 -2.703 1317 HB3 ALA 46 HB3 ALA 46 -6.576 -22.861 -1.667 Start of MODEL 6 1 H LEU 6 HT1 LEU 6 10.376 13.191 5.289 2 HA LEU 6 HA LEU 6 10.564 15.765 3.852 3 HB2 LEU 6 HB2 LEU 6 12.180 13.229 3.930 4 HB3 LEU 6 HB1 LEU 6 12.276 14.315 2.559 5 HG LEU 6 HG LEU 6 12.850 16.124 4.332 6 HD11 LEU 6 HD11 LEU 6 13.407 13.589 5.852 7 HD12 LEU 6 HD12 LEU 6 12.367 14.929 6.332 8 HD13 LEU 6 HD13 LEU 6 14.113 15.154 6.246 9 HD21 LEU 6 HD21 LEU 6 15.230 15.530 4.170 10 HD22 LEU 6 HD22 LEU 6 14.395 15.340 2.631 11 HD23 LEU 6 HD23 LEU 6 14.784 13.922 3.602 12 H THR 7 HN THR 7 10.902 15.014 1.364 13 HA THR 7 HA THR 7 8.314 14.214 0.513 14 HB THR 7 HB THR 7 10.410 14.119 -1.523 15 HG1 THR 7 HG1 THR 7 11.541 15.638 -0.460 16 HG21 THR 7 HG21 THR 7 7.940 15.801 -1.087 17 HG22 THR 7 HG22 THR 7 8.104 14.398 -2.141 18 HG23 THR 7 HG23 THR 7 8.953 15.895 -2.523 19 H LYS 8 HN LYS 8 7.781 12.403 -0.814 20 HA LYS 8 HA LYS 8 8.698 9.919 0.111 21 HB2 LYS 8 HB2 LYS 8 6.535 10.727 -1.226 22 HB3 LYS 8 HB1 LYS 8 7.461 10.124 -2.591 23 HG2 LYS 8 HG2 LYS 8 7.519 7.936 -1.690 24 HG3 LYS 8 HG1 LYS 8 6.869 8.487 -0.143 25 HD2 LYS 8 HD2 LYS 8 5.076 7.472 -1.323 26 HD3 LYS 8 HD1 LYS 8 4.806 9.213 -1.398 27 HE2 LYS 8 HE2 LYS 8 5.790 9.246 -3.653 28 HE3 LYS 8 HE1 LYS 8 6.019 7.501 -3.564 29 HZ1 LYS 8 HZ1 LYS 8 3.370 8.800 -3.317 30 HZ2 LYS 8 HZ2 LYS 8 3.690 7.146 -3.527 31 HZ3 LYS 8 HZ3 LYS 8 3.998 8.241 -4.785 32 H THR 9 HN THR 9 9.514 11.818 -2.727 33 HA THR 9 HA THR 9 11.097 9.876 -4.027 34 HB THR 9 HB THR 9 12.080 12.345 -4.822 35 HG1 THR 9 HG1 THR 9 9.933 13.451 -5.084 36 HG21 THR 9 HG21 THR 9 9.642 10.934 -5.901 37 HG22 THR 9 HG22 THR 9 11.307 10.453 -6.235 38 HG23 THR 9 HG23 THR 9 10.710 12.024 -6.781 39 H ASP 10 HN ASP 10 11.756 12.165 -1.477 40 HA ASP 10 HA ASP 10 14.561 12.305 -1.717 41 HB2 ASP 10 HB2 ASP 10 12.601 12.900 0.435 42 HB3 ASP 10 HB1 ASP 10 14.283 12.693 0.913 43 H TYR 11 HN TYR 11 12.487 10.175 0.212 44 HA TYR 11 HA TYR 11 14.672 8.681 1.286 45 HB2 TYR 11 HB2 TYR 11 11.778 7.823 1.066 46 HB3 TYR 11 HB1 TYR 11 12.997 7.152 2.141 47 HD1 TYR 11 HD1 TYR 11 14.229 9.278 3.486 48 HD2 TYR 11 HD2 TYR 11 10.182 9.011 2.196 49 HE1 TYR 11 HE1 TYR 11 13.568 10.873 5.236 50 HE2 TYR 11 HE2 TYR 11 9.515 10.606 3.941 51 HH TYR 11 HH TYR 11 11.453 11.400 6.538 52 H LEU 12 HN LEU 12 12.431 8.299 -1.392 53 HA LEU 12 HA LEU 12 13.094 5.722 -2.208 54 HB2 LEU 12 HB2 LEU 12 11.171 6.871 -3.082 55 HB3 LEU 12 HB1 LEU 12 12.175 8.122 -3.786 56 HG LEU 12 HG LEU 12 13.100 6.484 -5.373 57 HD11 LEU 12 HD11 LEU 12 12.966 4.441 -4.188 58 HD12 LEU 12 HD12 LEU 12 11.872 4.288 -5.562 59 HD13 LEU 12 HD13 LEU 12 11.228 4.608 -3.953 60 HD21 LEU 12 HD21 LEU 12 10.089 6.581 -5.331 61 HD22 LEU 12 HD22 LEU 12 11.095 6.229 -6.734 62 HD23 LEU 12 HD23 LEU 12 11.153 7.824 -5.986 63 H MET 13 HN MET 13 14.493 8.835 -3.252 64 HA MET 13 HA MET 13 16.339 7.670 -5.047 65 HB2 MET 13 HB2 MET 13 16.124 10.358 -3.743 66 HB3 MET 13 HB1 MET 13 17.566 9.934 -4.658 67 HG2 MET 13 HG2 MET 13 14.738 10.139 -5.644 68 HG3 MET 13 HG1 MET 13 16.145 11.082 -6.140 69 HE1 MET 13 HE1 MET 13 18.151 10.111 -7.591 70 HE2 MET 13 HE2 MET 13 18.242 8.434 -8.130 71 HE3 MET 13 HE3 MET 13 18.387 8.817 -6.416 72 H ARG 14 HN ARG 14 16.523 8.432 -1.618 73 HA ARG 14 HA ARG 14 19.313 8.000 -1.340 74 HB2 ARG 14 HB2 ARG 14 18.047 9.209 0.361 75 HB3 ARG 14 HB1 ARG 14 17.079 7.780 0.698 76 HG2 ARG 14 HG2 ARG 14 19.987 7.424 0.990 77 HG3 ARG 14 HG1 ARG 14 19.237 8.537 2.138 78 HD2 ARG 14 HD2 ARG 14 17.687 6.835 2.842 79 HD3 ARG 14 HD1 ARG 14 18.260 5.737 1.590 80 HE ARG 14 HE ARG 14 19.586 6.395 4.102 81 HH11 ARG 14 HH11 ARG 14 19.795 4.809 0.978 82 HH12 ARG 14 HH12 ARG 14 21.065 3.737 1.467 83 HH21 ARG 14 HH21 ARG 14 21.266 4.958 4.737 84 HH22 ARG 14 HH22 ARG 14 21.904 3.825 3.589 85 H LEU 15 HN LEU 15 16.519 5.895 -1.362 86 HA LEU 15 HA LEU 15 18.048 3.581 -0.520 87 HB2 LEU 15 HB2 LEU 15 15.199 3.843 -1.481 88 HB3 LEU 15 HB1 LEU 15 15.917 2.358 -0.891 89 HG LEU 15 HG LEU 15 15.551 4.871 0.747 90 HD11 LEU 15 HD11 LEU 15 13.992 2.291 0.719 91 HD12 LEU 15 HD12 LEU 15 13.410 3.876 0.213 92 HD13 LEU 15 HD13 LEU 15 13.804 3.580 1.905 93 HD21 LEU 15 HD21 LEU 15 17.439 3.579 1.513 94 HD22 LEU 15 HD22 LEU 15 16.479 2.098 1.489 95 HD23 LEU 15 HD23 LEU 15 16.096 3.379 2.643 96 H ARG 16 HN ARG 16 17.715 5.236 -3.379 97 HA ARG 16 HA ARG 16 17.481 3.088 -5.231 98 HB2 ARG 16 HB2 ARG 16 17.623 5.916 -5.354 99 HB3 ARG 16 HB1 ARG 16 18.933 5.296 -6.351 100 HG2 ARG 16 HG2 ARG 16 17.155 5.494 -7.828 101 HG3 ARG 16 HG1 ARG 16 17.157 3.781 -7.407 102 HD2 ARG 16 HD2 ARG 16 15.426 4.273 -5.687 103 HD3 ARG 16 HD1 ARG 16 15.353 5.925 -6.299 104 HE ARG 16 HE ARG 16 14.435 3.495 -7.673 105 HH11 ARG 16 HH11 ARG 16 14.783 7.004 -7.655 106 HH12 ARG 16 HH12 ARG 16 13.619 7.240 -8.922 107 HH21 ARG 16 HH21 ARG 16 12.903 3.822 -9.323 108 HH22 ARG 16 HH22 ARG 16 12.563 5.446 -9.875 109 H ARG 17 HN ARG 17 20.029 4.212 -3.280 110 HA ARG 17 HA ARG 17 22.108 3.134 -5.001 111 HB2 ARG 17 HB2 ARG 17 22.417 4.231 -2.207 112 HB3 ARG 17 HB1 ARG 17 23.675 4.028 -3.422 113 HG2 ARG 17 HG2 ARG 17 22.340 5.695 -4.823 114 HG3 ARG 17 HG1 ARG 17 21.462 6.049 -3.331 115 HD2 ARG 17 HD2 ARG 17 24.360 6.483 -3.965 116 HD3 ARG 17 HD1 ARG 17 23.174 7.641 -3.374 117 HE ARG 17 HE ARG 17 24.375 5.484 -1.750 118 HH11 ARG 17 HH11 ARG 17 22.857 8.638 -2.002 119 HH12 ARG 17 HH12 ARG 17 23.146 9.041 -0.341 120 HH21 ARG 17 HH21 ARG 17 24.712 5.982 0.420 121 HH22 ARG 17 HH22 ARG 17 24.202 7.516 1.053 122 H CYS 18 HN CYS 18 19.926 1.904 -2.891 123 HA CYS 18 HA CYS 18 21.676 -0.064 -1.656 124 HB2 CYS 18 HB2 CYS 18 18.666 0.190 -1.476 125 HB3 CYS 18 HB1 CYS 18 19.701 -0.793 -0.445 126 HG CYS 18 HG CYS 18 20.002 1.008 1.360 127 H GLN 19 HN GLN 19 22.170 -1.870 -2.651 128 HA GLN 19 HA GLN 19 20.323 -2.966 -4.672 129 HB2 GLN 19 HB2 GLN 19 23.160 -2.340 -4.787 130 HB3 GLN 19 HB1 GLN 19 22.855 -4.025 -5.192 131 HG2 GLN 19 HG2 GLN 19 21.469 -1.689 -6.492 132 HG3 GLN 19 HG1 GLN 19 22.900 -2.486 -7.143 133 HE21 GLN 19 HE21 GLN 19 20.304 -2.232 -8.360 134 HE22 GLN 19 HE22 GLN 19 19.705 -3.835 -8.612 135 H THR 20 HN THR 20 21.251 -5.390 -5.124 136 HA THR 20 HA THR 20 21.403 -7.538 -4.425 137 HB THR 20 HB THR 20 22.262 -6.723 -1.675 138 HG1 THR 20 HG1 THR 20 23.556 -5.384 -2.824 139 HG21 THR 20 HG21 THR 20 23.871 -8.602 -2.078 140 HG22 THR 20 HG22 THR 20 23.040 -8.909 -3.605 141 HG23 THR 20 HG23 THR 20 22.174 -9.081 -2.077 142 H ILE 21 HN ILE 21 19.268 -5.398 -3.063 143 HA ILE 21 HA ILE 21 17.208 -5.622 -2.142 144 HB ILE 21 HB ILE 21 17.682 -8.594 -2.420 145 HG12 ILE 21 HG12 ILE 21 15.945 -6.751 -4.079 146 HG13 ILE 21 HG11 ILE 21 17.584 -7.214 -4.534 147 HG21 ILE 21 HG21 ILE 21 15.223 -7.047 -1.609 148 HG22 ILE 21 HG22 ILE 21 16.044 -8.328 -0.717 149 HG23 ILE 21 HG23 ILE 21 15.166 -8.705 -2.197 150 HD11 ILE 21 HD11 ILE 21 15.282 -9.105 -4.130 151 HD12 ILE 21 HD12 ILE 21 16.908 -9.532 -4.658 152 HD13 ILE 21 HD13 ILE 21 15.884 -8.535 -5.687 153 H ASP 22 HN ASP 22 19.352 -8.122 -0.761 154 HA ASP 22 HA ASP 22 18.299 -8.152 1.821 155 HB2 ASP 22 HB2 ASP 22 19.905 -9.816 1.011 156 HB3 ASP 22 HB1 ASP 22 21.167 -8.593 0.964 157 H THR 23 HN THR 23 20.836 -6.097 0.449 158 HA THR 23 HA THR 23 21.581 -4.788 2.809 159 HB THR 23 HB THR 23 21.569 -3.439 0.119 160 HG1 THR 23 HG1 THR 23 23.140 -5.608 1.057 161 HG21 THR 23 HG21 THR 23 23.699 -2.505 0.929 162 HG22 THR 23 HG22 THR 23 23.513 -3.397 2.438 163 HG23 THR 23 HG23 THR 23 22.370 -2.119 2.022 164 H LEU 24 HN LEU 24 18.869 -4.329 0.661 165 HA LEU 24 HA LEU 24 18.099 -1.768 1.712 166 HB2 LEU 24 HB2 LEU 24 17.473 -2.428 -0.562 167 HB3 LEU 24 HB1 LEU 24 16.574 -3.797 0.065 168 HG LEU 24 HG LEU 24 15.137 -2.067 1.294 169 HD11 LEU 24 HD11 LEU 24 15.099 0.149 0.501 170 HD12 LEU 24 HD12 LEU 24 16.203 -0.223 -0.823 171 HD13 LEU 24 HD13 LEU 24 16.793 -0.216 0.840 172 HD21 LEU 24 HD21 LEU 24 13.707 -1.768 -0.638 173 HD22 LEU 24 HD22 LEU 24 14.393 -3.393 -0.639 174 HD23 LEU 24 HD23 LEU 24 15.043 -2.160 -1.717 175 H GLU 25 HN GLU 25 17.086 -5.124 2.123 176 HA GLU 25 HA GLU 25 14.954 -4.714 3.876 177 HB2 GLU 25 HB2 GLU 25 15.674 -6.856 2.682 178 HB3 GLU 25 HB1 GLU 25 16.820 -7.081 3.992 179 HG2 GLU 25 HG2 GLU 25 15.018 -8.381 4.626 180 HG3 GLU 25 HG1 GLU 25 14.776 -6.894 5.536 181 H ARG 26 HN ARG 26 18.408 -4.775 4.429 182 HA ARG 26 HA ARG 26 18.257 -4.947 7.278 183 HB2 ARG 26 HB2 ARG 26 20.487 -4.011 5.480 184 HB3 ARG 26 HB1 ARG 26 20.640 -4.263 7.210 185 HG2 ARG 26 HG2 ARG 26 20.021 -6.649 6.835 186 HG3 ARG 26 HG1 ARG 26 20.117 -6.334 5.100 187 HD2 ARG 26 HD2 ARG 26 22.465 -5.443 5.574 188 HD3 ARG 26 HD1 ARG 26 22.312 -6.211 7.151 189 HE ARG 26 HE ARG 26 21.780 -7.954 4.910 190 HH11 ARG 26 HH11 ARG 26 24.221 -6.655 7.057 191 HH12 ARG 26 HH12 ARG 26 25.319 -7.973 6.814 192 HH21 ARG 26 HH21 ARG 26 23.209 -9.675 4.569 193 HH22 ARG 26 HH22 ARG 26 24.740 -9.710 5.393 194 H VAL 27 HN VAL 27 18.863 -2.256 5.006 195 HA VAL 27 HA VAL 27 19.191 -0.312 7.018 196 HB VAL 27 HB VAL 27 19.978 -0.085 4.645 197 HG11 VAL 27 HG11 VAL 27 17.863 -0.741 3.555 198 HG12 VAL 27 HG12 VAL 27 18.492 0.799 2.970 199 HG13 VAL 27 HG13 VAL 27 17.144 0.771 4.105 200 HG21 VAL 27 HG21 VAL 27 20.051 1.787 6.184 201 HG22 VAL 27 HG22 VAL 27 18.381 2.198 5.796 202 HG23 VAL 27 HG23 VAL 27 19.632 2.341 4.564 203 H ILE 28 HN ILE 28 16.283 -1.441 5.348 204 HA ILE 28 HA ILE 28 14.629 0.669 6.300 205 HB ILE 28 HB ILE 28 12.715 -0.689 5.646 206 HG12 ILE 28 HG12 ILE 28 14.702 -2.867 4.977 207 HG13 ILE 28 HG11 ILE 28 13.655 -2.879 6.393 208 HG21 ILE 28 HG21 ILE 28 14.153 0.587 3.991 209 HG22 ILE 28 HG22 ILE 28 13.089 -0.653 3.325 210 HG23 ILE 28 HG23 ILE 28 14.811 -0.980 3.515 211 HD11 ILE 28 HD11 ILE 28 12.870 -3.051 3.503 212 HD12 ILE 28 HD12 ILE 28 11.710 -2.747 4.797 213 HD13 ILE 28 HD13 ILE 28 12.632 -4.251 4.774 214 H GLU 29 HN GLU 29 15.745 -2.325 7.667 215 HA GLU 29 HA GLU 29 13.787 -2.509 9.731 216 HB2 GLU 29 HB2 GLU 29 15.155 -4.437 9.011 217 HB3 GLU 29 HB1 GLU 29 16.594 -3.636 9.622 218 HG2 GLU 29 HG2 GLU 29 15.929 -5.264 11.209 219 HG3 GLU 29 HG1 GLU 29 15.584 -3.677 11.886 220 H LYS 30 HN LYS 30 16.989 -1.066 9.432 221 HA LYS 30 HA LYS 30 17.283 -0.271 12.127 222 HB2 LYS 30 HB2 LYS 30 18.460 0.925 9.611 223 HB3 LYS 30 HB1 LYS 30 18.970 1.335 11.241 224 HG2 LYS 30 HG2 LYS 30 19.364 -1.250 11.434 225 HG3 LYS 30 HG1 LYS 30 19.440 -1.147 9.673 226 HD2 LYS 30 HD2 LYS 30 21.659 -0.897 10.424 227 HD3 LYS 30 HD1 LYS 30 21.120 0.729 9.997 228 HE2 LYS 30 HE2 LYS 30 22.163 1.057 12.037 229 HE3 LYS 30 HE1 LYS 30 20.469 0.900 12.493 230 HZ1 LYS 30 HZ1 LYS 30 21.659 -0.444 13.974 231 HZ2 LYS 30 HZ2 LYS 30 22.624 -1.102 12.751 232 HZ3 LYS 30 HZ3 LYS 30 20.991 -1.531 12.860 233 H ASN 31 HN ASN 31 16.134 1.450 9.257 234 HA ASN 31 HA ASN 31 15.578 3.887 10.526 235 HB2 ASN 31 HB2 ASN 31 14.851 2.629 7.946 236 HB3 ASN 31 HB1 ASN 31 13.809 3.939 8.490 237 HD21 ASN 31 HD21 ASN 31 14.635 6.009 8.658 238 HD22 ASN 31 HD22 ASN 31 16.127 6.471 7.923 239 H LYS 32 HN LYS 32 13.830 0.908 10.431 240 HA LYS 32 HA LYS 32 11.238 1.798 10.989 241 HB2 LYS 32 HB2 LYS 32 11.823 -0.519 10.358 242 HB3 LYS 32 HB1 LYS 32 12.596 -0.741 11.918 243 HG2 LYS 32 HG2 LYS 32 10.340 -0.241 12.956 244 HG3 LYS 32 HG1 LYS 32 9.673 -0.389 11.330 245 HD2 LYS 32 HD2 LYS 32 11.362 -2.543 12.579 246 HD3 LYS 32 HD1 LYS 32 9.613 -2.477 12.790 247 HE2 LYS 32 HE2 LYS 32 9.223 -2.758 10.475 248 HE3 LYS 32 HE1 LYS 32 10.915 -2.467 10.082 249 HZ1 LYS 32 HZ1 LYS 32 11.546 -4.541 10.827 250 HZ2 LYS 32 HZ2 LYS 32 10.046 -4.862 10.106 251 HZ3 LYS 32 HZ3 LYS 32 10.162 -4.745 11.786 252 H TYR 33 HN TYR 33 14.049 1.488 13.041 253 HA TYR 33 HA TYR 33 12.408 2.201 15.384 254 HB2 TYR 33 HB2 TYR 33 15.220 1.085 15.438 255 HB3 TYR 33 HB1 TYR 33 14.097 1.224 16.785 256 HD1 TYR 33 HD1 TYR 33 11.831 -0.101 16.459 257 HD2 TYR 33 HD2 TYR 33 15.450 -0.970 14.402 258 HE1 TYR 33 HE1 TYR 33 11.020 -2.376 16.005 259 HE2 TYR 33 HE2 TYR 33 14.646 -3.250 13.940 260 HH TYR 33 HH TYR 33 12.822 -4.596 13.934 261 H GLU 34 HN GLU 34 14.342 3.599 13.119 262 HA GLU 34 HA GLU 34 15.513 5.523 15.004 263 HB2 GLU 34 HB2 GLU 34 16.126 4.992 12.095 264 HB3 GLU 34 HB1 GLU 34 16.818 6.320 13.012 265 HG2 GLU 34 HG2 GLU 34 17.749 4.642 14.601 266 HG3 GLU 34 HG1 GLU 34 17.202 3.376 13.503 267 H LEU 35 HN LEU 35 13.082 5.181 12.586 268 HA LEU 35 HA LEU 35 12.829 7.959 11.960 269 HB2 LEU 35 HB2 LEU 35 11.050 5.576 11.507 270 HB3 LEU 35 HB1 LEU 35 10.593 7.198 11.012 271 HG LEU 35 HG LEU 35 12.971 5.615 10.017 272 HD11 LEU 35 HD11 LEU 35 10.395 6.475 8.713 273 HD12 LEU 35 HD12 LEU 35 10.921 4.830 9.058 274 HD13 LEU 35 HD13 LEU 35 11.772 5.793 7.852 275 HD21 LEU 35 HD21 LEU 35 13.768 7.785 9.946 276 HD22 LEU 35 HD22 LEU 35 12.171 8.475 9.660 277 HD23 LEU 35 HD23 LEU 35 13.007 7.622 8.362 278 H SER 36 HN SER 36 11.078 9.335 12.501 279 HA SER 36 HA SER 36 10.315 9.071 15.276 280 HB2 SER 36 HB2 SER 36 9.468 11.353 13.532 281 HB3 SER 36 HB1 SER 36 9.943 11.354 15.232 282 HG SER 36 HG SER 36 12.088 10.972 14.562 283 H ASP 37 H ASP 37 9.054 7.463 12.972 284 HA ASP 37 HA ASP 37 7.069 6.406 12.616 285 HB2 ASP 37 3HB ASP 37 6.200 8.093 15.061 286 HB3 ASP 37 2HB ASP 37 5.105 6.990 14.237 287 H ASN 38 HN ASN 38 6.803 9.947 13.019 288 HA ASN 38 HA ASN 38 4.431 10.275 11.589 289 HB2 ASN 38 HB2 ASN 38 5.113 12.610 11.260 290 HB3 ASN 38 HB1 ASN 38 5.375 12.084 12.913 291 HD21 ASN 38 HD21 ASN 38 6.550 14.324 11.635 292 HD22 ASN 38 HD22 ASN 38 8.263 14.069 11.587 293 H GLU 39 HN GLU 39 7.779 10.499 10.361 294 HA GLU 39 HA GLU 39 6.835 10.680 7.642 295 HB2 GLU 39 HB2 GLU 39 9.295 10.609 7.096 296 HB3 GLU 39 HB1 GLU 39 8.774 11.944 8.110 297 HG2 GLU 39 HG2 GLU 39 9.635 10.807 10.080 298 HG3 GLU 39 HG1 GLU 39 10.102 9.424 9.089 299 H LEU 40 HN LEU 40 6.942 8.135 9.645 300 HA LEU 40 HA LEU 40 8.254 6.144 8.106 301 HB2 LEU 40 HB2 LEU 40 7.752 5.850 10.482 302 HB3 LEU 40 HB1 LEU 40 6.034 5.905 10.146 303 HG LEU 40 HG LEU 40 6.349 3.809 8.764 304 HD11 LEU 40 HD11 LEU 40 8.757 3.983 8.422 305 HD12 LEU 40 HD12 LEU 40 8.338 2.468 9.220 306 HD13 LEU 40 HD13 LEU 40 9.023 3.800 10.153 307 HD21 LEU 40 HD21 LEU 40 5.318 3.465 10.808 308 HD22 LEU 40 HD22 LEU 40 6.740 3.952 11.725 309 HD23 LEU 40 HD23 LEU 40 6.716 2.395 10.902 310 H ALA 41 HN ALA 41 5.219 7.721 7.872 311 HA ALA 41 HA ALA 41 3.781 5.768 6.414 312 HB1 ALA 41 HB1 ALA 41 3.397 8.760 6.382 313 HB2 ALA 41 HB2 ALA 41 2.725 7.670 7.592 314 HB3 ALA 41 HB3 ALA 41 2.214 7.538 5.911 315 H VAL 42 HN VAL 42 5.614 8.648 5.378 316 HA VAL 42 HA VAL 42 5.246 8.084 2.602 317 HB VAL 42 HB VAL 42 7.280 9.786 2.462 318 HG11 VAL 42 HG11 VAL 42 5.063 10.235 1.613 319 HG12 VAL 42 HG12 VAL 42 5.633 11.623 2.538 320 HG13 VAL 42 HG13 VAL 42 4.463 10.517 3.246 321 HG21 VAL 42 HG21 VAL 42 7.351 11.323 4.320 322 HG22 VAL 42 HG22 VAL 42 7.697 9.695 4.912 323 HG23 VAL 42 HG23 VAL 42 6.103 10.410 5.166 324 H PHE 43 HN PHE 43 7.557 7.197 5.018 325 HA PHE 43 HA PHE 43 9.653 6.424 3.283 326 HB2 PHE 43 HB2 PHE 43 9.827 6.816 5.770 327 HB3 PHE 43 HB1 PHE 43 9.053 5.252 6.002 328 HD1 PHE 43 HD1 PHE 43 12.049 6.921 4.594 329 HD2 PHE 43 HD2 PHE 43 10.281 3.255 5.872 330 HE1 PHE 43 HE1 PHE 43 14.238 5.811 4.434 331 HE2 PHE 43 HE2 PHE 43 12.477 2.147 5.715 332 HZ PHE 43 HZ PHE 43 14.457 3.427 4.996 333 H TYR 44 HN TYR 44 6.764 4.849 4.469 334 HA TYR 44 HA TYR 44 7.311 2.194 3.818 335 HB2 TYR 44 HB2 TYR 44 4.797 3.804 4.037 336 HB3 TYR 44 HB1 TYR 44 4.702 2.197 3.332 337 HD1 TYR 44 HD1 TYR 44 6.828 0.899 5.135 338 HD2 TYR 44 HD2 TYR 44 3.514 3.434 5.968 339 HE1 TYR 44 HE1 TYR 44 6.665 -0.070 7.388 340 HE2 TYR 44 HE2 TYR 44 3.340 2.479 8.225 341 HH TYR 44 HH TYR 44 5.785 0.556 9.595 342 H SER 45 HN SER 45 5.705 4.675 1.861 343 HA SER 45 HA SER 45 5.377 3.171 -0.471 344 HB2 SER 45 HB2 SER 45 5.671 6.143 -0.040 345 HB3 SER 45 HB1 SER 45 5.202 5.419 -1.577 346 HG SER 45 HG SER 45 3.297 4.866 -0.779 347 H ALA 46 HN ALA 46 8.102 5.078 0.686 348 HA ALA 46 HA ALA 46 9.585 5.067 -1.724 349 HB1 ALA 46 HB1 ALA 46 10.030 6.604 0.156 350 HB2 ALA 46 HB2 ALA 46 11.477 5.736 -0.362 351 HB3 ALA 46 HB3 ALA 46 10.626 5.240 1.105 352 H ALA 47 HN ALA 47 9.590 2.963 1.119 353 HA ALA 47 HA ALA 47 11.638 1.229 0.229 354 HB1 ALA 47 HB1 ALA 47 10.908 1.415 2.591 355 HB2 ALA 47 HB2 ALA 47 10.933 -0.248 2.007 356 HB3 ALA 47 HB3 ALA 47 9.403 0.607 2.160 357 H ASP 48 HN ASP 48 8.096 1.032 0.096 358 HA ASP 48 HA ASP 48 7.847 -1.455 -1.128 359 HB2 ASP 48 HB2 ASP 48 6.133 1.007 -1.096 360 HB3 ASP 48 HB1 ASP 48 5.694 -0.338 -2.136 361 H HIS 49 HN HIS 49 8.115 1.765 -2.598 362 HA HIS 49 HA HIS 49 7.923 0.963 -5.280 363 HB2 HIS 49 HB2 HIS 49 7.718 3.320 -4.545 364 HB3 HIS 49 HB1 HIS 49 9.429 3.341 -4.155 365 HD1 HIS 49 HD1 HIS 49 7.321 4.570 -6.638 366 HD2 HIS 49 HD2 HIS 49 10.904 2.476 -6.771 367 HE1 HIS 49 HE1 HIS 49 8.281 5.018 -8.917 368 HE2 HIS 49 HE2 HIS 49 10.359 3.598 -9.032 369 H ARG 50 HN ARG 50 10.807 1.598 -3.292 370 HA ARG 50 HA ARG 50 12.689 0.973 -5.271 371 HB2 ARG 50 HB2 ARG 50 13.273 2.176 -3.227 372 HB3 ARG 50 HB1 ARG 50 12.948 0.738 -2.271 373 HG2 ARG 50 HG2 ARG 50 15.336 1.088 -2.613 374 HG3 ARG 50 HG1 ARG 50 14.787 -0.424 -3.341 375 HD2 ARG 50 HD2 ARG 50 14.663 0.745 -5.533 376 HD3 ARG 50 HD1 ARG 50 15.357 2.176 -4.769 377 HE ARG 50 HE ARG 50 17.198 0.377 -4.170 378 HH11 ARG 50 HH11 ARG 50 15.554 0.968 -7.222 379 HH12 ARG 50 HH12 ARG 50 16.872 0.346 -8.171 380 HH21 ARG 50 HH21 ARG 50 18.905 -0.434 -5.424 381 HH22 ARG 50 HH22 ARG 50 18.776 -0.436 -7.159 382 H LEU 51 HN LEU 51 11.179 -1.084 -2.803 383 HA LEU 51 HA LEU 51 12.703 -3.385 -3.291 384 HB2 LEU 51 HB2 LEU 51 11.282 -3.086 -1.329 385 HB3 LEU 51 HB1 LEU 51 9.849 -3.144 -2.337 386 HG LEU 51 HG LEU 51 10.460 -5.491 -2.962 387 HD11 LEU 51 HD11 LEU 51 12.560 -5.056 -0.849 388 HD12 LEU 51 HD12 LEU 51 12.811 -5.497 -2.542 389 HD13 LEU 51 HD13 LEU 51 12.055 -6.643 -1.430 390 HD21 LEU 51 HD21 LEU 51 8.870 -4.817 -1.114 391 HD22 LEU 51 HD22 LEU 51 10.187 -5.161 0.011 392 HD23 LEU 51 HD23 LEU 51 9.544 -6.442 -1.018 393 H ALA 52 HN ALA 52 9.664 -2.287 -4.753 394 HA ALA 52 HA ALA 52 9.099 -4.554 -6.287 395 HB1 ALA 52 HB1 ALA 52 7.688 -3.102 -7.629 396 HB2 ALA 52 HB2 ALA 52 8.494 -1.678 -6.970 397 HB3 ALA 52 HB3 ALA 52 7.520 -2.707 -5.917 398 H GLU 53 HN GLU 53 10.834 -1.589 -7.252 399 HA GLU 53 HA GLU 53 11.486 -2.616 -9.833 400 HB2 GLU 53 HB2 GLU 53 13.047 -0.606 -9.890 401 HB3 GLU 53 HB1 GLU 53 11.331 -0.277 -9.702 402 HG2 GLU 53 HG2 GLU 53 11.575 0.207 -7.406 403 HG3 GLU 53 HG1 GLU 53 13.216 -0.431 -7.374 404 H LEU 54 HN LEU 54 12.982 -2.802 -6.717 405 HA LEU 54 HA LEU 54 15.617 -3.400 -7.636 406 HB2 LEU 54 HB2 LEU 54 15.010 -2.543 -5.353 407 HB3 LEU 54 HB1 LEU 54 14.375 -4.134 -4.987 408 HG LEU 54 HG LEU 54 16.547 -5.122 -5.072 409 HD11 LEU 54 HD11 LEU 54 18.556 -3.682 -5.556 410 HD12 LEU 54 HD12 LEU 54 17.439 -2.497 -6.233 411 HD13 LEU 54 HD13 LEU 54 17.555 -4.105 -6.946 412 HD21 LEU 54 HD21 LEU 54 16.028 -3.967 -3.003 413 HD22 LEU 54 HD22 LEU 54 16.678 -2.465 -3.661 414 HD23 LEU 54 HD23 LEU 54 17.752 -3.831 -3.366 415 H THR 55 HN THR 55 12.825 -5.350 -6.697 416 HA THR 55 HA THR 55 14.128 -7.858 -6.854 417 HB THR 55 HB THR 55 11.192 -7.348 -7.347 418 HG1 THR 55 HG1 THR 55 11.706 -6.361 -5.396 419 HG21 THR 55 HG21 THR 55 10.854 -9.578 -6.542 420 HG22 THR 55 HG22 THR 55 12.547 -9.725 -6.068 421 HG23 THR 55 HG23 THR 55 12.115 -9.653 -7.777 422 H MET 56 HN MET 56 12.404 -5.888 -9.206 423 HA MET 56 HA MET 56 12.642 -7.851 -11.309 424 HB2 MET 56 HB2 MET 56 11.662 -5.003 -11.223 425 HB3 MET 56 HB1 MET 56 11.785 -5.901 -12.728 426 HG2 MET 56 HG2 MET 56 10.193 -6.877 -10.376 427 HG3 MET 56 HG1 MET 56 9.516 -5.840 -11.626 428 HE1 MET 56 HE1 MET 56 10.670 -6.791 -14.325 429 HE2 MET 56 HE2 MET 56 8.949 -6.554 -14.021 430 HE3 MET 56 HE3 MET 56 9.518 -8.040 -14.779 431 H ASN 57 HN ASN 57 14.561 -5.408 -9.966 432 HA ASN 57 HA ASN 57 16.583 -4.514 -10.430 433 HB2 ASN 57 HB2 ASN 57 17.030 -7.011 -10.947 434 HB3 ASN 57 HB1 ASN 57 16.971 -6.523 -12.639 435 HD21 ASN 57 HD21 ASN 57 19.119 -6.979 -13.012 436 HD22 ASN 57 HD22 ASN 57 20.401 -6.018 -12.364 437 H LYS 58 HN LYS 58 14.390 -3.333 -11.584 438 HA LYS 58 HA LYS 58 15.612 -1.956 -13.824 439 HB2 LYS 58 HB2 LYS 58 14.158 -3.933 -14.683 440 HB3 LYS 58 HB1 LYS 58 12.790 -2.963 -14.157 441 HG2 LYS 58 HG2 LYS 58 13.130 -2.612 -16.497 442 HG3 LYS 58 HG1 LYS 58 13.580 -1.137 -15.640 443 HD2 LYS 58 HD2 LYS 58 15.859 -1.487 -15.985 444 HD3 LYS 58 HD1 LYS 58 15.641 -3.203 -16.312 445 HE2 LYS 58 HE2 LYS 58 16.147 -2.109 -18.375 446 HE3 LYS 58 HE1 LYS 58 14.453 -2.592 -18.409 447 HZ1 LYS 58 HZ1 LYS 58 13.779 -0.370 -18.000 448 HZ2 LYS 58 HZ2 LYS 58 14.911 -0.316 -19.256 449 HZ3 LYS 58 HZ3 LYS 58 15.363 0.136 -17.690 450 H LEU 59 HN LEU 59 15.287 0.164 -13.504 451 HA LEU 59 HA LEU 59 13.582 1.034 -11.362 452 HB2 LEU 59 HB2 LEU 59 15.643 2.230 -13.082 453 HB3 LEU 59 HB1 LEU 59 14.365 3.331 -12.609 454 HG LEU 59 HG LEU 59 14.815 2.780 -10.227 455 HD11 LEU 59 HD11 LEU 59 15.800 0.641 -10.266 456 HD12 LEU 59 HD12 LEU 59 17.102 1.735 -9.798 457 HD13 LEU 59 HD13 LEU 59 17.009 1.131 -11.449 458 HD21 LEU 59 HD21 LEU 59 15.759 4.777 -11.140 459 HD22 LEU 59 HD22 LEU 59 17.083 3.872 -11.877 460 HD23 LEU 59 HD23 LEU 59 16.981 4.010 -10.120 461 H TYR 60 HN TYR 60 11.597 1.837 -11.451 462 HA TYR 60 HA TYR 60 10.466 2.535 -14.086 463 HB2 TYR 60 HB2 TYR 60 9.114 1.077 -11.804 464 HB3 TYR 60 HB1 TYR 60 8.285 1.668 -13.239 465 HD1 TYR 60 HD1 TYR 60 9.380 0.818 -15.522 466 HD2 TYR 60 HD2 TYR 60 9.734 -1.150 -11.766 467 HE1 TYR 60 HE1 TYR 60 9.856 -1.302 -16.675 468 HE2 TYR 60 HE2 TYR 60 10.213 -3.270 -12.918 469 HH TYR 60 HH TYR 60 10.988 -3.447 -16.201 470 H ASP 61 HN ASP 61 9.092 4.294 -14.151 471 HA ASP 61 HA ASP 61 9.463 6.320 -12.226 472 HB2 ASP 61 HB2 ASP 61 8.272 6.102 -14.787 473 HB3 ASP 61 HB1 ASP 61 7.052 6.780 -13.712 474 H LYS 62 HN LYS 62 6.493 4.565 -13.073 475 HA LYS 62 HA LYS 62 5.588 4.917 -10.296 476 HB2 LYS 62 HB2 LYS 62 4.134 5.986 -12.104 477 HB3 LYS 62 HB1 LYS 62 3.796 4.356 -12.675 478 HG2 LYS 62 HG2 LYS 62 3.058 3.899 -10.246 479 HG3 LYS 62 HG1 LYS 62 2.978 5.657 -10.108 480 HD2 LYS 62 HD2 LYS 62 0.950 5.582 -11.016 481 HD3 LYS 62 HD1 LYS 62 1.683 5.008 -12.513 482 HE2 LYS 62 HE2 LYS 62 0.099 3.368 -12.055 483 HE3 LYS 62 HE1 LYS 62 1.578 2.673 -11.399 484 HZ1 LYS 62 HZ1 LYS 62 -0.372 2.458 -9.917 485 HZ2 LYS 62 HZ2 LYS 62 -0.438 4.154 -9.789 486 HZ3 LYS 62 HZ3 LYS 62 0.909 3.309 -9.203 487 H ILE 63 HN ILE 63 4.676 3.075 -9.282 488 HA ILE 63 HA ILE 63 5.866 0.625 -10.209 489 HB ILE 63 HB ILE 63 4.203 1.207 -7.764 490 HG12 ILE 63 HG12 ILE 63 6.370 2.305 -7.738 491 HG13 ILE 63 HG11 ILE 63 6.365 0.971 -6.591 492 HG21 ILE 63 HG21 ILE 63 3.880 -1.083 -8.202 493 HG22 ILE 63 HG22 ILE 63 5.163 -1.012 -6.992 494 HG23 ILE 63 HG23 ILE 63 5.561 -1.304 -8.688 495 HD11 ILE 63 HD11 ILE 63 7.480 -0.405 -8.391 496 HD12 ILE 63 HD12 ILE 63 8.444 0.893 -7.688 497 HD13 ILE 63 HD13 ILE 63 7.704 1.104 -9.276 498 HA PRO 64 HA PRO 64 2.219 -0.557 -12.508 499 HB2 PRO 64 HB2 PRO 64 3.587 -3.178 -12.579 500 HB3 PRO 64 HB1 PRO 64 3.064 -2.146 -13.923 501 HG2 PRO 64 HG2 PRO 64 5.640 -2.442 -13.308 502 HG3 PRO 64 HG1 PRO 64 4.979 -0.913 -13.921 503 HD2 PRO 64 HD2 PRO 64 5.749 -1.650 -11.137 504 HD3 PRO 64 HD1 PRO 64 5.917 -0.103 -11.991 505 H SER 65 HN SER 65 0.340 -1.363 -11.772 506 HA SER 65 HA SER 65 0.011 -2.297 -9.179 507 HB2 SER 65 HB2 SER 65 -2.020 -3.142 -11.155 508 HB3 SER 65 HB1 SER 65 -2.210 -2.232 -9.657 509 HG SER 65 HG SER 65 -1.558 -0.370 -10.704 510 H SER 66 H SER 66 0.714 -4.053 -12.101 511 HA SER 66 HA SER 66 -0.044 -6.653 -10.995 512 HB2 SER 66 3HB SER 66 0.684 -7.578 -13.157 513 HB3 SER 66 2HB SER 66 -0.330 -6.179 -13.470 514 HG SER 66 HG SER 66 1.614 -4.954 -13.778 515 H VAL 67 HN VAL 67 2.680 -4.658 -10.642 516 HA VAL 67 HA VAL 67 4.487 -6.949 -10.438 517 HB VAL 67 HB VAL 67 5.057 -4.601 -11.478 518 HG11 VAL 67 HG11 VAL 67 5.557 -4.176 -8.552 519 HG12 VAL 67 HG12 VAL 67 4.631 -3.166 -9.660 520 HG13 VAL 67 HG13 VAL 67 6.381 -3.260 -9.813 521 HG21 VAL 67 HG21 VAL 67 6.546 -6.559 -11.331 522 HG22 VAL 67 HG22 VAL 67 7.024 -6.045 -9.714 523 HG23 VAL 67 HG23 VAL 67 7.401 -5.033 -11.110 524 H TRP 68 HN TRP 68 2.399 -5.237 -8.468 525 HA TRP 68 HA TRP 68 3.814 -5.111 -6.032 526 HB2 TRP 68 HB2 TRP 68 0.899 -5.188 -6.742 527 HB3 TRP 68 HB1 TRP 68 1.406 -5.229 -5.060 528 HD1 TRP 68 HD1 TRP 68 0.140 -2.863 -7.353 529 HE1 TRP 68 HE1 TRP 68 0.907 -0.451 -6.857 530 HE3 TRP 68 HE3 TRP 68 4.065 -3.905 -4.251 531 HZ2 TRP 68 HZ2 TRP 68 2.922 0.829 -5.336 532 HZ3 TRP 68 HZ3 TRP 68 5.361 -2.037 -3.322 533 HH2 TRP 68 HH2 TRP 68 4.800 0.278 -3.851 534 H LYS 69 HN LYS 69 2.484 -7.752 -7.755 535 HA LYS 69 HA LYS 69 2.000 -9.481 -5.532 536 HB2 LYS 69 HB2 LYS 69 1.086 -9.533 -7.993 537 HB3 LYS 69 HB1 LYS 69 2.516 -10.507 -8.293 538 HG2 LYS 69 HG2 LYS 69 0.596 -11.914 -7.855 539 HG3 LYS 69 HG1 LYS 69 1.795 -12.090 -6.569 540 HD2 LYS 69 HD2 LYS 69 0.498 -10.953 -5.030 541 HD3 LYS 69 HD1 LYS 69 -0.418 -10.102 -6.275 542 HE2 LYS 69 HE2 LYS 69 -1.832 -11.746 -5.235 543 HE3 LYS 69 HE1 LYS 69 -1.489 -12.242 -6.891 544 HZ1 LYS 69 HZ1 LYS 69 0.204 -13.750 -6.034 545 HZ2 LYS 69 HZ2 LYS 69 -1.324 -14.109 -5.405 546 HZ3 LYS 69 HZ3 LYS 69 -0.178 -13.309 -4.446 547 H PHE 70 HN PHE 70 4.865 -8.334 -6.731 548 HA PHE 70 HA PHE 70 6.283 -10.851 -6.170 549 HB2 PHE 70 HB2 PHE 70 7.229 -8.394 -7.657 550 HB3 PHE 70 HB1 PHE 70 8.190 -9.842 -7.371 551 HD1 PHE 70 HD1 PHE 70 6.965 -12.088 -8.124 552 HD2 PHE 70 HD2 PHE 70 6.181 -8.206 -9.689 553 HE1 PHE 70 HE1 PHE 70 6.030 -13.098 -10.164 554 HE2 PHE 70 HE2 PHE 70 5.249 -9.212 -11.727 555 HZ PHE 70 HZ PHE 70 5.168 -11.662 -11.968 556 H ILE 71 HN ILE 71 5.284 -8.458 -4.396 557 HA ILE 71 HA ILE 71 7.771 -7.638 -3.162 558 HB ILE 71 HB ILE 71 4.921 -6.855 -2.898 559 HG12 ILE 71 HG12 ILE 71 5.927 -4.599 -2.810 560 HG13 ILE 71 HG11 ILE 71 7.529 -5.327 -2.787 561 HG21 ILE 71 HG21 ILE 71 5.509 -5.598 -0.752 562 HG22 ILE 71 HG22 ILE 71 6.829 -6.759 -0.584 563 HG23 ILE 71 HG23 ILE 71 5.158 -7.323 -0.621 564 HD11 ILE 71 HD11 ILE 71 6.637 -4.417 -4.997 565 HD12 ILE 71 HD12 ILE 71 5.621 -5.858 -5.025 566 HD13 ILE 71 HD13 ILE 71 7.378 -6.017 -4.999 567 H ARG 72 HN ARG 72 8.650 -8.426 -1.334 568 HA ARG 72 HA ARG 72 7.814 -10.973 -0.376 569 HB2 ARG 72 HB2 ARG 72 9.624 -9.790 1.477 570 HB3 ARG 72 HB1 ARG 72 9.939 -11.066 0.312 571 HG2 ARG 72 HG2 ARG 72 10.604 -9.471 -1.344 572 HG3 ARG 72 HG1 ARG 72 10.096 -8.131 -0.315 573 HD2 ARG 72 HD2 ARG 72 12.459 -8.283 -0.129 574 HD3 ARG 72 HD1 ARG 72 11.783 -8.913 1.371 575 HE ARG 72 HE ARG 72 12.311 -10.941 -0.600 576 HH11 ARG 72 HH11 ARG 72 13.686 -9.046 2.027 577 HH12 ARG 72 HH12 ARG 72 14.954 -10.200 2.347 578 HH21 ARG 72 HH21 ARG 72 13.979 -12.438 -0.173 579 HH22 ARG 72 HH22 ARG 72 15.109 -12.133 1.109 580 H GLU 3 HN GLU 3 -6.089 7.878 11.001 581 HA GLU 3 HA GLU 3 -3.405 6.749 10.905 582 HB2 GLU 3 HB2 GLU 3 -3.908 5.708 12.983 583 HB3 GLU 3 HB1 GLU 3 -4.579 7.328 13.071 584 HG2 GLU 3 HG2 GLU 3 -6.291 5.010 12.267 585 HG3 GLU 3 HG1 GLU 3 -5.941 5.335 13.961 586 H ALA 4 HN ALA 4 -6.682 5.898 10.076 587 HA ALA 4 HA ALA 4 -6.397 3.116 9.837 588 HB1 ALA 4 HB1 ALA 4 -8.227 4.915 8.247 589 HB2 ALA 4 HB2 ALA 4 -8.564 4.295 9.867 590 HB3 ALA 4 HB3 ALA 4 -8.415 3.179 8.504 591 H LEU 5 HN LEU 5 -5.832 5.709 7.501 592 HA LEU 5 HA LEU 5 -5.136 3.825 5.425 593 HB2 LEU 5 HB2 LEU 5 -5.157 6.835 5.535 594 HB3 LEU 5 HB1 LEU 5 -4.576 5.941 4.141 595 HG LEU 5 HG LEU 5 -6.990 4.794 4.385 596 HD11 LEU 5 HD11 LEU 5 -8.667 6.442 4.973 597 HD12 LEU 5 HD12 LEU 5 -7.413 7.611 5.377 598 HD13 LEU 5 HD13 LEU 5 -7.598 6.148 6.343 599 HD21 LEU 5 HD21 LEU 5 -6.540 7.458 3.045 600 HD22 LEU 5 HD22 LEU 5 -7.747 6.245 2.615 601 HD23 LEU 5 HD23 LEU 5 -6.031 5.901 2.391 602 H LYS 6 HN LYS 6 -3.517 4.848 8.064 603 HA LYS 6 HA LYS 6 -0.966 5.464 6.891 604 HB2 LYS 6 HB2 LYS 6 -1.654 6.320 9.116 605 HB3 LYS 6 HB1 LYS 6 -1.618 4.679 9.740 606 HG2 LYS 6 HG2 LYS 6 0.558 4.800 10.124 607 HG3 LYS 6 HG1 LYS 6 0.887 5.325 8.475 608 HD2 LYS 6 HD2 LYS 6 0.296 7.635 9.128 609 HD3 LYS 6 HD1 LYS 6 0.058 7.076 10.784 610 HE2 LYS 6 HE2 LYS 6 2.316 6.660 11.111 611 HE3 LYS 6 HE1 LYS 6 2.652 6.568 9.384 612 HZ1 LYS 6 HZ1 LYS 6 1.989 9.025 10.907 613 HZ2 LYS 6 HZ2 LYS 6 2.252 8.965 9.241 614 HZ3 LYS 6 HZ3 LYS 6 3.514 8.606 10.308 615 H ILE 7 HN ILE 7 -2.460 2.617 8.359 616 HA ILE 7 HA ILE 7 -0.085 1.017 7.841 617 HB ILE 7 HB ILE 7 -1.426 -0.843 8.844 618 HG12 ILE 7 HG12 ILE 7 -3.407 1.306 9.608 619 HG13 ILE 7 HG11 ILE 7 -3.651 0.250 8.220 620 HG21 ILE 7 HG21 ILE 7 -1.464 0.212 11.164 621 HG22 ILE 7 HG22 ILE 7 -0.923 1.690 10.371 622 HG23 ILE 7 HG23 ILE 7 0.067 0.235 10.290 623 HD11 ILE 7 HD11 ILE 7 -3.608 -1.691 9.695 624 HD12 ILE 7 HD12 ILE 7 -4.868 -0.550 10.161 625 HD13 ILE 7 HD13 ILE 7 -3.366 -0.633 11.084 626 H LEU 8 HN LEU 8 -2.829 1.981 6.222 627 HA LEU 8 HA LEU 8 -3.286 -0.401 4.660 628 HB2 LEU 8 HB2 LEU 8 -5.113 1.128 5.225 629 HB3 LEU 8 HB1 LEU 8 -4.300 2.432 4.389 630 HG LEU 8 HG LEU 8 -4.543 1.057 2.268 631 HD11 LEU 8 HD11 LEU 8 -4.968 -1.096 3.296 632 HD12 LEU 8 HD12 LEU 8 -6.328 -0.622 2.277 633 HD13 LEU 8 HD13 LEU 8 -6.445 -0.477 4.034 634 HD21 LEU 8 HD21 LEU 8 -5.927 3.005 2.750 635 HD22 LEU 8 HD22 LEU 8 -7.039 2.002 3.679 636 HD23 LEU 8 HD23 LEU 8 -6.868 1.753 1.941 637 H ASN 9 HN ASN 9 -1.062 2.110 4.633 638 HA ASN 9 HA ASN 9 -0.732 2.256 1.765 639 HB2 ASN 9 HB2 ASN 9 -0.383 4.202 3.357 640 HB3 ASN 9 HB1 ASN 9 1.113 3.414 3.851 641 HD21 ASN 9 HD21 ASN 9 2.462 4.988 3.077 642 HD22 ASN 9 HD22 ASN 9 2.678 5.309 1.390 643 H ASN 10 HN ASN 10 0.021 -0.144 3.788 644 HA ASN 10 HA ASN 10 2.343 -0.867 2.166 645 HB2 ASN 10 HB2 ASN 10 3.266 0.054 4.253 646 HB3 ASN 10 HB1 ASN 10 2.328 -1.111 5.185 647 HD21 ASN 10 HD21 ASN 10 4.695 -0.943 2.549 648 HD22 ASN 10 HD22 ASN 10 5.550 -2.377 3.002 649 H ILE 11 HN ILE 11 2.461 -2.934 1.604 650 HA ILE 11 HA ILE 11 0.149 -4.564 1.840 651 HB ILE 11 HB ILE 11 2.883 -5.367 0.841 652 HG12 ILE 11 HG12 ILE 11 0.563 -4.340 -0.797 653 HG13 ILE 11 HG11 ILE 11 1.862 -3.296 -0.229 654 HG21 ILE 11 HG21 ILE 11 1.283 -7.206 1.311 655 HG22 ILE 11 HG22 ILE 11 1.742 -7.089 -0.386 656 HG23 ILE 11 HG23 ILE 11 0.173 -6.484 0.145 657 HD11 ILE 11 HD11 ILE 11 1.938 -5.469 -2.269 658 HD12 ILE 11 HD12 ILE 11 3.405 -4.996 -1.409 659 HD13 ILE 11 HD13 ILE 11 2.526 -3.806 -2.368 660 H ARG 12 HN ARG 12 3.345 -4.685 3.369 661 HA ARG 12 HA ARG 12 3.089 -7.244 4.507 662 HB2 ARG 12 HB2 ARG 12 4.757 -4.847 5.217 663 HB3 ARG 12 HB1 ARG 12 4.802 -6.307 6.193 664 HG2 ARG 12 HG2 ARG 12 5.532 -7.608 4.292 665 HG3 ARG 12 HG1 ARG 12 5.406 -6.195 3.244 666 HD2 ARG 12 HD2 ARG 12 7.152 -5.074 4.522 667 HD3 ARG 12 HD1 ARG 12 7.252 -6.453 5.618 668 HE ARG 12 HE ARG 12 7.663 -7.288 2.932 669 HH11 ARG 12 HH11 ARG 12 9.315 -5.641 5.576 670 HH12 ARG 12 HH12 ARG 12 10.905 -6.079 5.010 671 HH21 ARG 12 HH21 ARG 12 9.742 -7.846 2.232 672 HH22 ARG 12 HH22 ARG 12 11.147 -7.318 3.118 673 H THR 13 HN THR 13 2.248 -4.037 5.806 674 HA THR 13 HA THR 13 1.358 -5.081 8.316 675 HB THR 13 HB THR 13 0.212 -2.735 8.409 676 HG1 THR 13 HG1 THR 13 0.324 -1.863 6.455 677 HG21 THR 13 HG21 THR 13 2.377 -1.697 8.995 678 HG22 THR 13 HG22 THR 13 3.209 -3.070 8.266 679 HG23 THR 13 HG23 THR 13 2.193 -3.310 9.686 680 H LEU 14 HN LEU 14 -0.159 -4.308 5.242 681 HA LEU 14 HA LEU 14 -2.842 -4.433 6.107 682 HB2 LEU 14 HB2 LEU 14 -1.852 -3.501 3.923 683 HB3 LEU 14 HB1 LEU 14 -1.912 -5.151 3.344 684 HG LEU 14 HG LEU 14 -4.269 -5.211 3.413 685 HD11 LEU 14 HD11 LEU 14 -4.061 -2.682 5.021 686 HD12 LEU 14 HD12 LEU 14 -4.788 -4.220 5.491 687 HD13 LEU 14 HD13 LEU 14 -5.559 -3.216 4.262 688 HD21 LEU 14 HD21 LEU 14 -3.409 -2.492 2.432 689 HD22 LEU 14 HD22 LEU 14 -4.894 -3.334 1.985 690 HD23 LEU 14 HD23 LEU 14 -3.330 -4.002 1.524 691 H ARG 15 HN ARG 15 -0.636 -6.884 4.836 692 HA ARG 15 HA ARG 15 -2.433 -8.972 4.474 693 HB2 ARG 15 HB2 ARG 15 0.487 -8.885 5.147 694 HB3 ARG 15 HB1 ARG 15 -0.360 -10.423 5.133 695 HG2 ARG 15 HG2 ARG 15 -1.005 -10.039 2.800 696 HG3 ARG 15 HG1 ARG 15 -0.118 -8.513 2.818 697 HD2 ARG 15 HD2 ARG 15 1.930 -9.790 3.427 698 HD3 ARG 15 HD1 ARG 15 1.018 -11.279 3.208 699 HE ARG 15 HE ARG 15 0.682 -10.342 0.823 700 HH11 ARG 15 HH11 ARG 15 3.548 -9.879 2.793 701 HH12 ARG 15 HH12 ARG 15 4.635 -9.823 1.438 702 HH21 ARG 15 HH21 ARG 15 2.074 -10.249 -0.953 703 HH22 ARG 15 HH22 ARG 15 3.782 -10.018 -0.719 704 H ALA 16 HN ALA 16 -0.871 -7.808 7.388 705 HA ALA 16 HA ALA 16 -1.547 -9.977 9.067 706 HB1 ALA 16 HB1 ALA 16 0.225 -8.491 9.699 707 HB2 ALA 16 HB2 ALA 16 -1.048 -8.399 10.916 708 HB3 ALA 16 HB3 ALA 16 -0.879 -7.112 9.719 709 H GLN 17 HN GLN 17 -3.072 -6.780 8.662 710 HA GLN 17 HA GLN 17 -5.183 -7.324 10.478 711 HB2 GLN 17 HB2 GLN 17 -4.268 -5.100 9.057 712 HB3 GLN 17 HB1 GLN 17 -5.889 -5.384 8.444 713 HG2 GLN 17 HG2 GLN 17 -5.957 -3.820 10.275 714 HG3 GLN 17 HG1 GLN 17 -6.757 -5.322 10.742 715 HE21 GLN 17 HE21 GLN 17 -5.906 -6.557 12.370 716 HE22 GLN 17 HE22 GLN 17 -4.566 -6.046 13.347 717 H ALA 18 HN ALA 18 -4.708 -8.091 7.124 718 HA ALA 18 HA ALA 18 -7.479 -8.476 6.503 719 HB1 ALA 18 HB1 ALA 18 -5.871 -7.923 4.766 720 HB2 ALA 18 HB2 ALA 18 -6.659 -9.463 4.422 721 HB3 ALA 18 HB3 ALA 18 -5.016 -9.439 5.060 722 H ARG 19 HN ARG 19 -5.591 -10.172 8.561 723 HA ARG 19 HA ARG 19 -6.473 -12.823 7.733 724 HB2 ARG 19 HB2 ARG 19 -4.705 -11.864 9.975 725 HB3 ARG 19 HB1 ARG 19 -5.237 -13.534 9.844 726 HG2 ARG 19 HG2 ARG 19 -3.520 -12.006 7.903 727 HG3 ARG 19 HG1 ARG 19 -3.058 -13.386 8.904 728 HD2 ARG 19 HD2 ARG 19 -4.808 -14.715 7.674 729 HD3 ARG 19 HD1 ARG 19 -4.959 -13.351 6.569 730 HE ARG 19 HE ARG 19 -2.261 -14.245 6.838 731 HH11 ARG 19 HH11 ARG 19 -5.300 -14.923 5.242 732 HH12 ARG 19 HH12 ARG 19 -4.549 -15.665 3.854 733 HH21 ARG 19 HH21 ARG 19 -1.285 -15.265 5.059 734 HH22 ARG 19 HH22 ARG 19 -2.279 -15.911 3.780 735 H GLU 20 HN GLU 20 -7.551 -10.298 9.776 736 HA GLU 20 HA GLU 20 -9.126 -12.132 11.414 737 HB2 GLU 20 HB2 GLU 20 -9.750 -10.209 12.737 738 HB3 GLU 20 HB1 GLU 20 -8.007 -10.247 12.532 739 HG2 GLU 20 HG2 GLU 20 -8.259 -8.569 10.700 740 HG3 GLU 20 HG1 GLU 20 -9.969 -8.451 11.118 741 H CYS 21 H CYS 21 -9.422 -10.769 8.470 742 HA CYS 21 HA CYS 21 -12.386 -10.653 8.682 743 HB2 CYS 21 3HB CYS 21 -11.372 -8.417 8.126 744 HB3 CYS 21 2HB CYS 21 -10.490 -9.114 6.762 745 HG CYS 21 HG CYS 21 -12.244 -9.104 5.157 746 H THR 22 HN THR 22 -13.556 -11.859 7.383 747 HA THR 22 HA THR 22 -12.323 -14.037 6.011 748 HB THR 22 HB THR 22 -15.219 -13.291 5.686 749 HG1 THR 22 HG1 THR 22 -13.923 -14.296 8.022 750 HG21 THR 22 HG21 THR 22 -14.423 -15.275 4.517 751 HG22 THR 22 HG22 THR 22 -15.504 -15.747 5.828 752 HG23 THR 22 HG23 THR 22 -13.759 -15.920 6.017 753 H LEU 23 HN LEU 23 -12.666 -14.545 3.718 754 HA LEU 23 HA LEU 23 -11.858 -12.539 1.993 755 HB2 LEU 23 HB2 LEU 23 -11.672 -14.936 1.504 756 HB3 LEU 23 HB1 LEU 23 -13.411 -15.038 1.312 757 HG LEU 23 HG LEU 23 -13.203 -13.409 -0.600 758 HD11 LEU 23 HD11 LEU 23 -11.020 -12.473 0.012 759 HD12 LEU 23 HD12 LEU 23 -11.018 -13.130 -1.627 760 HD13 LEU 23 HD13 LEU 23 -10.266 -14.034 -0.316 761 HD21 LEU 23 HD21 LEU 23 -12.320 -15.125 -2.162 762 HD22 LEU 23 HD22 LEU 23 -13.520 -15.744 -1.030 763 HD23 LEU 23 HD23 LEU 23 -11.807 -16.075 -0.767 764 H GLU 24 HN GLU 24 -15.095 -13.613 2.814 765 HA GLU 24 HA GLU 24 -16.583 -12.245 0.906 766 HB2 GLU 24 HB2 GLU 24 -17.285 -13.937 2.773 767 HB3 GLU 24 HB1 GLU 24 -17.538 -12.492 3.741 768 HG2 GLU 24 HG2 GLU 24 -19.604 -13.220 2.711 769 HG3 GLU 24 HG1 GLU 24 -19.110 -11.650 2.079 770 H THR 25 HN THR 25 -15.553 -11.174 4.141 771 HA THR 25 HA THR 25 -16.718 -8.610 4.010 772 HB THR 25 HB THR 25 -14.269 -8.857 5.623 773 HG1 THR 25 HG1 THR 25 -16.491 -10.502 6.315 774 HG21 THR 25 HG21 THR 25 -15.895 -7.067 5.954 775 HG22 THR 25 HG22 THR 25 -15.799 -8.085 7.390 776 HG23 THR 25 HG23 THR 25 -17.156 -8.251 6.275 777 H LEU 26 HN LEU 26 -13.556 -9.872 3.120 778 HA LEU 26 HA LEU 26 -12.298 -7.402 2.642 779 HB2 LEU 26 HB2 LEU 26 -11.758 -10.106 1.424 780 HB3 LEU 26 HB1 LEU 26 -10.697 -8.717 1.283 781 HG LEU 26 HG LEU 26 -11.450 -9.995 3.912 782 HD11 LEU 26 HD11 LEU 26 -8.833 -10.267 2.467 783 HD12 LEU 26 HD12 LEU 26 -10.122 -11.459 2.337 784 HD13 LEU 26 HD13 LEU 26 -9.385 -11.127 3.901 785 HD21 LEU 26 HD21 LEU 26 -9.579 -8.698 4.782 786 HD22 LEU 26 HD22 LEU 26 -10.794 -7.645 4.058 787 HD23 LEU 26 HD23 LEU 26 -9.307 -8.005 3.183 788 H GLU 27 HN GLU 27 -13.961 -9.643 0.438 789 HA GLU 27 HA GLU 27 -13.649 -8.104 -1.892 790 HB2 GLU 27 HB2 GLU 27 -14.519 -10.549 -1.526 791 HB3 GLU 27 HB1 GLU 27 -16.090 -9.776 -1.396 792 HG2 GLU 27 HG2 GLU 27 -15.971 -10.398 -3.623 793 HG3 GLU 27 HG1 GLU 27 -15.520 -8.691 -3.653 794 H GLU 28 HN GLU 28 -16.050 -8.057 0.665 795 HA GLU 28 HA GLU 28 -17.910 -6.312 -0.542 796 HB2 GLU 28 HB2 GLU 28 -17.877 -7.792 1.734 797 HB3 GLU 28 HB1 GLU 28 -17.603 -6.190 2.402 798 HG2 GLU 28 HG2 GLU 28 -19.803 -6.499 0.447 799 HG3 GLU 28 HG1 GLU 28 -20.026 -7.201 2.048 800 H MET 29 HN MET 29 -15.246 -5.692 1.758 801 HA MET 29 HA MET 29 -15.696 -2.872 1.745 802 HB2 MET 29 HB2 MET 29 -13.648 -2.702 3.056 803 HB3 MET 29 HB1 MET 29 -14.701 -3.959 3.684 804 HG2 MET 29 HG2 MET 29 -12.681 -4.999 3.796 805 HG3 MET 29 HG1 MET 29 -13.217 -5.513 2.201 806 HE1 MET 29 HE1 MET 29 -10.086 -2.205 2.947 807 HE2 MET 29 HE2 MET 29 -10.828 -3.163 4.227 808 HE3 MET 29 HE3 MET 29 -11.791 -1.987 3.335 809 H LEU 30 HN LEU 30 -13.823 -5.015 -0.250 810 HA LEU 30 HA LEU 30 -12.007 -3.112 -1.263 811 HB2 LEU 30 HB2 LEU 30 -11.694 -5.511 -1.598 812 HB3 LEU 30 HB1 LEU 30 -13.143 -5.579 -2.582 813 HG LEU 30 HG LEU 30 -12.041 -4.087 -4.240 814 HD11 LEU 30 HD11 LEU 30 -10.442 -2.911 -2.976 815 HD12 LEU 30 HD12 LEU 30 -9.524 -3.951 -4.066 816 HD13 LEU 30 HD13 LEU 30 -9.711 -4.396 -2.368 817 HD21 LEU 30 HD21 LEU 30 -12.045 -6.511 -4.523 818 HD22 LEU 30 HD22 LEU 30 -10.545 -6.620 -3.605 819 HD23 LEU 30 HD23 LEU 30 -10.568 -5.786 -5.158 820 H GLU 31 HN GLU 31 -15.207 -4.150 -2.352 821 HA GLU 31 HA GLU 31 -15.327 -2.489 -4.624 822 HB2 GLU 31 HB2 GLU 31 -17.507 -3.677 -2.902 823 HB3 GLU 31 HB1 GLU 31 -17.827 -2.787 -4.385 824 HG2 GLU 31 HG2 GLU 31 -16.316 -4.440 -5.548 825 HG3 GLU 31 HG1 GLU 31 -16.389 -5.398 -4.069 826 H LYS 32 HN LYS 32 -16.002 -1.985 -1.246 827 HA LYS 32 HA LYS 32 -17.374 0.461 -1.399 828 HB2 LYS 32 HB2 LYS 32 -15.675 -0.805 0.742 829 HB3 LYS 32 HB1 LYS 32 -16.426 0.768 0.970 830 HG2 LYS 32 HG2 LYS 32 -18.022 -1.654 0.200 831 HG3 LYS 32 HG1 LYS 32 -17.649 -1.266 1.883 832 HD2 LYS 32 HD2 LYS 32 -18.685 0.957 1.561 833 HD3 LYS 32 HD1 LYS 32 -19.125 0.481 -0.081 834 HE2 LYS 32 HE2 LYS 32 -20.027 -0.873 2.458 835 HE3 LYS 32 HE1 LYS 32 -20.999 0.209 1.466 836 HZ1 LYS 32 HZ1 LYS 32 -21.651 -1.852 0.743 837 HZ2 LYS 32 HZ2 LYS 32 -20.115 -2.543 0.887 838 HZ3 LYS 32 HZ3 LYS 32 -20.455 -1.478 -0.390 839 H LEU 33 HN LEU 33 -13.921 -0.293 -1.145 840 HA LEU 33 HA LEU 33 -13.150 2.464 -1.076 841 HB2 LEU 33 HB2 LEU 33 -11.788 0.636 -0.092 842 HB3 LEU 33 HB1 LEU 33 -11.472 0.036 -1.710 843 HG LEU 33 HG LEU 33 -10.334 2.173 -2.253 844 HD11 LEU 33 HD11 LEU 33 -11.433 3.659 -0.712 845 HD12 LEU 33 HD12 LEU 33 -9.699 3.657 -0.380 846 HD13 LEU 33 HD13 LEU 33 -10.802 2.757 0.665 847 HD21 LEU 33 HD21 LEU 33 -8.331 1.763 -0.874 848 HD22 LEU 33 HD22 LEU 33 -9.005 0.288 -1.561 849 HD23 LEU 33 HD23 LEU 33 -9.279 0.672 0.137 850 H GLU 34 HN GLU 34 -13.374 -0.037 -3.552 851 HA GLU 34 HA GLU 34 -12.072 1.222 -5.654 852 HB2 GLU 34 HB2 GLU 34 -12.665 -1.022 -5.996 853 HB3 GLU 34 HB1 GLU 34 -14.335 -0.746 -5.528 854 HG2 GLU 34 HG2 GLU 34 -14.390 -1.087 -7.836 855 HG3 GLU 34 HG1 GLU 34 -14.549 0.654 -7.623 856 H VAL 35 HN VAL 35 -15.548 1.396 -4.812 857 HA VAL 35 HA VAL 35 -16.197 3.183 -6.886 858 HB VAL 35 HB VAL 35 -18.221 3.770 -5.516 859 HG11 VAL 35 HG11 VAL 35 -17.602 0.876 -6.062 860 HG12 VAL 35 HG12 VAL 35 -18.353 2.040 -7.157 861 HG13 VAL 35 HG13 VAL 35 -19.213 1.499 -5.717 862 HG21 VAL 35 HG21 VAL 35 -17.032 1.753 -3.618 863 HG22 VAL 35 HG22 VAL 35 -18.691 2.345 -3.551 864 HG23 VAL 35 HG23 VAL 35 -17.351 3.460 -3.290 865 H VAL 36 HN VAL 36 -14.933 3.725 -3.666 866 HA VAL 36 HA VAL 36 -15.422 6.520 -3.598 867 HB VAL 36 HB VAL 36 -13.503 4.756 -2.085 868 HG11 VAL 36 HG11 VAL 36 -13.929 7.699 -1.583 869 HG12 VAL 36 HG12 VAL 36 -12.517 7.029 -2.404 870 HG13 VAL 36 HG13 VAL 36 -12.841 6.606 -0.722 871 HG21 VAL 36 HG21 VAL 36 -14.980 5.529 -0.188 872 HG22 VAL 36 HG22 VAL 36 -15.730 4.463 -1.376 873 HG23 VAL 36 HG23 VAL 36 -16.053 6.197 -1.420 874 H VAL 37 HN VAL 37 -12.609 4.558 -4.546 875 HA VAL 37 HA VAL 37 -10.954 6.741 -5.233 876 HB VAL 37 HB VAL 37 -10.929 3.947 -6.401 877 HG11 VAL 37 HG11 VAL 37 -8.763 6.043 -6.341 878 HG12 VAL 37 HG12 VAL 37 -9.676 5.539 -7.762 879 HG13 VAL 37 HG13 VAL 37 -8.598 4.400 -6.958 880 HG21 VAL 37 HG21 VAL 37 -9.331 3.360 -4.732 881 HG22 VAL 37 HG22 VAL 37 -10.720 4.075 -3.911 882 HG23 VAL 37 HG23 VAL 37 -9.247 5.020 -4.140 883 H ASN 38 HN ASN 38 -13.339 4.867 -7.004 884 HA ASN 38 HA ASN 38 -12.924 5.950 -9.560 885 HB2 ASN 38 HB2 ASN 38 -14.343 3.929 -8.887 886 HB3 ASN 38 HB1 ASN 38 -15.600 5.080 -8.457 887 HD21 ASN 38 HD21 ASN 38 -15.217 2.946 -10.614 888 HD22 ASN 38 HD22 ASN 38 -15.703 3.752 -12.067 889 H GLU 39 HN GLU 39 -15.059 6.968 -6.895 890 HA GLU 39 HA GLU 39 -16.248 9.147 -8.217 891 HB2 GLU 39 HB2 GLU 39 -15.725 8.682 -5.280 892 HB3 GLU 39 HB1 GLU 39 -16.710 10.002 -5.895 893 HG2 GLU 39 HG2 GLU 39 -18.034 8.107 -7.074 894 HG3 GLU 39 HG1 GLU 39 -17.261 7.069 -5.879 895 H ARG 40 HN ARG 40 -13.409 8.980 -6.095 896 HA ARG 40 HA ARG 40 -12.750 11.705 -6.170 897 HB2 ARG 40 HB2 ARG 40 -11.190 9.206 -5.612 898 HB3 ARG 40 HB1 ARG 40 -10.346 10.741 -5.754 899 HG2 ARG 40 HG2 ARG 40 -12.576 10.154 -3.818 900 HG3 ARG 40 HG1 ARG 40 -10.855 10.159 -3.430 901 HD2 ARG 40 HD2 ARG 40 -12.621 12.471 -4.175 902 HD3 ARG 40 HD1 ARG 40 -11.625 12.267 -2.737 903 HE ARG 40 HE ARG 40 -10.682 12.993 -5.424 904 HH11 ARG 40 HH11 ARG 40 -9.986 12.545 -2.005 905 HH12 ARG 40 HH12 ARG 40 -8.478 13.403 -2.085 906 HH21 ARG 40 HH21 ARG 40 -8.715 14.107 -5.520 907 HH22 ARG 40 HH22 ARG 40 -7.763 14.299 -4.069 908 H ARG 41 HN ARG 41 -11.600 9.006 -8.191 909 HA ARG 41 HA ARG 41 -9.866 10.502 -9.817 910 HB2 ARG 41 HB2 ARG 41 -11.162 7.851 -9.952 911 HB3 ARG 41 HB1 ARG 41 -10.696 8.540 -11.502 912 HG2 ARG 41 HG2 ARG 41 -8.402 8.887 -10.510 913 HG3 ARG 41 HG1 ARG 41 -8.938 7.888 -9.157 914 HD2 ARG 41 HD2 ARG 41 -9.415 6.057 -10.694 915 HD3 ARG 41 HD1 ARG 41 -8.915 7.056 -12.057 916 HE ARG 41 HE ARG 41 -6.714 7.082 -10.527 917 HH11 ARG 41 HH11 ARG 41 -8.764 4.452 -11.610 918 HH12 ARG 41 HH12 ARG 41 -7.491 3.278 -11.602 919 HH21 ARG 41 HH21 ARG 41 -5.009 5.541 -10.550 920 HH22 ARG 41 HH22 ARG 41 -5.350 3.902 -11.015 921 H GLU 42 HN GLU 42 -13.317 9.786 -10.124 922 HA GLU 42 HA GLU 42 -13.722 10.838 -12.688 923 HB2 GLU 42 HB2 GLU 42 -15.298 9.473 -11.141 924 HB3 GLU 42 HB1 GLU 42 -15.777 11.041 -10.506 925 HG2 GLU 42 HG2 GLU 42 -17.316 10.278 -12.211 926 HG3 GLU 42 HG1 GLU 42 -16.479 11.741 -12.726 927 H GLU 43 HN GLU 43 -14.024 12.379 -9.497 928 HA GLU 43 HA GLU 43 -14.730 14.919 -10.550 929 HB2 GLU 43 HB2 GLU 43 -13.731 14.053 -7.845 930 HB3 GLU 43 HB1 GLU 43 -14.178 15.712 -8.219 931 HG2 GLU 43 HG2 GLU 43 -16.433 15.080 -8.664 932 HG3 GLU 43 HG1 GLU 43 -16.029 13.369 -8.527 933 H GLU 44 HN GLU 44 -11.722 13.326 -9.932 934 HA GLU 44 HA GLU 44 -10.117 15.700 -9.970 935 HB2 GLU 44 HB2 GLU 44 -9.696 13.143 -9.139 936 HB3 GLU 44 HB1 GLU 44 -8.838 13.139 -10.673 937 HG2 GLU 44 HG2 GLU 44 -7.189 13.757 -9.195 938 HG3 GLU 44 HG1 GLU 44 -7.751 15.318 -9.789 939 H SER 45 HN SER 45 -11.235 13.378 -12.342 940 HA SER 45 HA SER 45 -9.483 14.406 -14.399 941 HB2 SER 45 HB2 SER 45 -10.958 12.849 -15.860 942 HB3 SER 45 HB1 SER 45 -9.882 12.112 -14.676 943 HG SER 45 HG SER 45 -11.595 11.711 -13.351 944 H ALA 46 HN ALA 46 -12.976 14.438 -13.716 945 HA ALA 46 HA ALA 46 -13.473 16.254 -15.914 946 HB1 ALA 46 HB1 ALA 46 -15.087 14.478 -15.263 947 HB2 ALA 46 HB2 ALA 46 -15.790 16.093 -15.302 948 HB3 ALA 46 HB3 ALA 46 -15.378 15.349 -13.757 949 H GLU 3 HN GLU 3 -10.411 -2.332 14.547 950 HA GLU 3 HA GLU 3 -12.853 -0.968 15.458 951 HB2 GLU 3 HB2 GLU 3 -10.504 0.607 15.901 952 HB3 GLU 3 HB1 GLU 3 -11.591 -0.087 17.092 953 HG2 GLU 3 HG2 GLU 3 -9.526 -0.930 17.693 954 HG3 GLU 3 HG1 GLU 3 -10.234 -2.250 16.765 955 H ALA 4 HN ALA 4 -9.834 -0.218 13.722 956 HA ALA 4 HA ALA 4 -10.947 2.081 12.435 957 HB1 ALA 4 HB1 ALA 4 -8.462 0.604 11.607 958 HB2 ALA 4 HB2 ALA 4 -8.517 1.710 12.977 959 HB3 ALA 4 HB3 ALA 4 -8.849 2.305 11.350 960 H LEU 5 HN LEU 5 -10.502 -1.284 11.528 961 HA LEU 5 HA LEU 5 -11.106 -0.913 8.769 962 HB2 LEU 5 HB2 LEU 5 -10.454 -3.112 10.526 963 HB3 LEU 5 HB1 LEU 5 -11.747 -3.553 9.431 964 HG LEU 5 HG LEU 5 -9.582 -4.196 8.524 965 HD11 LEU 5 HD11 LEU 5 -9.727 -3.050 6.348 966 HD12 LEU 5 HD12 LEU 5 -10.887 -1.920 7.048 967 HD13 LEU 5 HD13 LEU 5 -11.285 -3.634 6.931 968 HD21 LEU 5 HD21 LEU 5 -7.944 -2.497 7.870 969 HD22 LEU 5 HD22 LEU 5 -8.187 -2.535 9.614 970 HD23 LEU 5 HD23 LEU 5 -8.922 -1.254 8.650 971 H LYS 6 HN LYS 6 -13.050 -1.078 11.577 972 HA LYS 6 HA LYS 6 -15.396 -2.176 10.423 973 HB2 LYS 6 HB2 LYS 6 -14.906 -2.080 12.868 974 HB3 LYS 6 HB1 LYS 6 -15.177 -0.346 12.816 975 HG2 LYS 6 HG2 LYS 6 -17.124 -1.514 13.669 976 HG3 LYS 6 HG1 LYS 6 -17.492 -0.722 12.134 977 HD2 LYS 6 HD2 LYS 6 -17.321 -2.816 10.959 978 HD3 LYS 6 HD1 LYS 6 -16.764 -3.634 12.420 979 HE2 LYS 6 HE2 LYS 6 -19.455 -2.298 12.160 980 HE3 LYS 6 HE1 LYS 6 -19.173 -4.012 11.858 981 HZ1 LYS 6 HZ1 LYS 6 -18.376 -4.225 14.143 982 HZ2 LYS 6 HZ2 LYS 6 -19.969 -3.664 14.098 983 HZ3 LYS 6 HZ3 LYS 6 -18.705 -2.593 14.426 984 H ILE 7 HN ILE 7 -14.100 1.084 10.631 985 HA ILE 7 HA ILE 7 -16.574 2.239 9.651 986 HB ILE 7 HB ILE 7 -15.466 4.394 9.774 987 HG12 ILE 7 HG12 ILE 7 -12.988 2.995 10.774 988 HG13 ILE 7 HG11 ILE 7 -13.194 3.430 9.079 989 HG21 ILE 7 HG21 ILE 7 -16.430 3.310 11.808 990 HG22 ILE 7 HG22 ILE 7 -15.191 4.518 12.143 991 HG23 ILE 7 HG23 ILE 7 -14.800 2.799 12.243 992 HD11 ILE 7 HD11 ILE 7 -13.578 5.535 11.134 993 HD12 ILE 7 HD12 ILE 7 -12.965 5.660 9.486 994 HD13 ILE 7 HD13 ILE 7 -11.942 5.007 10.761 995 H LEU 8 HN LEU 8 -13.893 0.752 8.268 996 HA LEU 8 HA LEU 8 -13.745 2.357 5.884 997 HB2 LEU 8 HB2 LEU 8 -12.353 0.059 6.993 998 HB3 LEU 8 HB1 LEU 8 -12.664 -0.128 5.278 999 HG LEU 8 HG LEU 8 -11.524 2.004 4.833 1000 HD11 LEU 8 HD11 LEU 8 -11.253 2.040 7.814 1001 HD12 LEU 8 HD12 LEU 8 -11.814 3.310 6.728 1002 HD13 LEU 8 HD13 LEU 8 -10.106 2.885 6.779 1003 HD21 LEU 8 HD21 LEU 8 -9.935 -0.003 6.427 1004 HD22 LEU 8 HD22 LEU 8 -9.229 1.265 5.425 1005 HD23 LEU 8 HD23 LEU 8 -10.203 -0.003 4.682 1006 H ASN 9 HN ASN 9 -15.685 -0.200 7.031 1007 HA ASN 9 HA ASN 9 -16.577 -1.113 4.444 1008 HB2 ASN 9 HB2 ASN 9 -16.542 -2.640 6.381 1009 HB3 ASN 9 HB1 ASN 9 -17.707 -1.617 7.213 1010 HD21 ASN 9 HD21 ASN 9 -17.221 -3.881 4.620 1011 HD22 ASN 9 HD22 ASN 9 -18.893 -4.237 4.337 1012 H ASN 10 HN ASN 10 -17.220 1.469 6.489 1013 HA ASN 10 HA ASN 10 -19.963 1.877 5.601 1014 HB2 ASN 10 HB2 ASN 10 -18.204 3.062 7.698 1015 HB3 ASN 10 HB1 ASN 10 -19.498 4.062 7.046 1016 HD21 ASN 10 HD21 ASN 10 -18.784 1.037 8.693 1017 HD22 ASN 10 HD22 ASN 10 -20.348 0.850 9.402 1018 H ILE 11 HN ILE 11 -20.291 2.811 3.725 1019 HA ILE 11 HA ILE 11 -18.326 4.167 2.240 1020 HB ILE 11 HB ILE 11 -20.275 3.020 1.237 1021 HG12 ILE 11 HG12 ILE 11 -20.819 4.824 -0.457 1022 HG13 ILE 11 HG11 ILE 11 -19.863 5.926 0.529 1023 HG21 ILE 11 HG21 ILE 11 -22.457 3.808 1.324 1024 HG22 ILE 11 HG22 ILE 11 -21.962 5.416 1.855 1025 HG23 ILE 11 HG23 ILE 11 -21.882 4.053 2.973 1026 HD11 ILE 11 HD11 ILE 11 -18.814 3.378 -0.675 1027 HD12 ILE 11 HD12 ILE 11 -17.887 4.623 0.153 1028 HD13 ILE 11 HD13 ILE 11 -18.641 4.974 -1.400 1029 H ARG 12 HN ARG 12 -20.617 5.255 4.598 1030 HA ARG 12 HA ARG 12 -20.711 7.987 3.895 1031 HB2 ARG 12 HB2 ARG 12 -21.212 6.530 6.483 1032 HB3 ARG 12 HB1 ARG 12 -21.427 8.267 6.321 1033 HG2 ARG 12 HG2 ARG 12 -22.831 6.281 4.557 1034 HG3 ARG 12 HG1 ARG 12 -23.504 6.866 6.078 1035 HD2 ARG 12 HD2 ARG 12 -23.574 9.106 5.278 1036 HD3 ARG 12 HD1 ARG 12 -22.628 8.690 3.853 1037 HE ARG 12 HE ARG 12 -24.707 7.174 3.404 1038 HH11 ARG 12 HH11 ARG 12 -24.670 10.411 4.714 1039 HH12 ARG 12 HH12 ARG 12 -26.214 10.837 4.047 1040 HH21 ARG 12 HH21 ARG 12 -26.745 7.717 2.535 1041 HH22 ARG 12 HH22 ARG 12 -27.399 9.300 2.807 1042 H THR 13 HN THR 13 -18.613 6.182 6.122 1043 HA THR 13 HA THR 13 -17.181 8.569 6.881 1044 HB THR 13 HB THR 13 -15.609 6.599 7.823 1045 HG1 THR 13 HG1 THR 13 -16.575 4.743 7.448 1046 HG21 THR 13 HG21 THR 13 -18.242 7.476 9.018 1047 HG22 THR 13 HG22 THR 13 -16.697 8.313 9.178 1048 HG23 THR 13 HG23 THR 13 -16.916 6.721 9.902 1049 H LEU 14 HN LEU 14 -16.732 5.836 4.707 1050 HA LEU 14 HA LEU 14 -14.014 6.265 4.113 1051 HB2 LEU 14 HB2 LEU 14 -15.686 4.316 3.494 1052 HB3 LEU 14 HB1 LEU 14 -15.876 5.241 2.017 1053 HG LEU 14 HG LEU 14 -13.422 5.075 1.638 1054 HD11 LEU 14 HD11 LEU 14 -12.156 3.439 2.977 1055 HD12 LEU 14 HD12 LEU 14 -13.533 3.296 4.065 1056 HD13 LEU 14 HD13 LEU 14 -12.679 4.830 3.925 1057 HD21 LEU 14 HD21 LEU 14 -14.733 3.492 0.478 1058 HD22 LEU 14 HD22 LEU 14 -15.042 2.556 1.939 1059 HD23 LEU 14 HD23 LEU 14 -13.431 2.566 1.223 1060 H ARG 15 HN ARG 15 -16.969 7.614 2.761 1061 HA ARG 15 HA ARG 15 -15.767 8.989 0.594 1062 HB2 ARG 15 HB2 ARG 15 -18.390 8.906 1.889 1063 HB3 ARG 15 HB1 ARG 15 -17.989 10.480 1.220 1064 HG2 ARG 15 HG2 ARG 15 -17.490 9.324 -0.951 1065 HG3 ARG 15 HG1 ARG 15 -18.158 7.852 -0.236 1066 HD2 ARG 15 HD2 ARG 15 -20.274 9.038 0.185 1067 HD3 ARG 15 HD1 ARG 15 -19.605 10.482 -0.573 1068 HE ARG 15 HE ARG 15 -19.365 8.909 -2.614 1069 HH11 ARG 15 HH11 ARG 15 -21.967 8.841 -0.252 1070 HH12 ARG 15 HH12 ARG 15 -23.130 8.204 -1.365 1071 HH21 ARG 15 HH21 ARG 15 -20.911 8.100 -4.091 1072 HH22 ARG 15 HH22 ARG 15 -22.536 7.779 -3.547 1073 H ALA 16 HN ALA 16 -15.736 9.575 3.946 1074 HA ALA 16 HA ALA 16 -15.176 12.429 3.594 1075 HB1 ALA 16 HB1 ALA 16 -15.376 12.606 5.993 1076 HB2 ALA 16 HB2 ALA 16 -15.470 10.852 6.147 1077 HB3 ALA 16 HB3 ALA 16 -16.768 11.736 5.351 1078 H GLN 17 HN GLN 17 -13.703 9.445 4.764 1079 HA GLN 17 HA GLN 17 -11.278 10.561 5.666 1080 HB2 GLN 17 HB2 GLN 17 -12.120 7.802 4.820 1081 HB3 GLN 17 HB1 GLN 17 -10.446 8.138 5.238 1082 HG2 GLN 17 HG2 GLN 17 -12.758 8.718 7.066 1083 HG3 GLN 17 HG1 GLN 17 -11.863 7.202 7.082 1084 HE21 GLN 17 HE21 GLN 17 -11.775 10.590 7.811 1085 HE22 GLN 17 HE22 GLN 17 -10.311 10.565 8.728 1086 H ALA 18 HN ALA 18 -12.342 9.435 2.518 1087 HA ALA 18 HA ALA 18 -9.757 9.544 1.303 1088 HB1 ALA 18 HB1 ALA 18 -11.561 8.085 0.487 1089 HB2 ALA 18 HB2 ALA 18 -10.925 9.140 -0.775 1090 HB3 ALA 18 HB3 ALA 18 -12.471 9.513 -0.010 1091 H ARG 19 HN ARG 19 -11.293 12.027 2.555 1092 HA ARG 19 HA ARG 19 -10.913 13.845 0.278 1093 HB2 ARG 19 HB2 ARG 19 -12.262 14.293 2.951 1094 HB3 ARG 19 HB1 ARG 19 -12.112 15.500 1.680 1095 HG2 ARG 19 HG2 ARG 19 -13.434 14.101 0.187 1096 HG3 ARG 19 HG1 ARG 19 -13.593 12.891 1.459 1097 HD2 ARG 19 HD2 ARG 19 -14.747 14.526 2.863 1098 HD3 ARG 19 HD1 ARG 19 -14.587 15.729 1.588 1099 HE ARG 19 HE ARG 19 -16.177 13.259 1.349 1100 HH11 ARG 19 HH11 ARG 19 -15.626 16.637 0.566 1101 HH12 ARG 19 HH12 ARG 19 -17.068 16.776 -0.390 1102 HH21 ARG 19 HH21 ARG 19 -18.064 13.447 0.089 1103 HH22 ARG 19 HH22 ARG 19 -18.451 14.957 -0.665 1104 H GLU 20 HN GLU 20 -9.478 12.759 3.138 1105 HA GLU 20 HA GLU 20 -7.894 15.176 3.531 1106 HB2 GLU 20 HB2 GLU 20 -8.848 13.939 5.478 1107 HB3 GLU 20 HB1 GLU 20 -7.840 12.563 5.058 1108 HG2 GLU 20 HG2 GLU 20 -5.853 14.110 5.322 1109 HG3 GLU 20 HG1 GLU 20 -6.974 15.260 6.046 1110 H CYS 21 H CYS 21 -7.716 12.073 2.068 1111 HA CYS 21 HA CYS 21 -4.771 12.198 1.826 1112 HB2 CYS 21 3HB CYS 21 -6.813 9.946 1.227 1113 HB3 CYS 21 2HB CYS 21 -5.073 9.788 0.953 1114 HG CYS 21 HG CYS 21 -4.391 9.377 3.193 1115 H THR 22 HN THR 22 -3.730 12.296 -0.086 1116 HA THR 22 HA THR 22 -5.037 13.599 -2.257 1117 HB THR 22 HB THR 22 -2.325 12.308 -2.465 1118 HG1 THR 22 HG1 THR 22 -1.892 14.686 -1.546 1119 HG21 THR 22 HG21 THR 22 -3.267 13.503 -4.415 1120 HG22 THR 22 HG22 THR 22 -1.798 14.256 -3.795 1121 HG23 THR 22 HG23 THR 22 -3.370 14.968 -3.436 1122 H LEU 23 HN LEU 23 -5.434 12.809 -4.358 1123 HA LEU 23 HA LEU 23 -6.413 10.210 -4.564 1124 HB2 LEU 23 HB2 LEU 23 -7.131 12.009 -6.054 1125 HB3 LEU 23 HB1 LEU 23 -5.534 12.072 -6.775 1126 HG LEU 23 HG LEU 23 -5.889 9.699 -7.544 1127 HD11 LEU 23 HD11 LEU 23 -8.776 10.238 -6.904 1128 HD12 LEU 23 HD12 LEU 23 -7.717 9.251 -5.894 1129 HD13 LEU 23 HD13 LEU 23 -8.057 8.761 -7.551 1130 HD21 LEU 23 HD21 LEU 23 -7.327 10.355 -9.419 1131 HD22 LEU 23 HD22 LEU 23 -6.110 11.577 -9.056 1132 HD23 LEU 23 HD23 LEU 23 -7.781 11.816 -8.544 1133 H GLU 24 HN GLU 24 -3.255 11.519 -5.427 1134 HA GLU 24 HA GLU 24 -2.253 9.344 -6.852 1135 HB2 GLU 24 HB2 GLU 24 -1.069 11.453 -6.819 1136 HB3 GLU 24 HB1 GLU 24 -0.799 11.319 -5.088 1137 HG2 GLU 24 HG2 GLU 24 0.637 9.393 -5.434 1138 HG3 GLU 24 HG1 GLU 24 0.331 9.459 -7.167 1139 H THR 25 HN THR 25 -2.031 10.038 -3.372 1140 HA THR 25 HA THR 25 -0.624 7.700 -2.685 1141 HB THR 25 HB THR 25 -1.980 8.291 -0.397 1142 HG1 THR 25 HG1 THR 25 -3.131 10.003 -1.443 1143 HG21 THR 25 HG21 THR 25 0.444 8.193 -0.632 1144 HG22 THR 25 HG22 THR 25 -0.023 9.690 0.176 1145 HG23 THR 25 HG23 THR 25 0.436 9.716 -1.528 1146 H LEU 26 HN LEU 26 -4.050 8.443 -2.955 1147 HA LEU 26 HA LEU 26 -5.089 6.112 -1.766 1148 HB2 LEU 26 HB2 LEU 26 -6.158 8.089 -3.752 1149 HB3 LEU 26 HB1 LEU 26 -7.066 6.634 -3.393 1150 HG LEU 26 HG LEU 26 -6.180 8.538 -1.237 1151 HD11 LEU 26 HD11 LEU 26 -7.565 9.714 -2.925 1152 HD12 LEU 26 HD12 LEU 26 -8.338 9.586 -1.345 1153 HD13 LEU 26 HD13 LEU 26 -8.837 8.519 -2.657 1154 HD21 LEU 26 HD21 LEU 26 -6.800 6.336 -0.461 1155 HD22 LEU 26 HD22 LEU 26 -8.298 6.400 -1.385 1156 HD23 LEU 26 HD23 LEU 26 -8.057 7.489 -0.021 1157 H GLU 27 HN GLU 27 -4.148 6.853 -5.084 1158 HA GLU 27 HA GLU 27 -4.995 4.420 -6.238 1159 HB2 GLU 27 HB2 GLU 27 -4.535 6.281 -7.672 1160 HB3 GLU 27 HB1 GLU 27 -2.892 6.426 -7.067 1161 HG2 GLU 27 HG2 GLU 27 -2.437 4.156 -8.048 1162 HG3 GLU 27 HG1 GLU 27 -4.025 4.252 -8.806 1163 H GLU 28 HN GLU 28 -1.838 5.478 -5.002 1164 HA GLU 28 HA GLU 28 -0.386 3.181 -5.614 1165 HB2 GLU 28 HB2 GLU 28 0.405 5.476 -4.679 1166 HB3 GLU 28 HB1 GLU 28 0.150 4.736 -3.103 1167 HG2 GLU 28 HG2 GLU 28 1.648 2.836 -3.996 1168 HG3 GLU 28 HG1 GLU 28 2.120 4.000 -5.233 1169 H MET 29 HN MET 29 -2.198 3.950 -2.641 1170 HA MET 29 HA MET 29 -1.527 1.431 -1.457 1171 HB2 MET 29 HB2 MET 29 -3.046 2.047 0.344 1172 HB3 MET 29 HB1 MET 29 -1.945 3.359 -0.043 1173 HG2 MET 29 HG2 MET 29 -3.750 4.437 -1.342 1174 HG3 MET 29 HG1 MET 29 -4.841 3.151 -0.828 1175 HE1 MET 29 HE1 MET 29 -2.459 5.993 0.386 1176 HE2 MET 29 HE2 MET 29 -2.004 4.683 1.473 1177 HE3 MET 29 HE3 MET 29 -2.838 6.100 2.103 1178 H LEU 30 HN LEU 30 -4.086 2.534 -3.547 1179 HA LEU 30 HA LEU 30 -5.993 0.536 -2.941 1180 HB2 LEU 30 HB2 LEU 30 -6.658 2.454 -4.247 1181 HB3 LEU 30 HB1 LEU 30 -5.482 2.072 -5.489 1182 HG LEU 30 HG LEU 30 -6.788 -0.085 -5.860 1183 HD11 LEU 30 HD11 LEU 30 -9.193 0.081 -5.215 1184 HD12 LEU 30 HD12 LEU 30 -8.754 1.414 -4.145 1185 HD13 LEU 30 HD13 LEU 30 -8.085 -0.195 -3.874 1186 HD21 LEU 30 HD21 LEU 30 -8.492 1.065 -7.233 1187 HD22 LEU 30 HD22 LEU 30 -6.868 1.720 -7.445 1188 HD23 LEU 30 HD23 LEU 30 -8.044 2.583 -6.455 1189 H GLU 31 HN GLU 31 -3.359 0.712 -5.295 1190 HA GLU 31 HA GLU 31 -3.793 -1.818 -6.466 1191 HB2 GLU 31 HB2 GLU 31 -1.191 -0.292 -6.207 1192 HB3 GLU 31 HB1 GLU 31 -1.517 -1.595 -7.341 1193 HG2 GLU 31 HG2 GLU 31 -3.107 -0.253 -8.527 1194 HG3 GLU 31 HG1 GLU 31 -3.011 1.019 -7.308 1195 H LYS 32 HN LYS 32 -2.132 -0.772 -3.582 1196 HA LYS 32 HA LYS 32 -0.748 -3.207 -3.088 1197 HB2 LYS 32 HB2 LYS 32 -1.492 -0.915 -1.264 1198 HB3 LYS 32 HB1 LYS 32 -0.502 -2.280 -0.762 1199 HG2 LYS 32 HG2 LYS 32 1.125 -1.715 -2.519 1200 HG3 LYS 32 HG1 LYS 32 0.148 -0.311 -2.946 1201 HD2 LYS 32 HD2 LYS 32 0.422 0.381 -0.488 1202 HD3 LYS 32 HD1 LYS 32 1.708 -0.827 -0.434 1203 HE2 LYS 32 HE2 LYS 32 2.797 0.314 -2.345 1204 HE3 LYS 32 HE1 LYS 32 1.557 1.565 -2.263 1205 HZ1 LYS 32 HZ1 LYS 32 3.311 2.447 -1.064 1206 HZ2 LYS 32 HZ2 LYS 32 3.709 0.961 -0.326 1207 HZ3 LYS 32 HZ3 LYS 32 2.317 1.806 0.156 1208 H LEU 33 HN LEU 33 -3.914 -1.944 -2.165 1209 HA LEU 33 HA LEU 33 -4.518 -4.110 -0.398 1210 HB2 LEU 33 HB2 LEU 33 -5.695 -2.044 -0.090 1211 HB3 LEU 33 HB1 LEU 33 -6.265 -2.053 -1.749 1212 HG LEU 33 HG LEU 33 -7.663 -4.035 -1.233 1213 HD11 LEU 33 HD11 LEU 33 -7.976 -4.787 1.023 1214 HD12 LEU 33 HD12 LEU 33 -6.878 -3.555 1.635 1215 HD13 LEU 33 HD13 LEU 33 -6.257 -4.875 0.643 1216 HD21 LEU 33 HD21 LEU 33 -8.076 -1.629 0.531 1217 HD22 LEU 33 HD22 LEU 33 -9.303 -2.843 0.170 1218 HD23 LEU 33 HD23 LEU 33 -8.650 -1.838 -1.123 1219 H GLU 34 HN GLU 34 -5.070 -3.403 -3.780 1220 HA GLU 34 HA GLU 34 -6.856 -5.388 -4.491 1221 HB2 GLU 34 HB2 GLU 34 -6.309 -3.739 -6.103 1222 HB3 GLU 34 HB1 GLU 34 -4.588 -4.080 -5.989 1223 HG2 GLU 34 HG2 GLU 34 -5.114 -5.056 -7.991 1224 HG3 GLU 34 HG1 GLU 34 -5.273 -6.422 -6.891 1225 H VAL 35 HN VAL 35 -3.286 -5.589 -4.414 1226 HA VAL 35 HA VAL 35 -3.242 -8.307 -5.226 1227 HB VAL 35 HB VAL 35 -0.876 -8.326 -4.403 1228 HG11 VAL 35 HG11 VAL 35 -1.582 -7.672 -6.706 1229 HG12 VAL 35 HG12 VAL 35 -0.063 -6.944 -6.183 1230 HG13 VAL 35 HG13 VAL 35 -1.544 -5.986 -6.185 1231 HG21 VAL 35 HG21 VAL 35 -1.406 -5.418 -3.798 1232 HG22 VAL 35 HG22 VAL 35 0.146 -6.247 -3.700 1233 HG23 VAL 35 HG23 VAL 35 -1.154 -6.681 -2.593 1234 H VAL 36 HN VAL 36 -3.398 -6.755 -2.064 1235 HA VAL 36 HA VAL 36 -2.811 -9.036 -0.513 1236 HB VAL 36 HB VAL 36 -4.514 -6.625 0.141 1237 HG11 VAL 36 HG11 VAL 36 -5.251 -8.409 1.569 1238 HG12 VAL 36 HG12 VAL 36 -4.232 -7.324 2.514 1239 HG13 VAL 36 HG13 VAL 36 -3.589 -8.862 1.940 1240 HG21 VAL 36 HG21 VAL 36 -2.547 -6.015 1.529 1241 HG22 VAL 36 HG22 VAL 36 -2.211 -6.053 -0.201 1242 HG23 VAL 36 HG23 VAL 36 -1.680 -7.382 0.829 1243 H VAL 37 HN VAL 37 -5.888 -7.704 -1.696 1244 HA VAL 37 HA VAL 37 -7.532 -9.725 -0.601 1245 HB VAL 37 HB VAL 37 -8.080 -8.102 -3.095 1246 HG11 VAL 37 HG11 VAL 37 -9.990 -9.426 -1.172 1247 HG12 VAL 37 HG12 VAL 37 -9.547 -10.058 -2.758 1248 HG13 VAL 37 HG13 VAL 37 -10.412 -8.527 -2.627 1249 HG21 VAL 37 HG21 VAL 37 -9.273 -6.556 -1.612 1250 HG22 VAL 37 HG22 VAL 37 -7.553 -6.631 -1.232 1251 HG23 VAL 37 HG23 VAL 37 -8.718 -7.475 -0.212 1252 H ASN 38 HN ASN 38 -5.839 -9.372 -3.676 1253 HA ASN 38 HA ASN 38 -6.872 -11.611 -5.005 1254 HB2 ASN 38 HB2 ASN 38 -5.170 -9.686 -5.752 1255 HB3 ASN 38 HB1 ASN 38 -3.992 -10.948 -5.398 1256 HD21 ASN 38 HD21 ASN 38 -4.220 -12.988 -6.523 1257 HD22 ASN 38 HD22 ASN 38 -4.926 -13.000 -8.104 1258 H GLU 39 HN GLU 39 -4.031 -11.295 -2.890 1259 HA GLU 39 HA GLU 39 -3.120 -13.933 -3.055 1260 HB2 GLU 39 HB2 GLU 39 -2.991 -11.974 -0.751 1261 HB3 GLU 39 HB1 GLU 39 -2.127 -13.503 -0.783 1262 HG2 GLU 39 HG2 GLU 39 -1.075 -12.643 -2.958 1263 HG3 GLU 39 HG1 GLU 39 -1.701 -11.065 -2.473 1264 H ARG 40 HN ARG 40 -5.497 -12.415 -0.968 1265 HA ARG 40 HA ARG 40 -6.096 -14.663 0.627 1266 HB2 ARG 40 HB2 ARG 40 -7.687 -12.184 -0.050 1267 HB3 ARG 40 HB1 ARG 40 -8.213 -13.382 1.125 1268 HG2 ARG 40 HG2 ARG 40 -5.579 -11.938 1.332 1269 HG3 ARG 40 HG1 ARG 40 -7.069 -11.339 2.063 1270 HD2 ARG 40 HD2 ARG 40 -5.778 -14.010 2.626 1271 HD3 ARG 40 HD1 ARG 40 -5.720 -12.594 3.673 1272 HE ARG 40 HE ARG 40 -8.004 -12.882 4.169 1273 HH11 ARG 40 HH11 ARG 40 -6.657 -15.498 2.263 1274 HH12 ARG 40 HH12 ARG 40 -8.074 -16.507 2.420 1275 HH21 ARG 40 HH21 ARG 40 -9.837 -14.224 4.414 1276 HH22 ARG 40 HH22 ARG 40 -9.890 -15.773 3.624 1277 H ARG 41 HN ARG 41 -7.407 -13.431 -2.395 1278 HA ARG 41 HA ARG 41 -9.593 -15.176 -2.667 1279 HB2 ARG 41 HB2 ARG 41 -7.866 -13.774 -4.715 1280 HB3 ARG 41 HB1 ARG 41 -9.248 -14.760 -5.168 1281 HG2 ARG 41 HG2 ARG 41 -9.606 -12.538 -3.207 1282 HG3 ARG 41 HG1 ARG 41 -9.477 -12.179 -4.928 1283 HD2 ARG 41 HD2 ARG 41 -11.480 -14.037 -3.651 1284 HD3 ARG 41 HD1 ARG 41 -11.810 -12.408 -4.239 1285 HE ARG 41 HE ARG 41 -10.774 -14.365 -6.139 1286 HH11 ARG 41 HH11 ARG 41 -13.458 -12.452 -4.961 1287 HH12 ARG 41 HH12 ARG 41 -14.452 -12.760 -6.359 1288 HH21 ARG 41 HH21 ARG 41 -12.062 -14.760 -7.983 1289 HH22 ARG 41 HH22 ARG 41 -13.656 -14.079 -8.079 1290 H GLU 42 HN GLU 42 -6.216 -15.437 -3.647 1291 HA GLU 42 HA GLU 42 -6.376 -17.877 -5.020 1292 HB2 GLU 42 HB2 GLU 42 -4.130 -16.458 -3.604 1293 HB3 GLU 42 HB1 GLU 42 -3.886 -18.011 -4.390 1294 HG2 GLU 42 HG2 GLU 42 -4.225 -17.138 -6.508 1295 HG3 GLU 42 HG1 GLU 42 -5.092 -15.728 -5.898 1296 H GLU 43 HN GLU 43 -5.682 -17.155 -1.623 1297 HA GLU 43 HA GLU 43 -5.079 -19.756 -0.776 1298 HB2 GLU 43 HB2 GLU 43 -6.300 -17.444 0.732 1299 HB3 GLU 43 HB1 GLU 43 -5.726 -18.923 1.491 1300 HG2 GLU 43 HG2 GLU 43 -3.474 -18.482 0.719 1301 HG3 GLU 43 HG1 GLU 43 -4.030 -17.039 -0.132 1302 H GLU 44 HN GLU 44 -8.175 -17.992 -0.594 1303 HA GLU 44 HA GLU 44 -9.629 -20.215 0.394 1304 HB2 GLU 44 HB2 GLU 44 -10.168 -17.471 -0.337 1305 HB3 GLU 44 HB1 GLU 44 -11.449 -18.532 -0.905 1306 HG2 GLU 44 HG2 GLU 44 -12.255 -18.079 1.152 1307 HG3 GLU 44 HG1 GLU 44 -11.265 -19.478 1.553 1308 H SER 45 HN SER 45 -8.462 -19.489 -2.719 1309 HA SER 45 HA SER 45 -10.477 -21.129 -4.064 1310 HB2 SER 45 HB2 SER 45 -9.472 -18.925 -5.005 1311 HB3 SER 45 HB1 SER 45 -8.071 -19.915 -5.408 1312 HG SER 45 HG SER 45 -9.193 -20.938 -6.912 1313 H ALA 46 HN ALA 46 -7.510 -21.484 -2.532 1314 HA ALA 46 HA ALA 46 -6.497 -23.635 -4.174 1315 HB1 ALA 46 HB1 ALA 46 -4.894 -22.212 -3.081 1316 HB2 ALA 46 HB2 ALA 46 -4.769 -23.836 -2.403 1317 HB3 ALA 46 HB3 ALA 46 -5.596 -22.564 -1.503 Start of MODEL 7 1 H LEU 6 HT1 LEU 6 10.456 13.309 5.931 2 HA LEU 6 HA LEU 6 10.472 15.899 4.503 3 HB2 LEU 6 HB2 LEU 6 12.387 13.683 4.698 4 HB3 LEU 6 HB1 LEU 6 11.975 14.120 3.051 5 HG LEU 6 HG LEU 6 12.719 16.395 3.413 6 HD11 LEU 6 HD11 LEU 6 13.475 15.568 6.211 7 HD12 LEU 6 HD12 LEU 6 12.037 16.508 5.810 8 HD13 LEU 6 HD13 LEU 6 13.640 17.165 5.484 9 HD21 LEU 6 HD21 LEU 6 15.103 15.973 3.766 10 HD22 LEU 6 HD22 LEU 6 14.379 14.739 2.730 11 HD23 LEU 6 HD23 LEU 6 14.724 14.381 4.423 12 H THR 7 HN THR 7 10.553 14.952 1.972 13 HA THR 7 HA THR 7 7.863 13.936 1.703 14 HB THR 7 HB THR 7 9.093 14.177 -0.839 15 HG1 THR 7 HG1 THR 7 10.717 15.451 -0.041 16 HG21 THR 7 HG21 THR 7 7.101 15.798 0.728 17 HG22 THR 7 HG22 THR 7 6.802 14.659 -0.588 18 HG23 THR 7 HG23 THR 7 7.556 16.216 -0.924 19 H LYS 8 HN LYS 8 7.346 12.195 0.238 20 HA LYS 8 HA LYS 8 8.674 9.797 0.792 21 HB2 LYS 8 HB2 LYS 8 6.364 9.758 0.195 22 HB3 LYS 8 HB1 LYS 8 6.675 10.575 -1.328 23 HG2 LYS 8 HG2 LYS 8 7.964 8.540 -2.041 24 HG3 LYS 8 HG1 LYS 8 7.340 7.740 -0.593 25 HD2 LYS 8 HD2 LYS 8 5.076 8.054 -1.321 26 HD3 LYS 8 HD1 LYS 8 5.604 9.040 -2.682 27 HE2 LYS 8 HE2 LYS 8 6.508 7.203 -3.814 28 HE3 LYS 8 HE1 LYS 8 6.506 6.201 -2.365 29 HZ1 LYS 8 HZ1 LYS 8 4.056 6.294 -2.404 30 HZ2 LYS 8 HZ2 LYS 8 4.708 5.519 -3.766 31 HZ3 LYS 8 HZ3 LYS 8 4.131 7.107 -3.886 32 H THR 9 HN THR 9 8.964 12.056 -1.851 33 HA THR 9 HA THR 9 10.395 10.529 -3.690 34 HB THR 9 HB THR 9 11.335 13.205 -3.789 35 HG1 THR 9 HG1 THR 9 9.112 14.170 -3.757 36 HG21 THR 9 HG21 THR 9 9.069 11.860 -5.279 37 HG22 THR 9 HG22 THR 9 10.775 11.800 -5.728 38 HG23 THR 9 HG23 THR 9 9.902 13.333 -5.777 39 H ASP 10 HN ASP 10 11.503 12.495 -0.968 40 HA ASP 10 HA ASP 10 14.263 12.370 -1.443 41 HB2 ASP 10 HB2 ASP 10 12.744 12.613 1.162 42 HB3 ASP 10 HB1 ASP 10 14.481 12.844 1.008 43 H TYR 11 HN TYR 11 12.200 10.348 0.627 44 HA TYR 11 HA TYR 11 14.250 8.610 1.478 45 HB2 TYR 11 HB2 TYR 11 11.308 7.951 1.241 46 HB3 TYR 11 HB1 TYR 11 12.487 7.163 2.286 47 HD1 TYR 11 HD1 TYR 11 13.864 9.333 3.597 48 HD2 TYR 11 HD2 TYR 11 9.757 9.019 2.556 49 HE1 TYR 11 HE1 TYR 11 13.293 10.883 5.416 50 HE2 TYR 11 HE2 TYR 11 9.173 10.572 4.369 51 HH TYR 11 HH TYR 11 10.561 11.164 6.790 52 H LEU 12 HN LEU 12 12.047 8.557 -1.252 53 HA LEU 12 HA LEU 12 12.543 5.953 -2.156 54 HB2 LEU 12 HB2 LEU 12 10.691 7.415 -2.925 55 HB3 LEU 12 HB1 LEU 12 11.852 8.386 -3.808 56 HG LEU 12 HG LEU 12 12.417 6.371 -5.178 57 HD11 LEU 12 HD11 LEU 12 11.730 4.641 -3.619 58 HD12 LEU 12 HD12 LEU 12 10.852 4.477 -5.137 59 HD13 LEU 12 HD13 LEU 12 10.057 5.180 -3.730 60 HD21 LEU 12 HD21 LEU 12 10.598 8.164 -5.679 61 HD22 LEU 12 HD22 LEU 12 9.471 6.840 -5.386 62 HD23 LEU 12 HD23 LEU 12 10.681 6.704 -6.661 63 H MET 13 HN MET 13 14.197 9.008 -2.836 64 HA MET 13 HA MET 13 15.980 7.906 -4.766 65 HB2 MET 13 HB2 MET 13 16.225 10.416 -3.095 66 HB3 MET 13 HB1 MET 13 17.305 9.986 -4.413 67 HG2 MET 13 HG2 MET 13 14.392 10.689 -4.563 68 HG3 MET 13 HG1 MET 13 15.762 11.546 -5.271 69 HE1 MET 13 HE1 MET 13 14.155 11.548 -7.537 70 HE2 MET 13 HE2 MET 13 12.977 10.568 -6.666 71 HE3 MET 13 HE3 MET 13 13.551 10.055 -8.253 72 H ARG 14 HN ARG 14 16.098 8.373 -1.294 73 HA ARG 14 HA ARG 14 18.818 7.716 -0.907 74 HB2 ARG 14 HB2 ARG 14 17.340 8.859 0.759 75 HB3 ARG 14 HB1 ARG 14 16.507 7.333 1.009 76 HG2 ARG 14 HG2 ARG 14 19.448 7.343 1.380 77 HG3 ARG 14 HG1 ARG 14 18.471 8.173 2.588 78 HD2 ARG 14 HD2 ARG 14 17.213 6.161 3.021 79 HD3 ARG 14 HD1 ARG 14 18.022 5.329 1.695 80 HE ARG 14 HE ARG 14 19.134 5.944 4.328 81 HH11 ARG 14 HH11 ARG 14 19.650 4.661 1.095 82 HH12 ARG 14 HH12 ARG 14 21.069 3.766 1.546 83 HH21 ARG 14 HH21 ARG 14 20.989 4.771 4.919 84 HH22 ARG 14 HH22 ARG 14 21.829 3.827 3.725 85 H LEU 15 HN LEU 15 15.891 5.779 -1.155 86 HA LEU 15 HA LEU 15 17.347 3.341 -0.507 87 HB2 LEU 15 HB2 LEU 15 14.459 3.716 -1.304 88 HB3 LEU 15 HB1 LEU 15 15.177 2.238 -0.691 89 HG LEU 15 HG LEU 15 15.019 4.799 0.893 90 HD11 LEU 15 HD11 LEU 15 13.210 2.395 0.941 91 HD12 LEU 15 HD12 LEU 15 12.777 4.028 0.439 92 HD13 LEU 15 HD13 LEU 15 13.193 3.704 2.122 93 HD21 LEU 15 HD21 LEU 15 16.788 3.345 1.645 94 HD22 LEU 15 HD22 LEU 15 15.694 1.961 1.654 95 HD23 LEU 15 HD23 LEU 15 15.451 3.283 2.795 96 H ARG 16 HN ARG 16 16.693 5.163 -3.264 97 HA ARG 16 HA ARG 16 16.354 3.098 -5.182 98 HB2 ARG 16 HB2 ARG 16 16.269 5.871 -5.223 99 HB3 ARG 16 HB1 ARG 16 17.686 5.493 -6.191 100 HG2 ARG 16 HG2 ARG 16 16.075 5.482 -7.806 101 HG3 ARG 16 HG1 ARG 16 16.050 3.780 -7.337 102 HD2 ARG 16 HD2 ARG 16 14.195 4.323 -5.759 103 HD3 ARG 16 HD1 ARG 16 14.160 5.950 -6.427 104 HE ARG 16 HE ARG 16 13.405 3.469 -7.825 105 HH11 ARG 16 HH11 ARG 16 13.511 6.987 -7.718 106 HH12 ARG 16 HH12 ARG 16 12.378 7.178 -9.017 107 HH21 ARG 16 HH21 ARG 16 11.921 3.723 -9.529 108 HH22 ARG 16 HH22 ARG 16 11.490 5.329 -10.063 109 H ARG 17 HN ARG 17 19.074 4.322 -3.495 110 HA ARG 17 HA ARG 17 20.993 3.287 -5.423 111 HB2 ARG 17 HB2 ARG 17 21.496 4.478 -2.693 112 HB3 ARG 17 HB1 ARG 17 22.687 4.208 -3.959 113 HG2 ARG 17 HG2 ARG 17 21.659 5.881 -5.348 114 HG3 ARG 17 HG1 ARG 17 20.339 6.072 -4.191 115 HD2 ARG 17 HD2 ARG 17 23.243 6.758 -3.778 116 HD3 ARG 17 HD1 ARG 17 21.888 7.877 -3.886 117 HE ARG 17 HE ARG 17 22.237 5.947 -1.680 118 HH11 ARG 17 HH11 ARG 17 21.326 9.116 -2.866 119 HH12 ARG 17 HH12 ARG 17 20.903 9.714 -1.295 120 HH21 ARG 17 HH21 ARG 17 21.664 6.729 0.370 121 HH22 ARG 17 HH22 ARG 17 21.094 8.363 0.543 122 H CYS 18 HN CYS 18 19.091 1.916 -3.141 123 HA CYS 18 HA CYS 18 21.135 0.067 -2.156 124 HB2 CYS 18 HB2 CYS 18 18.215 0.196 -1.387 125 HB3 CYS 18 HB1 CYS 18 19.505 -0.647 -0.535 126 HG CYS 18 HG CYS 18 20.584 2.344 -0.624 127 H GLN 19 HN GLN 19 21.320 -1.953 -2.880 128 HA GLN 19 HA GLN 19 19.192 -3.055 -4.583 129 HB2 GLN 19 HB2 GLN 19 22.136 -2.835 -5.115 130 HB3 GLN 19 HB1 GLN 19 21.214 -4.161 -5.817 131 HG2 GLN 19 HG2 GLN 19 19.984 -1.537 -6.176 132 HG3 GLN 19 HG1 GLN 19 21.559 -1.712 -6.947 133 HE21 GLN 19 HE21 GLN 19 20.457 -1.516 -8.953 134 HE22 GLN 19 HE22 GLN 19 19.637 -2.875 -9.642 135 H THR 20 HN THR 20 19.997 -5.499 -5.073 136 HA THR 20 HA THR 20 20.379 -7.595 -4.310 137 HB THR 20 HB THR 20 21.518 -6.432 -1.764 138 HG1 THR 20 HG1 THR 20 23.292 -5.933 -2.845 139 HG21 THR 20 HG21 THR 20 22.878 -8.515 -1.810 140 HG22 THR 20 HG22 THR 20 21.954 -9.051 -3.217 141 HG23 THR 20 HG23 THR 20 21.150 -8.821 -1.663 142 H ILE 21 HN ILE 21 18.610 -5.285 -2.545 143 HA ILE 21 HA ILE 21 16.617 -5.384 -1.463 144 HB ILE 21 HB ILE 21 16.724 -8.353 -2.025 145 HG12 ILE 21 HG12 ILE 21 15.013 -6.249 -3.347 146 HG13 ILE 21 HG11 ILE 21 16.594 -6.710 -3.974 147 HG21 ILE 21 HG21 ILE 21 14.444 -6.663 -1.002 148 HG22 ILE 21 HG22 ILE 21 15.317 -7.894 -0.092 149 HG23 ILE 21 HG23 ILE 21 14.326 -8.358 -1.480 150 HD11 ILE 21 HD11 ILE 21 14.190 -8.487 -3.653 151 HD12 ILE 21 HD12 ILE 21 15.783 -9.033 -4.177 152 HD13 ILE 21 HD13 ILE 21 14.873 -7.885 -5.164 153 H ASP 22 HN ASP 22 18.843 -7.988 -0.569 154 HA ASP 22 HA ASP 22 18.066 -8.428 2.062 155 HB2 ASP 22 HB2 ASP 22 20.069 -9.354 0.425 156 HB3 ASP 22 HB1 ASP 22 20.977 -8.470 1.649 157 H THR 23 HN THR 23 20.268 -5.995 0.753 158 HA THR 23 HA THR 23 21.006 -4.891 3.266 159 HB THR 23 HB THR 23 21.109 -3.380 0.671 160 HG1 THR 23 HG1 THR 23 22.937 -4.566 0.107 161 HG21 THR 23 HG21 THR 23 23.061 -2.388 1.579 162 HG22 THR 23 HG22 THR 23 23.170 -3.597 2.858 163 HG23 THR 23 HG23 THR 23 21.878 -2.397 2.886 164 H LEU 24 HN LEU 24 18.456 -4.256 0.951 165 HA LEU 24 HA LEU 24 17.607 -1.762 2.022 166 HB2 LEU 24 HB2 LEU 24 17.044 -2.466 -0.253 167 HB3 LEU 24 HB1 LEU 24 16.102 -3.804 0.378 168 HG LEU 24 HG LEU 24 14.688 -1.979 1.553 169 HD11 LEU 24 HD11 LEU 24 14.639 0.171 0.417 170 HD12 LEU 24 HD12 LEU 24 15.986 -0.326 -0.610 171 HD13 LEU 24 HD13 LEU 24 16.227 -0.123 1.127 172 HD21 LEU 24 HD21 LEU 24 13.265 -1.760 -0.393 173 HD22 LEU 24 HD22 LEU 24 13.917 -3.395 -0.302 174 HD23 LEU 24 HD23 LEU 24 14.593 -2.238 -1.448 175 H GLU 25 HN GLU 25 16.698 -5.114 2.532 176 HA GLU 25 HA GLU 25 14.494 -4.703 4.230 177 HB2 GLU 25 HB2 GLU 25 15.312 -6.855 3.046 178 HB3 GLU 25 HB1 GLU 25 16.355 -7.058 4.443 179 HG2 GLU 25 HG2 GLU 25 14.540 -8.329 5.025 180 HG3 GLU 25 HG1 GLU 25 14.161 -6.793 5.802 181 H ARG 26 HN ARG 26 17.902 -4.459 4.782 182 HA ARG 26 HA ARG 26 17.610 -4.642 7.674 183 HB2 ARG 26 HB2 ARG 26 19.948 -4.455 5.806 184 HB3 ARG 26 HB1 ARG 26 20.155 -4.113 7.522 185 HG2 ARG 26 HG2 ARG 26 19.298 -6.338 8.065 186 HG3 ARG 26 HG1 ARG 26 19.099 -6.677 6.345 187 HD2 ARG 26 HD2 ARG 26 21.522 -6.401 6.029 188 HD3 ARG 26 HD1 ARG 26 21.702 -6.097 7.761 189 HE ARG 26 HE ARG 26 21.202 -8.352 8.195 190 HH11 ARG 26 HH11 ARG 26 21.340 -7.637 4.783 191 HH12 ARG 26 HH12 ARG 26 21.328 -9.308 4.296 192 HH21 ARG 26 HH21 ARG 26 21.230 -10.554 7.565 193 HH22 ARG 26 HH22 ARG 26 21.285 -10.956 5.880 194 H VAL 27 HN VAL 27 18.422 -2.228 5.212 195 HA VAL 27 HA VAL 27 19.049 -0.155 7.011 196 HB VAL 27 HB VAL 27 19.598 -0.208 4.541 197 HG11 VAL 27 HG11 VAL 27 17.242 -0.683 3.813 198 HG12 VAL 27 HG12 VAL 27 18.051 0.616 2.943 199 HG13 VAL 27 HG13 VAL 27 16.866 0.997 4.189 200 HG21 VAL 27 HG21 VAL 27 19.861 1.766 6.076 201 HG22 VAL 27 HG22 VAL 27 18.320 2.359 5.451 202 HG23 VAL 27 HG23 VAL 27 19.695 2.157 4.366 203 H ILE 28 HN ILE 28 15.960 -1.231 5.694 204 HA ILE 28 HA ILE 28 14.527 1.056 6.679 205 HB ILE 28 HB ILE 28 12.477 -0.209 6.131 206 HG12 ILE 28 HG12 ILE 28 14.412 -2.392 5.317 207 HG13 ILE 28 HG11 ILE 28 13.243 -2.477 6.631 208 HG21 ILE 28 HG21 ILE 28 13.510 1.161 4.448 209 HG22 ILE 28 HG22 ILE 28 12.870 -0.301 3.695 210 HG23 ILE 28 HG23 ILE 28 14.602 -0.147 3.996 211 HD11 ILE 28 HD11 ILE 28 12.473 -2.103 3.748 212 HD12 ILE 28 HD12 ILE 28 11.417 -2.493 5.106 213 HD13 ILE 28 HD13 ILE 28 12.596 -3.676 4.535 214 H GLU 29 HN GLU 29 15.431 -2.049 7.956 215 HA GLU 29 HA GLU 29 13.543 -2.075 10.107 216 HB2 GLU 29 HB2 GLU 29 14.604 -4.138 9.245 217 HB3 GLU 29 HB1 GLU 29 16.167 -3.558 9.800 218 HG2 GLU 29 HG2 GLU 29 15.269 -5.197 11.327 219 HG3 GLU 29 HG1 GLU 29 15.386 -3.623 12.107 220 H LYS 30 HN LYS 30 16.949 -1.176 9.765 221 HA LYS 30 HA LYS 30 17.344 -0.464 12.480 222 HB2 LYS 30 HB2 LYS 30 18.811 0.148 9.926 223 HB3 LYS 30 HB1 LYS 30 19.295 0.891 11.446 224 HG2 LYS 30 HG2 LYS 30 19.703 -1.288 12.416 225 HG3 LYS 30 HG1 LYS 30 19.129 -2.077 10.945 226 HD2 LYS 30 HD2 LYS 30 21.606 -1.977 11.118 227 HD3 LYS 30 HD1 LYS 30 20.969 -1.175 9.683 228 HE2 LYS 30 HE2 LYS 30 22.764 0.119 10.780 229 HE3 LYS 30 HE1 LYS 30 21.234 0.991 10.727 230 HZ1 LYS 30 HZ1 LYS 30 22.329 1.199 12.878 231 HZ2 LYS 30 HZ2 LYS 30 22.286 -0.477 13.083 232 HZ3 LYS 30 HZ3 LYS 30 20.847 0.404 13.029 233 H ASN 31 HN ASN 31 16.450 1.360 9.592 234 HA ASN 31 HA ASN 31 16.475 3.915 10.826 235 HB2 ASN 31 HB2 ASN 31 16.529 3.343 8.313 236 HB3 ASN 31 HB1 ASN 31 14.781 3.195 8.439 237 HD21 ASN 31 HD21 ASN 31 14.340 4.907 7.118 238 HD22 ASN 31 HD22 ASN 31 14.621 6.550 7.580 239 H LYS 32 HN LYS 32 14.189 1.343 10.803 240 HA LYS 32 HA LYS 32 11.784 2.715 11.208 241 HB2 LYS 32 HB2 LYS 32 12.091 0.241 10.747 242 HB3 LYS 32 HB1 LYS 32 12.516 0.057 12.443 243 HG2 LYS 32 HG2 LYS 32 10.239 1.195 12.894 244 HG3 LYS 32 HG1 LYS 32 9.874 0.746 11.227 245 HD2 LYS 32 HD2 LYS 32 10.809 -1.186 13.350 246 HD3 LYS 32 HD1 LYS 32 9.121 -0.919 12.919 247 HE2 LYS 32 HE2 LYS 32 9.437 -1.781 10.740 248 HE3 LYS 32 HE1 LYS 32 11.195 -1.725 10.893 249 HZ1 LYS 32 HZ1 LYS 32 11.109 -3.819 11.566 250 HZ2 LYS 32 HZ2 LYS 32 9.413 -3.809 11.582 251 HZ3 LYS 32 HZ3 LYS 32 10.269 -3.326 12.955 252 H TYR 33 HN TYR 33 14.382 1.900 13.439 253 HA TYR 33 HA TYR 33 12.795 2.837 15.709 254 HB2 TYR 33 HB2 TYR 33 15.634 1.815 15.755 255 HB3 TYR 33 HB1 TYR 33 14.531 1.969 17.119 256 HD1 TYR 33 HD1 TYR 33 12.087 0.708 16.212 257 HD2 TYR 33 HD2 TYR 33 16.131 -0.411 15.472 258 HE1 TYR 33 HE1 TYR 33 11.385 -1.621 15.903 259 HE2 TYR 33 HE2 TYR 33 15.424 -2.744 15.154 260 HH TYR 33 HH TYR 33 12.871 -3.811 14.402 261 H GLU 34 HN GLU 34 14.444 4.350 13.392 262 HA GLU 34 HA GLU 34 15.690 6.276 15.240 263 HB2 GLU 34 HB2 GLU 34 16.229 5.832 12.302 264 HB3 GLU 34 HB1 GLU 34 17.054 7.001 13.328 265 HG2 GLU 34 HG2 GLU 34 17.743 5.004 14.757 266 HG3 GLU 34 HG1 GLU 34 17.203 4.009 13.405 267 H LEU 35 HN LEU 35 13.203 5.842 12.905 268 HA LEU 35 HA LEU 35 12.894 8.617 12.249 269 HB2 LEU 35 HB2 LEU 35 11.109 6.230 11.805 270 HB3 LEU 35 HB1 LEU 35 10.762 7.839 11.201 271 HG LEU 35 HG LEU 35 13.138 6.136 10.439 272 HD11 LEU 35 HD11 LEU 35 10.629 6.892 8.956 273 HD12 LEU 35 HD12 LEU 35 11.160 5.273 9.425 274 HD13 LEU 35 HD13 LEU 35 12.053 6.176 8.198 275 HD21 LEU 35 HD21 LEU 35 13.811 8.432 10.394 276 HD22 LEU 35 HD22 LEU 35 12.321 8.905 9.577 277 HD23 LEU 35 HD23 LEU 35 13.516 7.917 8.732 278 H SER 36 HN SER 36 10.667 9.647 12.557 279 HA SER 36 HA SER 36 10.182 9.739 15.415 280 HB2 SER 36 HB2 SER 36 8.693 11.343 13.358 281 HB3 SER 36 HB1 SER 36 9.114 11.782 15.014 282 HG SER 36 HG SER 36 10.382 12.590 13.013 283 H ASP 37 H ASP 37 8.969 8.075 12.789 284 HA ASP 37 HA ASP 37 7.366 6.441 12.641 285 HB2 ASP 37 3HB ASP 37 6.605 7.431 15.473 286 HB3 ASP 37 2HB ASP 37 5.738 6.144 14.644 287 H ASN 38 HN ASN 38 6.609 9.777 13.307 288 HA ASN 38 HA ASN 38 3.876 9.551 12.409 289 HB2 ASN 38 HB2 ASN 38 3.641 11.819 12.874 290 HB3 ASN 38 HB1 ASN 38 4.880 11.339 14.026 291 HD21 ASN 38 HD21 ASN 38 4.142 13.221 11.239 292 HD22 ASN 38 HD22 ASN 38 5.652 14.052 11.133 293 H GLU 39 HN GLU 39 6.994 10.177 10.979 294 HA GLU 39 HA GLU 39 5.713 10.887 8.432 295 HB2 GLU 39 HB2 GLU 39 8.317 11.218 7.875 296 HB3 GLU 39 HB1 GLU 39 7.329 12.481 8.593 297 HG2 GLU 39 HG2 GLU 39 9.451 12.318 9.734 298 HG3 GLU 39 HG1 GLU 39 8.135 11.855 10.813 299 H LEU 40 HN LEU 40 6.519 8.246 10.010 300 HA LEU 40 HA LEU 40 8.075 6.721 8.214 301 HB2 LEU 40 HB2 LEU 40 7.774 6.120 10.557 302 HB3 LEU 40 HB1 LEU 40 6.057 5.901 10.307 303 HG LEU 40 HG LEU 40 6.694 4.031 8.678 304 HD11 LEU 40 HD11 LEU 40 9.033 4.593 8.409 305 HD12 LEU 40 HD12 LEU 40 8.866 2.978 9.094 306 HD13 LEU 40 HD13 LEU 40 9.318 4.333 10.129 307 HD21 LEU 40 HD21 LEU 40 5.744 3.723 10.941 308 HD22 LEU 40 HD22 LEU 40 7.383 3.665 11.585 309 HD23 LEU 40 HD23 LEU 40 6.834 2.423 10.461 310 H ALA 41 HN ALA 41 4.804 7.730 8.191 311 HA ALA 41 HA ALA 41 3.544 5.693 6.752 312 HB1 ALA 41 HB1 ALA 41 2.911 8.630 6.539 313 HB2 ALA 41 HB2 ALA 41 2.442 7.626 7.908 314 HB3 ALA 41 HB3 ALA 41 1.815 7.266 6.299 315 H VAL 42 HN VAL 42 5.328 8.549 5.597 316 HA VAL 42 HA VAL 42 4.838 7.833 2.841 317 HB VAL 42 HB VAL 42 6.480 9.709 2.350 318 HG11 VAL 42 HG11 VAL 42 4.043 9.944 2.234 319 HG12 VAL 42 HG12 VAL 42 4.819 11.428 2.780 320 HG13 VAL 42 HG13 VAL 42 4.007 10.380 3.943 321 HG21 VAL 42 HG21 VAL 42 7.125 11.206 4.043 322 HG22 VAL 42 HG22 VAL 42 7.489 9.598 4.679 323 HG23 VAL 42 HG23 VAL 42 6.051 10.461 5.228 324 H PHE 43 HN PHE 43 7.189 7.159 5.236 325 HA PHE 43 HA PHE 43 9.387 6.578 3.540 326 HB2 PHE 43 HB2 PHE 43 9.689 6.948 5.953 327 HB3 PHE 43 HB1 PHE 43 8.731 5.513 6.302 328 HD1 PHE 43 HD1 PHE 43 11.770 6.541 4.411 329 HD2 PHE 43 HD2 PHE 43 9.829 3.525 6.698 330 HE1 PHE 43 HE1 PHE 43 13.817 5.179 4.345 331 HE2 PHE 43 HE2 PHE 43 11.871 2.157 6.639 332 HZ PHE 43 HZ PHE 43 13.869 2.982 5.464 333 H TYR 44 HN TYR 44 6.728 4.669 4.874 334 HA TYR 44 HA TYR 44 7.554 2.170 3.850 335 HB2 TYR 44 HB2 TYR 44 4.949 3.287 4.813 336 HB3 TYR 44 HB1 TYR 44 4.957 1.739 3.976 337 HD1 TYR 44 HD1 TYR 44 7.638 0.749 5.080 338 HD2 TYR 44 HD2 TYR 44 4.255 2.544 6.937 339 HE1 TYR 44 HE1 TYR 44 8.193 -0.401 7.177 340 HE2 TYR 44 HE2 TYR 44 4.802 1.402 9.046 341 HH TYR 44 HH TYR 44 7.714 0.057 9.702 342 H SER 45 HN SER 45 5.722 4.824 2.501 343 HA SER 45 HA SER 45 4.769 3.532 0.186 344 HB2 SER 45 HB2 SER 45 4.208 5.879 1.245 345 HB3 SER 45 HB1 SER 45 5.492 6.443 0.179 346 HG SER 45 HG SER 45 3.679 4.775 -1.066 347 H ALA 46 HN ALA 46 7.837 4.921 1.042 348 HA ALA 46 HA ALA 46 8.870 4.909 -1.655 349 HB1 ALA 46 HB1 ALA 46 9.677 6.592 -0.109 350 HB2 ALA 46 HB2 ALA 46 11.005 5.528 -0.572 351 HB3 ALA 46 HB3 ALA 46 10.234 5.341 1.003 352 H ALA 47 HN ALA 47 9.245 3.002 1.304 353 HA ALA 47 HA ALA 47 11.179 1.197 0.396 354 HB1 ALA 47 HB1 ALA 47 10.562 1.439 2.752 355 HB2 ALA 47 HB2 ALA 47 10.451 -0.242 2.232 356 HB3 ALA 47 HB3 ALA 47 8.988 0.726 2.413 357 H ASP 48 HN ASP 48 7.642 0.901 0.460 358 HA ASP 48 HA ASP 48 7.412 -1.612 -0.729 359 HB2 ASP 48 HB2 ASP 48 5.604 0.779 -0.581 360 HB3 ASP 48 HB1 ASP 48 5.146 -0.587 -1.584 361 H HIS 49 HN HIS 49 7.284 1.594 -2.211 362 HA HIS 49 HA HIS 49 6.946 0.803 -4.866 363 HB2 HIS 49 HB2 HIS 49 6.800 3.142 -3.766 364 HB3 HIS 49 HB1 HIS 49 8.524 3.237 -4.092 365 HD1 HIS 49 HD1 HIS 49 5.255 3.773 -5.612 366 HD2 HIS 49 HD2 HIS 49 9.139 3.059 -6.952 367 HE1 HIS 49 HE1 HIS 49 5.290 4.461 -8.036 368 HE2 HIS 49 HE2 HIS 49 7.586 3.832 -8.866 369 H ARG 50 HN ARG 50 9.929 1.365 -3.022 370 HA ARG 50 HA ARG 50 11.687 1.015 -5.220 371 HB2 ARG 50 HB2 ARG 50 12.430 2.163 -3.220 372 HB3 ARG 50 HB1 ARG 50 12.144 0.724 -2.250 373 HG2 ARG 50 HG2 ARG 50 14.519 1.095 -2.717 374 HG3 ARG 50 HG1 ARG 50 13.939 -0.438 -3.370 375 HD2 ARG 50 HD2 ARG 50 13.726 0.608 -5.584 376 HD3 ARG 50 HD1 ARG 50 14.353 2.117 -4.921 377 HE ARG 50 HE ARG 50 16.301 0.396 -4.297 378 HH11 ARG 50 HH11 ARG 50 14.603 0.988 -7.316 379 HH12 ARG 50 HH12 ARG 50 15.937 0.473 -8.305 380 HH21 ARG 50 HH21 ARG 50 18.042 -0.282 -5.576 381 HH22 ARG 50 HH22 ARG 50 17.915 -0.244 -7.309 382 H LEU 51 HN LEU 51 10.406 -1.221 -2.782 383 HA LEU 51 HA LEU 51 11.987 -3.435 -3.559 384 HB2 LEU 51 HB2 LEU 51 10.745 -3.207 -1.396 385 HB3 LEU 51 HB1 LEU 51 9.258 -3.498 -2.277 386 HG LEU 51 HG LEU 51 10.112 -5.729 -2.922 387 HD11 LEU 51 HD11 LEU 51 12.358 -5.114 -1.015 388 HD12 LEU 51 HD12 LEU 51 12.508 -5.226 -2.768 389 HD13 LEU 51 HD13 LEU 51 12.057 -6.648 -1.832 390 HD21 LEU 51 HD21 LEU 51 8.673 -5.393 -0.952 391 HD22 LEU 51 HD22 LEU 51 10.114 -5.242 0.053 392 HD23 LEU 51 HD23 LEU 51 9.768 -6.763 -0.772 393 H ALA 52 HN ALA 52 8.832 -2.259 -4.577 394 HA ALA 52 HA ALA 52 7.990 -4.426 -6.116 395 HB1 ALA 52 HB1 ALA 52 6.578 -2.782 -7.306 396 HB2 ALA 52 HB2 ALA 52 7.461 -1.484 -6.500 397 HB3 ALA 52 HB3 ALA 52 6.499 -2.620 -5.552 398 H GLU 53 HN GLU 53 9.714 -1.500 -7.211 399 HA GLU 53 HA GLU 53 10.024 -2.464 -9.869 400 HB2 GLU 53 HB2 GLU 53 11.583 -0.535 -10.122 401 HB3 GLU 53 HB1 GLU 53 10.000 -0.096 -9.500 402 HG2 GLU 53 HG2 GLU 53 10.839 0.212 -7.316 403 HG3 GLU 53 HG1 GLU 53 12.371 -0.555 -7.727 404 H LEU 54 HN LEU 54 11.976 -2.676 -6.964 405 HA LEU 54 HA LEU 54 14.406 -3.408 -8.206 406 HB2 LEU 54 HB2 LEU 54 13.972 -2.641 -5.800 407 HB3 LEU 54 HB1 LEU 54 13.548 -4.308 -5.467 408 HG LEU 54 HG LEU 54 15.753 -5.063 -5.863 409 HD11 LEU 54 HD11 LEU 54 17.528 -3.444 -6.661 410 HD12 LEU 54 HD12 LEU 54 16.211 -2.368 -7.124 411 HD13 LEU 54 HD13 LEU 54 16.354 -3.958 -7.873 412 HD21 LEU 54 HD21 LEU 54 15.515 -3.979 -3.721 413 HD22 LEU 54 HD22 LEU 54 15.847 -2.404 -4.444 414 HD23 LEU 54 HD23 LEU 54 17.115 -3.625 -4.374 415 H THR 55 HN THR 55 11.653 -5.292 -7.069 416 HA THR 55 HA THR 55 12.861 -7.828 -7.440 417 HB THR 55 HB THR 55 9.898 -7.224 -7.535 418 HG1 THR 55 HG1 THR 55 10.626 -6.344 -5.629 419 HG21 THR 55 HG21 THR 55 9.629 -9.484 -6.716 420 HG22 THR 55 HG22 THR 55 11.377 -9.682 -6.572 421 HG23 THR 55 HG23 THR 55 10.635 -9.528 -8.167 422 H MET 56 HN MET 56 11.074 -5.643 -9.529 423 HA MET 56 HA MET 56 10.940 -7.591 -11.675 424 HB2 MET 56 HB2 MET 56 9.548 -5.212 -11.012 425 HB3 MET 56 HB1 MET 56 10.326 -4.938 -12.563 426 HG2 MET 56 HG2 MET 56 8.466 -7.201 -11.874 427 HG3 MET 56 HG1 MET 56 8.084 -5.797 -12.866 428 HE1 MET 56 HE1 MET 56 8.912 -5.463 -15.353 429 HE2 MET 56 HE2 MET 56 10.245 -6.385 -16.049 430 HE3 MET 56 HE3 MET 56 10.526 -5.346 -14.653 431 H ASN 57 HN ASN 57 13.212 -5.481 -10.491 432 HA ASN 57 HA ASN 57 15.236 -4.754 -11.183 433 HB2 ASN 57 HB2 ASN 57 15.220 -7.191 -12.097 434 HB3 ASN 57 HB1 ASN 57 15.026 -6.425 -13.670 435 HD21 ASN 57 HD21 ASN 57 16.937 -6.656 -14.620 436 HD22 ASN 57 HD22 ASN 57 18.455 -6.178 -13.947 437 H LYS 58 HN LYS 58 12.875 -3.302 -11.978 438 HA LYS 58 HA LYS 58 14.080 -1.717 -14.086 439 HB2 LYS 58 HB2 LYS 58 12.548 -3.511 -15.125 440 HB3 LYS 58 HB1 LYS 58 11.221 -2.582 -14.448 441 HG2 LYS 58 HG2 LYS 58 11.256 -1.542 -16.431 442 HG3 LYS 58 HG1 LYS 58 12.597 -0.641 -15.727 443 HD2 LYS 58 HD2 LYS 58 14.154 -2.334 -16.675 444 HD3 LYS 58 HD1 LYS 58 12.779 -3.073 -17.493 445 HE2 LYS 58 HE2 LYS 58 13.855 -1.641 -19.063 446 HE3 LYS 58 HE1 LYS 58 12.346 -0.866 -18.586 447 HZ1 LYS 58 HZ1 LYS 58 13.889 0.836 -18.492 448 HZ2 LYS 58 HZ2 LYS 58 15.108 -0.136 -17.847 449 HZ3 LYS 58 HZ3 LYS 58 13.808 0.346 -16.879 450 H LEU 59 HN LEU 59 13.860 0.370 -13.593 451 HA LEU 59 HA LEU 59 12.389 1.189 -11.295 452 HB2 LEU 59 HB2 LEU 59 14.132 2.499 -13.306 453 HB3 LEU 59 HB1 LEU 59 13.014 3.530 -12.438 454 HG LEU 59 HG LEU 59 13.986 2.685 -10.296 455 HD11 LEU 59 HD11 LEU 59 14.891 0.583 -11.142 456 HD12 LEU 59 HD12 LEU 59 16.134 1.554 -10.354 457 HD13 LEU 59 HD13 LEU 59 16.061 1.471 -12.115 458 HD21 LEU 59 HD21 LEU 59 14.671 4.824 -11.198 459 HD22 LEU 59 HD22 LEU 59 15.856 4.035 -12.239 460 HD23 LEU 59 HD23 LEU 59 16.062 4.002 -10.488 461 H TYR 60 HN TYR 60 10.340 1.712 -11.149 462 HA TYR 60 HA TYR 60 8.941 2.690 -13.549 463 HB2 TYR 60 HB2 TYR 60 7.978 0.669 -11.525 464 HB3 TYR 60 HB1 TYR 60 6.893 1.502 -12.626 465 HD1 TYR 60 HD1 TYR 60 8.161 1.452 -15.176 466 HD2 TYR 60 HD2 TYR 60 8.225 -1.524 -12.134 467 HE1 TYR 60 HE1 TYR 60 8.568 -0.270 -16.876 468 HE2 TYR 60 HE2 TYR 60 8.638 -3.256 -13.828 469 HH TYR 60 HH TYR 60 8.275 -3.592 -16.241 470 H ASP 61 HN ASP 61 8.140 4.646 -13.271 471 HA ASP 61 HA ASP 61 8.057 5.977 -10.768 472 HB2 ASP 61 HB2 ASP 61 7.007 6.613 -13.513 473 HB3 ASP 61 HB1 ASP 61 6.533 7.611 -12.144 474 H LYS 62 HN LYS 62 5.686 4.359 -12.760 475 HA LYS 62 HA LYS 62 3.712 4.558 -10.584 476 HB2 LYS 62 HB2 LYS 62 2.956 3.667 -13.336 477 HB3 LYS 62 HB1 LYS 62 2.003 4.543 -12.147 478 HG2 LYS 62 HG2 LYS 62 2.874 6.592 -12.752 479 HG3 LYS 62 HG1 LYS 62 4.337 5.881 -13.441 480 HD2 LYS 62 HD2 LYS 62 2.992 4.943 -15.270 481 HD3 LYS 62 HD1 LYS 62 1.559 5.714 -14.593 482 HE2 LYS 62 HE2 LYS 62 2.671 7.911 -14.861 483 HE3 LYS 62 HE1 LYS 62 4.024 7.097 -15.639 484 HZ1 LYS 62 HZ1 LYS 62 2.507 7.993 -17.271 485 HZ2 LYS 62 HZ2 LYS 62 1.223 7.122 -16.606 486 HZ3 LYS 62 HZ3 LYS 62 2.504 6.302 -17.348 487 H ILE 63 HN ILE 63 2.898 2.627 -9.755 488 HA ILE 63 HA ILE 63 4.311 0.231 -10.675 489 HB ILE 63 HB ILE 63 2.898 0.736 -8.054 490 HG12 ILE 63 HG12 ILE 63 4.973 2.008 -8.237 491 HG13 ILE 63 HG11 ILE 63 5.174 0.687 -7.090 492 HG21 ILE 63 HG21 ILE 63 2.940 -1.645 -8.976 493 HG22 ILE 63 HG22 ILE 63 3.545 -1.393 -7.338 494 HG23 ILE 63 HG23 ILE 63 4.678 -1.597 -8.677 495 HD11 ILE 63 HD11 ILE 63 6.341 -0.607 -8.800 496 HD12 ILE 63 HD12 ILE 63 7.133 0.938 -8.488 497 HD13 ILE 63 HD13 ILE 63 6.146 0.728 -9.937 498 HA PRO 64 HA PRO 64 0.317 -1.140 -12.190 499 HB2 PRO 64 HB2 PRO 64 1.646 -3.552 -13.103 500 HB3 PRO 64 HB1 PRO 64 1.019 -2.209 -14.075 501 HG2 PRO 64 HG2 PRO 64 3.670 -2.799 -13.818 502 HG3 PRO 64 HG1 PRO 64 3.025 -1.200 -14.231 503 HD2 PRO 64 HD2 PRO 64 4.058 -2.199 -11.622 504 HD3 PRO 64 HD1 PRO 64 4.193 -0.589 -12.357 505 H SER 65 HN SER 65 -1.045 -1.972 -10.739 506 HA SER 65 HA SER 65 -0.575 -3.259 -8.430 507 HB2 SER 65 HB2 SER 65 -2.964 -4.262 -9.815 508 HB3 SER 65 HB1 SER 65 -2.820 -3.409 -8.278 509 HG SER 65 HG SER 65 -3.671 -1.867 -9.455 510 H SER 66 H SER 66 -0.824 -4.859 -11.585 511 HA SER 66 HA SER 66 -1.073 -7.533 -10.666 512 HB2 SER 66 3HB SER 66 -0.386 -8.200 -12.943 513 HB3 SER 66 2HB SER 66 -1.507 -6.854 -13.061 514 HG SER 66 HG SER 66 0.331 -5.467 -13.334 515 H VAL 67 HN VAL 67 1.741 -5.451 -10.771 516 HA VAL 67 HA VAL 67 3.615 -7.625 -10.738 517 HB VAL 67 HB VAL 67 4.008 -5.184 -11.530 518 HG11 VAL 67 HG11 VAL 67 4.578 -4.916 -8.585 519 HG12 VAL 67 HG12 VAL 67 3.419 -3.987 -9.541 520 HG13 VAL 67 HG13 VAL 67 5.153 -3.791 -9.818 521 HG21 VAL 67 HG21 VAL 67 5.702 -6.883 -11.642 522 HG22 VAL 67 HG22 VAL 67 6.033 -6.722 -9.918 523 HG23 VAL 67 HG23 VAL 67 6.424 -5.400 -11.015 524 H TRP 68 HN TRP 68 1.764 -6.013 -8.322 525 HA TRP 68 HA TRP 68 3.488 -6.377 -6.118 526 HB2 TRP 68 HB2 TRP 68 0.547 -5.904 -6.398 527 HB3 TRP 68 HB1 TRP 68 1.238 -6.282 -4.824 528 HD1 TRP 68 HD1 TRP 68 0.304 -3.405 -6.762 529 HE1 TRP 68 HE1 TRP 68 1.560 -1.278 -6.014 530 HE3 TRP 68 HE3 TRP 68 4.019 -5.597 -4.019 531 HZ2 TRP 68 HZ2 TRP 68 3.819 -0.640 -4.469 532 HZ3 TRP 68 HZ3 TRP 68 5.692 -4.151 -2.939 533 HH2 TRP 68 HH2 TRP 68 5.592 -1.728 -3.163 534 H LYS 69 HN LYS 69 1.677 -8.645 -7.893 535 HA LYS 69 HA LYS 69 1.212 -10.526 -5.787 536 HB2 LYS 69 HB2 LYS 69 -0.136 -10.513 -7.850 537 HB3 LYS 69 HB1 LYS 69 1.289 -10.918 -8.791 538 HG2 LYS 69 HG2 LYS 69 -0.017 -12.887 -8.514 539 HG3 LYS 69 HG1 LYS 69 1.439 -13.055 -7.539 540 HD2 LYS 69 HD2 LYS 69 -0.226 -13.819 -6.111 541 HD3 LYS 69 HD1 LYS 69 -0.027 -12.140 -5.611 542 HE2 LYS 69 HE2 LYS 69 -2.372 -12.615 -5.750 543 HE3 LYS 69 HE1 LYS 69 -1.938 -11.533 -7.075 544 HZ1 LYS 69 HZ1 LYS 69 -3.013 -14.205 -7.165 545 HZ2 LYS 69 HZ2 LYS 69 -1.647 -14.014 -8.154 546 HZ3 LYS 69 HZ3 LYS 69 -2.986 -13.004 -8.357 547 H PHE 70 HN PHE 70 3.987 -9.517 -7.373 548 HA PHE 70 HA PHE 70 5.354 -12.078 -6.922 549 HB2 PHE 70 HB2 PHE 70 6.265 -9.705 -8.561 550 HB3 PHE 70 HB1 PHE 70 7.089 -11.255 -8.435 551 HD1 PHE 70 HD1 PHE 70 6.135 -13.258 -9.490 552 HD2 PHE 70 HD2 PHE 70 4.358 -9.415 -9.960 553 HE1 PHE 70 HE1 PHE 70 4.841 -14.093 -11.405 554 HE2 PHE 70 HE2 PHE 70 3.061 -10.244 -11.878 555 HZ PHE 70 HZ PHE 70 3.303 -12.589 -12.600 556 H ILE 71 HN ILE 71 4.763 -9.339 -5.274 557 HA ILE 71 HA ILE 71 7.444 -9.334 -4.047 558 HB ILE 71 HB ILE 71 5.557 -7.027 -4.481 559 HG12 ILE 71 HG12 ILE 71 8.092 -6.204 -5.100 560 HG13 ILE 71 HG11 ILE 71 8.157 -7.905 -5.553 561 HG21 ILE 71 HG21 ILE 71 7.134 -5.659 -3.143 562 HG22 ILE 71 HG22 ILE 71 7.935 -7.143 -2.634 563 HG23 ILE 71 HG23 ILE 71 6.256 -6.850 -2.184 564 HD11 ILE 71 HD11 ILE 71 6.420 -5.729 -6.649 565 HD12 ILE 71 HD12 ILE 71 5.994 -7.428 -6.845 566 HD13 ILE 71 HD13 ILE 71 7.516 -6.820 -7.498 567 H ARG 72 HN ARG 72 7.556 -9.868 -1.966 568 HA ARG 72 HA ARG 72 5.064 -9.879 -0.406 569 HB2 ARG 72 HB2 ARG 72 7.337 -11.817 -0.532 570 HB3 ARG 72 HB1 ARG 72 6.455 -11.638 0.978 571 HG2 ARG 72 HG2 ARG 72 5.121 -12.244 -1.644 572 HG3 ARG 72 HG1 ARG 72 5.665 -13.482 -0.510 573 HD2 ARG 72 HD2 ARG 72 4.153 -12.760 1.159 574 HD3 ARG 72 HD1 ARG 72 3.822 -11.253 0.312 575 HE ARG 72 HE ARG 72 2.379 -12.383 -1.135 576 HH11 ARG 72 HH11 ARG 72 3.955 -14.624 1.065 577 HH12 ARG 72 HH12 ARG 72 2.830 -15.902 0.754 578 HH21 ARG 72 HH21 ARG 72 0.901 -14.056 -1.510 579 HH22 ARG 72 HH22 ARG 72 1.097 -15.583 -0.702 580 H GLU 3 HN GLU 3 -3.871 8.378 11.352 581 HA GLU 3 HA GLU 3 -1.564 6.923 12.452 582 HB2 GLU 3 HB2 GLU 3 -3.041 6.147 14.214 583 HB3 GLU 3 HB1 GLU 3 -3.139 7.896 14.100 584 HG2 GLU 3 HG2 GLU 3 -5.160 5.951 12.997 585 HG3 GLU 3 HG1 GLU 3 -5.321 6.865 14.494 586 H ALA 4 HN ALA 4 -4.695 6.495 10.874 587 HA ALA 4 HA ALA 4 -4.420 3.659 10.603 588 HB1 ALA 4 HB1 ALA 4 -6.256 5.558 9.139 589 HB2 ALA 4 HB2 ALA 4 -6.615 4.761 10.671 590 HB3 ALA 4 HB3 ALA 4 -6.408 3.804 9.204 591 H LEU 5 HN LEU 5 -4.004 6.416 8.408 592 HA LEU 5 HA LEU 5 -3.344 4.903 6.109 593 HB2 LEU 5 HB2 LEU 5 -3.010 7.756 6.931 594 HB3 LEU 5 HB1 LEU 5 -2.179 7.182 5.499 595 HG LEU 5 HG LEU 5 -4.409 6.459 4.586 596 HD11 LEU 5 HD11 LEU 5 -6.428 7.315 5.562 597 HD12 LEU 5 HD12 LEU 5 -5.520 8.126 6.837 598 HD13 LEU 5 HD13 LEU 5 -5.573 6.364 6.780 599 HD21 LEU 5 HD21 LEU 5 -3.771 9.330 5.177 600 HD22 LEU 5 HD22 LEU 5 -5.177 8.882 4.216 601 HD23 LEU 5 HD23 LEU 5 -3.560 8.433 3.674 602 H LYS 6 HN LYS 6 -1.586 5.709 8.911 603 HA LYS 6 HA LYS 6 1.053 5.725 7.925 604 HB2 LYS 6 HB2 LYS 6 0.688 6.605 10.086 605 HB3 LYS 6 HB1 LYS 6 -0.153 5.158 10.623 606 HG2 LYS 6 HG2 LYS 6 2.005 3.930 10.472 607 HG3 LYS 6 HG1 LYS 6 2.796 5.464 10.095 608 HD2 LYS 6 HD2 LYS 6 2.551 6.269 12.215 609 HD3 LYS 6 HD1 LYS 6 1.069 5.363 12.512 610 HE2 LYS 6 HE2 LYS 6 3.776 4.071 12.294 611 HE3 LYS 6 HE1 LYS 6 3.098 4.637 13.821 612 HZ1 LYS 6 HZ1 LYS 6 1.202 3.152 13.443 613 HZ2 LYS 6 HZ2 LYS 6 2.661 2.303 13.533 614 HZ3 LYS 6 HZ3 LYS 6 1.936 2.576 12.035 615 H ILE 7 HN ILE 7 -1.020 3.091 9.079 616 HA ILE 7 HA ILE 7 1.116 1.183 8.438 617 HB ILE 7 HB ILE 7 -0.491 -0.493 9.550 618 HG12 ILE 7 HG12 ILE 7 -1.662 1.251 11.401 619 HG13 ILE 7 HG11 ILE 7 -1.987 1.978 9.832 620 HG21 ILE 7 HG21 ILE 7 0.361 0.045 11.762 621 HG22 ILE 7 HG22 ILE 7 0.770 1.670 11.221 622 HG23 ILE 7 HG23 ILE 7 1.611 0.281 10.539 623 HD11 ILE 7 HD11 ILE 7 -3.786 0.502 10.551 624 HD12 ILE 7 HD12 ILE 7 -2.651 -0.850 10.619 625 HD13 ILE 7 HD13 ILE 7 -3.017 -0.079 9.074 626 H LEU 8 HN LEU 8 -1.664 2.472 7.103 627 HA LEU 8 HA LEU 8 -2.504 0.076 5.717 628 HB2 LEU 8 HB2 LEU 8 -3.675 2.549 6.383 629 HB3 LEU 8 HB1 LEU 8 -3.623 2.490 4.632 630 HG LEU 8 HG LEU 8 -4.642 0.038 5.905 631 HD11 LEU 8 HD11 LEU 8 -5.613 1.642 7.432 632 HD12 LEU 8 HD12 LEU 8 -6.860 1.042 6.338 633 HD13 LEU 8 HD13 LEU 8 -6.158 2.640 6.087 634 HD21 LEU 8 HD21 LEU 8 -4.592 0.522 3.454 635 HD22 LEU 8 HD22 LEU 8 -5.778 1.803 3.733 636 HD23 LEU 8 HD23 LEU 8 -6.197 0.121 4.080 637 H ASN 9 HN ASN 9 -0.115 2.387 5.243 638 HA ASN 9 HA ASN 9 -0.216 2.146 2.326 639 HB2 ASN 9 HB2 ASN 9 0.073 4.394 3.538 640 HB3 ASN 9 HB1 ASN 9 1.714 3.856 3.884 641 HD21 ASN 9 HD21 ASN 9 2.123 5.872 2.639 642 HD22 ASN 9 HD22 ASN 9 2.264 5.733 0.920 643 H ASN 10 HN ASN 10 0.613 -0.030 4.157 644 HA ASN 10 HA ASN 10 3.171 -0.591 2.860 645 HB2 ASN 10 HB2 ASN 10 3.653 0.258 5.163 646 HB3 ASN 10 HB1 ASN 10 2.726 -1.091 5.809 647 HD21 ASN 10 HD21 ASN 10 4.916 -1.148 3.025 648 HD22 ASN 10 HD22 ASN 10 6.063 -2.224 3.742 649 H ILE 11 HN ILE 11 3.164 -2.521 1.933 650 HA ILE 11 HA ILE 11 0.924 -4.226 2.036 651 HB ILE 11 HB ILE 11 2.458 -5.884 0.860 652 HG12 ILE 11 HG12 ILE 11 4.316 -3.497 0.912 653 HG13 ILE 11 HG11 ILE 11 4.576 -5.002 1.786 654 HG21 ILE 11 HG21 ILE 11 0.957 -4.555 -0.405 655 HG22 ILE 11 HG22 ILE 11 2.523 -4.465 -1.210 656 HG23 ILE 11 HG23 ILE 11 1.964 -3.122 -0.217 657 HD11 ILE 11 HD11 ILE 11 5.917 -4.949 -0.213 658 HD12 ILE 11 HD12 ILE 11 4.483 -4.658 -1.196 659 HD13 ILE 11 HD13 ILE 11 4.678 -6.196 -0.357 660 H ARG 12 HN ARG 12 3.816 -4.135 3.935 661 HA ARG 12 HA ARG 12 3.802 -6.819 4.819 662 HB2 ARG 12 HB2 ARG 12 4.981 -4.327 6.053 663 HB3 ARG 12 HB1 ARG 12 5.245 -5.952 6.679 664 HG2 ARG 12 HG2 ARG 12 5.885 -5.219 3.842 665 HG3 ARG 12 HG1 ARG 12 7.034 -4.971 5.158 666 HD2 ARG 12 HD2 ARG 12 7.209 -7.270 5.584 667 HD3 ARG 12 HD1 ARG 12 5.730 -7.633 4.707 668 HE ARG 12 HE ARG 12 6.908 -7.655 2.733 669 HH11 ARG 12 HH11 ARG 12 8.962 -6.381 5.292 670 HH12 ARG 12 HH12 ARG 12 10.419 -6.469 4.337 671 HH21 ARG 12 HH21 ARG 12 8.801 -7.793 1.498 672 HH22 ARG 12 HH22 ARG 12 10.314 -7.253 2.173 673 H THR 13 HN THR 13 2.649 -3.838 6.404 674 HA THR 13 HA THR 13 1.473 -5.218 8.600 675 HB THR 13 HB THR 13 0.204 -2.859 8.675 676 HG1 THR 13 HG1 THR 13 0.902 -1.590 7.135 677 HG21 THR 13 HG21 THR 13 1.998 -2.039 10.062 678 HG22 THR 13 HG22 THR 13 3.154 -3.113 9.275 679 HG23 THR 13 HG23 THR 13 1.881 -3.783 10.292 680 H LEU 14 HN LEU 14 0.228 -3.955 5.549 681 HA LEU 14 HA LEU 14 -2.502 -4.256 6.066 682 HB2 LEU 14 HB2 LEU 14 -1.375 -3.068 4.127 683 HB3 LEU 14 HB1 LEU 14 -1.219 -4.644 3.376 684 HG LEU 14 HG LEU 14 -3.633 -4.890 3.282 685 HD11 LEU 14 HD11 LEU 14 -3.660 -2.265 4.756 686 HD12 LEU 14 HD12 LEU 14 -4.325 -3.810 5.289 687 HD13 LEU 14 HD13 LEU 14 -5.069 -2.947 3.946 688 HD21 LEU 14 HD21 LEU 14 -2.859 -2.145 2.303 689 HD22 LEU 14 HD22 LEU 14 -4.119 -3.198 1.658 690 HD23 LEU 14 HD23 LEU 14 -2.423 -3.651 1.496 691 H ARG 15 HN ARG 15 -0.158 -6.574 4.735 692 HA ARG 15 HA ARG 15 -2.132 -8.566 4.212 693 HB2 ARG 15 HB2 ARG 15 0.857 -8.531 4.226 694 HB3 ARG 15 HB1 ARG 15 0.003 -10.067 4.154 695 HG2 ARG 15 HG2 ARG 15 -1.250 -9.124 2.172 696 HG3 ARG 15 HG1 ARG 15 -0.075 -7.806 2.181 697 HD2 ARG 15 HD2 ARG 15 0.909 -10.619 2.204 698 HD3 ARG 15 HD1 ARG 15 0.282 -9.951 0.699 699 HE ARG 15 HE ARG 15 2.510 -8.736 2.211 700 HH11 ARG 15 HH11 ARG 15 1.001 -9.713 -0.817 701 HH12 ARG 15 HH12 ARG 15 2.289 -9.066 -1.795 702 HH21 ARG 15 HH21 ARG 15 4.214 -7.925 0.887 703 HH22 ARG 15 HH22 ARG 15 4.087 -8.064 -0.839 704 H ALA 16 HN ALA 16 -0.706 -7.489 7.076 705 HA ALA 16 HA ALA 16 -1.007 -10.070 8.421 706 HB1 ALA 16 HB1 ALA 16 -0.078 -8.809 10.393 707 HB2 ALA 16 HB2 ALA 16 0.145 -7.435 9.311 708 HB3 ALA 16 HB3 ALA 16 1.000 -8.944 9.005 709 H GLN 17 HN GLN 17 -2.257 -6.778 8.509 710 HA GLN 17 HA GLN 17 -4.090 -7.244 10.630 711 HB2 GLN 17 HB2 GLN 17 -3.101 -5.016 9.655 712 HB3 GLN 17 HB1 GLN 17 -4.493 -5.092 8.587 713 HG2 GLN 17 HG2 GLN 17 -5.056 -3.709 10.432 714 HG3 GLN 17 HG1 GLN 17 -5.946 -5.222 10.606 715 HE21 GLN 17 HE21 GLN 17 -5.457 -6.599 12.286 716 HE22 GLN 17 HE22 GLN 17 -4.413 -6.156 13.589 717 H ALA 18 HN ALA 18 -4.253 -7.601 7.149 718 HA ALA 18 HA ALA 18 -7.111 -7.776 7.043 719 HB1 ALA 18 HB1 ALA 18 -5.203 -8.783 4.953 720 HB2 ALA 18 HB2 ALA 18 -5.596 -7.077 5.145 721 HB3 ALA 18 HB3 ALA 18 -6.865 -8.233 4.740 722 H ARG 19 HN ARG 19 -4.962 -9.859 8.392 723 HA ARG 19 HA ARG 19 -5.941 -12.334 7.317 724 HB2 ARG 19 HB2 ARG 19 -4.294 -11.739 9.776 725 HB3 ARG 19 HB1 ARG 19 -4.702 -13.361 9.241 726 HG2 ARG 19 HG2 ARG 19 -2.955 -11.342 7.866 727 HG3 ARG 19 HG1 ARG 19 -2.500 -12.919 8.506 728 HD2 ARG 19 HD2 ARG 19 -4.199 -12.322 6.089 729 HD3 ARG 19 HD1 ARG 19 -2.622 -13.105 6.132 730 HE ARG 19 HE ARG 19 -4.616 -14.522 7.627 731 HH11 ARG 19 HH11 ARG 19 -3.257 -14.051 4.424 732 HH12 ARG 19 HH12 ARG 19 -3.849 -15.576 3.824 733 HH21 ARG 19 HH21 ARG 19 -5.400 -16.493 6.822 734 HH22 ARG 19 HH22 ARG 19 -5.068 -16.943 5.177 735 H GLU 20 HN GLU 20 -7.109 -10.119 9.618 736 HA GLU 20 HA GLU 20 -8.639 -12.119 11.072 737 HB2 GLU 20 HB2 GLU 20 -9.376 -10.299 12.491 738 HB3 GLU 20 HB1 GLU 20 -7.631 -10.217 12.292 739 HG2 GLU 20 HG2 GLU 20 -7.979 -8.476 10.546 740 HG3 GLU 20 HG1 GLU 20 -9.698 -8.488 10.951 741 H CYS 21 H CYS 21 -8.969 -10.923 8.133 742 HA CYS 21 HA CYS 21 -11.936 -10.816 8.312 743 HB2 CYS 21 3HB CYS 21 -10.983 -8.552 7.764 744 HB3 CYS 21 2HB CYS 21 -10.059 -9.227 6.415 745 HG CYS 21 HG CYS 21 -11.789 -9.275 4.784 746 H THR 22 HN THR 22 -13.062 -12.055 6.965 747 HA THR 22 HA THR 22 -11.711 -14.184 5.633 748 HB THR 22 HB THR 22 -14.577 -13.677 5.041 749 HG1 THR 22 HG1 THR 22 -15.129 -13.495 7.066 750 HG21 THR 22 HG21 THR 22 -13.304 -15.757 4.419 751 HG22 THR 22 HG22 THR 22 -14.777 -16.031 5.346 752 HG23 THR 22 HG23 THR 22 -13.207 -16.127 6.142 753 H LEU 23 HN LEU 23 -12.256 -14.734 3.299 754 HA LEU 23 HA LEU 23 -11.330 -12.772 1.572 755 HB2 LEU 23 HB2 LEU 23 -11.293 -15.179 1.080 756 HB3 LEU 23 HB1 LEU 23 -13.037 -15.171 0.908 757 HG LEU 23 HG LEU 23 -12.799 -13.628 -1.028 758 HD11 LEU 23 HD11 LEU 23 -9.860 -14.248 -0.862 759 HD12 LEU 23 HD12 LEU 23 -10.573 -12.734 -0.307 760 HD13 LEU 23 HD13 LEU 23 -10.680 -13.187 -2.008 761 HD21 LEU 23 HD21 LEU 23 -12.084 -15.320 -2.586 762 HD22 LEU 23 HD22 LEU 23 -12.995 -16.080 -1.282 763 HD23 LEU 23 HD23 LEU 23 -11.237 -16.192 -1.307 764 H GLU 24 HN GLU 24 -14.644 -13.701 2.354 765 HA GLU 24 HA GLU 24 -16.021 -12.191 0.471 766 HB2 GLU 24 HB2 GLU 24 -16.654 -13.707 2.777 767 HB3 GLU 24 HB1 GLU 24 -17.440 -12.143 2.957 768 HG2 GLU 24 HG2 GLU 24 -19.005 -13.497 1.865 769 HG3 GLU 24 HG1 GLU 24 -18.315 -12.471 0.608 770 H THR 25 HN THR 25 -15.113 -11.301 3.789 771 HA THR 25 HA THR 25 -16.160 -8.700 3.722 772 HB THR 25 HB THR 25 -13.867 -8.867 5.461 773 HG1 THR 25 HG1 THR 25 -15.714 -10.914 6.057 774 HG21 THR 25 HG21 THR 25 -15.742 -7.466 5.971 775 HG22 THR 25 HG22 THR 25 -15.687 -8.729 7.197 776 HG23 THR 25 HG23 THR 25 -16.860 -8.825 5.884 777 H LEU 26 HN LEU 26 -13.013 -10.003 2.805 778 HA LEU 26 HA LEU 26 -11.757 -7.471 2.497 779 HB2 LEU 26 HB2 LEU 26 -11.082 -10.217 1.468 780 HB3 LEU 26 HB1 LEU 26 -10.079 -8.816 1.142 781 HG LEU 26 HG LEU 26 -10.719 -9.926 3.879 782 HD11 LEU 26 HD11 LEU 26 -8.159 -9.948 2.294 783 HD12 LEU 26 HD12 LEU 26 -9.202 -11.339 2.591 784 HD13 LEU 26 HD13 LEU 26 -8.371 -10.554 3.936 785 HD21 LEU 26 HD21 LEU 26 -8.976 -8.316 4.629 786 HD22 LEU 26 HD22 LEU 26 -10.455 -7.554 4.045 787 HD23 LEU 26 HD23 LEU 26 -9.018 -7.589 3.022 788 H GLU 27 HN GLU 27 -13.327 -9.692 0.207 789 HA GLU 27 HA GLU 27 -12.832 -8.100 -2.087 790 HB2 GLU 27 HB2 GLU 27 -14.964 -10.166 -1.523 791 HB3 GLU 27 HB1 GLU 27 -14.740 -9.405 -3.090 792 HG2 GLU 27 HG2 GLU 27 -12.449 -10.312 -3.169 793 HG3 GLU 27 HG1 GLU 27 -12.755 -11.146 -1.646 794 H GLU 28 HN GLU 28 -15.365 -8.212 0.299 795 HA GLU 28 HA GLU 28 -17.274 -6.562 -0.905 796 HB2 GLU 28 HB2 GLU 28 -17.109 -8.015 1.385 797 HB3 GLU 28 HB1 GLU 28 -16.960 -6.388 2.027 798 HG2 GLU 28 HG2 GLU 28 -19.151 -6.891 0.108 799 HG3 GLU 28 HG1 GLU 28 -19.294 -7.599 1.716 800 H MET 29 HN MET 29 -14.596 -5.776 1.313 801 HA MET 29 HA MET 29 -15.214 -2.974 1.282 802 HB2 MET 29 HB2 MET 29 -13.183 -2.692 2.606 803 HB3 MET 29 HB1 MET 29 -14.197 -3.973 3.253 804 HG2 MET 29 HG2 MET 29 -12.235 -5.055 3.374 805 HG3 MET 29 HG1 MET 29 -12.595 -5.431 1.691 806 HE1 MET 29 HE1 MET 29 -11.232 -2.049 3.414 807 HE2 MET 29 HE2 MET 29 -9.509 -2.372 3.209 808 HE3 MET 29 HE3 MET 29 -10.494 -3.441 4.207 809 H LEU 30 HN LEU 30 -13.261 -5.058 -0.661 810 HA LEU 30 HA LEU 30 -11.406 -3.207 -1.645 811 HB2 LEU 30 HB2 LEU 30 -11.191 -5.607 -2.015 812 HB3 LEU 30 HB1 LEU 30 -12.622 -5.599 -3.030 813 HG LEU 30 HG LEU 30 -11.438 -4.133 -4.644 814 HD11 LEU 30 HD11 LEU 30 -9.082 -4.588 -2.824 815 HD12 LEU 30 HD12 LEU 30 -9.897 -3.053 -3.123 816 HD13 LEU 30 HD13 LEU 30 -9.013 -3.849 -4.423 817 HD21 LEU 30 HD21 LEU 30 -11.311 -6.295 -5.363 818 HD22 LEU 30 HD22 LEU 30 -10.457 -6.840 -3.920 819 HD23 LEU 30 HD23 LEU 30 -9.596 -5.935 -5.165 820 H GLU 31 HN GLU 31 -14.543 -4.205 -3.006 821 HA GLU 31 HA GLU 31 -14.476 -2.422 -5.186 822 HB2 GLU 31 HB2 GLU 31 -16.774 -3.780 -3.783 823 HB3 GLU 31 HB1 GLU 31 -16.980 -2.796 -5.226 824 HG2 GLU 31 HG2 GLU 31 -15.103 -4.395 -6.161 825 HG3 GLU 31 HG1 GLU 31 -15.724 -5.466 -4.908 826 H LYS 32 HN LYS 32 -15.333 -1.997 -1.846 827 HA LYS 32 HA LYS 32 -16.859 0.365 -2.100 828 HB2 LYS 32 HB2 LYS 32 -15.188 -0.676 0.190 829 HB3 LYS 32 HB1 LYS 32 -16.174 0.774 0.296 830 HG2 LYS 32 HG2 LYS 32 -18.130 -0.699 -0.381 831 HG3 LYS 32 HG1 LYS 32 -17.066 -2.067 -0.043 832 HD2 LYS 32 HD2 LYS 32 -16.665 -0.835 2.214 833 HD3 LYS 32 HD1 LYS 32 -18.177 -0.014 1.821 834 HE2 LYS 32 HE2 LYS 32 -17.824 -3.005 1.946 835 HE3 LYS 32 HE1 LYS 32 -18.481 -2.016 3.247 836 HZ1 LYS 32 HZ1 LYS 32 -20.454 -1.979 2.269 837 HZ2 LYS 32 HZ2 LYS 32 -19.889 -3.167 1.204 838 HZ3 LYS 32 HZ3 LYS 32 -19.809 -1.529 0.771 839 H LEU 33 HN LEU 33 -13.382 -0.168 -1.550 840 HA LEU 33 HA LEU 33 -12.808 2.643 -1.546 841 HB2 LEU 33 HB2 LEU 33 -11.421 0.925 -0.367 842 HB3 LEU 33 HB1 LEU 33 -10.882 0.352 -1.935 843 HG LEU 33 HG LEU 33 -9.926 2.609 -2.383 844 HD11 LEU 33 HD11 LEU 33 -11.221 4.014 -0.980 845 HD12 LEU 33 HD12 LEU 33 -9.571 4.058 -0.358 846 HD13 LEU 33 HD13 LEU 33 -10.796 3.086 0.455 847 HD21 LEU 33 HD21 LEU 33 -8.007 2.361 -0.871 848 HD22 LEU 33 HD22 LEU 33 -8.504 0.821 -1.576 849 HD23 LEU 33 HD23 LEU 33 -8.930 1.204 0.092 850 H GLU 34 HN GLU 34 -12.843 0.078 -3.919 851 HA GLU 34 HA GLU 34 -11.381 1.272 -5.962 852 HB2 GLU 34 HB2 GLU 34 -12.186 -1.086 -5.970 853 HB3 GLU 34 HB1 GLU 34 -13.810 -0.498 -6.298 854 HG2 GLU 34 HG2 GLU 34 -12.974 0.534 -8.380 855 HG3 GLU 34 HG1 GLU 34 -11.399 -0.191 -8.073 856 H VAL 35 HN VAL 35 -14.882 1.509 -5.275 857 HA VAL 35 HA VAL 35 -15.412 3.227 -7.461 858 HB VAL 35 HB VAL 35 -17.558 3.722 -6.412 859 HG11 VAL 35 HG11 VAL 35 -16.909 0.798 -6.129 860 HG12 VAL 35 HG12 VAL 35 -17.181 1.615 -7.665 861 HG13 VAL 35 HG13 VAL 35 -18.476 1.523 -6.476 862 HG21 VAL 35 HG21 VAL 35 -16.585 2.101 -4.066 863 HG22 VAL 35 HG22 VAL 35 -18.191 2.798 -4.275 864 HG23 VAL 35 HG23 VAL 35 -16.791 3.853 -4.079 865 H VAL 36 HN VAL 36 -14.390 3.819 -4.156 866 HA VAL 36 HA VAL 36 -14.873 6.601 -4.102 867 HB VAL 36 HB VAL 36 -12.824 4.962 -2.600 868 HG11 VAL 36 HG11 VAL 36 -13.683 7.814 -2.104 869 HG12 VAL 36 HG12 VAL 36 -12.119 7.312 -2.749 870 HG13 VAL 36 HG13 VAL 36 -12.583 6.868 -1.106 871 HG21 VAL 36 HG21 VAL 36 -14.368 5.149 -0.748 872 HG22 VAL 36 HG22 VAL 36 -15.174 4.428 -2.139 873 HG23 VAL 36 HG23 VAL 36 -15.465 6.117 -1.726 874 H VAL 37 HN VAL 37 -11.883 4.765 -4.774 875 HA VAL 37 HA VAL 37 -10.341 7.011 -5.491 876 HB VAL 37 HB VAL 37 -9.983 4.163 -6.451 877 HG11 VAL 37 HG11 VAL 37 -8.100 6.509 -6.352 878 HG12 VAL 37 HG12 VAL 37 -8.644 5.617 -7.772 879 HG13 VAL 37 HG13 VAL 37 -7.580 4.841 -6.602 880 HG21 VAL 37 HG21 VAL 37 -8.427 3.921 -4.569 881 HG22 VAL 37 HG22 VAL 37 -10.071 4.250 -4.024 882 HG23 VAL 37 HG23 VAL 37 -8.866 5.538 -4.009 883 H ASN 38 HN ASN 38 -12.470 4.903 -7.316 884 HA ASN 38 HA ASN 38 -11.867 5.754 -9.921 885 HB2 ASN 38 HB2 ASN 38 -13.267 3.810 -9.550 886 HB3 ASN 38 HB1 ASN 38 -14.470 4.791 -8.717 887 HD21 ASN 38 HD21 ASN 38 -16.173 4.439 -10.044 888 HD22 ASN 38 HD22 ASN 38 -16.235 4.941 -11.696 889 H GLU 39 HN GLU 39 -14.380 6.894 -7.671 890 HA GLU 39 HA GLU 39 -15.381 8.970 -9.268 891 HB2 GLU 39 HB2 GLU 39 -15.296 8.651 -6.269 892 HB3 GLU 39 HB1 GLU 39 -16.172 9.943 -7.084 893 HG2 GLU 39 HG2 GLU 39 -17.554 8.301 -8.229 894 HG3 GLU 39 HG1 GLU 39 -16.655 6.995 -7.457 895 H ARG 40 HN ARG 40 -12.893 9.015 -6.743 896 HA ARG 40 HA ARG 40 -12.302 11.747 -6.847 897 HB2 ARG 40 HB2 ARG 40 -10.738 9.315 -6.044 898 HB3 ARG 40 HB1 ARG 40 -9.944 10.881 -6.106 899 HG2 ARG 40 HG2 ARG 40 -12.450 10.391 -4.531 900 HG3 ARG 40 HG1 ARG 40 -10.831 10.169 -3.863 901 HD2 ARG 40 HD2 ARG 40 -11.976 12.721 -4.999 902 HD3 ARG 40 HD1 ARG 40 -11.686 12.373 -3.293 903 HE ARG 40 HE ARG 40 -9.646 12.897 -5.351 904 HH11 ARG 40 HH11 ARG 40 -10.452 12.316 -1.991 905 HH12 ARG 40 HH12 ARG 40 -8.907 12.835 -1.403 906 HH21 ARG 40 HH21 ARG 40 -7.649 13.599 -4.594 907 HH22 ARG 40 HH22 ARG 40 -7.317 13.596 -2.880 908 H ARG 41 HN ARG 41 -11.064 9.023 -8.720 909 HA ARG 41 HA ARG 41 -9.068 10.346 -10.163 910 HB2 ARG 41 HB2 ARG 41 -10.741 7.918 -10.640 911 HB3 ARG 41 HB1 ARG 41 -9.818 8.567 -11.988 912 HG2 ARG 41 HG2 ARG 41 -7.767 8.371 -10.627 913 HG3 ARG 41 HG1 ARG 41 -8.732 7.630 -9.346 914 HD2 ARG 41 HD2 ARG 41 -9.239 5.755 -10.677 915 HD3 ARG 41 HD1 ARG 41 -8.659 6.544 -12.145 916 HE ARG 41 HE ARG 41 -6.540 6.357 -10.301 917 HH11 ARG 41 HH11 ARG 41 -8.522 4.332 -12.354 918 HH12 ARG 41 HH12 ARG 41 -7.282 3.141 -12.585 919 HH21 ARG 41 HH21 ARG 41 -4.917 4.797 -10.595 920 HH22 ARG 41 HH22 ARG 41 -5.241 3.394 -11.578 921 H GLU 42 HN GLU 42 -12.459 9.729 -11.033 922 HA GLU 42 HA GLU 42 -12.476 11.093 -13.465 923 HB2 GLU 42 HB2 GLU 42 -14.260 9.573 -12.315 924 HB3 GLU 42 HB1 GLU 42 -14.877 11.092 -11.677 925 HG2 GLU 42 HG2 GLU 42 -16.113 10.683 -13.618 926 HG3 GLU 42 HG1 GLU 42 -14.934 11.914 -14.068 927 H GLU 43 HN GLU 43 -13.292 12.260 -10.217 928 HA GLU 43 HA GLU 43 -14.058 14.856 -10.937 929 HB2 GLU 43 HB2 GLU 43 -12.905 13.733 -8.391 930 HB3 GLU 43 HB1 GLU 43 -13.426 15.404 -8.537 931 HG2 GLU 43 HG2 GLU 43 -15.683 14.704 -9.015 932 HG3 GLU 43 HG1 GLU 43 -15.189 13.013 -9.009 933 H GLU 44 HN GLU 44 -10.868 13.597 -9.979 934 HA GLU 44 HA GLU 44 -9.645 16.185 -10.338 935 HB2 GLU 44 HB2 GLU 44 -8.484 13.477 -9.670 936 HB3 GLU 44 HB1 GLU 44 -7.521 14.944 -9.822 937 HG2 GLU 44 HG2 GLU 44 -8.821 15.992 -8.048 938 HG3 GLU 44 HG1 GLU 44 -9.797 14.539 -7.889 939 H SER 45 HN SER 45 -10.792 14.186 -12.545 940 HA SER 45 HA SER 45 -8.583 14.689 -14.425 941 HB2 SER 45 HB2 SER 45 -10.718 12.542 -14.543 942 HB3 SER 45 HB1 SER 45 -9.519 12.844 -15.802 943 HG SER 45 HG SER 45 -9.159 11.830 -13.193 944 H ALA 46 HN ALA 46 -11.975 15.037 -13.763 945 HA ALA 46 HA ALA 46 -12.679 16.091 -16.327 946 HB1 ALA 46 HB1 ALA 46 -14.373 15.015 -15.021 947 HB2 ALA 46 HB2 ALA 46 -14.801 16.721 -15.182 948 HB3 ALA 46 HB3 ALA 46 -14.104 16.123 -13.674 949 H GLU 3 HN GLU 3 -9.730 -1.717 14.718 950 HA GLU 3 HA GLU 3 -12.339 -0.477 14.492 951 HB2 GLU 3 HB2 GLU 3 -10.486 1.546 14.884 952 HB3 GLU 3 HB1 GLU 3 -11.418 0.742 16.137 953 HG2 GLU 3 HG2 GLU 3 -9.157 0.734 16.830 954 HG3 GLU 3 HG1 GLU 3 -9.553 -0.913 16.347 955 H ALA 4 HN ALA 4 -9.163 -0.245 12.918 956 HA ALA 4 HA ALA 4 -9.851 1.753 11.057 957 HB1 ALA 4 HB1 ALA 4 -7.756 -0.411 10.941 958 HB2 ALA 4 HB2 ALA 4 -7.548 1.260 11.471 959 HB3 ALA 4 HB3 ALA 4 -7.881 0.909 9.773 960 H LEU 5 HN LEU 5 -10.064 -1.756 10.934 961 HA LEU 5 HA LEU 5 -10.971 -1.799 8.205 962 HB2 LEU 5 HB2 LEU 5 -10.682 -3.865 10.361 963 HB3 LEU 5 HB1 LEU 5 -11.543 -4.238 8.883 964 HG LEU 5 HG LEU 5 -9.385 -5.058 8.528 965 HD11 LEU 5 HD11 LEU 5 -10.295 -3.528 6.724 966 HD12 LEU 5 HD12 LEU 5 -8.561 -3.857 6.682 967 HD13 LEU 5 HD13 LEU 5 -9.153 -2.324 7.318 968 HD21 LEU 5 HD21 LEU 5 -7.338 -3.825 8.990 969 HD22 LEU 5 HD22 LEU 5 -8.309 -4.019 10.448 970 HD23 LEU 5 HD23 LEU 5 -8.287 -2.472 9.603 971 H LYS 6 HN LYS 6 -12.418 -0.883 11.022 972 HA LYS 6 HA LYS 6 -15.027 -2.035 10.514 973 HB2 LYS 6 HB2 LYS 6 -14.146 -1.643 12.830 974 HB3 LYS 6 HB1 LYS 6 -14.235 0.085 12.523 975 HG2 LYS 6 HG2 LYS 6 -16.145 -0.558 13.786 976 HG3 LYS 6 HG1 LYS 6 -16.678 -0.174 12.150 977 HD2 LYS 6 HD2 LYS 6 -16.826 -2.501 11.589 978 HD3 LYS 6 HD1 LYS 6 -16.101 -2.963 13.128 979 HE2 LYS 6 HE2 LYS 6 -18.711 -1.486 12.863 980 HE3 LYS 6 HE1 LYS 6 -18.577 -3.234 13.024 981 HZ1 LYS 6 HZ1 LYS 6 -17.480 -2.902 15.162 982 HZ2 LYS 6 HZ2 LYS 6 -19.022 -2.205 15.149 983 HZ3 LYS 6 HZ3 LYS 6 -17.653 -1.225 15.008 984 H ILE 7 HN ILE 7 -13.629 1.233 10.654 985 HA ILE 7 HA ILE 7 -15.918 2.516 9.584 986 HB ILE 7 HB ILE 7 -14.264 4.419 9.141 987 HG12 ILE 7 HG12 ILE 7 -12.453 2.584 10.733 988 HG13 ILE 7 HG11 ILE 7 -12.244 2.991 9.036 989 HG21 ILE 7 HG21 ILE 7 -14.654 3.294 11.915 990 HG22 ILE 7 HG22 ILE 7 -15.717 4.413 11.056 991 HG23 ILE 7 HG23 ILE 7 -14.113 4.938 11.568 992 HD11 ILE 7 HD11 ILE 7 -12.082 4.890 11.363 993 HD12 ILE 7 HD12 ILE 7 -11.944 5.347 9.668 994 HD13 ILE 7 HD13 ILE 7 -10.740 4.285 10.395 995 H LEU 8 HN LEU 8 -13.222 0.907 8.119 996 HA LEU 8 HA LEU 8 -13.458 2.137 5.557 997 HB2 LEU 8 HB2 LEU 8 -11.852 0.030 6.778 998 HB3 LEU 8 HB1 LEU 8 -12.260 -0.304 5.107 999 HG LEU 8 HG LEU 8 -11.336 1.978 4.530 1000 HD11 LEU 8 HD11 LEU 8 -10.267 1.812 7.343 1001 HD12 LEU 8 HD12 LEU 8 -11.434 2.993 6.740 1002 HD13 LEU 8 HD13 LEU 8 -9.781 2.993 6.123 1003 HD21 LEU 8 HD21 LEU 8 -9.514 -0.109 5.710 1004 HD22 LEU 8 HD22 LEU 8 -8.976 1.228 4.692 1005 HD23 LEU 8 HD23 LEU 8 -10.070 0.007 4.040 1006 H ASN 9 HN ASN 9 -15.391 -0.110 7.163 1007 HA ASN 9 HA ASN 9 -16.266 -1.457 4.730 1008 HB2 ASN 9 HB2 ASN 9 -16.054 -2.597 7.028 1009 HB3 ASN 9 HB1 ASN 9 -17.532 -1.743 7.457 1010 HD21 ASN 9 HD21 ASN 9 -16.472 -3.373 4.487 1011 HD22 ASN 9 HD22 ASN 9 -17.829 -4.446 4.382 1012 H ASN 10 HN ASN 10 -16.729 1.486 5.943 1013 HA ASN 10 HA ASN 10 -19.542 1.611 5.079 1014 HB2 ASN 10 HB2 ASN 10 -19.149 2.135 7.508 1015 HB3 ASN 10 HB1 ASN 10 -18.180 3.511 6.996 1016 HD21 ASN 10 HD21 ASN 10 -20.319 3.885 8.617 1017 HD22 ASN 10 HD22 ASN 10 -21.586 4.693 7.755 1018 H ILE 11 HN ILE 11 -19.814 2.609 3.222 1019 HA ILE 11 HA ILE 11 -17.737 3.895 1.827 1020 HB ILE 11 HB ILE 11 -19.617 2.748 0.719 1021 HG12 ILE 11 HG12 ILE 11 -20.045 4.474 -1.046 1022 HG13 ILE 11 HG11 ILE 11 -19.269 5.664 -0.003 1023 HG21 ILE 11 HG21 ILE 11 -21.805 3.657 0.579 1024 HG22 ILE 11 HG22 ILE 11 -21.310 5.141 1.396 1025 HG23 ILE 11 HG23 ILE 11 -21.370 3.621 2.289 1026 HD11 ILE 11 HD11 ILE 11 -17.846 4.680 -1.830 1027 HD12 ILE 11 HD12 ILE 11 -17.883 3.165 -0.929 1028 HD13 ILE 11 HD13 ILE 11 -17.172 4.605 -0.204 1029 H ARG 12 HN ARG 12 -20.187 5.127 3.990 1030 HA ARG 12 HA ARG 12 -20.114 7.826 3.153 1031 HB2 ARG 12 HB2 ARG 12 -20.752 6.740 5.901 1032 HB3 ARG 12 HB1 ARG 12 -21.165 8.339 5.297 1033 HG2 ARG 12 HG2 ARG 12 -22.166 5.778 4.084 1034 HG3 ARG 12 HG1 ARG 12 -23.043 6.705 5.299 1035 HD2 ARG 12 HD2 ARG 12 -23.108 8.628 3.809 1036 HD3 ARG 12 HD1 ARG 12 -22.198 7.731 2.592 1037 HE ARG 12 HE ARG 12 -24.510 6.287 3.317 1038 HH11 ARG 12 HH11 ARG 12 -23.567 9.155 1.541 1039 HH12 ARG 12 HH12 ARG 12 -24.919 9.078 0.456 1040 HH21 ARG 12 HH21 ARG 12 -26.288 6.192 1.889 1041 HH22 ARG 12 HH22 ARG 12 -26.454 7.398 0.652 1042 H THR 13 HN THR 13 -18.454 6.149 5.807 1043 HA THR 13 HA THR 13 -16.919 8.428 6.551 1044 HB THR 13 HB THR 13 -15.497 6.362 7.581 1045 HG1 THR 13 HG1 THR 13 -16.577 4.586 7.196 1046 HG21 THR 13 HG21 THR 13 -18.098 7.371 8.719 1047 HG22 THR 13 HG22 THR 13 -16.556 8.225 8.808 1048 HG23 THR 13 HG23 THR 13 -16.751 6.670 9.620 1049 H LEU 14 HN LEU 14 -16.411 5.649 4.455 1050 HA LEU 14 HA LEU 14 -13.664 5.896 4.030 1051 HB2 LEU 14 HB2 LEU 14 -15.275 4.031 3.310 1052 HB3 LEU 14 HB1 LEU 14 -15.615 5.029 1.911 1053 HG LEU 14 HG LEU 14 -13.245 4.920 1.258 1054 HD11 LEU 14 HD11 LEU 14 -11.861 3.152 2.427 1055 HD12 LEU 14 HD12 LEU 14 -13.040 3.234 3.735 1056 HD13 LEU 14 HD13 LEU 14 -12.103 4.664 3.302 1057 HD21 LEU 14 HD21 LEU 14 -14.900 3.275 0.438 1058 HD22 LEU 14 HD22 LEU 14 -14.431 2.195 1.752 1059 HD23 LEU 14 HD23 LEU 14 -13.258 2.636 0.513 1060 H ARG 15 HN ARG 15 -16.400 7.374 2.304 1061 HA ARG 15 HA ARG 15 -14.829 8.705 0.358 1062 HB2 ARG 15 HB2 ARG 15 -17.642 8.881 1.302 1063 HB3 ARG 15 HB1 ARG 15 -17.006 10.270 0.437 1064 HG2 ARG 15 HG2 ARG 15 -16.240 8.370 -1.257 1065 HG3 ARG 15 HG1 ARG 15 -17.622 7.547 -0.532 1066 HD2 ARG 15 HD2 ARG 15 -18.942 9.664 -0.997 1067 HD3 ARG 15 HD1 ARG 15 -17.580 10.180 -1.984 1068 HE ARG 15 HE ARG 15 -18.093 8.526 -3.554 1069 HH11 ARG 15 HH11 ARG 15 -20.281 8.442 -0.811 1070 HH12 ARG 15 HH12 ARG 15 -21.440 7.432 -1.613 1071 HH21 ARG 15 HH21 ARG 15 -19.601 7.177 -4.604 1072 HH22 ARG 15 HH22 ARG 15 -21.057 6.711 -3.762 1073 H ALA 16 HN ALA 16 -15.674 9.471 3.640 1074 HA ALA 16 HA ALA 16 -14.993 12.258 3.440 1075 HB1 ALA 16 HB1 ALA 16 -15.329 12.317 5.849 1076 HB2 ALA 16 HB2 ALA 16 -15.420 10.556 5.891 1077 HB3 ALA 16 HB3 ALA 16 -16.663 11.483 5.049 1078 H GLN 17 HN GLN 17 -13.481 9.388 4.897 1079 HA GLN 17 HA GLN 17 -11.168 10.735 5.809 1080 HB2 GLN 17 HB2 GLN 17 -11.877 8.603 6.747 1081 HB3 GLN 17 HB1 GLN 17 -11.616 7.813 5.201 1082 HG2 GLN 17 HG2 GLN 17 -9.227 8.259 5.361 1083 HG3 GLN 17 HG1 GLN 17 -9.482 9.082 6.902 1084 HE21 GLN 17 HE21 GLN 17 -8.072 6.538 5.957 1085 HE22 GLN 17 HE22 GLN 17 -8.583 5.348 7.100 1086 H ALA 18 HN ALA 18 -11.932 9.084 2.793 1087 HA ALA 18 HA ALA 18 -9.295 9.075 1.759 1088 HB1 ALA 18 HB1 ALA 18 -11.235 7.674 0.962 1089 HB2 ALA 18 HB2 ALA 18 -10.245 8.410 -0.301 1090 HB3 ALA 18 HB3 ALA 18 -11.812 9.110 0.113 1091 H ARG 19 HN ARG 19 -11.655 11.559 2.055 1092 HA ARG 19 HA ARG 19 -10.588 13.192 -0.066 1093 HB2 ARG 19 HB2 ARG 19 -12.692 13.575 2.030 1094 HB3 ARG 19 HB1 ARG 19 -12.077 14.961 1.139 1095 HG2 ARG 19 HG2 ARG 19 -12.657 13.768 -0.973 1096 HG3 ARG 19 HG1 ARG 19 -13.438 12.529 0.013 1097 HD2 ARG 19 HD2 ARG 19 -14.991 14.142 0.893 1098 HD3 ARG 19 HD1 ARG 19 -14.150 15.458 0.076 1099 HE ARG 19 HE ARG 19 -14.814 14.219 -2.044 1100 HH11 ARG 19 HH11 ARG 19 -16.740 14.119 0.890 1101 HH12 ARG 19 HH12 ARG 19 -18.238 13.911 0.042 1102 HH21 ARG 19 HH21 ARG 19 -16.784 13.930 -3.148 1103 HH22 ARG 19 HH22 ARG 19 -18.262 13.804 -2.255 1104 H GLU 20 HN GLU 20 -9.397 12.377 2.874 1105 HA GLU 20 HA GLU 20 -8.302 15.019 3.473 1106 HB2 GLU 20 HB2 GLU 20 -8.062 12.416 4.992 1107 HB3 GLU 20 HB1 GLU 20 -7.476 13.984 5.538 1108 HG2 GLU 20 HG2 GLU 20 -9.918 14.751 5.261 1109 HG3 GLU 20 HG1 GLU 20 -10.301 13.030 5.247 1110 H CYS 21 H CYS 21 -7.574 13.121 1.210 1111 HA CYS 21 HA CYS 21 -4.704 13.636 1.298 1112 HB2 CYS 21 3HB CYS 21 -4.088 11.227 0.866 1113 HB3 CYS 21 2HB CYS 21 -4.874 11.395 2.441 1114 HG CYS 21 HG CYS 21 -6.785 10.038 2.037 1115 H THR 22 HN THR 22 -3.687 13.164 -0.776 1116 HA THR 22 HA THR 22 -5.398 14.017 -2.919 1117 HB THR 22 HB THR 22 -2.889 13.351 -3.980 1118 HG1 THR 22 HG1 THR 22 -1.516 14.461 -2.425 1119 HG21 THR 22 HG21 THR 22 -4.180 15.333 -4.554 1120 HG22 THR 22 HG22 THR 22 -2.557 15.789 -4.032 1121 HG23 THR 22 HG23 THR 22 -3.925 15.986 -2.934 1122 H LEU 23 HN LEU 23 -5.198 12.939 -5.086 1123 HA LEU 23 HA LEU 23 -6.220 10.335 -4.988 1124 HB2 LEU 23 HB2 LEU 23 -6.605 11.978 -6.801 1125 HB3 LEU 23 HB1 LEU 23 -4.943 11.773 -7.319 1126 HG LEU 23 HG LEU 23 -5.433 9.392 -7.831 1127 HD11 LEU 23 HD11 LEU 23 -8.216 10.216 -7.043 1128 HD12 LEU 23 HD12 LEU 23 -7.235 8.926 -6.350 1129 HD13 LEU 23 HD13 LEU 23 -7.856 8.776 -7.992 1130 HD21 LEU 23 HD21 LEU 23 -6.651 9.831 -9.865 1131 HD22 LEU 23 HD22 LEU 23 -5.562 11.178 -9.537 1132 HD23 LEU 23 HD23 LEU 23 -7.288 11.340 -9.205 1133 H GLU 24 HN GLU 24 -3.017 11.590 -5.565 1134 HA GLU 24 HA GLU 24 -1.658 9.388 -6.488 1135 HB2 GLU 24 HB2 GLU 24 -0.653 11.486 -4.555 1136 HB3 GLU 24 HB1 GLU 24 0.362 10.399 -5.489 1137 HG2 GLU 24 HG2 GLU 24 0.447 12.341 -6.714 1138 HG3 GLU 24 HG1 GLU 24 -0.813 11.433 -7.543 1139 H THR 25 HN THR 25 -2.138 10.292 -3.067 1140 HA THR 25 HA THR 25 -0.763 8.045 -2.029 1141 HB THR 25 HB THR 25 -2.695 8.930 -0.148 1142 HG1 THR 25 HG1 THR 25 -2.655 11.094 -0.337 1143 HG21 THR 25 HG21 THR 25 -0.402 8.218 0.347 1144 HG22 THR 25 HG22 THR 25 -0.734 9.819 1.005 1145 HG23 THR 25 HG23 THR 25 0.222 9.651 -0.466 1146 H LEU 26 HN LEU 26 -4.145 8.666 -2.807 1147 HA LEU 26 HA LEU 26 -5.183 6.314 -1.599 1148 HB2 LEU 26 HB2 LEU 26 -6.281 8.087 -3.777 1149 HB3 LEU 26 HB1 LEU 26 -7.183 6.783 -3.029 1150 HG LEU 26 HG LEU 26 -6.054 9.056 -1.414 1151 HD11 LEU 26 HD11 LEU 26 -8.701 8.874 -2.833 1152 HD12 LEU 26 HD12 LEU 26 -7.454 10.105 -3.036 1153 HD13 LEU 26 HD13 LEU 26 -8.361 10.008 -1.528 1154 HD21 LEU 26 HD21 LEU 26 -6.692 7.102 -0.140 1155 HD22 LEU 26 HD22 LEU 26 -8.254 7.045 -0.951 1156 HD23 LEU 26 HD23 LEU 26 -7.872 8.383 0.130 1157 H GLU 27 HN GLU 27 -3.759 7.037 -4.668 1158 HA GLU 27 HA GLU 27 -4.682 4.771 -6.078 1159 HB2 GLU 27 HB2 GLU 27 -3.695 6.925 -7.014 1160 HB3 GLU 27 HB1 GLU 27 -2.118 6.256 -6.627 1161 HG2 GLU 27 HG2 GLU 27 -2.176 4.772 -8.330 1162 HG3 GLU 27 HG1 GLU 27 -3.917 4.533 -8.201 1163 H GLU 28 HN GLU 28 -1.483 5.420 -4.583 1164 HA GLU 28 HA GLU 28 -0.518 2.818 -5.103 1165 HB2 GLU 28 HB2 GLU 28 0.724 5.075 -4.350 1166 HB3 GLU 28 HB1 GLU 28 0.651 4.264 -2.793 1167 HG2 GLU 28 HG2 GLU 28 1.688 2.258 -3.917 1168 HG3 GLU 28 HG1 GLU 28 1.956 3.281 -5.319 1169 H MET 29 HN MET 29 -2.688 3.954 -2.725 1170 HA MET 29 HA MET 29 -2.105 1.749 -0.924 1171 HB2 MET 29 HB2 MET 29 -3.396 2.780 0.652 1172 HB3 MET 29 HB1 MET 29 -2.988 4.182 -0.324 1173 HG2 MET 29 HG2 MET 29 -5.113 4.228 -1.330 1174 HG3 MET 29 HG1 MET 29 -5.503 2.608 -0.757 1175 HE1 MET 29 HE1 MET 29 -4.768 6.335 0.464 1176 HE2 MET 29 HE2 MET 29 -3.684 5.294 1.384 1177 HE3 MET 29 HE3 MET 29 -5.010 6.125 2.199 1178 H LEU 30 HN LEU 30 -4.209 2.498 -3.550 1179 HA LEU 30 HA LEU 30 -6.172 0.484 -2.980 1180 HB2 LEU 30 HB2 LEU 30 -6.798 2.392 -4.327 1181 HB3 LEU 30 HB1 LEU 30 -5.539 2.032 -5.493 1182 HG LEU 30 HG LEU 30 -6.810 -0.202 -5.846 1183 HD11 LEU 30 HD11 LEU 30 -9.134 -0.217 -5.342 1184 HD12 LEU 30 HD12 LEU 30 -9.087 1.457 -4.787 1185 HD13 LEU 30 HD13 LEU 30 -8.286 0.195 -3.850 1186 HD21 LEU 30 HD21 LEU 30 -8.152 0.793 -7.576 1187 HD22 LEU 30 HD22 LEU 30 -6.621 1.663 -7.470 1188 HD23 LEU 30 HD23 LEU 30 -8.083 2.365 -6.780 1189 H GLU 31 HN GLU 31 -3.426 0.772 -5.212 1190 HA GLU 31 HA GLU 31 -3.667 -1.708 -6.469 1191 HB2 GLU 31 HB2 GLU 31 -1.171 -1.452 -6.872 1192 HB3 GLU 31 HB1 GLU 31 -2.186 -0.125 -7.421 1193 HG2 GLU 31 HG2 GLU 31 -1.599 1.156 -5.436 1194 HG3 GLU 31 HG1 GLU 31 -0.602 -0.180 -4.865 1195 H LYS 32 HN LYS 32 -2.128 -0.825 -3.428 1196 HA LYS 32 HA LYS 32 -0.952 -3.397 -2.993 1197 HB2 LYS 32 HB2 LYS 32 -1.484 -1.119 -1.074 1198 HB3 LYS 32 HB1 LYS 32 -0.561 -2.563 -0.678 1199 HG2 LYS 32 HG2 LYS 32 1.090 -1.996 -2.361 1200 HG3 LYS 32 HG1 LYS 32 0.148 -0.575 -2.824 1201 HD2 LYS 32 HD2 LYS 32 0.358 0.127 -0.366 1202 HD3 LYS 32 HD1 LYS 32 1.637 -1.084 -0.262 1203 HE2 LYS 32 HE2 LYS 32 2.873 0.032 -2.025 1204 HE3 LYS 32 HE1 LYS 32 1.561 1.192 -2.233 1205 HZ1 LYS 32 HZ1 LYS 32 3.311 2.161 -0.936 1206 HZ2 LYS 32 HZ2 LYS 32 3.266 0.879 0.181 1207 HZ3 LYS 32 HZ3 LYS 32 1.954 1.948 0.053 1208 H LEU 33 HN LEU 33 -4.041 -1.950 -2.296 1209 HA LEU 33 HA LEU 33 -4.792 -3.895 -0.326 1210 HB2 LEU 33 HB2 LEU 33 -5.718 -1.616 -0.352 1211 HB3 LEU 33 HB1 LEU 33 -6.505 -1.960 -1.882 1212 HG LEU 33 HG LEU 33 -7.768 -3.805 -0.686 1213 HD11 LEU 33 HD11 LEU 33 -7.945 -3.596 1.754 1214 HD12 LEU 33 HD12 LEU 33 -6.662 -2.384 1.730 1215 HD13 LEU 33 HD13 LEU 33 -6.314 -4.045 1.245 1216 HD21 LEU 33 HD21 LEU 33 -9.302 -2.160 0.455 1217 HD22 LEU 33 HD22 LEU 33 -8.935 -1.834 -1.236 1218 HD23 LEU 33 HD23 LEU 33 -8.133 -0.909 0.031 1219 H GLU 34 HN GLU 34 -5.635 -3.349 -3.748 1220 HA GLU 34 HA GLU 34 -7.463 -5.456 -3.949 1221 HB2 GLU 34 HB2 GLU 34 -7.177 -5.285 -6.374 1222 HB3 GLU 34 HB1 GLU 34 -7.368 -3.711 -5.621 1223 HG2 GLU 34 HG2 GLU 34 -5.051 -3.226 -5.876 1224 HG3 GLU 34 HG1 GLU 34 -4.704 -4.878 -6.389 1225 H VAL 35 HN VAL 35 -3.957 -5.461 -4.268 1226 HA VAL 35 HA VAL 35 -3.849 -8.107 -5.320 1227 HB VAL 35 HB VAL 35 -1.453 -8.045 -4.887 1228 HG11 VAL 35 HG11 VAL 35 -1.715 -5.360 -5.945 1229 HG12 VAL 35 HG12 VAL 35 -2.913 -6.461 -6.620 1230 HG13 VAL 35 HG13 VAL 35 -1.197 -6.841 -6.746 1231 HG21 VAL 35 HG21 VAL 35 -0.423 -6.012 -3.936 1232 HG22 VAL 35 HG22 VAL 35 -1.416 -6.877 -2.766 1233 HG23 VAL 35 HG23 VAL 35 -2.029 -5.413 -3.530 1234 H VAL 36 HN VAL 36 -3.802 -6.775 -2.053 1235 HA VAL 36 HA VAL 36 -2.968 -9.128 -0.730 1236 HB VAL 36 HB VAL 36 -4.715 -6.858 0.249 1237 HG11 VAL 36 HG11 VAL 36 -5.200 -8.879 1.541 1238 HG12 VAL 36 HG12 VAL 36 -4.338 -7.687 2.512 1239 HG13 VAL 36 HG13 VAL 36 -3.478 -9.086 1.868 1240 HG21 VAL 36 HG21 VAL 36 -2.663 -6.267 1.531 1241 HG22 VAL 36 HG22 VAL 36 -2.481 -6.135 -0.220 1242 HG23 VAL 36 HG23 VAL 36 -1.802 -7.522 0.638 1243 H VAL 37 HN VAL 37 -6.107 -7.911 -1.746 1244 HA VAL 37 HA VAL 37 -7.646 -10.032 -0.656 1245 HB VAL 37 HB VAL 37 -8.320 -8.295 -3.045 1246 HG11 VAL 37 HG11 VAL 37 -10.047 -9.929 -1.192 1247 HG12 VAL 37 HG12 VAL 37 -9.795 -10.186 -2.920 1248 HG13 VAL 37 HG13 VAL 37 -10.664 -8.757 -2.357 1249 HG21 VAL 37 HG21 VAL 37 -7.815 -6.858 -1.205 1250 HG22 VAL 37 HG22 VAL 37 -8.784 -7.836 -0.104 1251 HG23 VAL 37 HG23 VAL 37 -9.568 -6.917 -1.388 1252 H ASN 38 HN ASN 38 -6.060 -9.454 -3.744 1253 HA ASN 38 HA ASN 38 -7.074 -11.678 -5.143 1254 HB2 ASN 38 HB2 ASN 38 -5.739 -9.605 -5.994 1255 HB3 ASN 38 HB1 ASN 38 -4.320 -10.584 -5.636 1256 HD21 ASN 38 HD21 ASN 38 -7.500 -11.338 -7.008 1257 HD22 ASN 38 HD22 ASN 38 -6.887 -12.053 -8.461 1258 H GLU 39 HN GLU 39 -4.234 -11.279 -3.066 1259 HA GLU 39 HA GLU 39 -3.146 -13.850 -3.540 1260 HB2 GLU 39 HB2 GLU 39 -2.826 -11.923 -1.235 1261 HB3 GLU 39 HB1 GLU 39 -1.943 -13.439 -1.341 1262 HG2 GLU 39 HG2 GLU 39 -1.119 -12.636 -3.600 1263 HG3 GLU 39 HG1 GLU 39 -1.766 -11.058 -3.153 1264 H ARG 40 HN ARG 40 -5.433 -12.590 -1.171 1265 HA ARG 40 HA ARG 40 -5.673 -14.960 0.361 1266 HB2 ARG 40 HB2 ARG 40 -7.405 -12.536 -0.030 1267 HB3 ARG 40 HB1 ARG 40 -7.994 -13.902 0.905 1268 HG2 ARG 40 HG2 ARG 40 -5.385 -12.550 1.525 1269 HG3 ARG 40 HG1 ARG 40 -6.919 -11.988 2.186 1270 HD2 ARG 40 HD2 ARG 40 -5.886 -14.802 2.492 1271 HD3 ARG 40 HD1 ARG 40 -5.623 -13.528 3.678 1272 HE ARG 40 HE ARG 40 -8.023 -13.469 4.024 1273 HH11 ARG 40 HH11 ARG 40 -6.735 -16.264 2.342 1274 HH12 ARG 40 HH12 ARG 40 -8.120 -17.267 2.680 1275 HH21 ARG 40 HH21 ARG 40 -9.816 -14.803 4.501 1276 HH22 ARG 40 HH22 ARG 40 -9.877 -16.433 3.889 1277 H ARG 41 HN ARG 41 -6.921 -13.926 -2.663 1278 HA ARG 41 HA ARG 41 -9.152 -15.626 -2.891 1279 HB2 ARG 41 HB2 ARG 41 -7.498 -14.004 -4.739 1280 HB3 ARG 41 HB1 ARG 41 -8.391 -15.330 -5.463 1281 HG2 ARG 41 HG2 ARG 41 -9.643 -13.220 -3.736 1282 HG3 ARG 41 HG1 ARG 41 -9.569 -13.145 -5.499 1283 HD2 ARG 41 HD2 ARG 41 -10.714 -15.533 -4.104 1284 HD3 ARG 41 HD1 ARG 41 -11.694 -14.096 -4.377 1285 HE ARG 41 HE ARG 41 -10.489 -15.758 -6.493 1286 HH11 ARG 41 HH11 ARG 41 -12.858 -13.426 -5.386 1287 HH12 ARG 41 HH12 ARG 41 -13.798 -13.505 -6.854 1288 HH21 ARG 41 HH21 ARG 41 -11.721 -15.863 -8.423 1289 HH22 ARG 41 HH22 ARG 41 -13.148 -14.881 -8.581 1290 H GLU 42 HN GLU 42 -5.922 -15.945 -4.388 1291 HA GLU 42 HA GLU 42 -6.280 -18.569 -5.286 1292 HB2 GLU 42 HB2 GLU 42 -3.895 -16.856 -4.735 1293 HB3 GLU 42 HB1 GLU 42 -3.643 -18.572 -5.015 1294 HG2 GLU 42 HG2 GLU 42 -3.351 -17.462 -7.086 1295 HG3 GLU 42 HG1 GLU 42 -4.883 -18.326 -7.161 1296 H GLU 43 HN GLU 43 -5.250 -17.283 -2.213 1297 HA GLU 43 HA GLU 43 -4.255 -19.626 -1.039 1298 HB2 GLU 43 HB2 GLU 43 -4.070 -17.232 -0.200 1299 HB3 GLU 43 HB1 GLU 43 -5.707 -17.417 0.415 1300 HG2 GLU 43 HG2 GLU 43 -4.955 -19.284 1.811 1301 HG3 GLU 43 HG1 GLU 43 -3.313 -19.045 1.219 1302 H GLU 44 HN GLU 44 -7.519 -18.230 -1.056 1303 HA GLU 44 HA GLU 44 -8.620 -20.409 0.461 1304 HB2 GLU 44 HB2 GLU 44 -9.398 -17.803 -0.059 1305 HB3 GLU 44 HB1 GLU 44 -10.546 -18.758 -0.989 1306 HG2 GLU 44 HG2 GLU 44 -11.625 -18.576 1.024 1307 HG3 GLU 44 HG1 GLU 44 -10.792 -20.117 1.211 1308 H SER 45 HN SER 45 -8.027 -19.763 -2.855 1309 HA SER 45 HA SER 45 -10.056 -21.502 -3.897 1310 HB2 SER 45 HB2 SER 45 -7.574 -20.397 -5.232 1311 HB3 SER 45 HB1 SER 45 -8.913 -21.196 -6.055 1312 HG SER 45 HG SER 45 -9.000 -18.755 -4.593 1313 H ALA 46 HN ALA 46 -6.809 -21.896 -2.746 1314 HA ALA 46 HA ALA 46 -6.747 -24.644 -3.790 1315 HB1 ALA 46 HB1 ALA 46 -4.842 -23.141 -4.358 1316 HB2 ALA 46 HB2 ALA 46 -4.371 -24.600 -3.487 1317 HB3 ALA 46 HB3 ALA 46 -4.460 -23.057 -2.636 Start of MODEL 8 1 H LEU 6 HT1 LEU 6 10.749 13.500 5.103 2 HA LEU 6 HA LEU 6 11.603 15.805 3.471 3 HB2 LEU 6 HB2 LEU 6 12.580 13.004 3.894 4 HB3 LEU 6 HB1 LEU 6 12.826 13.769 2.338 5 HG LEU 6 HG LEU 6 13.796 14.960 4.927 6 HD11 LEU 6 HD11 LEU 6 14.920 12.878 4.695 7 HD12 LEU 6 HD12 LEU 6 16.030 14.143 4.172 8 HD13 LEU 6 HD13 LEU 6 15.197 13.151 2.978 9 HD21 LEU 6 HD21 LEU 6 15.246 16.254 3.420 10 HD22 LEU 6 HD22 LEU 6 13.533 16.558 3.129 11 HD23 LEU 6 HD23 LEU 6 14.440 15.514 2.035 12 H THR 7 HN THR 7 11.476 15.261 1.120 13 HA THR 7 HA THR 7 8.797 14.693 0.415 14 HB THR 7 HB THR 7 10.649 14.524 -1.817 15 HG1 THR 7 HG1 THR 7 12.109 15.866 -1.016 16 HG21 THR 7 HG21 THR 7 8.641 16.631 -0.999 17 HG22 THR 7 HG22 THR 7 8.286 15.202 -1.967 18 HG23 THR 7 HG23 THR 7 9.359 16.450 -2.597 19 H LYS 8 HN LYS 8 8.037 13.020 -0.988 20 HA LYS 8 HA LYS 8 8.705 10.421 -0.224 21 HB2 LYS 8 HB2 LYS 8 6.524 11.136 -1.184 22 HB3 LYS 8 HB1 LYS 8 7.295 11.311 -2.752 23 HG2 LYS 8 HG2 LYS 8 7.449 9.054 -3.087 24 HG3 LYS 8 HG1 LYS 8 7.436 8.679 -1.363 25 HD2 LYS 8 HD2 LYS 8 5.171 8.666 -1.253 26 HD3 LYS 8 HD1 LYS 8 5.010 9.993 -2.400 27 HE2 LYS 8 HE2 LYS 8 5.421 8.478 -4.248 28 HE3 LYS 8 HE1 LYS 8 5.679 7.144 -3.125 29 HZ1 LYS 8 HZ1 LYS 8 3.323 7.672 -2.334 30 HZ2 LYS 8 HZ2 LYS 8 3.487 6.886 -3.819 31 HZ3 LYS 8 HZ3 LYS 8 3.158 8.558 -3.771 32 H THR 9 HN THR 9 9.675 12.300 -3.054 33 HA THR 9 HA THR 9 11.075 10.226 -4.372 34 HB THR 9 HB THR 9 12.190 12.765 -5.036 35 HG1 THR 9 HG1 THR 9 10.527 14.104 -4.898 36 HG21 THR 9 HG21 THR 9 10.072 11.085 -6.400 37 HG22 THR 9 HG22 THR 9 11.817 10.902 -6.585 38 HG23 THR 9 HG23 THR 9 11.022 12.368 -7.159 39 H ASP 10 HN ASP 10 11.940 12.452 -1.820 40 HA ASP 10 HA ASP 10 14.750 12.352 -2.070 41 HB2 ASP 10 HB2 ASP 10 12.826 13.220 -0.011 42 HB3 ASP 10 HB1 ASP 10 14.399 12.724 0.602 43 H TYR 11 HN TYR 11 12.515 10.525 -0.006 44 HA TYR 11 HA TYR 11 14.498 8.875 1.146 45 HB2 TYR 11 HB2 TYR 11 11.517 8.457 0.826 46 HB3 TYR 11 HB1 TYR 11 12.564 7.384 1.749 47 HD1 TYR 11 HD1 TYR 11 14.186 8.861 3.415 48 HD2 TYR 11 HD2 TYR 11 10.274 9.892 2.109 49 HE1 TYR 11 HE1 TYR 11 13.913 10.297 5.394 50 HE2 TYR 11 HE2 TYR 11 9.991 11.332 4.083 51 HH TYR 11 HH TYR 11 11.342 11.203 6.663 52 H LEU 12 HN LEU 12 12.528 8.643 -1.738 53 HA LEU 12 HA LEU 12 13.024 5.984 -2.439 54 HB2 LEU 12 HB2 LEU 12 11.308 7.276 -3.537 55 HB3 LEU 12 HB1 LEU 12 12.489 8.418 -4.142 56 HG LEU 12 HG LEU 12 13.451 6.612 -5.559 57 HD11 LEU 12 HD11 LEU 12 12.053 4.585 -5.908 58 HD12 LEU 12 HD12 LEU 12 11.100 5.052 -4.499 59 HD13 LEU 12 HD13 LEU 12 12.811 4.665 -4.320 60 HD21 LEU 12 HD21 LEU 12 10.504 7.128 -5.958 61 HD22 LEU 12 HD22 LEU 12 11.645 6.610 -7.198 62 HD23 LEU 12 HD23 LEU 12 11.814 8.202 -6.456 63 H MET 13 HN MET 13 14.836 8.940 -3.160 64 HA MET 13 HA MET 13 16.760 7.702 -4.829 65 HB2 MET 13 HB2 MET 13 16.836 10.287 -3.272 66 HB3 MET 13 HB1 MET 13 18.099 9.784 -4.388 67 HG2 MET 13 HG2 MET 13 15.246 10.487 -5.003 68 HG3 MET 13 HG1 MET 13 16.716 11.266 -5.583 69 HE1 MET 13 HE1 MET 13 18.127 10.466 -7.612 70 HE2 MET 13 HE2 MET 13 18.105 8.807 -8.200 71 HE3 MET 13 HE3 MET 13 18.615 9.148 -6.549 72 H ARG 14 HN ARG 14 16.660 8.389 -1.363 73 HA ARG 14 HA ARG 14 19.318 7.562 -0.831 74 HB2 ARG 14 HB2 ARG 14 17.895 8.958 0.696 75 HB3 ARG 14 HB1 ARG 14 16.974 7.516 1.086 76 HG2 ARG 14 HG2 ARG 14 19.928 7.469 1.458 77 HG3 ARG 14 HG1 ARG 14 18.935 8.348 2.620 78 HD2 ARG 14 HD2 ARG 14 17.685 6.366 3.143 79 HD3 ARG 14 HD1 ARG 14 18.459 5.477 1.834 80 HE ARG 14 HE ARG 14 19.690 6.251 4.386 81 HH11 ARG 14 HH11 ARG 14 19.901 4.533 1.330 82 HH12 ARG 14 HH12 ARG 14 21.234 3.547 1.836 83 HH21 ARG 14 HH21 ARG 14 21.448 4.962 5.047 84 HH22 ARG 14 HH22 ARG 14 22.128 3.803 3.947 85 H LEU 15 HN LEU 15 16.241 5.865 -0.937 86 HA LEU 15 HA LEU 15 17.348 3.409 0.062 87 HB2 LEU 15 HB2 LEU 15 14.708 3.992 -1.275 88 HB3 LEU 15 HB1 LEU 15 15.140 2.454 -0.553 89 HG LEU 15 HG LEU 15 14.903 5.070 0.944 90 HD11 LEU 15 HD11 LEU 15 13.069 2.679 0.963 91 HD12 LEU 15 HD12 LEU 15 12.744 4.195 0.130 92 HD13 LEU 15 HD13 LEU 15 12.875 4.168 1.887 93 HD21 LEU 15 HD21 LEU 15 16.536 3.555 1.939 94 HD22 LEU 15 HD22 LEU 15 15.339 2.260 1.953 95 HD23 LEU 15 HD23 LEU 15 15.097 3.694 2.951 96 H ARG 16 HN ARG 16 17.285 4.942 -2.986 97 HA ARG 16 HA ARG 16 17.361 2.531 -4.541 98 HB2 ARG 16 HB2 ARG 16 17.606 5.433 -5.114 99 HB3 ARG 16 HB1 ARG 16 18.362 4.330 -6.258 100 HG2 ARG 16 HG2 ARG 16 16.201 3.125 -6.445 101 HG3 ARG 16 HG1 ARG 16 15.472 4.358 -5.419 102 HD2 ARG 16 HD2 ARG 16 15.825 6.043 -7.050 103 HD3 ARG 16 HD1 ARG 16 16.877 4.995 -8.006 104 HE ARG 16 HE ARG 16 14.578 3.604 -8.013 105 HH11 ARG 16 HH11 ARG 16 15.236 6.990 -8.663 106 HH12 ARG 16 HH12 ARG 16 13.912 7.166 -9.770 107 HH21 ARG 16 HH21 ARG 16 12.829 3.825 -9.441 108 HH22 ARG 16 HH22 ARG 16 12.535 5.362 -10.220 109 H ARG 17 HN ARG 17 19.504 3.974 -2.499 110 HA ARG 17 HA ARG 17 21.924 3.291 -3.928 111 HB2 ARG 17 HB2 ARG 17 21.512 4.155 -1.056 112 HB3 ARG 17 HB1 ARG 17 23.060 4.036 -1.876 113 HG2 ARG 17 HG2 ARG 17 20.930 5.798 -2.997 114 HG3 ARG 17 HG1 ARG 17 21.891 6.340 -1.621 115 HD2 ARG 17 HD2 ARG 17 23.295 5.212 -3.993 116 HD3 ARG 17 HD1 ARG 17 22.638 6.847 -4.096 117 HE ARG 17 HE ARG 17 24.678 5.948 -2.165 118 HH11 ARG 17 HH11 ARG 17 23.104 8.495 -3.989 119 HH12 ARG 17 HH12 ARG 17 24.186 9.728 -3.428 120 HH21 ARG 17 HH21 ARG 17 26.091 7.574 -1.421 121 HH22 ARG 17 HH22 ARG 17 25.890 9.204 -1.978 122 H CYS 18 HN CYS 18 19.620 1.752 -2.037 123 HA CYS 18 HA CYS 18 21.396 -0.289 -0.979 124 HB2 CYS 18 HB2 CYS 18 18.381 -0.296 -0.857 125 HB3 CYS 18 HB1 CYS 18 19.519 -1.082 0.233 126 HG CYS 18 HG CYS 18 20.490 1.508 1.137 127 H GLN 19 HN GLN 19 21.534 -2.360 -1.749 128 HA GLN 19 HA GLN 19 19.904 -3.052 -4.105 129 HB2 GLN 19 HB2 GLN 19 22.793 -2.727 -3.910 130 HB3 GLN 19 HB1 GLN 19 22.350 -4.333 -4.467 131 HG2 GLN 19 HG2 GLN 19 21.455 -1.746 -5.720 132 HG3 GLN 19 HG1 GLN 19 22.755 -2.779 -6.312 133 HE21 GLN 19 HE21 GLN 19 20.478 -2.035 -7.800 134 HE22 GLN 19 HE22 GLN 19 19.577 -3.473 -8.141 135 H THR 20 HN THR 20 20.407 -5.502 -4.626 136 HA THR 20 HA THR 20 20.189 -7.689 -4.054 137 HB THR 20 HB THR 20 21.268 -7.242 -1.305 138 HG1 THR 20 HG1 THR 20 22.766 -6.030 -2.247 139 HG21 THR 20 HG21 THR 20 22.523 -9.281 -1.830 140 HG22 THR 20 HG22 THR 20 21.856 -9.273 -3.463 141 HG23 THR 20 HG23 THR 20 20.790 -9.517 -2.078 142 H ILE 21 HN ILE 21 18.442 -5.340 -2.583 143 HA ILE 21 HA ILE 21 16.416 -5.298 -1.556 144 HB ILE 21 HB ILE 21 16.526 -8.312 -1.784 145 HG12 ILE 21 HG12 ILE 21 15.018 -6.217 -3.373 146 HG13 ILE 21 HG11 ILE 21 16.417 -7.122 -3.937 147 HG21 ILE 21 HG21 ILE 21 14.133 -6.616 -1.091 148 HG22 ILE 21 HG22 ILE 21 15.094 -7.498 0.093 149 HG23 ILE 21 HG23 ILE 21 14.217 -8.377 -1.158 150 HD11 ILE 21 HD11 ILE 21 13.699 -8.236 -3.282 151 HD12 ILE 21 HD12 ILE 21 15.102 -9.198 -3.746 152 HD13 ILE 21 HD13 ILE 21 14.410 -8.043 -4.884 153 H ASP 22 HN ASP 22 18.603 -7.756 -0.243 154 HA ASP 22 HA ASP 22 17.673 -7.904 2.353 155 HB2 ASP 22 HB2 ASP 22 19.342 -9.441 1.728 156 HB3 ASP 22 HB1 ASP 22 20.440 -8.162 1.209 157 H THR 23 HN THR 23 20.096 -5.616 1.070 158 HA THR 23 HA THR 23 20.618 -4.286 3.469 159 HB THR 23 HB THR 23 20.563 -2.746 0.906 160 HG1 THR 23 HG1 THR 23 22.240 -4.965 1.502 161 HG21 THR 23 HG21 THR 23 22.689 -1.887 1.765 162 HG22 THR 23 HG22 THR 23 22.580 -2.984 3.143 163 HG23 THR 23 HG23 THR 23 21.398 -1.689 2.951 164 H LEU 24 HN LEU 24 18.119 -3.796 1.038 165 HA LEU 24 HA LEU 24 17.041 -1.411 2.130 166 HB2 LEU 24 HB2 LEU 24 16.643 -2.208 -0.194 167 HB3 LEU 24 HB1 LEU 24 15.681 -3.525 0.445 168 HG LEU 24 HG LEU 24 14.170 -1.736 1.461 169 HD11 LEU 24 HD11 LEU 24 14.220 0.451 0.397 170 HD12 LEU 24 HD12 LEU 24 15.666 -0.010 -0.506 171 HD13 LEU 24 HD13 LEU 24 15.729 0.132 1.252 172 HD21 LEU 24 HD21 LEU 24 12.894 -1.522 -0.553 173 HD22 LEU 24 HD22 LEU 24 13.663 -3.110 -0.556 174 HD23 LEU 24 HD23 LEU 24 14.323 -1.810 -1.544 175 H GLU 25 HN GLU 25 16.250 -4.831 2.469 176 HA GLU 25 HA GLU 25 13.982 -4.666 4.067 177 HB2 GLU 25 HB2 GLU 25 14.670 -6.741 3.045 178 HB3 GLU 25 HB1 GLU 25 16.185 -6.731 3.935 179 HG2 GLU 25 HG2 GLU 25 14.934 -8.289 5.077 180 HG3 GLU 25 HG1 GLU 25 14.683 -6.828 6.031 181 H ARG 26 HN ARG 26 17.397 -4.659 4.969 182 HA ARG 26 HA ARG 26 16.838 -4.662 7.789 183 HB2 ARG 26 HB2 ARG 26 19.386 -4.278 6.223 184 HB3 ARG 26 HB1 ARG 26 19.314 -4.277 7.979 185 HG2 ARG 26 HG2 ARG 26 18.627 -6.546 8.045 186 HG3 ARG 26 HG1 ARG 26 18.354 -6.582 6.303 187 HD2 ARG 26 HD2 ARG 26 20.483 -7.117 5.921 188 HD3 ARG 26 HD1 ARG 26 21.050 -5.756 6.891 189 HE ARG 26 HE ARG 26 20.805 -7.224 8.858 190 HH11 ARG 26 HH11 ARG 26 20.990 -8.722 5.694 191 HH12 ARG 26 HH12 ARG 26 21.660 -10.203 6.300 192 HH21 ARG 26 HH21 ARG 26 21.646 -9.188 9.663 193 HH22 ARG 26 HH22 ARG 26 22.042 -10.469 8.564 194 H VAL 27 HN VAL 27 17.739 -2.220 5.390 195 HA VAL 27 HA VAL 27 18.229 -0.187 7.307 196 HB VAL 27 HB VAL 27 19.060 -0.216 4.900 197 HG11 VAL 27 HG11 VAL 27 16.538 -0.414 4.117 198 HG12 VAL 27 HG12 VAL 27 17.759 0.394 3.136 199 HG13 VAL 27 HG13 VAL 27 16.657 1.344 4.132 200 HG21 VAL 27 HG21 VAL 27 19.432 1.668 6.375 201 HG22 VAL 27 HG22 VAL 27 17.836 2.310 6.002 202 HG23 VAL 27 HG23 VAL 27 19.073 2.245 4.748 203 H ILE 28 HN ILE 28 15.288 -1.184 5.603 204 HA ILE 28 HA ILE 28 13.811 1.132 6.436 205 HB ILE 28 HB ILE 28 11.798 -0.090 5.702 206 HG12 ILE 28 HG12 ILE 28 13.688 -2.338 4.973 207 HG13 ILE 28 HG11 ILE 28 12.626 -2.365 6.377 208 HG21 ILE 28 HG21 ILE 28 12.965 1.199 4.072 209 HG22 ILE 28 HG22 ILE 28 12.475 -0.312 3.310 210 HG23 ILE 28 HG23 ILE 28 14.146 -0.084 3.822 211 HD11 ILE 28 HD11 ILE 28 11.689 -2.104 3.528 212 HD12 ILE 28 HD12 ILE 28 10.683 -2.312 4.965 213 HD13 ILE 28 HD13 ILE 28 11.748 -3.616 4.436 214 H GLU 29 HN GLU 29 14.573 -1.944 7.819 215 HA GLU 29 HA GLU 29 12.505 -1.872 9.809 216 HB2 GLU 29 HB2 GLU 29 13.524 -3.980 8.941 217 HB3 GLU 29 HB1 GLU 29 15.028 -3.538 9.736 218 HG2 GLU 29 HG2 GLU 29 13.836 -5.153 11.063 219 HG3 GLU 29 HG1 GLU 29 13.883 -3.604 11.905 220 H LYS 30 HN LYS 30 15.989 -1.221 9.736 221 HA LYS 30 HA LYS 30 16.193 -0.631 12.504 222 HB2 LYS 30 HB2 LYS 30 18.098 -1.298 11.024 223 HB3 LYS 30 HB1 LYS 30 18.016 0.295 10.285 224 HG2 LYS 30 HG2 LYS 30 18.775 1.367 12.200 225 HG3 LYS 30 HG1 LYS 30 18.353 0.011 13.241 226 HD2 LYS 30 HD2 LYS 30 20.132 -1.299 11.934 227 HD3 LYS 30 HD1 LYS 30 20.669 0.276 11.351 228 HE2 LYS 30 HE2 LYS 30 21.964 -0.381 13.298 229 HE3 LYS 30 HE1 LYS 30 20.960 1.020 13.678 230 HZ1 LYS 30 HZ1 LYS 30 19.372 -0.434 14.750 231 HZ2 LYS 30 HZ2 LYS 30 20.896 -0.637 15.446 232 HZ3 LYS 30 HZ3 LYS 30 20.302 -1.797 14.366 233 H ASN 31 HN ASN 31 15.841 1.402 9.617 234 HA ASN 31 HA ASN 31 16.010 3.873 11.028 235 HB2 ASN 31 HB2 ASN 31 16.400 3.409 8.512 236 HB3 ASN 31 HB1 ASN 31 14.652 3.534 8.362 237 HD21 ASN 31 HD21 ASN 31 13.742 5.515 8.274 238 HD22 ASN 31 HD22 ASN 31 14.608 6.998 8.456 239 H LYS 32 HN LYS 32 13.577 1.567 10.813 240 HA LYS 32 HA LYS 32 11.222 3.064 10.725 241 HB2 LYS 32 HB2 LYS 32 11.299 0.627 10.516 242 HB3 LYS 32 HB1 LYS 32 11.790 0.488 12.196 243 HG2 LYS 32 HG2 LYS 32 9.617 1.538 12.837 244 HG3 LYS 32 HG1 LYS 32 9.137 1.428 11.140 245 HD2 LYS 32 HD2 LYS 32 9.915 -0.884 12.920 246 HD3 LYS 32 HD1 LYS 32 8.275 -0.473 12.417 247 HE2 LYS 32 HE2 LYS 32 8.878 -0.892 10.090 248 HE3 LYS 32 HE1 LYS 32 10.537 -1.239 10.570 249 HZ1 LYS 32 HZ1 LYS 32 8.921 -3.184 10.190 250 HZ2 LYS 32 HZ2 LYS 32 8.310 -2.794 11.716 251 HZ3 LYS 32 HZ3 LYS 32 9.941 -3.225 11.543 252 H TYR 33 HN TYR 33 13.184 2.082 13.519 253 HA TYR 33 HA TYR 33 11.420 3.452 15.368 254 HB2 TYR 33 HB2 TYR 33 14.079 2.524 16.297 255 HB3 TYR 33 HB1 TYR 33 12.495 2.343 17.041 256 HD1 TYR 33 HD1 TYR 33 10.879 0.643 15.839 257 HD2 TYR 33 HD2 TYR 33 15.105 0.691 15.362 258 HE1 TYR 33 HE1 TYR 33 10.817 -1.701 15.103 259 HE2 TYR 33 HE2 TYR 33 15.054 -1.650 14.623 260 HH TYR 33 HH TYR 33 12.337 -3.214 13.610 261 H GLU 34 HN GLU 34 13.897 4.383 13.358 262 HA GLU 34 HA GLU 34 14.843 6.486 15.160 263 HB2 GLU 34 HB2 GLU 34 15.889 5.654 12.451 264 HB3 GLU 34 HB1 GLU 34 16.623 6.835 13.528 265 HG2 GLU 34 HG2 GLU 34 16.880 5.057 15.230 266 HG3 GLU 34 HG1 GLU 34 16.283 3.892 14.051 267 H LEU 35 HN LEU 35 12.356 6.123 13.162 268 HA LEU 35 HA LEU 35 12.525 8.723 11.855 269 HB2 LEU 35 HB2 LEU 35 10.573 6.443 11.712 270 HB3 LEU 35 HB1 LEU 35 10.170 8.020 11.060 271 HG LEU 35 HG LEU 35 12.581 6.418 10.199 272 HD11 LEU 35 HD11 LEU 35 10.528 5.234 9.635 273 HD12 LEU 35 HD12 LEU 35 11.301 5.890 8.192 274 HD13 LEU 35 HD13 LEU 35 9.888 6.691 8.880 275 HD21 LEU 35 HD21 LEU 35 12.854 8.779 9.804 276 HD22 LEU 35 HD22 LEU 35 11.247 8.887 9.088 277 HD23 LEU 35 HD23 LEU 35 12.517 7.975 8.269 278 H SER 36 HN SER 36 10.414 10.046 11.945 279 HA SER 36 HA SER 36 9.848 10.480 14.777 280 HB2 SER 36 HB2 SER 36 8.770 12.261 12.634 281 HB3 SER 36 HB1 SER 36 9.400 12.675 14.227 282 HG SER 36 HG SER 36 10.945 11.822 11.986 283 H ASP 37 H ASP 37 8.603 8.641 12.421 284 HA ASP 37 HA ASP 37 6.708 7.397 12.194 285 HB2 ASP 37 3HB ASP 37 5.822 8.947 14.726 286 HB3 ASP 37 2HB ASP 37 4.834 7.711 13.957 287 H ASN 38 HN ASN 38 6.972 10.628 11.708 288 HA ASN 38 HA ASN 38 4.231 10.966 10.719 289 HB2 ASN 38 HB2 ASN 38 5.205 12.811 12.062 290 HB3 ASN 38 HB1 ASN 38 6.492 12.979 10.871 291 HD21 ASN 38 HD21 ASN 38 3.109 13.447 11.523 292 HD22 ASN 38 HD22 ASN 38 2.798 14.504 10.191 293 H GLU 39 HN GLU 39 7.574 10.919 9.726 294 HA GLU 39 HA GLU 39 6.963 11.256 6.919 295 HB2 GLU 39 HB2 GLU 39 9.648 10.307 7.573 296 HB3 GLU 39 HB1 GLU 39 9.149 11.745 6.697 297 HG2 GLU 39 HG2 GLU 39 10.244 12.640 8.500 298 HG3 GLU 39 HG1 GLU 39 8.569 12.673 9.046 299 H LEU 40 HN LEU 40 6.802 8.777 9.088 300 HA LEU 40 HA LEU 40 7.889 6.571 7.755 301 HB2 LEU 40 HB2 LEU 40 7.161 6.527 10.094 302 HB3 LEU 40 HB1 LEU 40 5.492 6.712 9.591 303 HG LEU 40 HG LEU 40 5.692 4.506 8.404 304 HD11 LEU 40 HD11 LEU 40 8.055 4.319 8.128 305 HD12 LEU 40 HD12 LEU 40 7.539 3.031 9.218 306 HD13 LEU 40 HD13 LEU 40 8.324 4.470 9.867 307 HD21 LEU 40 HD21 LEU 40 4.607 4.704 10.575 308 HD22 LEU 40 HD22 LEU 40 6.162 4.528 11.385 309 HD23 LEU 40 HD23 LEU 40 5.492 3.187 10.456 310 H ALA 41 HN ALA 41 4.949 8.346 7.266 311 HA ALA 41 HA ALA 41 3.468 6.454 5.812 312 HB1 ALA 41 HB1 ALA 41 3.403 9.447 5.476 313 HB2 ALA 41 HB2 ALA 41 2.568 8.572 6.757 314 HB3 ALA 41 HB3 ALA 41 2.126 8.303 5.073 315 H VAL 42 HN VAL 42 5.510 9.138 4.628 316 HA VAL 42 HA VAL 42 5.318 8.255 1.917 317 HB VAL 42 HB VAL 42 7.148 9.938 1.493 318 HG11 VAL 42 HG11 VAL 42 4.803 10.492 1.212 319 HG12 VAL 42 HG12 VAL 42 5.680 11.871 1.876 320 HG13 VAL 42 HG13 VAL 42 4.666 10.882 2.926 321 HG21 VAL 42 HG21 VAL 42 7.696 11.508 3.282 322 HG22 VAL 42 HG22 VAL 42 8.185 9.868 3.710 323 HG23 VAL 42 HG23 VAL 42 6.728 10.567 4.415 324 H PHE 43 HN PHE 43 7.406 7.528 4.568 325 HA PHE 43 HA PHE 43 9.675 6.655 3.133 326 HB2 PHE 43 HB2 PHE 43 9.565 7.103 5.615 327 HB3 PHE 43 HB1 PHE 43 8.698 5.581 5.789 328 HD1 PHE 43 HD1 PHE 43 11.863 6.979 4.441 329 HD2 PHE 43 HD2 PHE 43 9.882 3.632 6.162 330 HE1 PHE 43 HE1 PHE 43 14.011 5.796 4.592 331 HE2 PHE 43 HE2 PHE 43 12.033 2.439 6.318 332 HZ PHE 43 HZ PHE 43 14.101 3.523 5.533 333 H TYR 44 HN TYR 44 6.721 5.023 4.180 334 HA TYR 44 HA TYR 44 7.407 2.406 3.435 335 HB2 TYR 44 HB2 TYR 44 4.889 3.881 3.986 336 HB3 TYR 44 HB1 TYR 44 4.740 2.388 3.063 337 HD1 TYR 44 HD1 TYR 44 6.597 0.571 4.241 338 HD2 TYR 44 HD2 TYR 44 4.222 3.532 6.164 339 HE1 TYR 44 HE1 TYR 44 6.671 -0.735 6.319 340 HE2 TYR 44 HE2 TYR 44 4.289 2.231 8.254 341 HH TYR 44 HH TYR 44 6.428 -0.039 8.939 342 H SER 45 HN SER 45 5.717 4.972 1.673 343 HA SER 45 HA SER 45 5.218 3.567 -0.687 344 HB2 SER 45 HB2 SER 45 5.763 6.525 -0.364 345 HB3 SER 45 HB1 SER 45 4.907 5.759 -1.702 346 HG SER 45 HG SER 45 3.170 5.647 -0.541 347 H ALA 46 HN ALA 46 8.047 5.395 0.350 348 HA ALA 46 HA ALA 46 9.403 5.340 -2.135 349 HB1 ALA 46 HB1 ALA 46 9.947 6.930 -0.341 350 HB2 ALA 46 HB2 ALA 46 11.366 6.028 -0.873 351 HB3 ALA 46 HB3 ALA 46 10.566 5.602 0.640 352 H ALA 47 HN ALA 47 9.494 3.262 0.726 353 HA ALA 47 HA ALA 47 11.531 1.533 -0.200 354 HB1 ALA 47 HB1 ALA 47 10.776 1.730 2.173 355 HB2 ALA 47 HB2 ALA 47 10.898 0.072 1.585 356 HB3 ALA 47 HB3 ALA 47 9.320 0.843 1.725 357 H ASP 48 HN ASP 48 8.001 1.363 -0.322 358 HA ASP 48 HA ASP 48 7.726 -1.122 -1.557 359 HB2 ASP 48 HB2 ASP 48 6.022 1.347 -1.472 360 HB3 ASP 48 HB1 ASP 48 5.567 0.015 -2.527 361 H HIS 49 HN HIS 49 8.154 2.100 -2.935 362 HA HIS 49 HA HIS 49 7.893 1.373 -5.648 363 HB2 HIS 49 HB2 HIS 49 7.951 3.729 -4.571 364 HB3 HIS 49 HB1 HIS 49 9.697 3.584 -4.689 365 HD1 HIS 49 HD1 HIS 49 6.807 4.663 -6.541 366 HD2 HIS 49 HD2 HIS 49 10.565 3.162 -7.506 367 HE1 HIS 49 HE1 HIS 49 7.187 5.288 -8.948 368 HE2 HIS 49 HE2 HIS 49 9.377 4.191 -9.566 369 H ARG 50 HN ARG 50 10.727 1.713 -3.557 370 HA ARG 50 HA ARG 50 12.662 1.087 -5.492 371 HB2 ARG 50 HB2 ARG 50 13.212 2.180 -3.380 372 HB3 ARG 50 HB1 ARG 50 12.736 0.740 -2.491 373 HG2 ARG 50 HG2 ARG 50 15.170 0.960 -2.687 374 HG3 ARG 50 HG1 ARG 50 14.564 -0.511 -3.450 375 HD2 ARG 50 HD2 ARG 50 14.679 0.577 -5.636 376 HD3 ARG 50 HD1 ARG 50 15.267 2.053 -4.875 377 HE ARG 50 HE ARG 50 17.089 0.267 -4.072 378 HH11 ARG 50 HH11 ARG 50 15.738 0.968 -7.241 379 HH12 ARG 50 HH12 ARG 50 17.169 0.453 -8.085 380 HH21 ARG 50 HH21 ARG 50 18.954 -0.410 -5.178 381 HH22 ARG 50 HH22 ARG 50 19.006 -0.321 -6.913 382 H LEU 51 HN LEU 51 10.794 -0.937 -3.284 383 HA LEU 51 HA LEU 51 12.224 -3.324 -3.834 384 HB2 LEU 51 HB2 LEU 51 10.808 -2.936 -1.819 385 HB3 LEU 51 HB1 LEU 51 9.388 -3.044 -2.840 386 HG LEU 51 HG LEU 51 9.960 -5.365 -3.397 387 HD11 LEU 51 HD11 LEU 51 12.219 -4.992 -1.432 388 HD12 LEU 51 HD12 LEU 51 12.384 -5.241 -3.172 389 HD13 LEU 51 HD13 LEU 51 11.725 -6.522 -2.155 390 HD21 LEU 51 HD21 LEU 51 8.492 -4.859 -1.481 391 HD22 LEU 51 HD22 LEU 51 9.903 -4.868 -0.424 392 HD23 LEU 51 HD23 LEU 51 9.414 -6.344 -1.252 393 H ALA 52 HN ALA 52 9.261 -1.896 -5.153 394 HA ALA 52 HA ALA 52 8.491 -4.033 -6.780 395 HB1 ALA 52 HB1 ALA 52 7.226 -2.341 -8.067 396 HB2 ALA 52 HB2 ALA 52 8.057 -1.075 -7.159 397 HB3 ALA 52 HB3 ALA 52 6.996 -2.210 -6.322 398 H GLU 53 HN GLU 53 10.513 -1.211 -7.609 399 HA GLU 53 HA GLU 53 10.934 -2.017 -10.293 400 HB2 GLU 53 HB2 GLU 53 12.757 -0.340 -10.293 401 HB3 GLU 53 HB1 GLU 53 11.242 0.301 -9.677 402 HG2 GLU 53 HG2 GLU 53 12.100 -0.020 -7.377 403 HG3 GLU 53 HG1 GLU 53 13.641 -0.534 -8.065 404 H LEU 54 HN LEU 54 12.621 -2.709 -7.300 405 HA LEU 54 HA LEU 54 14.935 -3.831 -8.525 406 HB2 LEU 54 HB2 LEU 54 14.592 -2.921 -6.122 407 HB3 LEU 54 HB1 LEU 54 13.975 -4.523 -5.768 408 HG LEU 54 HG LEU 54 16.080 -5.537 -6.174 409 HD11 LEU 54 HD11 LEU 54 18.029 -4.145 -6.966 410 HD12 LEU 54 HD12 LEU 54 16.851 -2.910 -7.419 411 HD13 LEU 54 HD13 LEU 54 16.797 -4.504 -8.176 412 HD21 LEU 54 HD21 LEU 54 15.977 -4.439 -4.032 413 HD22 LEU 54 HD22 LEU 54 16.487 -2.912 -4.750 414 HD23 LEU 54 HD23 LEU 54 17.603 -4.276 -4.690 415 H THR 55 HN THR 55 11.866 -5.108 -7.413 416 HA THR 55 HA THR 55 12.543 -7.846 -7.545 417 HB THR 55 HB THR 55 9.809 -6.593 -7.858 418 HG1 THR 55 HG1 THR 55 10.740 -5.982 -5.895 419 HG21 THR 55 HG21 THR 55 9.066 -8.799 -6.879 420 HG22 THR 55 HG22 THR 55 10.696 -9.403 -7.186 421 HG23 THR 55 HG23 THR 55 9.679 -8.880 -8.532 422 H MET 56 HN MET 56 11.453 -5.548 -9.971 423 HA MET 56 HA MET 56 11.235 -7.706 -11.941 424 HB2 MET 56 HB2 MET 56 10.353 -4.837 -11.928 425 HB3 MET 56 HB1 MET 56 10.491 -5.726 -13.440 426 HG2 MET 56 HG2 MET 56 8.733 -6.391 -11.095 427 HG3 MET 56 HG1 MET 56 8.225 -5.811 -12.679 428 HE1 MET 56 HE1 MET 56 10.165 -7.808 -14.665 429 HE2 MET 56 HE2 MET 56 8.590 -7.035 -14.832 430 HE3 MET 56 HE3 MET 56 8.735 -8.783 -15.016 431 H ASN 57 HN ASN 57 13.569 -5.741 -10.740 432 HA ASN 57 HA ASN 57 15.628 -5.067 -11.400 433 HB2 ASN 57 HB2 ASN 57 15.742 -7.516 -12.000 434 HB3 ASN 57 HB1 ASN 57 15.319 -7.069 -13.648 435 HD21 ASN 57 HD21 ASN 57 17.281 -7.955 -14.365 436 HD22 ASN 57 HD22 ASN 57 18.776 -7.104 -14.169 437 H LYS 58 HN LYS 58 13.611 -3.422 -12.203 438 HA LYS 58 HA LYS 58 14.829 -2.113 -14.456 439 HB2 LYS 58 HB2 LYS 58 13.100 -3.879 -15.296 440 HB3 LYS 58 HB1 LYS 58 11.905 -2.714 -14.747 441 HG2 LYS 58 HG2 LYS 58 12.337 -2.473 -17.119 442 HG3 LYS 58 HG1 LYS 58 12.845 -1.033 -16.237 443 HD2 LYS 58 HD2 LYS 58 15.078 -1.441 -16.588 444 HD3 LYS 58 HD1 LYS 58 14.846 -3.183 -16.731 445 HE2 LYS 58 HE2 LYS 58 15.452 -2.151 -18.874 446 HE3 LYS 58 HE1 LYS 58 13.857 -2.902 -18.921 447 HZ1 LYS 58 HZ1 LYS 58 13.914 -0.718 -19.995 448 HZ2 LYS 58 HZ2 LYS 58 14.350 -0.002 -18.525 449 HZ3 LYS 58 HZ3 LYS 58 12.844 -0.747 -18.688 450 H LEU 59 HN LEU 59 14.934 -0.069 -13.793 451 HA LEU 59 HA LEU 59 13.290 0.934 -11.699 452 HB2 LEU 59 HB2 LEU 59 15.570 1.882 -13.266 453 HB3 LEU 59 HB1 LEU 59 14.458 3.155 -12.803 454 HG LEU 59 HG LEU 59 14.690 2.435 -10.432 455 HD11 LEU 59 HD11 LEU 59 15.322 0.121 -10.779 456 HD12 LEU 59 HD12 LEU 59 16.558 0.958 -9.839 457 HD13 LEU 59 HD13 LEU 59 16.826 0.623 -11.550 458 HD21 LEU 59 HD21 LEU 59 16.008 4.283 -11.315 459 HD22 LEU 59 HD22 LEU 59 17.261 3.153 -11.836 460 HD23 LEU 59 HD23 LEU 59 16.926 3.365 -10.120 461 H TYR 60 HN TYR 60 11.386 1.855 -11.804 462 HA TYR 60 HA TYR 60 10.503 3.031 -14.354 463 HB2 TYR 60 HB2 TYR 60 9.077 1.059 -12.592 464 HB3 TYR 60 HB1 TYR 60 8.165 2.172 -13.602 465 HD1 TYR 60 HD1 TYR 60 9.261 2.229 -16.149 466 HD2 TYR 60 HD2 TYR 60 9.276 -1.047 -13.441 467 HE1 TYR 60 HE1 TYR 60 9.471 0.680 -18.038 468 HE2 TYR 60 HE2 TYR 60 9.484 -2.611 -15.329 469 HH TYR 60 HH TYR 60 8.919 -2.597 -17.812 470 H ASP 61 HN ASP 61 9.407 4.933 -14.204 471 HA ASP 61 HA ASP 61 9.534 6.384 -11.755 472 HB2 ASP 61 HB2 ASP 61 8.041 7.054 -14.305 473 HB3 ASP 61 HB1 ASP 61 8.355 8.176 -12.984 474 H LYS 62 HN LYS 62 7.074 4.609 -13.456 475 HA LYS 62 HA LYS 62 5.207 5.095 -11.234 476 HB2 LYS 62 HB2 LYS 62 3.394 4.966 -12.686 477 HB3 LYS 62 HB1 LYS 62 4.591 5.788 -13.674 478 HG2 LYS 62 HG2 LYS 62 4.788 4.068 -15.122 479 HG3 LYS 62 HG1 LYS 62 4.550 2.845 -13.870 480 HD2 LYS 62 HD2 LYS 62 2.360 4.598 -14.976 481 HD3 LYS 62 HD1 LYS 62 2.702 2.964 -15.536 482 HE2 LYS 62 HE2 LYS 62 1.855 1.994 -13.664 483 HE3 LYS 62 HE1 LYS 62 2.327 3.334 -12.625 484 HZ1 LYS 62 HZ1 LYS 62 0.045 3.329 -14.515 485 HZ2 LYS 62 HZ2 LYS 62 0.502 4.635 -13.547 486 HZ3 LYS 62 HZ3 LYS 62 -0.059 3.207 -12.836 487 H ILE 63 HN ILE 63 3.899 3.189 -10.603 488 HA ILE 63 HA ILE 63 5.401 0.710 -11.123 489 HB ILE 63 HB ILE 63 3.945 1.477 -8.593 490 HG12 ILE 63 HG12 ILE 63 6.072 2.685 -8.915 491 HG13 ILE 63 HG11 ILE 63 6.161 1.556 -7.570 492 HG21 ILE 63 HG21 ILE 63 3.838 -0.934 -9.101 493 HG22 ILE 63 HG22 ILE 63 4.792 -0.584 -7.655 494 HG23 ILE 63 HG23 ILE 63 5.600 -0.972 -9.172 495 HD11 ILE 63 HD11 ILE 63 7.319 -0.052 -9.064 496 HD12 ILE 63 HD12 ILE 63 8.201 1.455 -8.808 497 HD13 ILE 63 HD13 ILE 63 7.328 1.189 -10.320 498 HA PRO 64 HA PRO 64 1.537 -0.747 -12.847 499 HB2 PRO 64 HB2 PRO 64 2.826 -3.399 -12.706 500 HB3 PRO 64 HB1 PRO 64 2.253 -2.506 -14.122 501 HG2 PRO 64 HG2 PRO 64 4.856 -2.859 -13.620 502 HG3 PRO 64 HG1 PRO 64 4.225 -1.396 -14.406 503 HD2 PRO 64 HD2 PRO 64 5.119 -1.792 -11.587 504 HD3 PRO 64 HD1 PRO 64 5.320 -0.388 -12.655 505 H SER 65 HN SER 65 -0.255 -1.321 -11.797 506 HA SER 65 HA SER 65 -0.396 -1.932 -9.106 507 HB2 SER 65 HB2 SER 65 -2.572 -2.867 -10.927 508 HB3 SER 65 HB1 SER 65 -2.685 -1.986 -9.405 509 HG SER 65 HG SER 65 -1.977 -0.123 -10.458 510 H SER 66 H SER 66 -0.105 -4.135 -11.816 511 HA SER 66 HA SER 66 -0.823 -6.461 -10.182 512 HB2 SER 66 3HB SER 66 -0.545 -7.776 -12.248 513 HB3 SER 66 2HB SER 66 -1.539 -6.375 -12.608 514 HG SER 66 HG SER 66 0.361 -5.358 -13.461 515 H VAL 67 HN VAL 67 1.902 -4.641 -10.258 516 HA VAL 67 HA VAL 67 3.740 -6.903 -10.305 517 HB VAL 67 HB VAL 67 4.148 -4.436 -11.211 518 HG11 VAL 67 HG11 VAL 67 5.294 -4.309 -8.425 519 HG12 VAL 67 HG12 VAL 67 3.908 -3.380 -8.999 520 HG13 VAL 67 HG13 VAL 67 5.503 -3.115 -9.703 521 HG21 VAL 67 HG21 VAL 67 5.657 -6.241 -11.606 522 HG22 VAL 67 HG22 VAL 67 6.192 -6.231 -9.925 523 HG23 VAL 67 HG23 VAL 67 6.585 -4.877 -10.984 524 H TRP 68 HN TRP 68 1.934 -5.097 -8.051 525 HA TRP 68 HA TRP 68 3.624 -5.271 -5.794 526 HB2 TRP 68 HB2 TRP 68 0.614 -5.061 -5.955 527 HB3 TRP 68 HB1 TRP 68 1.552 -4.865 -4.480 528 HD1 TRP 68 HD1 TRP 68 0.055 -2.900 -7.152 529 HE1 TRP 68 HE1 TRP 68 0.991 -0.497 -7.194 530 HE3 TRP 68 HE3 TRP 68 4.135 -3.590 -4.149 531 HZ2 TRP 68 HZ2 TRP 68 3.184 0.901 -6.093 532 HZ3 TRP 68 HZ3 TRP 68 5.606 -1.669 -3.700 533 HH2 TRP 68 HH2 TRP 68 5.135 0.530 -4.654 534 H LYS 69 HN LYS 69 1.777 -7.630 -7.418 535 HA LYS 69 HA LYS 69 1.247 -9.378 -5.250 536 HB2 LYS 69 HB2 LYS 69 0.024 -9.563 -7.347 537 HB3 LYS 69 HB1 LYS 69 1.509 -9.918 -8.214 538 HG2 LYS 69 HG2 LYS 69 0.340 -11.962 -7.931 539 HG3 LYS 69 HG1 LYS 69 1.723 -11.992 -6.838 540 HD2 LYS 69 HD2 LYS 69 -0.085 -10.972 -5.163 541 HD3 LYS 69 HD1 LYS 69 -1.180 -11.850 -6.235 542 HE2 LYS 69 HE2 LYS 69 -0.681 -13.439 -4.627 543 HE3 LYS 69 HE1 LYS 69 0.474 -13.817 -5.903 544 HZ1 LYS 69 HZ1 LYS 69 0.989 -12.371 -3.363 545 HZ2 LYS 69 HZ2 LYS 69 2.093 -12.393 -4.651 546 HZ3 LYS 69 HZ3 LYS 69 1.656 -13.837 -3.887 547 H PHE 70 HN PHE 70 4.085 -8.667 -7.072 548 HA PHE 70 HA PHE 70 5.426 -11.141 -6.346 549 HB2 PHE 70 HB2 PHE 70 6.363 -8.701 -7.862 550 HB3 PHE 70 HB1 PHE 70 7.375 -10.105 -7.534 551 HD1 PHE 70 HD1 PHE 70 6.645 -12.343 -8.452 552 HD2 PHE 70 HD2 PHE 70 4.912 -8.659 -9.702 553 HE1 PHE 70 HE1 PHE 70 5.791 -13.440 -10.477 554 HE2 PHE 70 HE2 PHE 70 4.049 -9.753 -11.730 555 HZ PHE 70 HZ PHE 70 4.484 -12.149 -12.118 556 H ILE 71 HN ILE 71 4.735 -8.291 -4.844 557 HA ILE 71 HA ILE 71 7.241 -7.963 -3.430 558 HB ILE 71 HB ILE 71 4.663 -6.484 -3.553 559 HG12 ILE 71 HG12 ILE 71 6.238 -4.536 -3.543 560 HG13 ILE 71 HG11 ILE 71 7.575 -5.671 -3.441 561 HG21 ILE 71 HG21 ILE 71 5.251 -5.170 -1.522 562 HG22 ILE 71 HG22 ILE 71 6.454 -6.397 -1.134 563 HG23 ILE 71 HG23 ILE 71 4.746 -6.825 -1.188 564 HD11 ILE 71 HD11 ILE 71 7.378 -6.305 -5.613 565 HD12 ILE 71 HD12 ILE 71 6.763 -4.654 -5.732 566 HD13 ILE 71 HD13 ILE 71 5.640 -6.011 -5.661 567 H ARG 72 HN ARG 72 7.730 -8.863 -1.531 568 HA ARG 72 HA ARG 72 5.588 -10.170 0.000 569 HB2 ARG 72 HB2 ARG 72 8.364 -11.235 -0.559 570 HB3 ARG 72 HB1 ARG 72 7.227 -11.954 0.573 571 HG2 ARG 72 HG2 ARG 72 5.683 -12.436 -1.225 572 HG3 ARG 72 HG1 ARG 72 6.747 -11.636 -2.386 573 HD2 ARG 72 HD2 ARG 72 6.882 -14.154 -2.324 574 HD3 ARG 72 HD1 ARG 72 8.415 -13.303 -2.131 575 HE ARG 72 HE ARG 72 6.964 -14.147 0.266 576 HH11 ARG 72 HH11 ARG 72 9.663 -14.607 -1.912 577 HH12 ARG 72 HH12 ARG 72 10.610 -15.485 -0.757 578 HH21 ARG 72 HH21 ARG 72 8.201 -15.306 1.785 579 HH22 ARG 72 HH22 ARG 72 9.772 -15.896 1.344 580 H GLU 3 HN GLU 3 -4.722 7.785 11.359 581 HA GLU 3 HA GLU 3 -1.975 6.901 10.998 582 HB2 GLU 3 HB2 GLU 3 -2.199 5.772 13.099 583 HB3 GLU 3 HB1 GLU 3 -2.921 7.363 13.275 584 HG2 GLU 3 HG2 GLU 3 -4.537 4.891 12.710 585 HG3 GLU 3 HG1 GLU 3 -4.160 5.442 14.339 586 H ALA 4 HN ALA 4 -5.246 5.685 10.632 587 HA ALA 4 HA ALA 4 -4.640 2.978 10.196 588 HB1 ALA 4 HB1 ALA 4 -6.931 4.614 9.109 589 HB2 ALA 4 HB2 ALA 4 -6.905 3.728 10.631 590 HB3 ALA 4 HB3 ALA 4 -6.841 2.851 9.105 591 H LEU 5 HN LEU 5 -4.822 5.706 7.967 592 HA LEU 5 HA LEU 5 -4.386 4.174 5.610 593 HB2 LEU 5 HB2 LEU 5 -4.341 7.089 6.277 594 HB3 LEU 5 HB1 LEU 5 -3.710 6.554 4.732 595 HG LEU 5 HG LEU 5 -5.947 5.462 4.308 596 HD11 LEU 5 HD11 LEU 5 -7.853 6.230 5.597 597 HD12 LEU 5 HD12 LEU 5 -6.783 7.121 6.680 598 HD13 LEU 5 HD13 LEU 5 -6.716 5.359 6.627 599 HD21 LEU 5 HD21 LEU 5 -5.667 8.432 4.628 600 HD22 LEU 5 HD22 LEU 5 -7.090 7.687 3.895 601 HD23 LEU 5 HD23 LEU 5 -5.500 7.460 3.165 602 H LYS 6 HN LYS 6 -2.347 5.172 8.110 603 HA LYS 6 HA LYS 6 0.060 5.420 6.545 604 HB2 LYS 6 HB2 LYS 6 -0.418 6.565 8.777 605 HB3 LYS 6 HB1 LYS 6 -0.126 5.004 9.528 606 HG2 LYS 6 HG2 LYS 6 2.146 4.990 8.720 607 HG3 LYS 6 HG1 LYS 6 1.871 6.489 7.828 608 HD2 LYS 6 HD2 LYS 6 1.760 6.137 10.828 609 HD3 LYS 6 HD1 LYS 6 3.042 6.934 9.916 610 HE2 LYS 6 HE2 LYS 6 1.330 8.569 9.096 611 HE3 LYS 6 HE1 LYS 6 0.176 7.829 10.202 612 HZ1 LYS 6 HZ1 LYS 6 2.727 8.719 11.321 613 HZ2 LYS 6 HZ2 LYS 6 1.178 8.730 12.004 614 HZ3 LYS 6 HZ3 LYS 6 1.610 9.915 10.875 615 H ILE 7 HN ILE 7 -1.479 2.958 8.560 616 HA ILE 7 HA ILE 7 0.718 1.100 8.158 617 HB ILE 7 HB ILE 7 -0.618 -0.471 9.513 618 HG12 ILE 7 HG12 ILE 7 -2.621 1.801 9.660 619 HG13 ILE 7 HG11 ILE 7 -2.866 0.276 8.813 620 HG21 ILE 7 HG21 ILE 7 -0.482 0.768 11.616 621 HG22 ILE 7 HG22 ILE 7 -0.356 2.281 10.718 622 HG23 ILE 7 HG23 ILE 7 0.924 1.072 10.593 623 HD11 ILE 7 HD11 ILE 7 -3.978 0.430 11.031 624 HD12 ILE 7 HD12 ILE 7 -2.378 0.488 11.771 625 HD13 ILE 7 HD13 ILE 7 -2.878 -0.938 10.860 626 H LEU 8 HN LEU 8 -2.292 1.868 6.704 627 HA LEU 8 HA LEU 8 -2.667 -0.698 5.431 628 HB2 LEU 8 HB2 LEU 8 -4.310 1.444 5.996 629 HB3 LEU 8 HB1 LEU 8 -4.065 1.598 4.270 630 HG LEU 8 HG LEU 8 -4.756 -0.881 4.141 631 HD11 LEU 8 HD11 LEU 8 -4.635 -1.472 6.456 632 HD12 LEU 8 HD12 LEU 8 -6.325 -1.535 5.961 633 HD13 LEU 8 HD13 LEU 8 -5.733 -0.167 6.900 634 HD21 LEU 8 HD21 LEU 8 -6.130 0.901 3.274 635 HD22 LEU 8 HD22 LEU 8 -6.721 1.277 4.893 636 HD23 LEU 8 HD23 LEU 8 -7.149 -0.256 4.134 637 H ASN 9 HN ASN 9 -0.625 1.858 4.933 638 HA ASN 9 HA ASN 9 -0.663 2.014 2.082 639 HB2 ASN 9 HB2 ASN 9 0.158 3.839 3.576 640 HB3 ASN 9 HB1 ASN 9 1.550 2.836 3.969 641 HD21 ASN 9 HD21 ASN 9 2.781 4.639 3.148 642 HD22 ASN 9 HD22 ASN 9 3.046 4.796 1.447 643 H ASN 10 HN ASN 10 1.100 0.073 4.429 644 HA ASN 10 HA ASN 10 2.700 -1.056 2.250 645 HB2 ASN 10 HB2 ASN 10 3.859 -0.278 4.339 646 HB3 ASN 10 HB1 ASN 10 3.046 -1.577 5.202 647 HD21 ASN 10 HD21 ASN 10 5.209 -0.922 2.483 648 HD22 ASN 10 HD22 ASN 10 6.041 -2.432 2.560 649 H ILE 11 HN ILE 11 2.655 -3.156 1.677 650 HA ILE 11 HA ILE 11 0.224 -4.563 2.039 651 HB ILE 11 HB ILE 11 2.828 -5.521 0.842 652 HG12 ILE 11 HG12 ILE 11 0.379 -4.384 -0.519 653 HG13 ILE 11 HG11 ILE 11 1.859 -3.482 -0.206 654 HG21 ILE 11 HG21 ILE 11 0.036 -6.632 0.645 655 HG22 ILE 11 HG22 ILE 11 1.450 -7.413 1.355 656 HG23 ILE 11 HG23 ILE 11 1.381 -7.126 -0.385 657 HD11 ILE 11 HD11 ILE 11 3.087 -5.070 -1.627 658 HD12 ILE 11 HD12 ILE 11 1.801 -4.231 -2.493 659 HD13 ILE 11 HD13 ILE 11 1.571 -5.901 -1.973 660 H ARG 12 HN ARG 12 3.388 -4.862 3.567 661 HA ARG 12 HA ARG 12 2.990 -7.456 4.646 662 HB2 ARG 12 HB2 ARG 12 4.831 -5.207 5.420 663 HB3 ARG 12 HB1 ARG 12 4.819 -6.747 6.268 664 HG2 ARG 12 HG2 ARG 12 5.410 -7.913 4.241 665 HG3 ARG 12 HG1 ARG 12 5.312 -6.413 3.320 666 HD2 ARG 12 HD2 ARG 12 7.162 -5.485 4.548 667 HD3 ARG 12 HD1 ARG 12 7.212 -6.892 5.607 668 HE ARG 12 HE ARG 12 7.521 -7.655 2.884 669 HH11 ARG 12 HH11 ARG 12 9.229 -6.247 5.597 670 HH12 ARG 12 HH12 ARG 12 10.797 -6.764 5.060 671 HH21 ARG 12 HH21 ARG 12 9.578 -8.315 2.144 672 HH22 ARG 12 HH22 ARG 12 11.003 -7.921 3.087 673 H THR 13 HN THR 13 2.259 -4.228 5.879 674 HA THR 13 HA THR 13 1.451 -5.178 8.462 675 HB THR 13 HB THR 13 0.246 -2.752 8.258 676 HG1 THR 13 HG1 THR 13 0.904 -1.841 6.473 677 HG21 THR 13 HG21 THR 13 2.204 -1.829 9.347 678 HG22 THR 13 HG22 THR 13 3.196 -3.163 8.759 679 HG23 THR 13 HG23 THR 13 1.920 -3.468 9.936 680 H LEU 14 HN LEU 14 -0.116 -4.458 5.416 681 HA LEU 14 HA LEU 14 -2.798 -4.591 6.344 682 HB2 LEU 14 HB2 LEU 14 -2.127 -3.449 4.280 683 HB3 LEU 14 HB1 LEU 14 -1.638 -4.981 3.583 684 HG LEU 14 HG LEU 14 -3.915 -5.738 3.463 685 HD11 LEU 14 HD11 LEU 14 -4.509 -3.271 5.078 686 HD12 LEU 14 HD12 LEU 14 -4.917 -4.946 5.443 687 HD13 LEU 14 HD13 LEU 14 -5.750 -4.102 4.140 688 HD21 LEU 14 HD21 LEU 14 -3.602 -2.889 2.527 689 HD22 LEU 14 HD22 LEU 14 -4.876 -3.986 1.995 690 HD23 LEU 14 HD23 LEU 14 -3.188 -4.352 1.633 691 H ARG 15 HN ARG 15 -0.596 -6.952 4.888 692 HA ARG 15 HA ARG 15 -2.318 -9.080 4.443 693 HB2 ARG 15 HB2 ARG 15 0.577 -8.796 5.004 694 HB3 ARG 15 HB1 ARG 15 -0.106 -10.401 5.240 695 HG2 ARG 15 HG2 ARG 15 -0.928 -10.380 2.926 696 HG3 ARG 15 HG1 ARG 15 -0.201 -8.785 2.694 697 HD2 ARG 15 HD2 ARG 15 2.003 -9.760 3.261 698 HD3 ARG 15 HD1 ARG 15 1.248 -11.347 3.361 699 HE ARG 15 HE ARG 15 0.651 -10.998 0.942 700 HH11 ARG 15 HH11 ARG 15 3.455 -9.477 2.400 701 HH12 ARG 15 HH12 ARG 15 4.306 -9.297 0.906 702 HH21 ARG 15 HH21 ARG 15 1.784 -10.790 -1.040 703 HH22 ARG 15 HH22 ARG 15 3.354 -10.023 -1.059 704 H ALA 16 HN ALA 16 -0.725 -8.125 7.448 705 HA ALA 16 HA ALA 16 -1.361 -10.393 8.976 706 HB1 ALA 16 HB1 ALA 16 0.339 -8.702 9.571 707 HB2 ALA 16 HB2 ALA 16 -0.765 -9.082 10.895 708 HB3 ALA 16 HB3 ALA 16 -0.964 -7.586 9.982 709 H GLN 17 HN GLN 17 -3.033 -7.229 8.830 710 HA GLN 17 HA GLN 17 -5.126 -8.064 10.578 711 HB2 GLN 17 HB2 GLN 17 -4.413 -5.689 10.248 712 HB3 GLN 17 HB1 GLN 17 -5.153 -5.732 8.651 713 HG2 GLN 17 HG2 GLN 17 -7.081 -5.138 9.561 714 HG3 GLN 17 HG1 GLN 17 -7.091 -6.646 10.470 715 HE21 GLN 17 HE21 GLN 17 -6.407 -6.659 12.618 716 HE22 GLN 17 HE22 GLN 17 -6.256 -5.191 13.529 717 H ALA 18 HN ALA 18 -4.541 -8.479 7.237 718 HA ALA 18 HA ALA 18 -7.263 -8.759 6.406 719 HB1 ALA 18 HB1 ALA 18 -4.787 -9.810 5.046 720 HB2 ALA 18 HB2 ALA 18 -5.419 -8.173 4.863 721 HB3 ALA 18 HB3 ALA 18 -6.373 -9.553 4.319 722 H ARG 19 HN ARG 19 -5.251 -10.718 8.263 723 HA ARG 19 HA ARG 19 -6.308 -13.237 7.325 724 HB2 ARG 19 HB2 ARG 19 -4.666 -12.712 9.802 725 HB3 ARG 19 HB1 ARG 19 -4.988 -14.274 9.071 726 HG2 ARG 19 HG2 ARG 19 -3.248 -12.064 8.024 727 HG3 ARG 19 HG1 ARG 19 -2.791 -13.709 8.458 728 HD2 ARG 19 HD2 ARG 19 -4.584 -12.953 6.150 729 HD3 ARG 19 HD1 ARG 19 -2.876 -13.360 6.017 730 HE ARG 19 HE ARG 19 -4.433 -15.416 7.285 731 HH11 ARG 19 HH11 ARG 19 -3.353 -14.119 4.222 732 HH12 ARG 19 HH12 ARG 19 -3.646 -15.591 3.339 733 HH21 ARG 19 HH21 ARG 19 -4.773 -17.381 6.145 734 HH22 ARG 19 HH22 ARG 19 -4.411 -17.462 4.440 735 H GLU 20 HN GLU 20 -7.257 -10.837 9.587 736 HA GLU 20 HA GLU 20 -8.910 -12.737 11.076 737 HB2 GLU 20 HB2 GLU 20 -9.419 -10.881 12.580 738 HB3 GLU 20 HB1 GLU 20 -7.683 -11.080 12.392 739 HG2 GLU 20 HG2 GLU 20 -7.811 -9.243 10.654 740 HG3 GLU 20 HG1 GLU 20 -9.449 -8.954 11.236 741 H CYS 21 H CYS 21 -9.118 -10.645 8.434 742 HA CYS 21 HA CYS 21 -12.043 -10.362 8.668 743 HB2 CYS 21 3HB CYS 21 -9.989 -9.181 6.672 744 HB3 CYS 21 2HB CYS 21 -11.728 -8.872 6.581 745 HG CYS 21 HG CYS 21 -11.892 -7.230 8.294 746 H THR 22 HN THR 22 -13.429 -11.524 7.552 747 HA THR 22 HA THR 22 -12.664 -13.897 6.262 748 HB THR 22 HB THR 22 -15.306 -12.748 5.571 749 HG1 THR 22 HG1 THR 22 -14.898 -13.576 8.252 750 HG21 THR 22 HG21 THR 22 -14.509 -15.148 5.257 751 HG22 THR 22 HG22 THR 22 -16.080 -14.923 6.021 752 HG23 THR 22 HG23 THR 22 -14.669 -15.308 7.005 753 H LEU 23 HN LEU 23 -12.880 -14.506 4.040 754 HA LEU 23 HA LEU 23 -11.759 -12.770 2.180 755 HB2 LEU 23 HB2 LEU 23 -11.805 -15.234 1.947 756 HB3 LEU 23 HB1 LEU 23 -13.527 -15.159 1.628 757 HG LEU 23 HG LEU 23 -13.021 -13.798 -0.419 758 HD11 LEU 23 HD11 LEU 23 -10.184 -14.594 0.209 759 HD12 LEU 23 HD12 LEU 23 -10.840 -12.957 0.260 760 HD13 LEU 23 HD13 LEU 23 -10.740 -13.819 -1.276 761 HD21 LEU 23 HD21 LEU 23 -12.616 -15.655 -1.752 762 HD22 LEU 23 HD22 LEU 23 -13.284 -16.369 -0.285 763 HD23 LEU 23 HD23 LEU 23 -11.545 -16.396 -0.566 764 H GLU 24 HN GLU 24 -15.129 -13.572 2.802 765 HA GLU 24 HA GLU 24 -16.390 -12.179 0.768 766 HB2 GLU 24 HB2 GLU 24 -17.138 -13.492 3.153 767 HB3 GLU 24 HB1 GLU 24 -17.834 -11.883 3.246 768 HG2 GLU 24 HG2 GLU 24 -19.467 -13.261 2.263 769 HG3 GLU 24 HG1 GLU 24 -18.797 -12.282 0.957 770 H THR 25 HN THR 25 -15.522 -11.055 4.021 771 HA THR 25 HA THR 25 -16.457 -8.429 3.767 772 HB THR 25 HB THR 25 -14.072 -8.954 5.467 773 HG1 THR 25 HG1 THR 25 -16.602 -9.961 6.241 774 HG21 THR 25 HG21 THR 25 -15.260 -6.814 5.617 775 HG22 THR 25 HG22 THR 25 -15.433 -7.721 7.121 776 HG23 THR 25 HG23 THR 25 -16.766 -7.659 5.967 777 H LEU 26 HN LEU 26 -13.266 -9.843 3.152 778 HA LEU 26 HA LEU 26 -11.893 -7.446 2.658 779 HB2 LEU 26 HB2 LEU 26 -11.409 -10.262 1.706 780 HB3 LEU 26 HB1 LEU 26 -10.316 -8.939 1.345 781 HG LEU 26 HG LEU 26 -11.049 -9.719 4.164 782 HD11 LEU 26 HD11 LEU 26 -9.024 -10.850 2.308 783 HD12 LEU 26 HD12 LEU 26 -9.981 -11.645 3.559 784 HD13 LEU 26 HD13 LEU 26 -8.595 -10.650 4.005 785 HD21 LEU 26 HD21 LEU 26 -9.088 -8.457 4.772 786 HD22 LEU 26 HD22 LEU 26 -10.149 -7.443 3.792 787 HD23 LEU 26 HD23 LEU 26 -8.704 -8.163 3.075 788 H GLU 27 HN GLU 27 -13.611 -9.625 0.432 789 HA GLU 27 HA GLU 27 -12.991 -8.099 -1.890 790 HB2 GLU 27 HB2 GLU 27 -15.250 -10.048 -1.394 791 HB3 GLU 27 HB1 GLU 27 -14.805 -9.405 -2.969 792 HG2 GLU 27 HG2 GLU 27 -12.671 -10.501 -2.866 793 HG3 GLU 27 HG1 GLU 27 -12.979 -11.026 -1.209 794 H GLU 28 HN GLU 28 -15.688 -8.171 0.365 795 HA GLU 28 HA GLU 28 -17.418 -6.419 -0.968 796 HB2 GLU 28 HB2 GLU 28 -17.580 -7.887 1.293 797 HB3 GLU 28 HB1 GLU 28 -17.360 -6.290 1.991 798 HG2 GLU 28 HG2 GLU 28 -19.285 -5.833 0.106 799 HG3 GLU 28 HG1 GLU 28 -19.678 -7.457 0.662 800 H MET 29 HN MET 29 -14.878 -5.765 1.439 801 HA MET 29 HA MET 29 -15.400 -2.948 1.435 802 HB2 MET 29 HB2 MET 29 -13.491 -2.730 2.891 803 HB3 MET 29 HB1 MET 29 -14.459 -4.101 3.408 804 HG2 MET 29 HG2 MET 29 -12.380 -4.998 3.569 805 HG3 MET 29 HG1 MET 29 -12.766 -5.445 1.911 806 HE1 MET 29 HE1 MET 29 -10.539 -3.210 4.262 807 HE2 MET 29 HE2 MET 29 -11.677 -2.057 3.563 808 HE3 MET 29 HE3 MET 29 -9.970 -1.984 3.129 809 H LEU 30 HN LEU 30 -13.330 -5.084 -0.375 810 HA LEU 30 HA LEU 30 -11.426 -3.281 -1.320 811 HB2 LEU 30 HB2 LEU 30 -11.158 -5.640 -1.707 812 HB3 LEU 30 HB1 LEU 30 -12.654 -5.712 -2.618 813 HG LEU 30 HG LEU 30 -11.557 -4.201 -4.331 814 HD11 LEU 30 HD11 LEU 30 -9.766 -3.451 -2.734 815 HD12 LEU 30 HD12 LEU 30 -9.209 -3.936 -4.334 816 HD13 LEU 30 HD13 LEU 30 -9.012 -5.029 -2.962 817 HD21 LEU 30 HD21 LEU 30 -10.086 -6.794 -3.988 818 HD22 LEU 30 HD22 LEU 30 -10.582 -5.995 -5.478 819 HD23 LEU 30 HD23 LEU 30 -11.790 -6.740 -4.432 820 H GLU 31 HN GLU 31 -14.585 -4.162 -2.660 821 HA GLU 31 HA GLU 31 -14.470 -2.463 -4.907 822 HB2 GLU 31 HB2 GLU 31 -16.970 -3.347 -3.469 823 HB3 GLU 31 HB1 GLU 31 -16.810 -2.891 -5.158 824 HG2 GLU 31 HG2 GLU 31 -15.240 -4.850 -5.403 825 HG3 GLU 31 HG1 GLU 31 -15.783 -5.354 -3.803 826 H LYS 32 HN LYS 32 -15.495 -1.956 -1.596 827 HA LYS 32 HA LYS 32 -16.814 0.507 -1.982 828 HB2 LYS 32 HB2 LYS 32 -15.437 -0.530 0.499 829 HB3 LYS 32 HB1 LYS 32 -16.567 0.815 0.445 830 HG2 LYS 32 HG2 LYS 32 -18.280 -0.804 -0.438 831 HG3 LYS 32 HG1 LYS 32 -17.131 -2.092 -0.072 832 HD2 LYS 32 HD2 LYS 32 -17.072 -0.959 2.282 833 HD3 LYS 32 HD1 LYS 32 -18.630 -0.298 1.781 834 HE2 LYS 32 HE2 LYS 32 -17.881 -3.217 1.871 835 HE3 LYS 32 HE1 LYS 32 -18.910 -2.378 3.030 836 HZ1 LYS 32 HZ1 LYS 32 -20.480 -1.934 1.219 837 HZ2 LYS 32 HZ2 LYS 32 -20.238 -3.595 1.442 838 HZ3 LYS 32 HZ3 LYS 32 -19.500 -2.799 0.141 839 H LEU 33 HN LEU 33 -13.444 -0.259 -1.103 840 HA LEU 33 HA LEU 33 -12.689 2.485 -0.919 841 HB2 LEU 33 HB2 LEU 33 -11.425 0.674 0.177 842 HB3 LEU 33 HB1 LEU 33 -10.960 0.051 -1.394 843 HG LEU 33 HG LEU 33 -9.751 2.192 -1.832 844 HD11 LEU 33 HD11 LEU 33 -11.047 3.582 -0.262 845 HD12 LEU 33 HD12 LEU 33 -9.304 3.717 -0.030 846 HD13 LEU 33 HD13 LEU 33 -10.269 2.747 1.083 847 HD21 LEU 33 HD21 LEU 33 -7.919 1.746 -0.162 848 HD22 LEU 33 HD22 LEU 33 -8.431 0.365 -1.134 849 HD23 LEU 33 HD23 LEU 33 -8.976 0.520 0.538 850 H GLU 34 HN GLU 34 -12.692 0.094 -3.480 851 HA GLU 34 HA GLU 34 -11.171 1.481 -5.373 852 HB2 GLU 34 HB2 GLU 34 -11.883 -0.928 -5.496 853 HB3 GLU 34 HB1 GLU 34 -13.480 -0.367 -5.961 854 HG2 GLU 34 HG2 GLU 34 -12.164 0.917 -7.814 855 HG3 GLU 34 HG1 GLU 34 -10.934 -0.304 -7.493 856 H VAL 35 HN VAL 35 -14.719 1.462 -4.856 857 HA VAL 35 HA VAL 35 -15.274 3.186 -7.010 858 HB VAL 35 HB VAL 35 -17.457 3.622 -5.964 859 HG11 VAL 35 HG11 VAL 35 -16.479 0.793 -6.124 860 HG12 VAL 35 HG12 VAL 35 -17.350 1.723 -7.343 861 HG13 VAL 35 HG13 VAL 35 -18.173 1.201 -5.875 862 HG21 VAL 35 HG21 VAL 35 -16.351 2.009 -3.669 863 HG22 VAL 35 HG22 VAL 35 -18.055 2.405 -3.888 864 HG23 VAL 35 HG23 VAL 35 -16.878 3.691 -3.631 865 H VAL 36 HN VAL 36 -14.310 3.876 -3.703 866 HA VAL 36 HA VAL 36 -14.932 6.657 -3.802 867 HB VAL 36 HB VAL 36 -12.862 5.283 -2.064 868 HG11 VAL 36 HG11 VAL 36 -14.234 7.959 -1.769 869 HG12 VAL 36 HG12 VAL 36 -12.545 7.713 -2.209 870 HG13 VAL 36 HG13 VAL 36 -13.119 7.244 -0.607 871 HG21 VAL 36 HG21 VAL 36 -15.646 6.072 -1.262 872 HG22 VAL 36 HG22 VAL 36 -14.517 5.016 -0.414 873 HG23 VAL 36 HG23 VAL 36 -15.276 4.475 -1.911 874 H VAL 37 HN VAL 37 -12.040 4.728 -4.478 875 HA VAL 37 HA VAL 37 -10.342 6.906 -5.100 876 HB VAL 37 HB VAL 37 -10.237 4.021 -6.021 877 HG11 VAL 37 HG11 VAL 37 -8.097 6.135 -6.227 878 HG12 VAL 37 HG12 VAL 37 -9.020 5.469 -7.577 879 HG13 VAL 37 HG13 VAL 37 -7.926 4.432 -6.656 880 HG21 VAL 37 HG21 VAL 37 -8.434 3.845 -4.330 881 HG22 VAL 37 HG22 VAL 37 -10.008 4.230 -3.631 882 HG23 VAL 37 HG23 VAL 37 -8.794 5.495 -3.821 883 H ASN 38 HN ASN 38 -12.551 4.912 -6.961 884 HA ASN 38 HA ASN 38 -12.010 5.927 -9.520 885 HB2 ASN 38 HB2 ASN 38 -13.297 3.908 -9.269 886 HB3 ASN 38 HB1 ASN 38 -14.522 4.740 -8.319 887 HD21 ASN 38 HD21 ASN 38 -16.149 4.084 -9.712 888 HD22 ASN 38 HD22 ASN 38 -16.357 4.783 -11.280 889 H GLU 39 HN GLU 39 -14.296 6.928 -7.024 890 HA GLU 39 HA GLU 39 -15.545 9.003 -8.416 891 HB2 GLU 39 HB2 GLU 39 -15.117 8.365 -5.533 892 HB3 GLU 39 HB1 GLU 39 -15.664 9.983 -5.947 893 HG2 GLU 39 HG2 GLU 39 -17.641 9.166 -6.940 894 HG3 GLU 39 HG1 GLU 39 -17.054 7.505 -6.903 895 H ARG 40 HN ARG 40 -12.750 9.087 -6.217 896 HA ARG 40 HA ARG 40 -12.148 11.802 -6.517 897 HB2 ARG 40 HB2 ARG 40 -10.566 9.398 -5.694 898 HB3 ARG 40 HB1 ARG 40 -9.751 10.939 -5.927 899 HG2 ARG 40 HG2 ARG 40 -12.078 10.497 -4.066 900 HG3 ARG 40 HG1 ARG 40 -10.380 10.507 -3.586 901 HD2 ARG 40 HD2 ARG 40 -12.016 12.785 -4.680 902 HD3 ARG 40 HD1 ARG 40 -11.230 12.663 -3.108 903 HE ARG 40 HE ARG 40 -9.833 13.028 -5.683 904 HH11 ARG 40 HH11 ARG 40 -9.926 13.342 -2.181 905 HH12 ARG 40 HH12 ARG 40 -8.434 14.220 -2.105 906 HH21 ARG 40 HH21 ARG 40 -7.903 14.188 -5.587 907 HH22 ARG 40 HH22 ARG 40 -7.280 14.710 -4.044 908 H ARG 41 HN ARG 41 -11.141 8.990 -8.390 909 HA ARG 41 HA ARG 41 -9.206 10.172 -10.013 910 HB2 ARG 41 HB2 ARG 41 -11.100 7.878 -10.389 911 HB3 ARG 41 HB1 ARG 41 -10.143 8.434 -11.751 912 HG2 ARG 41 HG2 ARG 41 -8.100 7.937 -10.596 913 HG3 ARG 41 HG1 ARG 41 -8.984 7.561 -9.114 914 HD2 ARG 41 HD2 ARG 41 -10.015 5.654 -10.141 915 HD3 ARG 41 HD1 ARG 41 -9.341 6.077 -11.712 916 HE ARG 41 HE ARG 41 -7.173 5.764 -10.027 917 HH11 ARG 41 HH11 ARG 41 -9.831 3.770 -11.161 918 HH12 ARG 41 HH12 ARG 41 -8.940 2.287 -11.033 919 HH21 ARG 41 HH21 ARG 41 -5.998 3.833 -9.891 920 HH22 ARG 41 HH22 ARG 41 -6.742 2.323 -10.329 921 H GLU 42 HN GLU 42 -12.715 9.903 -10.468 922 HA GLU 42 HA GLU 42 -12.856 11.168 -12.964 923 HB2 GLU 42 HB2 GLU 42 -14.670 9.839 -11.717 924 HB3 GLU 42 HB1 GLU 42 -15.009 11.339 -10.862 925 HG2 GLU 42 HG2 GLU 42 -16.526 10.999 -12.742 926 HG3 GLU 42 HG1 GLU 42 -15.540 12.447 -12.947 927 H GLU 43 HN GLU 43 -13.130 12.490 -9.679 928 HA GLU 43 HA GLU 43 -13.665 15.149 -10.467 929 HB2 GLU 43 HB2 GLU 43 -12.255 14.342 -7.921 930 HB3 GLU 43 HB1 GLU 43 -13.278 15.751 -8.187 931 HG2 GLU 43 HG2 GLU 43 -15.173 14.126 -8.597 932 HG3 GLU 43 HG1 GLU 43 -14.102 12.871 -7.984 933 H GLU 44 HN GLU 44 -10.688 13.365 -9.925 934 HA GLU 44 HA GLU 44 -8.925 15.573 -10.003 935 HB2 GLU 44 HB2 GLU 44 -8.734 12.792 -9.652 936 HB3 GLU 44 HB1 GLU 44 -7.712 13.166 -11.031 937 HG2 GLU 44 HG2 GLU 44 -6.467 13.185 -8.936 938 HG3 GLU 44 HG1 GLU 44 -6.469 14.773 -9.703 939 H SER 45 HN SER 45 -10.196 13.427 -12.523 940 HA SER 45 HA SER 45 -8.596 14.665 -14.574 941 HB2 SER 45 HB2 SER 45 -10.248 13.270 -16.062 942 HB3 SER 45 HB1 SER 45 -9.020 12.446 -15.103 943 HG SER 45 HG SER 45 -11.767 12.793 -14.456 944 H ALA 46 HN ALA 46 -11.729 15.215 -13.197 945 HA ALA 46 HA ALA 46 -12.735 16.702 -15.454 946 HB1 ALA 46 HB1 ALA 46 -14.280 15.491 -14.031 947 HB2 ALA 46 HB2 ALA 46 -14.627 17.215 -13.968 948 HB3 ALA 46 HB3 ALA 46 -13.772 16.440 -12.638 949 H GLU 3 HN GLU 3 -10.975 -2.746 15.812 950 HA GLU 3 HA GLU 3 -13.170 -1.269 14.974 951 HB2 GLU 3 HB2 GLU 3 -10.805 0.176 16.075 952 HB3 GLU 3 HB1 GLU 3 -12.501 0.338 16.486 953 HG2 GLU 3 HG2 GLU 3 -11.572 -0.607 18.378 954 HG3 GLU 3 HG1 GLU 3 -12.264 -1.988 17.533 955 H ALA 4 HN ALA 4 -9.762 -0.816 14.114 956 HA ALA 4 HA ALA 4 -9.997 1.480 12.574 957 HB1 ALA 4 HB1 ALA 4 -8.026 -0.783 12.303 958 HB2 ALA 4 HB2 ALA 4 -7.851 0.658 13.304 959 HB3 ALA 4 HB3 ALA 4 -7.859 0.802 11.550 960 H LEU 5 HN LEU 5 -10.216 -1.912 11.527 961 HA LEU 5 HA LEU 5 -10.634 -1.157 8.781 962 HB2 LEU 5 HB2 LEU 5 -10.250 -3.652 10.280 963 HB3 LEU 5 HB1 LEU 5 -11.320 -3.789 8.899 964 HG LEU 5 HG LEU 5 -8.973 -4.380 8.375 965 HD11 LEU 5 HD11 LEU 5 -10.055 -1.947 6.965 966 HD12 LEU 5 HD12 LEU 5 -10.422 -3.633 6.595 967 HD13 LEU 5 HD13 LEU 5 -8.795 -3.009 6.338 968 HD21 LEU 5 HD21 LEU 5 -7.336 -2.512 8.155 969 HD22 LEU 5 HD22 LEU 5 -7.761 -2.905 9.821 970 HD23 LEU 5 HD23 LEU 5 -8.462 -1.487 9.045 971 H LYS 6 HN LYS 6 -12.649 -1.513 11.503 972 HA LYS 6 HA LYS 6 -14.986 -2.451 10.180 973 HB2 LYS 6 HB2 LYS 6 -14.584 -2.580 12.645 974 HB3 LYS 6 HB1 LYS 6 -14.858 -0.845 12.734 975 HG2 LYS 6 HG2 LYS 6 -17.121 -1.147 11.894 976 HG3 LYS 6 HG1 LYS 6 -16.854 -2.887 11.775 977 HD2 LYS 6 HD2 LYS 6 -16.424 -2.932 14.223 978 HD3 LYS 6 HD1 LYS 6 -16.850 -1.220 14.292 979 HE2 LYS 6 HE2 LYS 6 -19.072 -1.775 13.363 980 HE3 LYS 6 HE1 LYS 6 -18.635 -3.483 13.414 981 HZ1 LYS 6 HZ1 LYS 6 -18.469 -3.382 15.784 982 HZ2 LYS 6 HZ2 LYS 6 -19.965 -2.736 15.337 983 HZ3 LYS 6 HZ3 LYS 6 -18.707 -1.706 15.788 984 H ILE 7 HN ILE 7 -13.662 0.763 10.753 985 HA ILE 7 HA ILE 7 -16.056 2.132 9.995 986 HB ILE 7 HB ILE 7 -14.699 4.167 9.943 987 HG12 ILE 7 HG12 ILE 7 -12.341 2.381 10.573 988 HG13 ILE 7 HG11 ILE 7 -12.652 3.080 8.986 989 HG21 ILE 7 HG21 ILE 7 -15.561 3.472 12.071 990 HG22 ILE 7 HG22 ILE 7 -13.924 4.093 12.308 991 HG23 ILE 7 HG23 ILE 7 -14.214 2.354 12.299 992 HD11 ILE 7 HD11 ILE 7 -12.565 5.338 10.109 993 HD12 ILE 7 HD12 ILE 7 -11.044 4.449 10.025 994 HD13 ILE 7 HD13 ILE 7 -11.954 4.499 11.536 995 H LEU 8 HN LEU 8 -13.877 0.369 8.197 996 HA LEU 8 HA LEU 8 -14.008 2.055 5.833 997 HB2 LEU 8 HB2 LEU 8 -12.598 -0.465 6.566 998 HB3 LEU 8 HB1 LEU 8 -12.877 -0.132 4.867 999 HG LEU 8 HG LEU 8 -11.804 2.222 5.588 1000 HD11 LEU 8 HD11 LEU 8 -10.245 0.295 7.266 1001 HD12 LEU 8 HD12 LEU 8 -11.542 1.277 7.940 1002 HD13 LEU 8 HD13 LEU 8 -10.136 2.052 7.209 1003 HD21 LEU 8 HD21 LEU 8 -10.200 -0.244 4.929 1004 HD22 LEU 8 HD22 LEU 8 -9.723 1.432 4.653 1005 HD23 LEU 8 HD23 LEU 8 -11.082 0.747 3.767 1006 H ASN 9 HN ASN 9 -15.974 -0.167 7.336 1007 HA ASN 9 HA ASN 9 -17.001 -1.484 4.988 1008 HB2 ASN 9 HB2 ASN 9 -17.045 -2.541 7.250 1009 HB3 ASN 9 HB1 ASN 9 -18.218 -1.330 7.759 1010 HD21 ASN 9 HD21 ASN 9 -17.669 -4.200 5.933 1011 HD22 ASN 9 HD22 ASN 9 -19.321 -4.547 5.560 1012 H ASN 10 HN ASN 10 -17.721 1.332 6.869 1013 HA ASN 10 HA ASN 10 -20.230 1.810 5.472 1014 HB2 ASN 10 HB2 ASN 10 -20.211 2.343 7.843 1015 HB3 ASN 10 HB1 ASN 10 -18.797 3.370 7.642 1016 HD21 ASN 10 HD21 ASN 10 -19.917 5.093 8.571 1017 HD22 ASN 10 HD22 ASN 10 -21.124 5.977 7.701 1018 H ILE 11 HN ILE 11 -20.219 2.792 3.569 1019 HA ILE 11 HA ILE 11 -17.910 3.888 2.399 1020 HB ILE 11 HB ILE 11 -19.936 2.935 1.199 1021 HG12 ILE 11 HG12 ILE 11 -19.698 4.599 -0.725 1022 HG13 ILE 11 HG11 ILE 11 -18.633 5.517 0.336 1023 HG21 ILE 11 HG21 ILE 11 -21.638 4.636 0.515 1024 HG22 ILE 11 HG22 ILE 11 -20.995 5.689 1.776 1025 HG23 ILE 11 HG23 ILE 11 -21.717 4.138 2.203 1026 HD11 ILE 11 HD11 ILE 11 -18.187 2.645 -0.442 1027 HD12 ILE 11 HD12 ILE 11 -17.088 3.694 0.455 1028 HD13 ILE 11 HD13 ILE 11 -17.445 4.032 -1.237 1029 H ARG 12 HN ARG 12 -20.358 5.326 4.394 1030 HA ARG 12 HA ARG 12 -20.014 8.016 3.588 1031 HB2 ARG 12 HB2 ARG 12 -20.929 6.903 6.246 1032 HB3 ARG 12 HB1 ARG 12 -21.053 8.589 5.766 1033 HG2 ARG 12 HG2 ARG 12 -22.390 6.290 4.363 1034 HG3 ARG 12 HG1 ARG 12 -23.168 7.367 5.521 1035 HD2 ARG 12 HD2 ARG 12 -22.539 9.275 4.008 1036 HD3 ARG 12 HD1 ARG 12 -22.034 8.074 2.823 1037 HE ARG 12 HE ARG 12 -24.597 7.376 3.485 1038 HH11 ARG 12 HH11 ARG 12 -23.040 10.227 2.185 1039 HH12 ARG 12 HH12 ARG 12 -24.445 10.753 1.320 1040 HH21 ARG 12 HH21 ARG 12 -26.443 8.054 2.344 1041 HH22 ARG 12 HH22 ARG 12 -26.386 9.511 1.405 1042 H THR 13 HN THR 13 -18.511 6.097 6.184 1043 HA THR 13 HA THR 13 -16.864 8.268 7.064 1044 HB THR 13 HB THR 13 -15.599 6.135 8.094 1045 HG1 THR 13 HG1 THR 13 -16.686 4.396 7.551 1046 HG21 THR 13 HG21 THR 13 -18.256 7.175 9.090 1047 HG22 THR 13 HG22 THR 13 -16.694 7.949 9.356 1048 HG23 THR 13 HG23 THR 13 -17.023 6.366 10.062 1049 H LEU 14 HN LEU 14 -16.480 5.481 4.961 1050 HA LEU 14 HA LEU 14 -13.704 5.640 4.568 1051 HB2 LEU 14 HB2 LEU 14 -15.169 3.715 3.940 1052 HB3 LEU 14 HB1 LEU 14 -15.777 4.669 2.602 1053 HG LEU 14 HG LEU 14 -13.510 4.735 1.627 1054 HD11 LEU 14 HD11 LEU 14 -11.773 3.256 2.536 1055 HD12 LEU 14 HD12 LEU 14 -12.812 2.901 3.919 1056 HD13 LEU 14 HD13 LEU 14 -12.202 4.537 3.673 1057 HD21 LEU 14 HD21 LEU 14 -15.027 3.014 0.888 1058 HD22 LEU 14 HD22 LEU 14 -14.602 1.996 2.262 1059 HD23 LEU 14 HD23 LEU 14 -13.406 2.335 1.015 1060 H ARG 15 HN ARG 15 -16.398 7.008 2.694 1061 HA ARG 15 HA ARG 15 -14.829 8.269 0.731 1062 HB2 ARG 15 HB2 ARG 15 -17.287 7.816 0.608 1063 HB3 ARG 15 HB1 ARG 15 -17.541 9.138 1.732 1064 HG2 ARG 15 HG2 ARG 15 -16.600 10.703 0.135 1065 HG3 ARG 15 HG1 ARG 15 -16.290 9.380 -0.989 1066 HD2 ARG 15 HD2 ARG 15 -19.051 9.805 0.057 1067 HD3 ARG 15 HD1 ARG 15 -18.445 10.842 -1.230 1068 HE ARG 15 HE ARG 15 -18.105 8.811 -2.567 1069 HH11 ARG 15 HH11 ARG 15 -20.301 8.630 0.178 1070 HH12 ARG 15 HH12 ARG 15 -21.191 7.288 -0.466 1071 HH21 ARG 15 HH21 ARG 15 -19.258 7.056 -3.401 1072 HH22 ARG 15 HH22 ARG 15 -20.588 6.384 -2.495 1073 H ALA 16 HN ALA 16 -15.723 9.223 3.962 1074 HA ALA 16 HA ALA 16 -14.927 11.974 3.613 1075 HB1 ALA 16 HB1 ALA 16 -15.380 12.214 5.986 1076 HB2 ALA 16 HB2 ALA 16 -15.542 10.463 6.151 1077 HB3 ALA 16 HB3 ALA 16 -16.710 11.371 5.189 1078 H GLN 17 HN GLN 17 -13.592 9.058 5.082 1079 HA GLN 17 HA GLN 17 -11.289 10.266 6.208 1080 HB2 GLN 17 HB2 GLN 17 -12.315 7.956 6.713 1081 HB3 GLN 17 HB1 GLN 17 -11.451 7.400 5.287 1082 HG2 GLN 17 HG2 GLN 17 -9.886 6.885 6.822 1083 HG3 GLN 17 HG1 GLN 17 -9.423 8.565 6.566 1084 HE21 GLN 17 HE21 GLN 17 -9.234 6.689 8.905 1085 HE22 GLN 17 HE22 GLN 17 -9.934 7.560 10.224 1086 H ALA 18 HN ALA 18 -12.049 9.024 3.031 1087 HA ALA 18 HA ALA 18 -9.416 8.811 2.031 1088 HB1 ALA 18 HB1 ALA 18 -11.494 7.797 1.040 1089 HB2 ALA 18 HB2 ALA 18 -10.401 8.565 -0.111 1090 HB3 ALA 18 HB3 ALA 18 -11.871 9.393 0.393 1091 H ARG 19 HN ARG 19 -11.368 11.534 2.694 1092 HA ARG 19 HA ARG 19 -10.169 13.292 0.760 1093 HB2 ARG 19 HB2 ARG 19 -11.791 13.941 3.227 1094 HB3 ARG 19 HB1 ARG 19 -11.401 15.057 1.926 1095 HG2 ARG 19 HG2 ARG 19 -12.715 13.724 0.366 1096 HG3 ARG 19 HG1 ARG 19 -13.066 12.563 1.647 1097 HD2 ARG 19 HD2 ARG 19 -14.286 14.226 2.887 1098 HD3 ARG 19 HD1 ARG 19 -13.825 15.475 1.734 1099 HE ARG 19 HE ARG 19 -15.850 13.422 1.377 1100 HH11 ARG 19 HH11 ARG 19 -13.960 15.999 -0.059 1101 HH12 ARG 19 HH12 ARG 19 -15.031 16.197 -1.410 1102 HH21 ARG 19 HH21 ARG 19 -17.286 13.727 -0.401 1103 HH22 ARG 19 HH22 ARG 19 -16.903 14.916 -1.605 1104 H GLU 20 HN GLU 20 -9.058 11.902 3.545 1105 HA GLU 20 HA GLU 20 -7.648 14.117 4.686 1106 HB2 GLU 20 HB2 GLU 20 -7.877 11.211 5.193 1107 HB3 GLU 20 HB1 GLU 20 -6.369 11.964 5.688 1108 HG2 GLU 20 HG2 GLU 20 -8.626 13.540 6.543 1109 HG3 GLU 20 HG1 GLU 20 -8.752 11.876 7.112 1110 H CYS 21 H CYS 21 -7.014 11.872 2.120 1111 HA CYS 21 HA CYS 21 -4.287 13.018 1.881 1112 HB2 CYS 21 3HB CYS 21 -5.082 10.041 1.556 1113 HB3 CYS 21 2HB CYS 21 -3.490 10.688 1.142 1114 HG CYS 21 HG CYS 21 -2.562 10.795 3.329 1115 H THR 22 HN THR 22 -3.356 12.688 -0.267 1116 HA THR 22 HA THR 22 -5.194 13.591 -2.266 1117 HB THR 22 HB THR 22 -2.880 13.218 -3.623 1118 HG1 THR 22 HG1 THR 22 -1.180 13.121 -2.287 1119 HG21 THR 22 HG21 THR 22 -4.095 15.356 -3.259 1120 HG22 THR 22 HG22 THR 22 -2.346 15.531 -3.116 1121 HG23 THR 22 HG23 THR 22 -3.347 15.475 -1.664 1122 H LEU 23 HN LEU 23 -5.319 12.619 -4.442 1123 HA LEU 23 HA LEU 23 -6.196 9.983 -4.388 1124 HB2 LEU 23 HB2 LEU 23 -6.910 11.532 -6.117 1125 HB3 LEU 23 HB1 LEU 23 -5.282 11.613 -6.759 1126 HG LEU 23 HG LEU 23 -5.455 9.157 -7.282 1127 HD11 LEU 23 HD11 LEU 23 -8.400 9.552 -6.803 1128 HD12 LEU 23 HD12 LEU 23 -7.320 8.743 -5.668 1129 HD13 LEU 23 HD13 LEU 23 -7.567 8.073 -7.277 1130 HD21 LEU 23 HD21 LEU 23 -6.772 9.503 -9.293 1131 HD22 LEU 23 HD22 LEU 23 -5.747 10.903 -8.971 1132 HD23 LEU 23 HD23 LEU 23 -7.470 10.967 -8.602 1133 H GLU 24 HN GLU 24 -3.023 11.270 -5.232 1134 HA GLU 24 HA GLU 24 -1.849 9.043 -6.370 1135 HB2 GLU 24 HB2 GLU 24 -0.825 11.335 -6.050 1136 HB3 GLU 24 HB1 GLU 24 -0.468 10.862 -4.396 1137 HG2 GLU 24 HG2 GLU 24 0.689 8.819 -5.596 1138 HG3 GLU 24 HG1 GLU 24 0.759 9.957 -6.941 1139 H THR 25 HN THR 25 -1.934 9.912 -2.923 1140 HA THR 25 HA THR 25 -0.714 7.548 -1.985 1141 HB THR 25 HB THR 25 -2.540 8.659 -0.051 1142 HG1 THR 25 HG1 THR 25 -2.576 10.599 -1.014 1143 HG21 THR 25 HG21 THR 25 -0.490 7.548 0.575 1144 HG22 THR 25 HG22 THR 25 -0.407 9.232 1.100 1145 HG23 THR 25 HG23 THR 25 0.466 8.710 -0.344 1146 H LEU 26 HN LEU 26 -4.109 8.486 -2.414 1147 HA LEU 26 HA LEU 26 -5.298 6.262 -1.170 1148 HB2 LEU 26 HB2 LEU 26 -6.341 7.938 -3.449 1149 HB3 LEU 26 HB1 LEU 26 -7.304 6.828 -2.495 1150 HG LEU 26 HG LEU 26 -5.967 9.342 -1.491 1151 HD11 LEU 26 HD11 LEU 26 -8.867 8.641 -1.936 1152 HD12 LEU 26 HD12 LEU 26 -7.909 9.793 -2.864 1153 HD13 LEU 26 HD13 LEU 26 -8.275 10.116 -1.171 1154 HD21 LEU 26 HD21 LEU 26 -5.925 7.959 0.368 1155 HD22 LEU 26 HD22 LEU 26 -7.401 7.114 -0.095 1156 HD23 LEU 26 HD23 LEU 26 -7.488 8.760 0.536 1157 H GLU 27 HN GLU 27 -4.415 6.821 -4.567 1158 HA GLU 27 HA GLU 27 -5.390 4.309 -5.471 1159 HB2 GLU 27 HB2 GLU 27 -5.039 6.226 -6.980 1160 HB3 GLU 27 HB1 GLU 27 -3.305 6.105 -6.721 1161 HG2 GLU 27 HG2 GLU 27 -3.141 4.116 -7.908 1162 HG3 GLU 27 HG1 GLU 27 -4.868 3.784 -7.785 1163 H GLU 28 HN GLU 28 -2.221 5.475 -4.435 1164 HA GLU 28 HA GLU 28 -0.712 3.220 -5.085 1165 HB2 GLU 28 HB2 GLU 28 0.124 5.477 -4.310 1166 HB3 GLU 28 HB1 GLU 28 -0.269 4.981 -2.671 1167 HG2 GLU 28 HG2 GLU 28 1.316 3.174 -2.790 1168 HG3 GLU 28 HG1 GLU 28 1.649 3.534 -4.485 1169 H MET 29 HN MET 29 -2.446 3.995 -2.059 1170 HA MET 29 HA MET 29 -1.695 1.545 -0.809 1171 HB2 MET 29 HB2 MET 29 -3.200 2.128 0.962 1172 HB3 MET 29 HB1 MET 29 -2.356 3.582 0.458 1173 HG2 MET 29 HG2 MET 29 -4.328 4.252 -0.838 1174 HG3 MET 29 HG1 MET 29 -5.172 2.813 -0.270 1175 HE1 MET 29 HE1 MET 29 -3.413 6.110 0.709 1176 HE2 MET 29 HE2 MET 29 -2.709 5.080 1.956 1177 HE3 MET 29 HE3 MET 29 -3.862 6.337 2.399 1178 H LEU 30 HN LEU 30 -4.284 2.472 -2.936 1179 HA LEU 30 HA LEU 30 -6.038 0.320 -2.389 1180 HB2 LEU 30 HB2 LEU 30 -6.833 2.241 -3.621 1181 HB3 LEU 30 HB1 LEU 30 -5.648 1.976 -4.884 1182 HG LEU 30 HG LEU 30 -6.836 -0.259 -5.300 1183 HD11 LEU 30 HD11 LEU 30 -9.291 -0.117 -4.667 1184 HD12 LEU 30 HD12 LEU 30 -8.807 1.108 -3.495 1185 HD13 LEU 30 HD13 LEU 30 -8.159 -0.529 -3.379 1186 HD21 LEU 30 HD21 LEU 30 -8.364 0.744 -6.820 1187 HD22 LEU 30 HD22 LEU 30 -6.966 1.815 -6.717 1188 HD23 LEU 30 HD23 LEU 30 -8.454 2.221 -5.859 1189 H GLU 31 HN GLU 31 -3.345 0.756 -4.613 1190 HA GLU 31 HA GLU 31 -3.582 -1.681 -5.994 1191 HB2 GLU 31 HB2 GLU 31 -1.101 -0.058 -5.421 1192 HB3 GLU 31 HB1 GLU 31 -1.238 -1.322 -6.634 1193 HG2 GLU 31 HG2 GLU 31 -3.143 0.111 -7.600 1194 HG3 GLU 31 HG1 GLU 31 -2.472 1.402 -6.607 1195 H LYS 32 HN LYS 32 -2.308 -0.888 -2.875 1196 HA LYS 32 HA LYS 32 -0.793 -3.306 -2.529 1197 HB2 LYS 32 HB2 LYS 32 -1.800 -1.615 -0.258 1198 HB3 LYS 32 HB1 LYS 32 -0.309 -2.534 -0.364 1199 HG2 LYS 32 HG2 LYS 32 -0.806 -0.137 -2.094 1200 HG3 LYS 32 HG1 LYS 32 -0.158 0.006 -0.458 1201 HD2 LYS 32 HD2 LYS 32 1.704 -1.470 -1.085 1202 HD3 LYS 32 HD1 LYS 32 1.060 -1.570 -2.726 1203 HE2 LYS 32 HE2 LYS 32 2.782 0.063 -2.761 1204 HE3 LYS 32 HE1 LYS 32 1.250 0.935 -2.842 1205 HZ1 LYS 32 HZ1 LYS 32 2.488 2.101 -1.283 1206 HZ2 LYS 32 HZ2 LYS 32 3.131 0.706 -0.567 1207 HZ3 LYS 32 HZ3 LYS 32 1.506 1.120 -0.314 1208 H LEU 33 HN LEU 33 -4.025 -2.188 -1.856 1209 HA LEU 33 HA LEU 33 -4.731 -4.365 -0.134 1210 HB2 LEU 33 HB2 LEU 33 -5.828 -2.240 0.132 1211 HB3 LEU 33 HB1 LEU 33 -6.382 -2.264 -1.530 1212 HG LEU 33 HG LEU 33 -7.697 -4.375 -0.856 1213 HD11 LEU 33 HD11 LEU 33 -8.340 -4.424 1.526 1214 HD12 LEU 33 HD12 LEU 33 -7.101 -3.218 1.863 1215 HD13 LEU 33 HD13 LEU 33 -6.642 -4.815 1.269 1216 HD21 LEU 33 HD21 LEU 33 -8.502 -1.733 0.346 1217 HD22 LEU 33 HD22 LEU 33 -9.572 -3.045 -0.151 1218 HD23 LEU 33 HD23 LEU 33 -8.654 -2.147 -1.363 1219 H GLU 34 HN GLU 34 -5.349 -3.591 -3.553 1220 HA GLU 34 HA GLU 34 -7.122 -5.703 -4.030 1221 HB2 GLU 34 HB2 GLU 34 -6.586 -5.416 -6.424 1222 HB3 GLU 34 HB1 GLU 34 -6.978 -3.911 -5.607 1223 HG2 GLU 34 HG2 GLU 34 -4.658 -3.299 -5.523 1224 HG3 GLU 34 HG1 GLU 34 -4.184 -4.855 -6.203 1225 H VAL 35 HN VAL 35 -3.571 -5.650 -4.243 1226 HA VAL 35 HA VAL 35 -3.416 -8.270 -5.350 1227 HB VAL 35 HB VAL 35 -1.015 -8.227 -4.679 1228 HG11 VAL 35 HG11 VAL 35 -0.393 -6.786 -6.387 1229 HG12 VAL 35 HG12 VAL 35 -1.685 -5.641 -6.028 1230 HG13 VAL 35 HG13 VAL 35 -2.061 -7.186 -6.793 1231 HG21 VAL 35 HG21 VAL 35 -1.865 -5.660 -3.387 1232 HG22 VAL 35 HG22 VAL 35 -0.213 -5.896 -3.947 1233 HG23 VAL 35 HG23 VAL 35 -0.889 -6.969 -2.723 1234 H VAL 36 HN VAL 36 -3.699 -7.045 -2.103 1235 HA VAL 36 HA VAL 36 -2.858 -9.399 -0.748 1236 HB VAL 36 HB VAL 36 -4.572 -7.058 0.084 1237 HG11 VAL 36 HG11 VAL 36 -5.330 -9.222 1.187 1238 HG12 VAL 36 HG12 VAL 36 -4.853 -7.914 2.267 1239 HG13 VAL 36 HG13 VAL 36 -3.750 -9.259 1.970 1240 HG21 VAL 36 HG21 VAL 36 -2.702 -6.590 1.573 1241 HG22 VAL 36 HG22 VAL 36 -2.151 -6.717 -0.098 1242 HG23 VAL 36 HG23 VAL 36 -1.887 -8.054 1.022 1243 H VAL 37 HN VAL 37 -5.970 -8.198 -1.908 1244 HA VAL 37 HA VAL 37 -7.562 -10.301 -0.921 1245 HB VAL 37 HB VAL 37 -8.017 -8.572 -3.370 1246 HG11 VAL 37 HG11 VAL 37 -10.449 -9.109 -2.871 1247 HG12 VAL 37 HG12 VAL 37 -9.844 -10.405 -1.837 1248 HG13 VAL 37 HG13 VAL 37 -9.480 -10.413 -3.563 1249 HG21 VAL 37 HG21 VAL 37 -9.464 -7.254 -1.841 1250 HG22 VAL 37 HG22 VAL 37 -7.758 -7.211 -1.406 1251 HG23 VAL 37 HG23 VAL 37 -8.871 -8.231 -0.499 1252 H ASN 38 HN ASN 38 -5.635 -9.901 -3.822 1253 HA ASN 38 HA ASN 38 -6.570 -12.088 -5.309 1254 HB2 ASN 38 HB2 ASN 38 -4.785 -10.147 -5.812 1255 HB3 ASN 38 HB1 ASN 38 -3.665 -11.452 -5.433 1256 HD21 ASN 38 HD21 ASN 38 -3.667 -13.345 -6.761 1257 HD22 ASN 38 HD22 ASN 38 -4.334 -13.286 -8.359 1258 H GLU 39 HN GLU 39 -3.869 -11.845 -3.005 1259 HA GLU 39 HA GLU 39 -3.019 -14.502 -3.141 1260 HB2 GLU 39 HB2 GLU 39 -2.955 -12.922 -0.575 1261 HB3 GLU 39 HB1 GLU 39 -1.814 -14.134 -1.139 1262 HG2 GLU 39 HG2 GLU 39 -1.316 -12.479 -3.037 1263 HG3 GLU 39 HG1 GLU 39 -2.110 -11.290 -2.007 1264 H ARG 40 HN ARG 40 -5.405 -12.959 -1.048 1265 HA ARG 40 HA ARG 40 -6.044 -15.196 0.523 1266 HB2 ARG 40 HB2 ARG 40 -7.662 -12.758 -0.235 1267 HB3 ARG 40 HB1 ARG 40 -8.237 -13.973 0.899 1268 HG2 ARG 40 HG2 ARG 40 -5.711 -12.372 1.242 1269 HG3 ARG 40 HG1 ARG 40 -7.258 -11.990 1.992 1270 HD2 ARG 40 HD2 ARG 40 -5.607 -14.480 2.423 1271 HD3 ARG 40 HD1 ARG 40 -5.837 -13.158 3.564 1272 HE ARG 40 HE ARG 40 -8.080 -13.868 3.897 1273 HH11 ARG 40 HH11 ARG 40 -6.128 -16.092 2.015 1274 HH12 ARG 40 HH12 ARG 40 -7.329 -17.357 2.063 1275 HH21 ARG 40 HH21 ARG 40 -9.597 -15.575 4.013 1276 HH22 ARG 40 HH22 ARG 40 -9.262 -17.074 3.191 1277 H ARG 41 HN ARG 41 -7.252 -14.074 -2.577 1278 HA ARG 41 HA ARG 41 -9.387 -15.907 -2.841 1279 HB2 ARG 41 HB2 ARG 41 -7.723 -14.393 -4.850 1280 HB3 ARG 41 HB1 ARG 41 -9.022 -15.469 -5.344 1281 HG2 ARG 41 HG2 ARG 41 -9.483 -13.220 -3.417 1282 HG3 ARG 41 HG1 ARG 41 -9.544 -12.986 -5.164 1283 HD2 ARG 41 HD2 ARG 41 -11.249 -14.861 -3.534 1284 HD3 ARG 41 HD1 ARG 41 -11.766 -13.368 -4.310 1285 HE ARG 41 HE ARG 41 -10.645 -15.343 -6.100 1286 HH11 ARG 41 HH11 ARG 41 -13.547 -14.005 -4.650 1287 HH12 ARG 41 HH12 ARG 41 -14.598 -14.725 -5.837 1288 HH21 ARG 41 HH21 ARG 41 -12.026 -16.243 -7.660 1289 HH22 ARG 41 HH22 ARG 41 -13.740 -16.002 -7.534 1290 H GLU 42 HN GLU 42 -6.003 -15.993 -3.843 1291 HA GLU 42 HA GLU 42 -6.012 -18.399 -5.250 1292 HB2 GLU 42 HB2 GLU 42 -3.813 -17.110 -3.626 1293 HB3 GLU 42 HB1 GLU 42 -3.565 -18.472 -4.710 1294 HG2 GLU 42 HG2 GLU 42 -3.985 -17.194 -6.609 1295 HG3 GLU 42 HG1 GLU 42 -4.780 -15.920 -5.686 1296 H GLU 43 HN GLU 43 -5.516 -17.782 -1.799 1297 HA GLU 43 HA GLU 43 -4.875 -20.395 -1.023 1298 HB2 GLU 43 HB2 GLU 43 -6.302 -18.239 0.535 1299 HB3 GLU 43 HB1 GLU 43 -5.623 -19.699 1.232 1300 HG2 GLU 43 HG2 GLU 43 -3.393 -19.005 0.598 1301 HG3 GLU 43 HG1 GLU 43 -4.046 -17.567 -0.190 1302 H GLU 44 HN GLU 44 -8.005 -18.728 -0.923 1303 HA GLU 44 HA GLU 44 -9.448 -20.984 -0.004 1304 HB2 GLU 44 HB2 GLU 44 -10.057 -18.236 -0.860 1305 HB3 GLU 44 HB1 GLU 44 -11.363 -19.389 -1.102 1306 HG2 GLU 44 HG2 GLU 44 -11.204 -18.072 1.124 1307 HG3 GLU 44 HG1 GLU 44 -11.617 -19.788 1.151 1308 H SER 45 HN SER 45 -8.508 -19.974 -3.196 1309 HA SER 45 HA SER 45 -10.505 -21.495 -4.567 1310 HB2 SER 45 HB2 SER 45 -7.834 -20.439 -5.525 1311 HB3 SER 45 HB1 SER 45 -9.074 -21.141 -6.567 1312 HG SER 45 HG SER 45 -9.246 -18.779 -4.997 1313 H ALA 46 HN ALA 46 -7.480 -22.211 -3.086 1314 HA ALA 46 HA ALA 46 -7.096 -24.725 -4.461 1315 HB1 ALA 46 HB1 ALA 46 -5.193 -23.341 -3.662 1316 HB2 ALA 46 HB2 ALA 46 -5.159 -25.001 -3.071 1317 HB3 ALA 46 HB3 ALA 46 -5.681 -23.698 -2.006 Start of MODEL 9 1 H LEU 6 HT1 LEU 6 7.668 16.571 3.478 2 HA LEU 6 HA LEU 6 9.682 16.322 2.225 3 HB2 LEU 6 HB2 LEU 6 10.799 15.272 4.370 4 HB3 LEU 6 HB1 LEU 6 10.224 13.763 3.685 5 HG LEU 6 HG LEU 6 11.513 14.222 1.629 6 HD11 LEU 6 HD11 LEU 6 12.637 16.571 3.156 7 HD12 LEU 6 HD12 LEU 6 11.504 16.690 1.812 8 HD13 LEU 6 HD13 LEU 6 13.114 16.030 1.547 9 HD21 LEU 6 HD21 LEU 6 13.638 13.668 2.527 10 HD22 LEU 6 HD22 LEU 6 12.428 12.944 3.586 11 HD23 LEU 6 HD23 LEU 6 13.254 14.424 4.071 12 H THR 7 HN THR 7 9.867 14.672 0.487 13 HA THR 7 HA THR 7 7.283 13.308 0.186 14 HB THR 7 HB THR 7 8.841 13.365 -2.237 15 HG1 THR 7 HG1 THR 7 9.834 15.218 -1.458 16 HG21 THR 7 HG21 THR 7 6.279 14.760 -1.462 17 HG22 THR 7 HG22 THR 7 6.399 13.118 -2.097 18 HG23 THR 7 HG23 THR 7 6.859 14.492 -3.106 19 H LYS 8 HN LYS 8 7.424 11.362 -1.330 20 HA LYS 8 HA LYS 8 8.980 9.353 -0.078 21 HB2 LYS 8 HB2 LYS 8 7.729 9.019 -2.788 22 HB3 LYS 8 HB1 LYS 8 7.909 7.829 -1.507 23 HG2 LYS 8 HG2 LYS 8 6.116 8.684 -0.295 24 HG3 LYS 8 HG1 LYS 8 6.144 10.222 -1.159 25 HD2 LYS 8 HD2 LYS 8 5.505 8.965 -3.236 26 HD3 LYS 8 HD1 LYS 8 5.267 7.540 -2.223 27 HE2 LYS 8 HE2 LYS 8 3.609 8.798 -0.895 28 HE3 LYS 8 HE1 LYS 8 3.816 10.170 -1.982 29 HZ1 LYS 8 HZ1 LYS 8 2.624 9.187 -3.608 30 HZ2 LYS 8 HZ2 LYS 8 1.943 8.341 -2.312 31 HZ3 LYS 8 HZ3 LYS 8 3.165 7.615 -3.229 32 H THR 9 HN THR 9 9.278 11.183 -3.058 33 HA THR 9 HA THR 9 11.260 9.710 -4.346 34 HB THR 9 HB THR 9 11.728 12.336 -5.072 35 HG1 THR 9 HG1 THR 9 9.743 13.368 -4.974 36 HG21 THR 9 HG21 THR 9 9.565 10.494 -6.109 37 HG22 THR 9 HG22 THR 9 11.266 10.425 -6.569 38 HG23 THR 9 HG23 THR 9 10.295 11.836 -6.985 39 H ASP 10 HN ASP 10 11.490 12.171 -1.854 40 HA ASP 10 HA ASP 10 14.266 12.645 -2.054 41 HB2 ASP 10 HB2 ASP 10 12.458 12.938 0.354 42 HB3 ASP 10 HB1 ASP 10 14.060 13.648 0.180 43 H TYR 11 HN TYR 11 12.348 10.230 -0.414 44 HA TYR 11 HA TYR 11 14.658 9.166 0.996 45 HB2 TYR 11 HB2 TYR 11 11.750 8.357 0.899 46 HB3 TYR 11 HB1 TYR 11 12.969 7.402 1.734 47 HD1 TYR 11 HD1 TYR 11 14.456 8.855 3.434 48 HD2 TYR 11 HD2 TYR 11 10.513 9.828 2.154 49 HE1 TYR 11 HE1 TYR 11 14.136 10.204 5.463 50 HE2 TYR 11 HE2 TYR 11 10.183 11.183 4.181 51 HH TYR 11 HH TYR 11 12.794 11.958 6.305 52 H LEU 12 HN LEU 12 12.677 8.530 -1.791 53 HA LEU 12 HA LEU 12 13.391 5.898 -2.350 54 HB2 LEU 12 HB2 LEU 12 11.590 7.050 -3.514 55 HB3 LEU 12 HB1 LEU 12 12.739 8.153 -4.248 56 HG LEU 12 HG LEU 12 13.744 6.245 -5.476 57 HD11 LEU 12 HD11 LEU 12 13.112 4.466 -3.919 58 HD12 LEU 12 HD12 LEU 12 12.571 4.115 -5.561 59 HD13 LEU 12 HD13 LEU 12 11.417 4.691 -4.356 60 HD21 LEU 12 HD21 LEU 12 10.802 6.768 -5.847 61 HD22 LEU 12 HD22 LEU 12 11.801 5.893 -7.009 62 HD23 LEU 12 HD23 LEU 12 12.156 7.581 -6.639 63 H MET 13 HN MET 13 14.908 8.926 -3.469 64 HA MET 13 HA MET 13 16.919 7.688 -4.995 65 HB2 MET 13 HB2 MET 13 16.721 10.409 -3.728 66 HB3 MET 13 HB1 MET 13 18.151 9.915 -4.620 67 HG2 MET 13 HG2 MET 13 15.349 10.253 -5.638 68 HG3 MET 13 HG1 MET 13 16.801 11.123 -6.128 69 HE1 MET 13 HE1 MET 13 18.679 10.114 -7.711 70 HE2 MET 13 HE2 MET 13 18.743 8.416 -8.177 71 HE3 MET 13 HE3 MET 13 18.957 8.872 -6.490 72 H ARG 14 HN ARG 14 16.589 8.131 -1.603 73 HA ARG 14 HA ARG 14 19.382 7.778 -0.992 74 HB2 ARG 14 HB2 ARG 14 17.879 9.072 0.481 75 HB3 ARG 14 HB1 ARG 14 16.936 7.626 0.795 76 HG2 ARG 14 HG2 ARG 14 19.843 7.570 1.398 77 HG3 ARG 14 HG1 ARG 14 18.776 8.474 2.474 78 HD2 ARG 14 HD2 ARG 14 17.440 6.497 2.870 79 HD3 ARG 14 HD1 ARG 14 18.381 5.586 1.692 80 HE ARG 14 HE ARG 14 19.159 6.292 4.402 81 HH11 ARG 14 HH11 ARG 14 20.138 4.996 1.301 82 HH12 ARG 14 HH12 ARG 14 21.551 4.208 1.924 83 HH21 ARG 14 HH21 ARG 14 21.005 5.274 5.235 84 HH22 ARG 14 HH22 ARG 14 22.051 4.365 4.186 85 H LEU 15 HN LEU 15 16.469 5.816 -1.082 86 HA LEU 15 HA LEU 15 17.801 3.458 -0.083 87 HB2 LEU 15 HB2 LEU 15 15.060 3.762 -1.310 88 HB3 LEU 15 HB1 LEU 15 15.661 2.344 -0.472 89 HG LEU 15 HG LEU 15 15.295 5.044 0.817 90 HD11 LEU 15 HD11 LEU 15 13.561 2.589 0.897 91 HD12 LEU 15 HD12 LEU 15 13.137 4.159 0.216 92 HD13 LEU 15 HD13 LEU 15 13.376 3.986 1.955 93 HD21 LEU 15 HD21 LEU 15 17.010 3.750 1.916 94 HD22 LEU 15 HD22 LEU 15 15.965 2.332 1.953 95 HD23 LEU 15 HD23 LEU 15 15.557 3.752 2.916 96 H ARG 16 HN ARG 16 17.320 4.946 -3.124 97 HA ARG 16 HA ARG 16 17.404 2.621 -4.749 98 HB2 ARG 16 HB2 ARG 16 17.789 5.549 -5.272 99 HB3 ARG 16 HB1 ARG 16 18.223 4.380 -6.514 100 HG2 ARG 16 HG2 ARG 16 15.852 3.437 -6.130 101 HG3 ARG 16 HG1 ARG 16 15.535 4.991 -5.360 102 HD2 ARG 16 HD2 ARG 16 15.823 6.170 -7.335 103 HD3 ARG 16 HD1 ARG 16 16.761 4.875 -8.087 104 HE ARG 16 HE ARG 16 14.411 3.664 -7.802 105 HH11 ARG 16 HH11 ARG 16 15.161 6.878 -9.013 106 HH12 ARG 16 HH12 ARG 16 13.767 6.948 -10.036 107 HH21 ARG 16 HH21 ARG 16 12.598 3.751 -9.159 108 HH22 ARG 16 HH22 ARG 16 12.314 5.171 -10.128 109 H ARG 17 HN ARG 17 19.751 4.105 -2.865 110 HA ARG 17 HA ARG 17 21.980 3.279 -4.532 111 HB2 ARG 17 HB2 ARG 17 21.878 4.584 -1.808 112 HB3 ARG 17 HB1 ARG 17 23.371 4.115 -2.614 113 HG2 ARG 17 HG2 ARG 17 22.724 5.580 -4.523 114 HG3 ARG 17 HG1 ARG 17 21.354 6.143 -3.565 115 HD2 ARG 17 HD2 ARG 17 24.180 6.296 -2.559 116 HD3 ARG 17 HD1 ARG 17 23.472 7.565 -3.555 117 HE ARG 17 HE ARG 17 22.714 6.862 -0.824 118 HH11 ARG 17 HH11 ARG 17 22.201 8.854 -3.662 119 HH12 ARG 17 HH12 ARG 17 21.379 10.110 -2.789 120 HH21 ARG 17 HH21 ARG 17 21.617 8.530 0.331 121 HH22 ARG 17 HH22 ARG 17 21.036 9.916 -0.532 122 H CYS 18 HN CYS 18 19.892 1.813 -2.436 123 HA CYS 18 HA CYS 18 21.858 -0.102 -1.416 124 HB2 CYS 18 HB2 CYS 18 18.899 0.076 -0.811 125 HB3 CYS 18 HB1 CYS 18 20.094 -0.899 0.041 126 HG CYS 18 HG CYS 18 21.442 1.261 1.153 127 H GLN 19 HN GLN 19 22.011 -2.130 -2.198 128 HA GLN 19 HA GLN 19 19.970 -3.021 -4.116 129 HB2 GLN 19 HB2 GLN 19 22.776 -2.505 -4.580 130 HB3 GLN 19 HB1 GLN 19 22.405 -4.197 -4.884 131 HG2 GLN 19 HG2 GLN 19 20.654 -2.086 -6.046 132 HG3 GLN 19 HG1 GLN 19 22.216 -2.432 -6.787 133 HE21 GLN 19 HE21 GLN 19 21.165 -3.173 -8.659 134 HE22 GLN 19 HE22 GLN 19 20.396 -4.724 -8.716 135 H THR 20 HN THR 20 20.689 -5.482 -4.684 136 HA THR 20 HA THR 20 20.854 -7.644 -4.024 137 HB THR 20 HB THR 20 21.892 -6.878 -1.322 138 HG1 THR 20 HG1 THR 20 24.013 -6.841 -2.538 139 HG21 THR 20 HG21 THR 20 23.221 -8.860 -1.569 140 HG22 THR 20 HG22 THR 20 22.776 -9.014 -3.270 141 HG23 THR 20 HG23 THR 20 21.570 -9.272 -2.006 142 H ILE 21 HN ILE 21 18.870 -5.435 -2.606 143 HA ILE 21 HA ILE 21 16.823 -5.591 -1.630 144 HB ILE 21 HB ILE 21 17.234 -8.586 -1.739 145 HG12 ILE 21 HG12 ILE 21 15.569 -6.791 -3.514 146 HG13 ILE 21 HG11 ILE 21 17.155 -7.413 -3.944 147 HG21 ILE 21 HG21 ILE 21 14.701 -7.028 -1.227 148 HG22 ILE 21 HG22 ILE 21 15.621 -7.910 -0.006 149 HG23 ILE 21 HG23 ILE 21 14.852 -8.783 -1.336 150 HD11 ILE 21 HD11 ILE 21 14.715 -9.078 -3.377 151 HD12 ILE 21 HD12 ILE 21 16.301 -9.690 -3.846 152 HD13 ILE 21 HD13 ILE 21 15.367 -8.704 -4.972 153 H ASP 22 HN ASP 22 18.933 -8.082 -0.221 154 HA ASP 22 HA ASP 22 17.991 -7.966 2.389 155 HB2 ASP 22 HB2 ASP 22 19.489 -9.715 1.544 156 HB3 ASP 22 HB1 ASP 22 20.809 -8.553 1.466 157 H THR 23 HN THR 23 20.541 -6.058 0.844 158 HA THR 23 HA THR 23 21.421 -4.670 3.107 159 HB THR 23 HB THR 23 21.317 -3.520 0.315 160 HG1 THR 23 HG1 THR 23 22.698 -5.006 -0.280 161 HG21 THR 23 HG21 THR 23 22.098 -2.123 2.302 162 HG22 THR 23 HG22 THR 23 23.212 -2.251 0.940 163 HG23 THR 23 HG23 THR 23 23.478 -3.216 2.392 164 H LEU 24 HN LEU 24 18.714 -4.161 0.945 165 HA LEU 24 HA LEU 24 17.997 -1.574 1.891 166 HB2 LEU 24 HB2 LEU 24 17.298 -2.398 -0.311 167 HB3 LEU 24 HB1 LEU 24 16.370 -3.673 0.453 168 HG LEU 24 HG LEU 24 15.035 -1.783 1.570 169 HD11 LEU 24 HD11 LEU 24 15.005 0.253 -0.018 170 HD12 LEU 24 HD12 LEU 24 16.624 -0.279 -0.474 171 HD13 LEU 24 HD13 LEU 24 16.273 0.145 1.203 172 HD21 LEU 24 HD21 LEU 24 14.776 -1.998 -1.419 173 HD22 LEU 24 HD22 LEU 24 13.504 -1.729 -0.227 174 HD23 LEU 24 HD23 LEU 24 14.312 -3.293 -0.315 175 H GLU 25 HN GLU 25 17.150 -4.882 2.733 176 HA GLU 25 HA GLU 25 15.011 -4.251 4.470 177 HB2 GLU 25 HB2 GLU 25 15.765 -6.534 3.433 178 HB3 GLU 25 HB1 GLU 25 16.750 -6.653 4.886 179 HG2 GLU 25 HG2 GLU 25 14.894 -7.712 5.629 180 HG3 GLU 25 HG1 GLU 25 14.445 -6.062 6.045 181 H ARG 26 HN ARG 26 18.467 -4.373 4.844 182 HA ARG 26 HA ARG 26 18.489 -4.289 7.694 183 HB2 ARG 26 HB2 ARG 26 20.642 -3.605 5.686 184 HB3 ARG 26 HB1 ARG 26 20.896 -3.710 7.423 185 HG2 ARG 26 HG2 ARG 26 20.191 -6.078 7.333 186 HG3 ARG 26 HG1 ARG 26 20.097 -5.948 5.577 187 HD2 ARG 26 HD2 ARG 26 22.530 -5.117 5.734 188 HD3 ARG 26 HD1 ARG 26 22.504 -5.801 7.359 189 HE ARG 26 HE ARG 26 21.690 -7.542 5.154 190 HH11 ARG 26 HH11 ARG 26 24.199 -6.617 7.441 191 HH12 ARG 26 HH12 ARG 26 25.083 -8.091 7.240 192 HH21 ARG 26 HH21 ARG 26 22.836 -9.450 4.915 193 HH22 ARG 26 HH22 ARG 26 24.309 -9.710 5.795 194 H VAL 27 HN VAL 27 18.745 -1.834 5.143 195 HA VAL 27 HA VAL 27 19.306 0.295 6.928 196 HB VAL 27 HB VAL 27 19.896 0.412 4.536 197 HG11 VAL 27 HG11 VAL 27 17.804 -0.606 3.673 198 HG12 VAL 27 HG12 VAL 27 18.286 0.868 2.836 199 HG13 VAL 27 HG13 VAL 27 16.977 0.910 4.018 200 HG21 VAL 27 HG21 VAL 27 19.826 2.459 5.801 201 HG22 VAL 27 HG22 VAL 27 18.097 2.619 5.521 202 HG23 VAL 27 HG23 VAL 27 19.222 2.757 4.173 203 H ILE 28 HN ILE 28 16.247 -0.884 5.510 204 HA ILE 28 HA ILE 28 14.693 1.243 6.569 205 HB ILE 28 HB ILE 28 12.725 -0.177 6.136 206 HG12 ILE 28 HG12 ILE 28 14.695 -2.258 5.170 207 HG13 ILE 28 HG11 ILE 28 13.832 -2.361 6.700 208 HG21 ILE 28 HG21 ILE 28 13.452 1.151 4.331 209 HG22 ILE 28 HG22 ILE 28 13.146 -0.449 3.654 210 HG23 ILE 28 HG23 ILE 28 14.798 0.072 3.975 211 HD11 ILE 28 HD11 ILE 28 12.516 -2.221 3.997 212 HD12 ILE 28 HD12 ILE 28 11.721 -2.497 5.549 213 HD13 ILE 28 HD13 ILE 28 12.826 -3.709 4.892 214 H GLU 29 HN GLU 29 15.776 -1.806 7.858 215 HA GLU 29 HA GLU 29 14.008 -1.936 10.070 216 HB2 GLU 29 HB2 GLU 29 15.382 -3.840 9.154 217 HB3 GLU 29 HB1 GLU 29 16.797 -3.091 9.876 218 HG2 GLU 29 HG2 GLU 29 15.989 -4.870 11.280 219 HG3 GLU 29 HG1 GLU 29 15.780 -3.320 12.091 220 H LYS 30 HN LYS 30 17.409 -0.905 9.824 221 HA LYS 30 HA LYS 30 17.624 0.022 12.478 222 HB2 LYS 30 HB2 LYS 30 19.494 -0.541 10.839 223 HB3 LYS 30 HB1 LYS 30 19.220 1.046 10.135 224 HG2 LYS 30 HG2 LYS 30 19.602 1.963 12.494 225 HG3 LYS 30 HG1 LYS 30 20.242 0.365 12.871 226 HD2 LYS 30 HD2 LYS 30 21.867 0.602 11.030 227 HD3 LYS 30 HD1 LYS 30 21.258 2.228 10.723 228 HE2 LYS 30 HE2 LYS 30 23.090 2.667 12.053 229 HE3 LYS 30 HE1 LYS 30 21.798 2.606 13.250 230 HZ1 LYS 30 HZ1 LYS 30 22.432 0.438 13.889 231 HZ2 LYS 30 HZ2 LYS 30 23.860 1.338 13.823 232 HZ3 LYS 30 HZ3 LYS 30 23.487 0.261 12.576 233 H ASN 31 HN ASN 31 16.531 1.528 9.517 234 HA ASN 31 HA ASN 31 16.607 4.219 10.382 235 HB2 ASN 31 HB2 ASN 31 15.680 2.758 8.070 236 HB3 ASN 31 HB1 ASN 31 14.502 3.986 8.531 237 HD21 ASN 31 HD21 ASN 31 14.963 6.110 8.212 238 HD22 ASN 31 HD22 ASN 31 16.407 6.674 7.449 239 H LYS 32 HN LYS 32 14.184 1.686 10.709 240 HA LYS 32 HA LYS 32 11.999 3.293 11.415 241 HB2 LYS 32 HB2 LYS 32 12.712 0.433 11.846 242 HB3 LYS 32 HB1 LYS 32 11.355 1.098 12.740 243 HG2 LYS 32 HG2 LYS 32 10.432 1.865 10.524 244 HG3 LYS 32 HG1 LYS 32 11.682 0.877 9.769 245 HD2 LYS 32 HD2 LYS 32 9.609 -0.137 11.712 246 HD3 LYS 32 HD1 LYS 32 9.513 -0.300 9.958 247 HE2 LYS 32 HE2 LYS 32 10.608 -2.229 10.183 248 HE3 LYS 32 HE1 LYS 32 12.031 -1.275 10.605 249 HZ1 LYS 32 HZ1 LYS 32 11.824 -2.730 12.369 250 HZ2 LYS 32 HZ2 LYS 32 10.132 -2.643 12.392 251 HZ3 LYS 32 HZ3 LYS 32 11.044 -1.342 12.961 252 H TYR 33 HN TYR 33 14.691 2.122 13.327 253 HA TYR 33 HA TYR 33 13.467 2.873 15.836 254 HB2 TYR 33 HB2 TYR 33 16.382 2.216 15.443 255 HB3 TYR 33 HB1 TYR 33 15.416 2.048 16.904 256 HD1 TYR 33 HD1 TYR 33 13.146 0.489 16.225 257 HD2 TYR 33 HD2 TYR 33 17.084 0.192 14.659 258 HE1 TYR 33 HE1 TYR 33 12.739 -1.871 15.678 259 HE2 TYR 33 HE2 TYR 33 16.695 -2.162 14.097 260 HH TYR 33 HH TYR 33 13.952 -3.542 13.738 261 H GLU 34 HN GLU 34 14.823 4.603 13.387 262 HA GLU 34 HA GLU 34 15.897 6.640 15.222 263 HB2 GLU 34 HB2 GLU 34 17.212 5.480 13.183 264 HB3 GLU 34 HB1 GLU 34 16.469 6.819 12.320 265 HG2 GLU 34 HG2 GLU 34 17.624 8.417 13.550 266 HG3 GLU 34 HG1 GLU 34 17.984 7.290 14.857 267 H LEU 35 HN LEU 35 13.373 5.893 13.100 268 HA LEU 35 HA LEU 35 12.778 8.587 12.295 269 HB2 LEU 35 HB2 LEU 35 11.316 5.970 12.067 270 HB3 LEU 35 HB1 LEU 35 10.575 7.481 11.581 271 HG LEU 35 HG LEU 35 13.159 6.439 10.421 272 HD11 LEU 35 HD11 LEU 35 11.271 4.933 9.920 273 HD12 LEU 35 HD12 LEU 35 11.882 5.756 8.487 274 HD13 LEU 35 HD13 LEU 35 10.388 6.303 9.243 275 HD21 LEU 35 HD21 LEU 35 13.054 8.778 10.128 276 HD22 LEU 35 HD22 LEU 35 11.338 8.724 9.734 277 HD23 LEU 35 HD23 LEU 35 12.523 8.078 8.601 278 H SER 36 HN SER 36 10.649 9.571 12.795 279 HA SER 36 HA SER 36 10.137 9.357 15.673 280 HB2 SER 36 HB2 SER 36 8.858 11.452 13.967 281 HB3 SER 36 HB1 SER 36 9.480 11.572 15.614 282 HG SER 36 HG SER 36 10.994 11.454 13.198 283 H ASP 37 H ASP 37 9.051 8.059 12.910 284 HA ASP 37 HA ASP 37 7.330 6.625 12.441 285 HB2 ASP 37 3HB ASP 37 6.216 7.623 15.152 286 HB3 ASP 37 2HB ASP 37 5.364 6.469 14.133 287 H ASN 38 HN ASN 38 7.110 9.987 12.799 288 HA ASN 38 HA ASN 38 4.459 10.194 11.629 289 HB2 ASN 38 HB2 ASN 38 4.658 12.538 11.868 290 HB3 ASN 38 HB1 ASN 38 5.457 11.872 13.286 291 HD21 ASN 38 HD21 ASN 38 5.833 13.653 10.363 292 HD22 ASN 38 HD22 ASN 38 7.489 14.091 10.585 293 H GLU 39 HN GLU 39 7.787 10.216 10.660 294 HA GLU 39 HA GLU 39 7.184 11.091 7.943 295 HB2 GLU 39 HB2 GLU 39 9.854 9.982 8.547 296 HB3 GLU 39 HB1 GLU 39 9.416 11.468 7.717 297 HG2 GLU 39 HG2 GLU 39 10.396 12.341 9.576 298 HG3 GLU 39 HG1 GLU 39 8.732 12.227 10.144 299 H LEU 40 HN LEU 40 6.977 8.311 9.678 300 HA LEU 40 HA LEU 40 8.042 6.356 7.962 301 HB2 LEU 40 HB2 LEU 40 7.333 6.084 10.372 302 HB3 LEU 40 HB1 LEU 40 5.676 6.027 9.803 303 HG LEU 40 HG LEU 40 6.178 3.996 8.519 304 HD11 LEU 40 HD11 LEU 40 8.481 4.297 7.984 305 HD12 LEU 40 HD12 LEU 40 8.343 2.841 8.973 306 HD13 LEU 40 HD13 LEU 40 8.929 4.342 9.689 307 HD21 LEU 40 HD21 LEU 40 5.447 3.953 10.926 308 HD22 LEU 40 HD22 LEU 40 7.134 3.676 11.355 309 HD23 LEU 40 HD23 LEU 40 6.272 2.504 10.352 310 H ALA 41 HN ALA 41 5.174 8.256 7.799 311 HA ALA 41 HA ALA 41 3.565 6.569 6.216 312 HB1 ALA 41 HB1 ALA 41 3.520 9.571 6.087 313 HB2 ALA 41 HB2 ALA 41 2.868 8.672 7.456 314 HB3 ALA 41 HB3 ALA 41 2.186 8.444 5.847 315 H VAL 42 HN VAL 42 5.799 9.197 5.303 316 HA VAL 42 HA VAL 42 5.442 8.652 2.497 317 HB VAL 42 HB VAL 42 7.396 10.303 2.272 318 HG11 VAL 42 HG11 VAL 42 5.028 10.846 1.884 319 HG12 VAL 42 HG12 VAL 42 5.924 12.203 2.560 320 HG13 VAL 42 HG13 VAL 42 4.851 11.251 3.590 321 HG21 VAL 42 HG21 VAL 42 7.888 11.706 4.141 322 HG22 VAL 42 HG22 VAL 42 8.155 10.032 4.629 323 HG23 VAL 42 HG23 VAL 42 6.698 10.876 5.144 324 H PHE 43 HN PHE 43 7.546 7.611 5.004 325 HA PHE 43 HA PHE 43 9.725 6.777 3.364 326 HB2 PHE 43 HB2 PHE 43 9.881 7.229 5.835 327 HB3 PHE 43 HB1 PHE 43 8.978 5.742 6.109 328 HD1 PHE 43 HD1 PHE 43 12.156 7.148 4.892 329 HD2 PHE 43 HD2 PHE 43 10.027 3.613 5.934 330 HE1 PHE 43 HE1 PHE 43 14.259 5.872 4.860 331 HE2 PHE 43 HE2 PHE 43 12.130 2.332 5.910 332 HZ PHE 43 HZ PHE 43 14.248 3.464 5.375 333 H TYR 44 HN TYR 44 6.790 5.261 4.589 334 HA TYR 44 HA TYR 44 7.351 2.604 3.931 335 HB2 TYR 44 HB2 TYR 44 4.967 4.183 4.552 336 HB3 TYR 44 HB1 TYR 44 4.643 2.815 3.494 337 HD1 TYR 44 HD1 TYR 44 6.314 0.692 4.422 338 HD2 TYR 44 HD2 TYR 44 4.342 3.686 6.707 339 HE1 TYR 44 HE1 TYR 44 6.310 -0.809 6.369 340 HE2 TYR 44 HE2 TYR 44 4.329 2.199 8.663 341 HH TYR 44 HH TYR 44 5.993 -0.896 8.637 342 H SER 45 HN SER 45 5.628 5.064 2.013 343 HA SER 45 HA SER 45 5.232 3.503 -0.264 344 HB2 SER 45 HB2 SER 45 5.687 6.488 -0.221 345 HB3 SER 45 HB1 SER 45 4.774 5.564 -1.415 346 HG SER 45 HG SER 45 3.106 5.682 -0.163 347 H ALA 46 HN ALA 46 7.998 5.431 0.746 348 HA ALA 46 HA ALA 46 9.430 5.335 -1.692 349 HB1 ALA 46 HB1 ALA 46 10.024 6.950 -0.007 350 HB2 ALA 46 HB2 ALA 46 11.406 5.888 -0.289 351 HB3 ALA 46 HB3 ALA 46 10.404 5.671 1.145 352 H ALA 47 HN ALA 47 9.534 3.306 1.225 353 HA ALA 47 HA ALA 47 11.522 1.529 0.273 354 HB1 ALA 47 HB1 ALA 47 11.174 1.570 2.606 355 HB2 ALA 47 HB2 ALA 47 10.572 -0.001 2.074 356 HB3 ALA 47 HB3 ALA 47 9.439 1.304 2.433 357 H ASP 48 HN ASP 48 7.994 1.463 0.235 358 HA ASP 48 HA ASP 48 7.601 -1.076 -0.866 359 HB2 ASP 48 HB2 ASP 48 6.024 1.170 -0.201 360 HB3 ASP 48 HB1 ASP 48 5.671 0.807 -1.887 361 H HIS 49 HN HIS 49 7.961 2.083 -2.436 362 HA HIS 49 HA HIS 49 7.721 1.192 -5.099 363 HB2 HIS 49 HB2 HIS 49 7.594 3.583 -4.285 364 HB3 HIS 49 HB1 HIS 49 9.343 3.557 -4.128 365 HD1 HIS 49 HD1 HIS 49 6.871 4.714 -6.358 366 HD2 HIS 49 HD2 HIS 49 10.497 2.733 -6.869 367 HE1 HIS 49 HE1 HIS 49 7.560 5.154 -8.736 368 HE2 HIS 49 HE2 HIS 49 9.656 3.791 -9.071 369 H ARG 50 HN ARG 50 10.553 1.704 -3.034 370 HA ARG 50 HA ARG 50 12.480 1.046 -4.982 371 HB2 ARG 50 HB2 ARG 50 13.055 2.283 -2.957 372 HB3 ARG 50 HB1 ARG 50 12.660 0.884 -1.968 373 HG2 ARG 50 HG2 ARG 50 15.063 1.111 -2.232 374 HG3 ARG 50 HG1 ARG 50 14.487 -0.370 -2.999 375 HD2 ARG 50 HD2 ARG 50 14.491 0.809 -5.176 376 HD3 ARG 50 HD1 ARG 50 15.184 2.222 -4.378 377 HE ARG 50 HE ARG 50 16.931 0.300 -3.715 378 HH11 ARG 50 HH11 ARG 50 15.532 1.223 -6.797 379 HH12 ARG 50 HH12 ARG 50 16.919 0.714 -7.709 380 HH21 ARG 50 HH21 ARG 50 18.753 -0.368 -4.908 381 HH22 ARG 50 HH22 ARG 50 18.758 -0.189 -6.635 382 H LEU 51 HN LEU 51 10.781 -0.922 -2.584 383 HA LEU 51 HA LEU 51 12.277 -3.270 -2.934 384 HB2 LEU 51 HB2 LEU 51 10.655 -2.843 -1.086 385 HB3 LEU 51 HB1 LEU 51 9.347 -3.064 -2.231 386 HG LEU 51 HG LEU 51 10.098 -5.400 -2.602 387 HD11 LEU 51 HD11 LEU 51 12.052 -4.755 -0.397 388 HD12 LEU 51 HD12 LEU 51 12.436 -5.194 -2.063 389 HD13 LEU 51 HD13 LEU 51 11.694 -6.379 -0.988 390 HD21 LEU 51 HD21 LEU 51 8.337 -4.876 -0.981 391 HD22 LEU 51 HD22 LEU 51 9.558 -4.685 0.278 392 HD23 LEU 51 HD23 LEU 51 9.299 -6.263 -0.468 393 H ALA 52 HN ALA 52 9.402 -2.065 -4.601 394 HA ALA 52 HA ALA 52 8.863 -4.318 -6.162 395 HB1 ALA 52 HB1 ALA 52 7.525 -2.882 -7.526 396 HB2 ALA 52 HB2 ALA 52 8.396 -1.454 -6.962 397 HB3 ALA 52 HB3 ALA 52 7.366 -2.355 -5.848 398 H GLU 53 HN GLU 53 10.836 -1.450 -6.950 399 HA GLU 53 HA GLU 53 11.568 -2.482 -9.519 400 HB2 GLU 53 HB2 GLU 53 13.189 -0.559 -9.528 401 HB3 GLU 53 HB1 GLU 53 11.506 -0.114 -9.288 402 HG2 GLU 53 HG2 GLU 53 11.904 0.109 -6.894 403 HG3 GLU 53 HG1 GLU 53 13.589 -0.351 -7.127 404 H LEU 54 HN LEU 54 12.959 -2.657 -6.318 405 HA LEU 54 HA LEU 54 15.551 -3.475 -7.186 406 HB2 LEU 54 HB2 LEU 54 14.975 -2.447 -4.953 407 HB3 LEU 54 HB1 LEU 54 14.305 -4.001 -4.497 408 HG LEU 54 HG LEU 54 16.472 -5.049 -4.646 409 HD11 LEU 54 HD11 LEU 54 18.486 -3.721 -5.170 410 HD12 LEU 54 HD12 LEU 54 17.448 -2.376 -5.642 411 HD13 LEU 54 HD13 LEU 54 17.395 -3.891 -6.541 412 HD21 LEU 54 HD21 LEU 54 15.898 -3.866 -2.565 413 HD22 LEU 54 HD22 LEU 54 16.690 -2.421 -3.190 414 HD23 LEU 54 HD23 LEU 54 17.635 -3.873 -2.873 415 H THR 55 HN THR 55 12.647 -5.206 -6.118 416 HA THR 55 HA THR 55 13.800 -7.781 -6.082 417 HB THR 55 HB THR 55 10.907 -7.123 -6.667 418 HG1 THR 55 HG1 THR 55 11.351 -6.118 -4.751 419 HG21 THR 55 HG21 THR 55 10.424 -9.289 -5.759 420 HG22 THR 55 HG22 THR 55 12.109 -9.526 -5.302 421 HG23 THR 55 HG23 THR 55 11.656 -9.484 -7.005 422 H MET 56 HN MET 56 12.376 -5.848 -8.635 423 HA MET 56 HA MET 56 12.515 -7.989 -10.576 424 HB2 MET 56 HB2 MET 56 11.736 -5.086 -10.719 425 HB3 MET 56 HB1 MET 56 11.907 -6.065 -12.167 426 HG2 MET 56 HG2 MET 56 10.035 -6.634 -9.880 427 HG3 MET 56 HG1 MET 56 9.589 -5.897 -11.417 428 HE1 MET 56 HE1 MET 56 10.128 -8.811 -13.951 429 HE2 MET 56 HE2 MET 56 11.287 -7.550 -13.530 430 HE3 MET 56 HE3 MET 56 9.582 -7.149 -13.728 431 H ASN 57 HN ASN 57 14.605 -5.725 -9.264 432 HA ASN 57 HA ASN 57 16.715 -5.037 -9.704 433 HB2 ASN 57 HB2 ASN 57 16.880 -7.585 -10.181 434 HB3 ASN 57 HB1 ASN 57 16.951 -7.102 -11.874 435 HD21 ASN 57 HD21 ASN 57 19.042 -7.905 -12.059 436 HD22 ASN 57 HD22 ASN 57 20.402 -7.067 -11.397 437 H LYS 58 HN LYS 58 14.617 -3.714 -10.994 438 HA LYS 58 HA LYS 58 16.081 -2.486 -13.181 439 HB2 LYS 58 HB2 LYS 58 14.548 -4.367 -14.092 440 HB3 LYS 58 HB1 LYS 58 13.221 -3.291 -13.676 441 HG2 LYS 58 HG2 LYS 58 13.753 -3.037 -16.002 442 HG3 LYS 58 HG1 LYS 58 14.206 -1.565 -15.142 443 HD2 LYS 58 HD2 LYS 58 16.498 -2.097 -15.226 444 HD3 LYS 58 HD1 LYS 58 16.173 -3.764 -15.701 445 HE2 LYS 58 HE2 LYS 58 16.986 -2.389 -17.577 446 HE3 LYS 58 HE1 LYS 58 15.370 -3.036 -17.861 447 HZ1 LYS 58 HZ1 LYS 58 15.608 -0.687 -18.503 448 HZ2 LYS 58 HZ2 LYS 58 15.941 -0.282 -16.897 449 HZ3 LYS 58 HZ3 LYS 58 14.426 -0.912 -17.317 450 H LEU 59 HN LEU 59 15.984 -0.369 -12.817 451 HA LEU 59 HA LEU 59 14.283 0.777 -10.876 452 HB2 LEU 59 HB2 LEU 59 16.327 1.741 -12.770 453 HB3 LEU 59 HB1 LEU 59 15.142 2.931 -12.268 454 HG LEU 59 HG LEU 59 15.730 2.309 -9.873 455 HD11 LEU 59 HD11 LEU 59 16.848 0.164 -10.516 456 HD12 LEU 59 HD12 LEU 59 17.782 1.198 -9.436 457 HD13 LEU 59 HD13 LEU 59 18.181 1.124 -11.152 458 HD21 LEU 59 HD21 LEU 59 16.475 4.369 -10.977 459 HD22 LEU 59 HD22 LEU 59 17.896 3.518 -11.585 460 HD23 LEU 59 HD23 LEU 59 17.682 3.749 -9.849 461 H TYR 60 HN TYR 60 12.289 1.536 -11.012 462 HA TYR 60 HA TYR 60 11.192 2.132 -13.676 463 HB2 TYR 60 HB2 TYR 60 9.846 0.684 -11.392 464 HB3 TYR 60 HB1 TYR 60 8.995 1.284 -12.807 465 HD1 TYR 60 HD1 TYR 60 10.469 0.495 -15.087 466 HD2 TYR 60 HD2 TYR 60 10.036 -1.597 -11.406 467 HE1 TYR 60 HE1 TYR 60 10.896 -1.632 -16.246 468 HE2 TYR 60 HE2 TYR 60 10.470 -3.725 -12.557 469 HH TYR 60 HH TYR 60 10.164 -4.561 -15.054 470 H ASP 61 HN ASP 61 10.357 4.092 -13.870 471 HA ASP 61 HA ASP 61 10.224 5.940 -11.737 472 HB2 ASP 61 HB2 ASP 61 8.688 6.164 -14.334 473 HB3 ASP 61 HB1 ASP 61 9.263 7.475 -13.308 474 H LYS 62 HN LYS 62 7.811 4.094 -13.496 475 HA LYS 62 HA LYS 62 5.866 4.574 -11.341 476 HB2 LYS 62 HB2 LYS 62 4.189 3.827 -13.171 477 HB3 LYS 62 HB1 LYS 62 4.842 5.457 -13.251 478 HG2 LYS 62 HG2 LYS 62 6.504 4.652 -14.905 479 HG3 LYS 62 HG1 LYS 62 5.708 3.075 -14.879 480 HD2 LYS 62 HD2 LYS 62 3.590 4.220 -15.544 481 HD3 LYS 62 HD1 LYS 62 4.514 5.712 -15.724 482 HE2 LYS 62 HE2 LYS 62 5.919 4.626 -17.414 483 HE3 LYS 62 HE1 LYS 62 4.965 3.153 -17.247 484 HZ1 LYS 62 HZ1 LYS 62 4.202 4.389 -19.139 485 HZ2 LYS 62 HZ2 LYS 62 3.989 5.785 -18.204 486 HZ3 LYS 62 HZ3 LYS 62 3.006 4.436 -17.944 487 H ILE 63 HN ILE 63 4.606 2.703 -10.682 488 HA ILE 63 HA ILE 63 6.071 0.207 -11.226 489 HB ILE 63 HB ILE 63 4.396 0.826 -8.793 490 HG12 ILE 63 HG12 ILE 63 6.392 2.288 -8.939 491 HG13 ILE 63 HG11 ILE 63 6.479 1.161 -7.589 492 HG21 ILE 63 HG21 ILE 63 4.582 -1.542 -9.291 493 HG22 ILE 63 HG22 ILE 63 5.508 -1.137 -7.846 494 HG23 ILE 63 HG23 ILE 63 6.339 -1.403 -9.380 495 HD11 ILE 63 HD11 ILE 63 7.948 -0.286 -8.972 496 HD12 ILE 63 HD12 ILE 63 8.625 1.304 -8.626 497 HD13 ILE 63 HD13 ILE 63 7.937 0.967 -10.213 498 HA PRO 64 HA PRO 64 2.249 -1.249 -13.023 499 HB2 PRO 64 HB2 PRO 64 3.114 -3.769 -13.598 500 HB3 PRO 64 HB1 PRO 64 3.564 -2.355 -14.567 501 HG2 PRO 64 HG2 PRO 64 5.147 -3.809 -12.520 502 HG3 PRO 64 HG1 PRO 64 5.663 -3.066 -14.046 503 HD2 PRO 64 HD2 PRO 64 6.020 -1.908 -11.591 504 HD3 PRO 64 HD1 PRO 64 5.918 -1.011 -13.116 505 H SER 65 HN SER 65 0.493 -2.206 -12.138 506 HA SER 65 HA SER 65 0.474 -2.995 -9.463 507 HB2 SER 65 HB2 SER 65 -1.715 -3.955 -11.197 508 HB3 SER 65 HB1 SER 65 -1.776 -2.992 -9.720 509 HG SER 65 HG SER 65 -1.384 -1.166 -10.854 510 H SER 66 H SER 66 1.062 -4.912 -12.315 511 HA SER 66 HA SER 66 0.305 -7.452 -11.109 512 HB2 SER 66 3HB SER 66 1.145 -8.473 -13.189 513 HB3 SER 66 2HB SER 66 0.139 -7.097 -13.609 514 HG SER 66 HG SER 66 2.087 -5.870 -13.882 515 H VAL 67 HN VAL 67 2.912 -5.469 -10.507 516 HA VAL 67 HA VAL 67 4.746 -7.735 -10.225 517 HB VAL 67 HB VAL 67 5.407 -5.473 -11.296 518 HG11 VAL 67 HG11 VAL 67 5.522 -4.796 -8.374 519 HG12 VAL 67 HG12 VAL 67 4.719 -3.915 -9.675 520 HG13 VAL 67 HG13 VAL 67 6.481 -3.954 -9.590 521 HG21 VAL 67 HG21 VAL 67 6.985 -7.240 -10.951 522 HG22 VAL 67 HG22 VAL 67 7.104 -6.856 -9.232 523 HG23 VAL 67 HG23 VAL 67 7.717 -5.722 -10.435 524 H TRP 68 HN TRP 68 2.664 -5.799 -8.310 525 HA TRP 68 HA TRP 68 4.052 -5.831 -5.859 526 HB2 TRP 68 HB2 TRP 68 1.076 -5.782 -6.374 527 HB3 TRP 68 HB1 TRP 68 1.837 -5.433 -4.828 528 HD1 TRP 68 HD1 TRP 68 0.438 -3.727 -7.690 529 HE1 TRP 68 HE1 TRP 68 1.225 -1.277 -7.841 530 HE3 TRP 68 HE3 TRP 68 4.349 -3.968 -4.405 531 HZ2 TRP 68 HZ2 TRP 68 3.263 0.331 -6.692 532 HZ3 TRP 68 HZ3 TRP 68 5.664 -1.931 -3.984 533 HH2 TRP 68 HH2 TRP 68 5.131 0.171 -5.106 534 H LYS 69 HN LYS 69 2.308 -8.279 -7.532 535 HA LYS 69 HA LYS 69 1.579 -9.929 -5.365 536 HB2 LYS 69 HB2 LYS 69 0.714 -10.013 -7.752 537 HB3 LYS 69 HB1 LYS 69 2.204 -10.849 -8.169 538 HG2 LYS 69 HG2 LYS 69 0.579 -12.523 -7.863 539 HG3 LYS 69 HG1 LYS 69 1.590 -12.559 -6.419 540 HD2 LYS 69 HD2 LYS 69 -0.046 -11.496 -5.111 541 HD3 LYS 69 HD1 LYS 69 -0.963 -10.979 -6.526 542 HE2 LYS 69 HE2 LYS 69 -2.206 -12.765 -5.687 543 HE3 LYS 69 HE1 LYS 69 -1.268 -13.483 -6.996 544 HZ1 LYS 69 HZ1 LYS 69 -0.406 -13.567 -4.153 545 HZ2 LYS 69 HZ2 LYS 69 0.200 -14.471 -5.455 546 HZ3 LYS 69 HZ3 LYS 69 -1.360 -14.781 -4.870 547 H PHE 70 HN PHE 70 4.598 -9.459 -7.022 548 HA PHE 70 HA PHE 70 5.708 -11.928 -5.931 549 HB2 PHE 70 HB2 PHE 70 6.997 -9.848 -7.708 550 HB3 PHE 70 HB1 PHE 70 7.700 -11.393 -7.255 551 HD1 PHE 70 HD1 PHE 70 6.638 -13.500 -8.061 552 HD2 PHE 70 HD2 PHE 70 5.481 -9.676 -9.502 553 HE1 PHE 70 HE1 PHE 70 5.590 -14.562 -10.022 554 HE2 PHE 70 HE2 PHE 70 4.432 -10.724 -11.463 555 HZ PHE 70 HZ PHE 70 4.483 -13.171 -11.725 556 H ILE 71 HN ILE 71 5.165 -8.959 -4.731 557 HA ILE 71 HA ILE 71 7.759 -8.565 -3.482 558 HB ILE 71 HB ILE 71 5.328 -6.928 -3.828 559 HG12 ILE 71 HG12 ILE 71 6.992 -5.138 -4.047 560 HG13 ILE 71 HG11 ILE 71 8.253 -6.236 -3.500 561 HG21 ILE 71 HG21 ILE 71 5.164 -6.911 -1.471 562 HG22 ILE 71 HG22 ILE 71 6.024 -5.427 -1.891 563 HG23 ILE 71 HG23 ILE 71 6.915 -6.817 -1.274 564 HD11 ILE 71 HD11 ILE 71 6.764 -6.232 -6.092 565 HD12 ILE 71 HD12 ILE 71 7.617 -7.668 -5.519 566 HD13 ILE 71 HD13 ILE 71 8.505 -6.174 -5.811 567 H ARG 72 HN ARG 72 8.240 -8.934 -1.398 568 HA ARG 72 HA ARG 72 6.329 -10.525 0.142 569 HB2 ARG 72 HB2 ARG 72 9.283 -10.099 0.639 570 HB3 ARG 72 HB1 ARG 72 8.240 -11.269 1.437 571 HG2 ARG 72 HG2 ARG 72 7.911 -12.380 -0.764 572 HG3 ARG 72 HG1 ARG 72 9.098 -11.267 -1.452 573 HD2 ARG 72 HD2 ARG 72 10.201 -13.331 -0.896 574 HD3 ARG 72 HD1 ARG 72 10.742 -12.083 0.220 575 HE ARG 72 HE ARG 72 8.841 -14.239 0.859 576 HH11 ARG 72 HH11 ARG 72 11.143 -11.788 1.886 577 HH12 ARG 72 HH12 ARG 72 11.113 -12.281 3.549 578 HH21 ARG 72 HH21 ARG 72 8.794 -14.873 3.052 579 HH22 ARG 72 HH22 ARG 72 9.777 -14.040 4.213 580 H GLU 3 HN GLU 3 -3.340 6.922 11.255 581 HA GLU 3 HA GLU 3 -0.707 5.674 10.854 582 HB2 GLU 3 HB2 GLU 3 -1.096 4.397 12.858 583 HB3 GLU 3 HB1 GLU 3 -1.423 6.081 13.225 584 HG2 GLU 3 HG2 GLU 3 -3.562 4.066 12.573 585 HG3 GLU 3 HG1 GLU 3 -3.035 4.445 14.210 586 H ALA 4 HN ALA 4 -4.176 5.222 10.650 587 HA ALA 4 HA ALA 4 -4.167 2.514 9.837 588 HB1 ALA 4 HB1 ALA 4 -6.253 4.597 9.211 589 HB2 ALA 4 HB2 ALA 4 -6.132 3.749 10.751 590 HB3 ALA 4 HB3 ALA 4 -6.473 2.850 9.275 591 H LEU 5 HN LEU 5 -4.266 5.558 8.016 592 HA LEU 5 HA LEU 5 -4.274 4.208 5.483 593 HB2 LEU 5 HB2 LEU 5 -4.343 6.999 6.428 594 HB3 LEU 5 HB1 LEU 5 -3.585 6.754 4.868 595 HG LEU 5 HG LEU 5 -5.672 5.563 4.128 596 HD11 LEU 5 HD11 LEU 5 -7.695 5.844 5.400 597 HD12 LEU 5 HD12 LEU 5 -6.829 6.740 6.647 598 HD13 LEU 5 HD13 LEU 5 -6.491 5.026 6.400 599 HD21 LEU 5 HD21 LEU 5 -6.150 8.395 5.023 600 HD22 LEU 5 HD22 LEU 5 -6.862 7.562 3.640 601 HD23 LEU 5 HD23 LEU 5 -5.142 7.959 3.643 602 H LYS 6 HN LYS 6 -1.935 4.491 7.697 603 HA LYS 6 HA LYS 6 0.253 5.005 5.842 604 HB2 LYS 6 HB2 LYS 6 0.483 6.047 7.987 605 HB3 LYS 6 HB1 LYS 6 0.135 4.541 8.821 606 HG2 LYS 6 HG2 LYS 6 2.239 3.602 8.012 607 HG3 LYS 6 HG1 LYS 6 2.587 5.112 7.174 608 HD2 LYS 6 HD2 LYS 6 3.798 5.089 9.245 609 HD3 LYS 6 HD1 LYS 6 2.503 6.281 9.367 610 HE2 LYS 6 HE2 LYS 6 1.124 4.527 10.511 611 HE3 LYS 6 HE1 LYS 6 2.559 3.500 10.533 612 HZ1 LYS 6 HZ1 LYS 6 2.158 6.090 11.917 613 HZ2 LYS 6 HZ2 LYS 6 3.677 5.370 11.751 614 HZ3 LYS 6 HZ3 LYS 6 2.460 4.572 12.609 615 H ILE 7 HN ILE 7 -0.907 2.457 8.017 616 HA ILE 7 HA ILE 7 0.994 0.530 7.115 617 HB ILE 7 HB ILE 7 -0.387 -1.100 8.377 618 HG12 ILE 7 HG12 ILE 7 -2.081 0.813 9.723 619 HG13 ILE 7 HG11 ILE 7 -2.424 0.810 7.995 620 HG21 ILE 7 HG21 ILE 7 -0.176 0.165 10.621 621 HG22 ILE 7 HG22 ILE 7 0.517 1.456 9.638 622 HG23 ILE 7 HG23 ILE 7 1.280 -0.135 9.670 623 HD11 ILE 7 HD11 ILE 7 -3.820 -0.751 9.323 624 HD12 ILE 7 HD12 ILE 7 -2.361 -1.662 9.703 625 HD13 ILE 7 HD13 ILE 7 -2.904 -1.527 8.035 626 H LEU 8 HN LEU 8 -2.001 1.657 5.939 627 HA LEU 8 HA LEU 8 -2.830 -0.688 4.544 628 HB2 LEU 8 HB2 LEU 8 -3.807 1.976 4.989 629 HB3 LEU 8 HB1 LEU 8 -3.918 1.584 3.286 630 HG LEU 8 HG LEU 8 -5.190 -0.474 3.895 631 HD11 LEU 8 HD11 LEU 8 -4.435 -0.825 6.141 632 HD12 LEU 8 HD12 LEU 8 -6.175 -0.550 6.176 633 HD13 LEU 8 HD13 LEU 8 -5.067 0.739 6.651 634 HD21 LEU 8 HD21 LEU 8 -6.232 1.730 3.262 635 HD22 LEU 8 HD22 LEU 8 -6.468 2.022 4.988 636 HD23 LEU 8 HD23 LEU 8 -7.253 0.648 4.209 637 H ASN 9 HN ASN 9 -0.491 1.741 3.884 638 HA ASN 9 HA ASN 9 -0.616 1.357 1.012 639 HB2 ASN 9 HB2 ASN 9 0.038 3.539 2.327 640 HB3 ASN 9 HB1 ASN 9 1.638 2.805 2.356 641 HD21 ASN 9 HD21 ASN 9 0.990 5.218 1.080 642 HD22 ASN 9 HD22 ASN 9 1.239 5.022 -0.626 643 H ASN 10 HN ASN 10 0.928 -0.075 3.672 644 HA ASN 10 HA ASN 10 3.061 -1.183 1.997 645 HB2 ASN 10 HB2 ASN 10 3.727 -0.242 4.177 646 HB3 ASN 10 HB1 ASN 10 2.661 -1.381 4.988 647 HD21 ASN 10 HD21 ASN 10 5.040 -1.682 2.340 648 HD22 ASN 10 HD22 ASN 10 5.936 -2.957 3.101 649 H ILE 11 HN ILE 11 2.855 -3.108 1.148 650 HA ILE 11 HA ILE 11 0.585 -4.709 1.355 651 HB ILE 11 HB ILE 11 3.360 -5.480 0.455 652 HG12 ILE 11 HG12 ILE 11 0.968 -4.572 -1.155 653 HG13 ILE 11 HG11 ILE 11 2.340 -3.553 -0.733 654 HG21 ILE 11 HG21 ILE 11 2.150 -7.488 0.861 655 HG22 ILE 11 HG22 ILE 11 2.158 -7.216 -0.882 656 HG23 ILE 11 HG23 ILE 11 0.713 -6.855 0.059 657 HD11 ILE 11 HD11 ILE 11 2.517 -4.360 -3.008 658 HD12 ILE 11 HD12 ILE 11 2.436 -6.029 -2.442 659 HD13 ILE 11 HD13 ILE 11 3.815 -5.016 -2.012 660 H ARG 12 HN ARG 12 3.633 -4.894 3.110 661 HA ARG 12 HA ARG 12 3.290 -7.442 4.225 662 HB2 ARG 12 HB2 ARG 12 4.822 -5.044 5.229 663 HB3 ARG 12 HB1 ARG 12 4.913 -6.642 5.967 664 HG2 ARG 12 HG2 ARG 12 5.762 -7.566 3.879 665 HG3 ARG 12 HG1 ARG 12 5.647 -5.978 3.118 666 HD2 ARG 12 HD2 ARG 12 7.275 -5.099 4.716 667 HD3 ARG 12 HD1 ARG 12 7.379 -6.685 5.482 668 HE ARG 12 HE ARG 12 7.915 -7.007 2.755 669 HH11 ARG 12 HH11 ARG 12 9.381 -5.519 5.569 670 HH12 ARG 12 HH12 ARG 12 11.008 -5.708 4.969 671 HH21 ARG 12 HH21 ARG 12 10.038 -7.235 1.982 672 HH22 ARG 12 HH22 ARG 12 11.376 -6.670 2.949 673 H THR 13 HN THR 13 2.562 -4.253 5.679 674 HA THR 13 HA THR 13 1.419 -5.363 8.017 675 HB THR 13 HB THR 13 0.265 -2.935 7.926 676 HG1 THR 13 HG1 THR 13 0.964 -2.089 6.075 677 HG21 THR 13 HG21 THR 13 2.244 -2.085 9.111 678 HG22 THR 13 HG22 THR 13 3.170 -3.478 8.550 679 HG23 THR 13 HG23 THR 13 1.811 -3.709 9.650 680 H LEU 14 HN LEU 14 0.098 -4.407 4.895 681 HA LEU 14 HA LEU 14 -2.631 -4.552 5.625 682 HB2 LEU 14 HB2 LEU 14 -1.594 -3.476 3.555 683 HB3 LEU 14 HB1 LEU 14 -1.542 -5.088 2.872 684 HG LEU 14 HG LEU 14 -3.931 -5.262 2.892 685 HD11 LEU 14 HD11 LEU 14 -3.811 -2.754 4.528 686 HD12 LEU 14 HD12 LEU 14 -4.623 -4.279 4.888 687 HD13 LEU 14 HD13 LEU 14 -5.261 -3.211 3.640 688 HD21 LEU 14 HD21 LEU 14 -3.014 -4.088 0.991 689 HD22 LEU 14 HD22 LEU 14 -3.046 -2.561 1.877 690 HD23 LEU 14 HD23 LEU 14 -4.556 -3.365 1.443 691 H ARG 15 HN ARG 15 -0.352 -6.940 4.379 692 HA ARG 15 HA ARG 15 -2.150 -9.023 3.856 693 HB2 ARG 15 HB2 ARG 15 0.756 -8.820 4.376 694 HB3 ARG 15 HB1 ARG 15 0.036 -10.397 4.657 695 HG2 ARG 15 HG2 ARG 15 -0.933 -10.205 2.317 696 HG3 ARG 15 HG1 ARG 15 0.165 -8.839 2.094 697 HD2 ARG 15 HD2 ARG 15 2.017 -10.395 2.845 698 HD3 ARG 15 HD1 ARG 15 0.856 -11.708 2.683 699 HE ARG 15 HE ARG 15 0.716 -11.181 0.308 700 HH11 ARG 15 HH11 ARG 15 3.439 -9.848 2.097 701 HH12 ARG 15 HH12 ARG 15 4.428 -9.641 0.692 702 HH21 ARG 15 HH21 ARG 15 2.019 -10.911 -1.537 703 HH22 ARG 15 HH22 ARG 15 3.623 -10.251 -1.386 704 H ALA 16 HN ALA 16 -0.385 -8.204 6.819 705 HA ALA 16 HA ALA 16 -1.415 -10.376 8.349 706 HB1 ALA 16 HB1 ALA 16 0.698 -9.202 8.870 707 HB2 ALA 16 HB2 ALA 16 -0.394 -9.285 10.250 708 HB3 ALA 16 HB3 ALA 16 -0.232 -7.781 9.343 709 H GLN 17 HN GLN 17 -2.416 -7.074 7.776 710 HA GLN 17 HA GLN 17 -4.372 -6.912 9.811 711 HB2 GLN 17 HB2 GLN 17 -3.491 -4.904 8.789 712 HB3 GLN 17 HB1 GLN 17 -4.050 -5.415 7.205 713 HG2 GLN 17 HG2 GLN 17 -5.503 -3.702 8.041 714 HG3 GLN 17 HG1 GLN 17 -6.379 -5.228 7.997 715 HE21 GLN 17 HE21 GLN 17 -6.965 -6.219 9.895 716 HE22 GLN 17 HE22 GLN 17 -6.919 -5.410 11.425 717 H ALA 18 HN ALA 18 -4.494 -7.900 6.411 718 HA ALA 18 HA ALA 18 -7.337 -8.241 6.378 719 HB1 ALA 18 HB1 ALA 18 -5.207 -9.188 4.469 720 HB2 ALA 18 HB2 ALA 18 -6.170 -7.718 4.336 721 HB3 ALA 18 HB3 ALA 18 -6.941 -9.295 4.176 722 H ARG 19 HN ARG 19 -5.226 -9.926 8.124 723 HA ARG 19 HA ARG 19 -6.261 -12.574 7.467 724 HB2 ARG 19 HB2 ARG 19 -4.074 -11.591 9.281 725 HB3 ARG 19 HB1 ARG 19 -4.665 -13.243 9.375 726 HG2 ARG 19 HG2 ARG 19 -3.541 -11.963 6.891 727 HG3 ARG 19 HG1 ARG 19 -2.630 -12.994 7.994 728 HD2 ARG 19 HD2 ARG 19 -4.028 -14.870 7.498 729 HD3 ARG 19 HD1 ARG 19 -5.145 -13.864 6.580 730 HE ARG 19 HE ARG 19 -2.463 -13.834 5.547 731 HH11 ARG 19 HH11 ARG 19 -5.502 -15.593 5.543 732 HH12 ARG 19 HH12 ARG 19 -5.237 -16.291 3.972 733 HH21 ARG 19 HH21 ARG 19 -2.122 -14.777 3.493 734 HH22 ARG 19 HH22 ARG 19 -3.326 -15.845 2.826 735 H GLU 20 HN GLU 20 -7.116 -9.989 9.426 736 HA GLU 20 HA GLU 20 -8.156 -11.622 11.597 737 HB2 GLU 20 HB2 GLU 20 -8.630 -9.645 12.753 738 HB3 GLU 20 HB1 GLU 20 -7.160 -9.262 11.870 739 HG2 GLU 20 HG2 GLU 20 -8.230 -7.824 10.439 740 HG3 GLU 20 HG1 GLU 20 -9.796 -8.605 10.654 741 H CYS 21 H CYS 21 -9.215 -10.418 8.589 742 HA CYS 21 HA CYS 21 -12.021 -11.111 9.275 743 HB2 CYS 21 3HB CYS 21 -12.739 -9.358 7.624 744 HB3 CYS 21 2HB CYS 21 -11.721 -8.627 8.872 745 HG CYS 21 HG CYS 21 -9.930 -7.893 7.491 746 H THR 22 HN THR 22 -13.290 -11.941 7.528 747 HA THR 22 HA THR 22 -11.780 -13.860 5.976 748 HB THR 22 HB THR 22 -14.312 -14.345 5.239 749 HG1 THR 22 HG1 THR 22 -15.759 -13.659 6.732 750 HG21 THR 22 HG21 THR 22 -12.873 -15.935 6.397 751 HG22 THR 22 HG22 THR 22 -14.469 -15.903 7.146 752 HG23 THR 22 HG23 THR 22 -13.117 -15.074 7.917 753 H LEU 23 HN LEU 23 -12.621 -14.258 3.655 754 HA LEU 23 HA LEU 23 -11.975 -11.985 2.118 755 HB2 LEU 23 HB2 LEU 23 -11.590 -14.288 1.350 756 HB3 LEU 23 HB1 LEU 23 -13.321 -14.536 1.242 757 HG LEU 23 HG LEU 23 -13.425 -12.744 -0.489 758 HD11 LEU 23 HD11 LEU 23 -11.625 -11.583 -1.208 759 HD12 LEU 23 HD12 LEU 23 -10.528 -12.946 -0.986 760 HD13 LEU 23 HD13 LEU 23 -11.005 -11.967 0.399 761 HD21 LEU 23 HD21 LEU 23 -12.548 -14.104 -2.282 762 HD22 LEU 23 HD22 LEU 23 -13.323 -15.130 -1.072 763 HD23 LEU 23 HD23 LEU 23 -11.562 -15.018 -1.140 764 H GLU 24 HN GLU 24 -15.025 -13.341 3.154 765 HA GLU 24 HA GLU 24 -16.809 -12.138 1.430 766 HB2 GLU 24 HB2 GLU 24 -17.097 -13.678 3.589 767 HB3 GLU 24 HB1 GLU 24 -17.484 -12.131 4.330 768 HG2 GLU 24 HG2 GLU 24 -19.489 -13.263 3.586 769 HG3 GLU 24 HG1 GLU 24 -19.236 -11.773 2.678 770 H THR 25 HN THR 25 -15.474 -10.799 4.436 771 HA THR 25 HA THR 25 -16.750 -8.273 4.135 772 HB THR 25 HB THR 25 -14.361 -8.238 5.799 773 HG1 THR 25 HG1 THR 25 -16.229 -9.993 6.875 774 HG21 THR 25 HG21 THR 25 -16.280 -6.692 6.008 775 HG22 THR 25 HG22 THR 25 -15.947 -7.553 7.510 776 HG23 THR 25 HG23 THR 25 -17.296 -8.051 6.491 777 H LEU 26 HN LEU 26 -13.535 -9.531 3.392 778 HA LEU 26 HA LEU 26 -12.324 -7.067 2.748 779 HB2 LEU 26 HB2 LEU 26 -11.656 -9.847 1.789 780 HB3 LEU 26 HB1 LEU 26 -10.631 -8.443 1.583 781 HG LEU 26 HG LEU 26 -11.449 -9.564 4.264 782 HD11 LEU 26 HD11 LEU 26 -8.956 -9.957 2.625 783 HD12 LEU 26 HD12 LEU 26 -10.062 -11.191 3.238 784 HD13 LEU 26 HD13 LEU 26 -9.044 -10.280 4.356 785 HD21 LEU 26 HD21 LEU 26 -9.715 -8.102 5.139 786 HD22 LEU 26 HD22 LEU 26 -10.938 -7.168 4.275 787 HD23 LEU 26 HD23 LEU 26 -9.379 -7.502 3.516 788 H GLU 27 HN GLU 27 -13.857 -9.523 0.658 789 HA GLU 27 HA GLU 27 -13.366 -8.191 -1.770 790 HB2 GLU 27 HB2 GLU 27 -14.005 -10.562 -1.609 791 HB3 GLU 27 HB1 GLU 27 -15.606 -10.093 -1.058 792 HG2 GLU 27 HG2 GLU 27 -16.168 -10.299 -3.200 793 HG3 GLU 27 HG1 GLU 27 -15.432 -8.713 -3.378 794 H GLU 28 HN GLU 28 -15.977 -7.921 0.569 795 HA GLU 28 HA GLU 28 -17.648 -6.312 -1.070 796 HB2 GLU 28 HB2 GLU 28 -18.483 -7.602 0.866 797 HB3 GLU 28 HB1 GLU 28 -17.604 -6.525 1.942 798 HG2 GLU 28 HG2 GLU 28 -18.959 -4.659 0.747 799 HG3 GLU 28 HG1 GLU 28 -20.030 -5.986 0.296 800 H MET 29 HN MET 29 -15.318 -5.554 1.523 801 HA MET 29 HA MET 29 -15.763 -2.760 1.406 802 HB2 MET 29 HB2 MET 29 -13.845 -2.506 2.809 803 HB3 MET 29 HB1 MET 29 -14.717 -3.928 3.345 804 HG2 MET 29 HG2 MET 29 -12.575 -4.693 3.441 805 HG3 MET 29 HG1 MET 29 -13.010 -5.182 1.807 806 HE1 MET 29 HE1 MET 29 -10.516 -1.438 2.778 807 HE2 MET 29 HE2 MET 29 -10.645 -2.751 3.950 808 HE3 MET 29 HE3 MET 29 -12.082 -1.847 3.475 809 H LEU 30 HN LEU 30 -13.844 -4.949 -0.467 810 HA LEU 30 HA LEU 30 -12.004 -3.175 -1.598 811 HB2 LEU 30 HB2 LEU 30 -11.823 -5.573 -1.918 812 HB3 LEU 30 HB1 LEU 30 -13.346 -5.609 -2.784 813 HG LEU 30 HG LEU 30 -12.190 -4.067 -4.494 814 HD11 LEU 30 HD11 LEU 30 -10.266 -3.453 -3.186 815 HD12 LEU 30 HD12 LEU 30 -9.745 -4.370 -4.600 816 HD13 LEU 30 HD13 LEU 30 -9.799 -5.143 -3.018 817 HD21 LEU 30 HD21 LEU 30 -12.782 -6.432 -4.871 818 HD22 LEU 30 HD22 LEU 30 -11.228 -6.908 -4.194 819 HD23 LEU 30 HD23 LEU 30 -11.287 -5.973 -5.686 820 H GLU 31 HN GLU 31 -15.242 -4.131 -2.671 821 HA GLU 31 HA GLU 31 -15.394 -2.460 -4.934 822 HB2 GLU 31 HB2 GLU 31 -17.613 -3.495 -3.158 823 HB3 GLU 31 HB1 GLU 31 -17.845 -2.760 -4.735 824 HG2 GLU 31 HG2 GLU 31 -16.604 -4.567 -5.780 825 HG3 GLU 31 HG1 GLU 31 -16.337 -5.304 -4.199 826 H LYS 32 HN LYS 32 -16.429 -2.014 -1.586 827 HA LYS 32 HA LYS 32 -17.658 0.478 -1.882 828 HB2 LYS 32 HB2 LYS 32 -16.427 -0.976 0.421 829 HB3 LYS 32 HB1 LYS 32 -16.980 0.680 0.633 830 HG2 LYS 32 HG2 LYS 32 -19.223 0.088 0.113 831 HG3 LYS 32 HG1 LYS 32 -18.733 -1.506 -0.462 832 HD2 LYS 32 HD2 LYS 32 -18.192 -2.221 1.741 833 HD3 LYS 32 HD1 LYS 32 -18.372 -0.585 2.384 834 HE2 LYS 32 HE2 LYS 32 -20.747 -0.630 1.907 835 HE3 LYS 32 HE1 LYS 32 -20.590 -2.219 1.160 836 HZ1 LYS 32 HZ1 LYS 32 -19.979 -1.636 4.001 837 HZ2 LYS 32 HZ2 LYS 32 -19.990 -3.166 3.260 838 HZ3 LYS 32 HZ3 LYS 32 -21.436 -2.303 3.451 839 H LEU 33 HN LEU 33 -14.262 -0.307 -1.191 840 HA LEU 33 HA LEU 33 -13.539 2.467 -0.943 841 HB2 LEU 33 HB2 LEU 33 -12.317 0.742 0.264 842 HB3 LEU 33 HB1 LEU 33 -11.835 -0.003 -1.245 843 HG LEU 33 HG LEU 33 -10.415 1.866 -1.793 844 HD11 LEU 33 HD11 LEU 33 -11.708 3.713 -0.982 845 HD12 LEU 33 HD12 LEU 33 -10.139 3.747 -0.178 846 HD13 LEU 33 HD13 LEU 33 -11.557 3.151 0.679 847 HD21 LEU 33 HD21 LEU 33 -8.728 1.463 -0.277 848 HD22 LEU 33 HD22 LEU 33 -9.774 0.064 -0.033 849 HD23 LEU 33 HD23 LEU 33 -9.832 1.412 1.098 850 H GLU 34 HN GLU 34 -13.463 0.038 -3.468 851 HA GLU 34 HA GLU 34 -11.851 1.415 -5.313 852 HB2 GLU 34 HB2 GLU 34 -12.752 -1.049 -5.302 853 HB3 GLU 34 HB1 GLU 34 -14.081 -0.362 -6.225 854 HG2 GLU 34 HG2 GLU 34 -12.441 0.501 -7.860 855 HG3 GLU 34 HG1 GLU 34 -11.162 -0.308 -6.960 856 H VAL 35 HN VAL 35 -15.394 1.387 -4.857 857 HA VAL 35 HA VAL 35 -15.924 3.060 -7.072 858 HB VAL 35 HB VAL 35 -18.120 3.527 -6.037 859 HG11 VAL 35 HG11 VAL 35 -18.852 1.092 -5.945 860 HG12 VAL 35 HG12 VAL 35 -17.158 0.691 -6.225 861 HG13 VAL 35 HG13 VAL 35 -18.051 1.634 -7.419 862 HG21 VAL 35 HG21 VAL 35 -17.119 1.818 -3.761 863 HG22 VAL 35 HG22 VAL 35 -18.763 2.429 -3.961 864 HG23 VAL 35 HG23 VAL 35 -17.432 3.551 -3.693 865 H VAL 36 HN VAL 36 -14.933 3.724 -3.803 866 HA VAL 36 HA VAL 36 -15.554 6.484 -3.751 867 HB VAL 36 HB VAL 36 -13.487 4.871 -2.244 868 HG11 VAL 36 HG11 VAL 36 -14.264 7.676 -1.515 869 HG12 VAL 36 HG12 VAL 36 -12.905 7.350 -2.590 870 HG13 VAL 36 HG13 VAL 36 -12.897 6.720 -0.944 871 HG21 VAL 36 HG21 VAL 36 -15.107 5.599 -0.347 872 HG22 VAL 36 HG22 VAL 36 -15.556 4.271 -1.412 873 HG23 VAL 36 HG23 VAL 36 -16.239 5.874 -1.668 874 H VAL 37 HN VAL 37 -12.643 4.667 -4.631 875 HA VAL 37 HA VAL 37 -11.044 6.894 -5.297 876 HB VAL 37 HB VAL 37 -10.898 4.099 -6.460 877 HG11 VAL 37 HG11 VAL 37 -8.901 6.348 -6.337 878 HG12 VAL 37 HG12 VAL 37 -9.560 5.560 -7.771 879 HG13 VAL 37 HG13 VAL 37 -8.466 4.679 -6.707 880 HG21 VAL 37 HG21 VAL 37 -9.320 3.583 -4.703 881 HG22 VAL 37 HG22 VAL 37 -10.847 4.117 -3.994 882 HG23 VAL 37 HG23 VAL 37 -9.471 5.216 -4.052 883 H ASN 38 HN ASN 38 -13.385 4.979 -7.065 884 HA ASN 38 HA ASN 38 -12.913 6.011 -9.650 885 HB2 ASN 38 HB2 ASN 38 -14.392 3.995 -8.832 886 HB3 ASN 38 HB1 ASN 38 -15.660 5.214 -8.752 887 HD21 ASN 38 HD21 ASN 38 -13.967 3.071 -10.718 888 HD22 ASN 38 HD22 ASN 38 -14.596 3.586 -12.244 889 H GLU 39 HN GLU 39 -15.141 6.983 -7.062 890 HA GLU 39 HA GLU 39 -16.363 9.116 -8.424 891 HB2 GLU 39 HB2 GLU 39 -15.874 8.693 -5.470 892 HB3 GLU 39 HB1 GLU 39 -16.869 9.990 -6.118 893 HG2 GLU 39 HG2 GLU 39 -18.357 8.311 -7.129 894 HG3 GLU 39 HG1 GLU 39 -17.369 7.036 -6.419 895 H ARG 40 HN ARG 40 -13.567 9.013 -6.262 896 HA ARG 40 HA ARG 40 -12.929 11.739 -6.289 897 HB2 ARG 40 HB2 ARG 40 -11.260 9.263 -5.867 898 HB3 ARG 40 HB1 ARG 40 -10.567 10.876 -5.774 899 HG2 ARG 40 HG2 ARG 40 -12.987 10.430 -4.160 900 HG3 ARG 40 HG1 ARG 40 -11.549 9.541 -3.667 901 HD2 ARG 40 HD2 ARG 40 -11.677 11.662 -2.498 902 HD3 ARG 40 HD1 ARG 40 -10.282 11.638 -3.583 903 HE ARG 40 HE ARG 40 -12.758 12.856 -4.575 904 HH11 ARG 40 HH11 ARG 40 -9.530 13.313 -3.234 905 HH12 ARG 40 HH12 ARG 40 -9.391 14.938 -3.817 906 HH21 ARG 40 HH21 ARG 40 -12.557 15.006 -5.308 907 HH22 ARG 40 HH22 ARG 40 -11.093 15.893 -4.996 908 H ARG 41 HN ARG 41 -11.953 9.105 -8.445 909 HA ARG 41 HA ARG 41 -10.145 10.612 -10.004 910 HB2 ARG 41 HB2 ARG 41 -11.510 7.995 -10.262 911 HB3 ARG 41 HB1 ARG 41 -10.997 8.746 -11.768 912 HG2 ARG 41 HG2 ARG 41 -8.713 8.948 -10.853 913 HG3 ARG 41 HG1 ARG 41 -9.247 8.086 -9.408 914 HD2 ARG 41 HD2 ARG 41 -9.679 6.107 -10.660 915 HD3 ARG 41 HD1 ARG 41 -9.467 6.957 -12.191 916 HE ARG 41 HE ARG 41 -7.142 7.026 -10.483 917 HH11 ARG 41 HH11 ARG 41 -8.818 5.227 -12.993 918 HH12 ARG 41 HH12 ARG 41 -7.391 4.396 -13.519 919 HH21 ARG 41 HH21 ARG 41 -5.274 5.932 -11.181 920 HH22 ARG 41 HH22 ARG 41 -5.388 4.792 -12.495 921 H GLU 42 HN GLU 42 -13.615 10.108 -10.186 922 HA GLU 42 HA GLU 42 -14.014 11.308 -12.711 923 HB2 GLU 42 HB2 GLU 42 -15.731 9.930 -11.620 924 HB3 GLU 42 HB1 GLU 42 -15.905 11.139 -10.356 925 HG2 GLU 42 HG2 GLU 42 -16.643 12.767 -12.053 926 HG3 GLU 42 HG1 GLU 42 -16.533 11.503 -13.274 927 H GLU 43 HN GLU 43 -14.084 12.585 -9.406 928 HA GLU 43 HA GLU 43 -14.833 15.212 -9.918 929 HB2 GLU 43 HB2 GLU 43 -12.818 14.278 -7.860 930 HB3 GLU 43 HB1 GLU 43 -13.687 15.804 -7.833 931 HG2 GLU 43 HG2 GLU 43 -15.771 14.667 -7.458 932 HG3 GLU 43 HG1 GLU 43 -14.985 13.095 -7.639 933 H GLU 44 HN GLU 44 -11.575 13.846 -9.741 934 HA GLU 44 HA GLU 44 -10.219 16.229 -10.408 935 HB2 GLU 44 HB2 GLU 44 -9.526 13.642 -9.599 936 HB3 GLU 44 HB1 GLU 44 -8.747 13.859 -11.158 937 HG2 GLU 44 HG2 GLU 44 -7.217 14.525 -9.467 938 HG3 GLU 44 HG1 GLU 44 -7.766 15.975 -10.301 939 H SER 45 HN SER 45 -11.504 13.601 -12.396 940 HA SER 45 HA SER 45 -10.154 14.438 -14.774 941 HB2 SER 45 HB2 SER 45 -12.612 12.695 -14.477 942 HB3 SER 45 HB1 SER 45 -11.637 12.858 -15.937 943 HG SER 45 HG SER 45 -10.867 11.745 -13.438 944 H ALA 46 HN ALA 46 -13.066 15.390 -13.177 945 HA ALA 46 HA ALA 46 -14.034 16.808 -15.551 946 HB1 ALA 46 HB1 ALA 46 -16.037 17.264 -14.151 947 HB2 ALA 46 HB2 ALA 46 -15.289 16.327 -12.856 948 HB3 ALA 46 HB3 ALA 46 -15.703 15.548 -14.381 949 H GLU 3 HN GLU 3 -10.223 -3.495 14.587 950 HA GLU 3 HA GLU 3 -11.905 -1.550 15.907 951 HB2 GLU 3 HB2 GLU 3 -8.895 -1.529 15.711 952 HB3 GLU 3 HB1 GLU 3 -9.898 -0.768 16.935 953 HG2 GLU 3 HG2 GLU 3 -9.106 -2.592 18.066 954 HG3 GLU 3 HG1 GLU 3 -10.637 -3.213 17.449 955 H ALA 4 HN ALA 4 -9.376 -1.508 13.413 956 HA ALA 4 HA ALA 4 -10.100 1.238 12.718 957 HB1 ALA 4 HB1 ALA 4 -7.810 -0.487 11.784 958 HB2 ALA 4 HB2 ALA 4 -7.737 0.779 13.011 959 HB3 ALA 4 HB3 ALA 4 -8.071 1.196 11.331 960 H LEU 5 HN LEU 5 -10.280 -2.009 11.507 961 HA LEU 5 HA LEU 5 -10.913 -1.262 8.810 962 HB2 LEU 5 HB2 LEU 5 -10.463 -3.709 10.307 963 HB3 LEU 5 HB1 LEU 5 -11.785 -3.867 9.167 964 HG LEU 5 HG LEU 5 -9.558 -4.581 8.284 965 HD11 LEU 5 HD11 LEU 5 -9.828 -3.537 6.125 966 HD12 LEU 5 HD12 LEU 5 -10.796 -2.247 6.837 967 HD13 LEU 5 HD13 LEU 5 -11.414 -3.898 6.807 968 HD21 LEU 5 HD21 LEU 5 -7.877 -3.004 7.759 969 HD22 LEU 5 HD22 LEU 5 -8.301 -2.728 9.450 970 HD23 LEU 5 HD23 LEU 5 -8.906 -1.643 8.198 971 H LYS 6 HN LYS 6 -12.691 -0.969 11.562 972 HA LYS 6 HA LYS 6 -15.205 -1.984 10.637 973 HB2 LYS 6 HB2 LYS 6 -14.454 -1.609 13.073 974 HB3 LYS 6 HB1 LYS 6 -14.886 0.075 12.807 975 HG2 LYS 6 HG2 LYS 6 -16.745 -0.955 13.833 976 HG3 LYS 6 HG1 LYS 6 -17.177 -0.724 12.137 977 HD2 LYS 6 HD2 LYS 6 -16.286 -3.147 11.843 978 HD3 LYS 6 HD1 LYS 6 -16.487 -3.251 13.594 979 HE2 LYS 6 HE2 LYS 6 -18.853 -2.520 13.298 980 HE3 LYS 6 HE1 LYS 6 -18.621 -2.619 11.553 981 HZ1 LYS 6 HZ1 LYS 6 -17.935 -5.005 11.990 982 HZ2 LYS 6 HZ2 LYS 6 -19.574 -4.637 12.160 983 HZ3 LYS 6 HZ3 LYS 6 -18.603 -4.812 13.531 984 H ILE 7 HN ILE 7 -13.665 1.205 10.680 985 HA ILE 7 HA ILE 7 -15.997 2.585 9.786 986 HB ILE 7 HB ILE 7 -14.322 4.432 9.215 987 HG12 ILE 7 HG12 ILE 7 -12.252 3.753 10.927 988 HG13 ILE 7 HG11 ILE 7 -12.522 2.270 10.016 989 HG21 ILE 7 HG21 ILE 7 -15.594 4.684 11.153 990 HG22 ILE 7 HG22 ILE 7 -13.929 4.847 11.707 991 HG23 ILE 7 HG23 ILE 7 -14.800 3.335 11.964 992 HD11 ILE 7 HD11 ILE 7 -12.089 4.957 8.747 993 HD12 ILE 7 HD12 ILE 7 -12.123 3.384 7.953 994 HD13 ILE 7 HD13 ILE 7 -10.808 3.787 9.056 995 H LEU 8 HN LEU 8 -13.603 0.750 8.154 996 HA LEU 8 HA LEU 8 -13.941 2.041 5.600 997 HB2 LEU 8 HB2 LEU 8 -12.524 -0.446 6.513 998 HB3 LEU 8 HB1 LEU 8 -12.711 -0.084 4.808 999 HG LEU 8 HG LEU 8 -11.676 2.243 6.089 1000 HD11 LEU 8 HD11 LEU 8 -10.085 -0.252 6.649 1001 HD12 LEU 8 HD12 LEU 8 -10.929 0.708 7.861 1002 HD13 LEU 8 HD13 LEU 8 -9.580 1.405 6.964 1003 HD21 LEU 8 HD21 LEU 8 -10.583 0.243 4.125 1004 HD22 LEU 8 HD22 LEU 8 -9.743 1.732 4.567 1005 HD23 LEU 8 HD23 LEU 8 -11.320 1.808 3.780 1006 H ASN 9 HN ASN 9 -15.825 0.015 7.409 1007 HA ASN 9 HA ASN 9 -16.895 -1.558 5.229 1008 HB2 ASN 9 HB2 ASN 9 -16.751 -2.523 7.478 1009 HB3 ASN 9 HB1 ASN 9 -17.813 -1.265 8.096 1010 HD21 ASN 9 HD21 ASN 9 -17.613 -4.135 6.126 1011 HD22 ASN 9 HD22 ASN 9 -19.307 -4.471 6.102 1012 H ASN 10 HN ASN 10 -17.573 1.398 6.869 1013 HA ASN 10 HA ASN 10 -20.220 1.609 5.622 1014 HB2 ASN 10 HB2 ASN 10 -19.342 2.300 8.144 1015 HB3 ASN 10 HB1 ASN 10 -19.306 3.842 7.300 1016 HD21 ASN 10 HD21 ASN 10 -21.544 3.153 5.549 1017 HD22 ASN 10 HD22 ASN 10 -22.961 3.216 6.535 1018 H ILE 11 HN ILE 11 -20.404 2.680 3.758 1019 HA ILE 11 HA ILE 11 -18.261 3.960 2.470 1020 HB ILE 11 HB ILE 11 -20.310 2.945 1.382 1021 HG12 ILE 11 HG12 ILE 11 -20.345 4.653 -0.477 1022 HG13 ILE 11 HG11 ILE 11 -19.350 5.685 0.543 1023 HG21 ILE 11 HG21 ILE 11 -22.122 4.679 0.905 1024 HG22 ILE 11 HG22 ILE 11 -21.503 5.530 2.321 1025 HG23 ILE 11 HG23 ILE 11 -22.135 3.893 2.480 1026 HD11 ILE 11 HD11 ILE 11 -18.560 2.921 -0.326 1027 HD12 ILE 11 HD12 ILE 11 -17.561 4.113 0.501 1028 HD13 ILE 11 HD13 ILE 11 -18.088 4.402 -1.154 1029 H ARG 12 HN ARG 12 -20.645 5.166 4.675 1030 HA ARG 12 HA ARG 12 -20.611 7.894 4.019 1031 HB2 ARG 12 HB2 ARG 12 -21.107 6.522 6.669 1032 HB3 ARG 12 HB1 ARG 12 -21.396 8.231 6.373 1033 HG2 ARG 12 HG2 ARG 12 -22.723 6.006 4.839 1034 HG3 ARG 12 HG1 ARG 12 -23.427 6.814 6.243 1035 HD2 ARG 12 HD2 ARG 12 -23.889 8.706 5.095 1036 HD3 ARG 12 HD1 ARG 12 -22.449 8.579 4.089 1037 HE ARG 12 HE ARG 12 -24.392 6.572 3.476 1038 HH11 ARG 12 HH11 ARG 12 -23.538 9.919 2.956 1039 HH12 ARG 12 HH12 ARG 12 -24.352 10.026 1.428 1040 HH21 ARG 12 HH21 ARG 12 -25.447 6.693 1.437 1041 HH22 ARG 12 HH22 ARG 12 -25.428 8.194 0.560 1042 H THR 13 HN THR 13 -18.841 6.169 6.578 1043 HA THR 13 HA THR 13 -17.231 8.397 7.277 1044 HB THR 13 HB THR 13 -15.803 6.406 8.287 1045 HG1 THR 13 HG1 THR 13 -16.672 4.582 7.554 1046 HG21 THR 13 HG21 THR 13 -18.582 7.097 9.256 1047 HG22 THR 13 HG22 THR 13 -17.117 8.010 9.592 1048 HG23 THR 13 HG23 THR 13 -17.299 6.379 10.227 1049 H LEU 14 HN LEU 14 -16.810 5.603 5.192 1050 HA LEU 14 HA LEU 14 -14.108 5.763 4.641 1051 HB2 LEU 14 HB2 LEU 14 -15.766 3.974 3.975 1052 HB3 LEU 14 HB1 LEU 14 -16.205 5.004 2.627 1053 HG LEU 14 HG LEU 14 -14.034 4.794 1.639 1054 HD11 LEU 14 HD11 LEU 14 -12.263 3.420 2.727 1055 HD12 LEU 14 HD12 LEU 14 -13.253 3.380 4.188 1056 HD13 LEU 14 HD13 LEU 14 -12.626 4.916 3.589 1057 HD21 LEU 14 HD21 LEU 14 -15.537 2.947 1.202 1058 HD22 LEU 14 HD22 LEU 14 -15.001 2.131 2.671 1059 HD23 LEU 14 HD23 LEU 14 -13.880 2.352 1.328 1060 H ARG 15 HN ARG 15 -16.757 7.254 2.741 1061 HA ARG 15 HA ARG 15 -15.010 8.559 0.938 1062 HB2 ARG 15 HB2 ARG 15 -17.392 8.155 0.438 1063 HB3 ARG 15 HB1 ARG 15 -17.844 9.302 1.689 1064 HG2 ARG 15 HG2 ARG 15 -16.589 11.057 0.400 1065 HG3 ARG 15 HG1 ARG 15 -16.419 9.878 -0.899 1066 HD2 ARG 15 HD2 ARG 15 -19.096 10.603 0.257 1067 HD3 ARG 15 HD1 ARG 15 -18.366 11.533 -1.051 1068 HE ARG 15 HE ARG 15 -18.315 9.319 -2.291 1069 HH11 ARG 15 HH11 ARG 15 -20.735 10.069 0.155 1070 HH12 ARG 15 HH12 ARG 15 -21.919 8.993 -0.512 1071 HH21 ARG 15 HH21 ARG 15 -19.883 7.939 -3.180 1072 HH22 ARG 15 HH22 ARG 15 -21.435 7.777 -2.405 1073 H ALA 16 HN ALA 16 -16.390 9.521 4.020 1074 HA ALA 16 HA ALA 16 -15.710 12.264 3.882 1075 HB1 ALA 16 HB1 ALA 16 -16.072 12.262 6.315 1076 HB2 ALA 16 HB2 ALA 16 -16.159 10.504 6.285 1077 HB3 ALA 16 HB3 ALA 16 -17.373 11.458 5.441 1078 H GLN 17 HN GLN 17 -13.978 9.438 5.117 1079 HA GLN 17 HA GLN 17 -11.775 11.047 6.087 1080 HB2 GLN 17 HB2 GLN 17 -12.044 8.046 5.838 1081 HB3 GLN 17 HB1 GLN 17 -10.755 8.891 6.683 1082 HG2 GLN 17 HG2 GLN 17 -12.101 9.495 8.430 1083 HG3 GLN 17 HG1 GLN 17 -13.572 9.428 7.463 1084 HE21 GLN 17 HE21 GLN 17 -13.114 8.265 10.036 1085 HE22 GLN 17 HE22 GLN 17 -13.326 6.562 9.862 1086 H ALA 18 HN ALA 18 -12.527 9.159 3.237 1087 HA ALA 18 HA ALA 18 -9.874 9.008 2.229 1088 HB1 ALA 18 HB1 ALA 18 -11.550 7.468 1.439 1089 HB2 ALA 18 HB2 ALA 18 -10.960 8.427 0.080 1090 HB3 ALA 18 HB3 ALA 18 -12.526 8.795 0.809 1091 H ARG 19 HN ARG 19 -12.292 11.489 2.199 1092 HA ARG 19 HA ARG 19 -11.290 12.955 -0.028 1093 HB2 ARG 19 HB2 ARG 19 -13.543 13.072 1.555 1094 HB3 ARG 19 HB1 ARG 19 -12.665 14.521 2.022 1095 HG2 ARG 19 HG2 ARG 19 -14.005 15.268 0.296 1096 HG3 ARG 19 HG1 ARG 19 -12.474 14.942 -0.521 1097 HD2 ARG 19 HD2 ARG 19 -13.308 12.790 -1.277 1098 HD3 ARG 19 HD1 ARG 19 -14.812 13.043 -0.393 1099 HE ARG 19 HE ARG 19 -14.052 14.217 -2.924 1100 HH11 ARG 19 HH11 ARG 19 -16.211 14.396 -0.159 1101 HH12 ARG 19 HH12 ARG 19 -17.446 15.238 -1.029 1102 HH21 ARG 19 HH21 ARG 19 -15.672 15.306 -4.071 1103 HH22 ARG 19 HH22 ARG 19 -17.148 15.754 -3.261 1104 H GLU 20 HN GLU 20 -10.103 12.482 3.086 1105 HA GLU 20 HA GLU 20 -8.870 15.077 3.384 1106 HB2 GLU 20 HB2 GLU 20 -8.230 12.570 4.937 1107 HB3 GLU 20 HB1 GLU 20 -7.960 14.236 5.425 1108 HG2 GLU 20 HG2 GLU 20 -10.709 13.151 4.929 1109 HG3 GLU 20 HG1 GLU 20 -9.904 12.999 6.489 1110 H CYS 21 H CYS 21 -8.042 11.927 2.182 1111 HA CYS 21 HA CYS 21 -5.205 12.666 1.852 1112 HB2 CYS 21 3HB CYS 21 -6.731 10.002 1.434 1113 HB3 CYS 21 2HB CYS 21 -4.996 10.192 1.149 1114 HG CYS 21 HG CYS 21 -4.247 10.088 3.404 1115 H THR 22 HN THR 22 -4.171 12.610 -0.118 1116 HA THR 22 HA THR 22 -5.675 13.630 -2.302 1117 HB THR 22 HB THR 22 -3.002 12.667 -2.969 1118 HG1 THR 22 HG1 THR 22 -2.545 14.680 -1.269 1119 HG21 THR 22 HG21 THR 22 -4.023 14.373 -4.288 1120 HG22 THR 22 HG22 THR 22 -2.694 15.127 -3.410 1121 HG23 THR 22 HG23 THR 22 -4.353 15.362 -2.863 1122 H LEU 23 HN LEU 23 -5.870 12.713 -4.416 1123 HA LEU 23 HA LEU 23 -6.767 10.077 -4.501 1124 HB2 LEU 23 HB2 LEU 23 -7.411 11.828 -6.107 1125 HB3 LEU 23 HB1 LEU 23 -5.798 11.797 -6.787 1126 HG LEU 23 HG LEU 23 -6.142 9.534 -7.607 1127 HD11 LEU 23 HD11 LEU 23 -8.831 9.762 -6.267 1128 HD12 LEU 23 HD12 LEU 23 -7.547 8.610 -5.905 1129 HD13 LEU 23 HD13 LEU 23 -8.411 8.514 -7.437 1130 HD21 LEU 23 HD21 LEU 23 -7.944 10.013 -9.231 1131 HD22 LEU 23 HD22 LEU 23 -6.790 11.333 -9.063 1132 HD23 LEU 23 HD23 LEU 23 -8.372 11.441 -8.290 1133 H GLU 24 HN GLU 24 -3.587 11.402 -5.076 1134 HA GLU 24 HA GLU 24 -2.381 9.268 -6.396 1135 HB2 GLU 24 HB2 GLU 24 -1.430 11.576 -5.963 1136 HB3 GLU 24 HB1 GLU 24 -1.026 11.020 -4.348 1137 HG2 GLU 24 HG2 GLU 24 0.218 9.114 -5.557 1138 HG3 GLU 24 HG1 GLU 24 0.110 10.155 -6.974 1139 H THR 25 HN THR 25 -2.558 9.938 -2.899 1140 HA THR 25 HA THR 25 -1.188 7.619 -2.085 1141 HB THR 25 HB THR 25 -3.283 8.730 -0.299 1142 HG1 THR 25 HG1 THR 25 -0.977 10.233 -1.069 1143 HG21 THR 25 HG21 THR 25 -1.617 7.114 0.497 1144 HG22 THR 25 HG22 THR 25 -1.440 8.667 1.314 1145 HG23 THR 25 HG23 THR 25 -0.321 8.216 0.031 1146 H LEU 26 HN LEU 26 -4.568 8.284 -2.773 1147 HA LEU 26 HA LEU 26 -5.651 5.911 -1.699 1148 HB2 LEU 26 HB2 LEU 26 -6.649 7.683 -3.930 1149 HB3 LEU 26 HB1 LEU 26 -7.580 6.377 -3.223 1150 HG LEU 26 HG LEU 26 -6.606 8.815 -1.734 1151 HD11 LEU 26 HD11 LEU 26 -9.342 8.098 -2.769 1152 HD12 LEU 26 HD12 LEU 26 -8.303 9.398 -3.355 1153 HD13 LEU 26 HD13 LEU 26 -8.967 9.469 -1.721 1154 HD21 LEU 26 HD21 LEU 26 -6.801 6.932 -0.253 1155 HD22 LEU 26 HD22 LEU 26 -8.383 6.523 -0.915 1156 HD23 LEU 26 HD23 LEU 26 -8.171 8.008 0.009 1157 H GLU 27 HN GLU 27 -4.629 6.760 -4.998 1158 HA GLU 27 HA GLU 27 -5.226 4.232 -6.114 1159 HB2 GLU 27 HB2 GLU 27 -3.320 6.385 -7.027 1160 HB3 GLU 27 HB1 GLU 27 -3.743 4.972 -7.982 1161 HG2 GLU 27 HG2 GLU 27 -6.152 5.732 -7.765 1162 HG3 GLU 27 HG1 GLU 27 -5.507 7.251 -7.150 1163 H GLU 28 HN GLU 28 -2.346 5.588 -4.627 1164 HA GLU 28 HA GLU 28 -0.526 3.574 -5.316 1165 HB2 GLU 28 HB2 GLU 28 -0.187 5.897 -4.156 1166 HB3 GLU 28 HB1 GLU 28 -0.373 4.976 -2.673 1167 HG2 GLU 28 HG2 GLU 28 1.512 3.563 -3.302 1168 HG3 GLU 28 HG1 GLU 28 1.684 4.458 -4.810 1169 H MET 29 HN MET 29 -2.590 3.915 -2.435 1170 HA MET 29 HA MET 29 -1.726 1.400 -1.361 1171 HB2 MET 29 HB2 MET 29 -3.247 1.778 0.430 1172 HB3 MET 29 HB1 MET 29 -2.528 3.326 0.035 1173 HG2 MET 29 HG2 MET 29 -4.538 3.957 -1.193 1174 HG3 MET 29 HG1 MET 29 -5.257 2.392 -0.821 1175 HE1 MET 29 HE1 MET 29 -3.936 5.762 0.609 1176 HE2 MET 29 HE2 MET 29 -3.054 4.625 1.630 1177 HE3 MET 29 HE3 MET 29 -4.322 5.634 2.324 1178 H LEU 30 HN LEU 30 -4.244 2.419 -3.521 1179 HA LEU 30 HA LEU 30 -6.028 0.265 -3.192 1180 HB2 LEU 30 HB2 LEU 30 -6.484 2.373 -4.472 1181 HB3 LEU 30 HB1 LEU 30 -5.461 1.753 -5.756 1182 HG LEU 30 HG LEU 30 -7.029 -0.223 -5.915 1183 HD11 LEU 30 HD11 LEU 30 -9.339 0.247 -5.020 1184 HD12 LEU 30 HD12 LEU 30 -8.602 1.499 -4.017 1185 HD13 LEU 30 HD13 LEU 30 -8.120 -0.185 -3.820 1186 HD21 LEU 30 HD21 LEU 30 -8.694 0.984 -7.207 1187 HD22 LEU 30 HD22 LEU 30 -7.083 1.639 -7.505 1188 HD23 LEU 30 HD23 LEU 30 -8.207 2.502 -6.451 1189 H GLU 31 HN GLU 31 -3.134 0.671 -5.149 1190 HA GLU 31 HA GLU 31 -3.324 -1.694 -6.655 1191 HB2 GLU 31 HB2 GLU 31 -0.872 -0.181 -5.746 1192 HB3 GLU 31 HB1 GLU 31 -0.876 -1.442 -6.970 1193 HG2 GLU 31 HG2 GLU 31 -2.824 0.379 -7.783 1194 HG3 GLU 31 HG1 GLU 31 -1.469 1.358 -7.219 1195 H LYS 32 HN LYS 32 -2.103 -1.035 -3.447 1196 HA LYS 32 HA LYS 32 -0.922 -3.623 -3.091 1197 HB2 LYS 32 HB2 LYS 32 -1.768 -1.934 -0.769 1198 HB3 LYS 32 HB1 LYS 32 -0.329 -2.923 -0.960 1199 HG2 LYS 32 HG2 LYS 32 -0.837 -0.292 -2.335 1200 HG3 LYS 32 HG1 LYS 32 0.186 -0.535 -0.919 1201 HD2 LYS 32 HD2 LYS 32 1.654 -1.994 -2.221 1202 HD3 LYS 32 HD1 LYS 32 0.622 -1.778 -3.635 1203 HE2 LYS 32 HE2 LYS 32 2.481 -0.305 -3.867 1204 HE3 LYS 32 HE1 LYS 32 1.062 0.672 -3.489 1205 HZ1 LYS 32 HZ1 LYS 32 2.920 1.410 -2.202 1206 HZ2 LYS 32 HZ2 LYS 32 3.208 -0.150 -1.607 1207 HZ3 LYS 32 HZ3 LYS 32 1.804 0.692 -1.154 1208 H LEU 33 HN LEU 33 -3.963 -2.069 -2.353 1209 HA LEU 33 HA LEU 33 -5.049 -4.094 -0.726 1210 HB2 LEU 33 HB2 LEU 33 -5.897 -1.782 -0.839 1211 HB3 LEU 33 HB1 LEU 33 -6.481 -2.089 -2.464 1212 HG LEU 33 HG LEU 33 -7.876 -3.980 -1.381 1213 HD11 LEU 33 HD11 LEU 33 -8.409 -3.753 0.919 1214 HD12 LEU 33 HD12 LEU 33 -7.472 -2.267 1.057 1215 HD13 LEU 33 HD13 LEU 33 -6.650 -3.805 0.803 1216 HD21 LEU 33 HD21 LEU 33 -8.431 -1.054 -0.967 1217 HD22 LEU 33 HD22 LEU 33 -9.634 -2.324 -0.745 1218 HD23 LEU 33 HD23 LEU 33 -8.914 -2.056 -2.332 1219 H GLU 34 HN GLU 34 -5.454 -3.425 -4.210 1220 HA GLU 34 HA GLU 34 -7.242 -5.509 -4.713 1221 HB2 GLU 34 HB2 GLU 34 -6.588 -5.297 -7.082 1222 HB3 GLU 34 HB1 GLU 34 -6.947 -3.755 -6.326 1223 HG2 GLU 34 HG2 GLU 34 -4.565 -3.299 -6.110 1224 HG3 GLU 34 HG1 GLU 34 -4.201 -4.858 -6.853 1225 H VAL 35 HN VAL 35 -3.678 -5.540 -4.801 1226 HA VAL 35 HA VAL 35 -3.604 -8.233 -5.742 1227 HB VAL 35 HB VAL 35 -1.209 -8.224 -5.235 1228 HG11 VAL 35 HG11 VAL 35 -0.600 -6.748 -6.922 1229 HG12 VAL 35 HG12 VAL 35 -1.807 -5.553 -6.449 1230 HG13 VAL 35 HG13 VAL 35 -2.308 -7.040 -7.256 1231 HG21 VAL 35 HG21 VAL 35 -0.141 -6.178 -4.349 1232 HG22 VAL 35 HG22 VAL 35 -1.175 -6.982 -3.168 1233 HG23 VAL 35 HG23 VAL 35 -1.743 -5.529 -3.993 1234 H VAL 36 HN VAL 36 -3.539 -6.762 -2.534 1235 HA VAL 36 HA VAL 36 -2.877 -9.128 -1.115 1236 HB VAL 36 HB VAL 36 -4.135 -6.522 -0.288 1237 HG11 VAL 36 HG11 VAL 36 -5.209 -8.311 1.047 1238 HG12 VAL 36 HG12 VAL 36 -4.196 -7.243 2.018 1239 HG13 VAL 36 HG13 VAL 36 -3.609 -8.846 1.568 1240 HG21 VAL 36 HG21 VAL 36 -1.606 -7.876 0.629 1241 HG22 VAL 36 HG22 VAL 36 -2.097 -6.207 0.913 1242 HG23 VAL 36 HG23 VAL 36 -1.680 -6.738 -0.716 1243 H VAL 37 HN VAL 37 -5.978 -7.582 -1.886 1244 HA VAL 37 HA VAL 37 -7.620 -9.487 -0.613 1245 HB VAL 37 HB VAL 37 -8.191 -7.651 -2.953 1246 HG11 VAL 37 HG11 VAL 37 -10.530 -8.141 -2.708 1247 HG12 VAL 37 HG12 VAL 37 -10.215 -9.181 -1.323 1248 HG13 VAL 37 HG13 VAL 37 -9.678 -9.670 -2.927 1249 HG21 VAL 37 HG21 VAL 37 -7.690 -6.598 -0.762 1250 HG22 VAL 37 HG22 VAL 37 -9.044 -7.484 -0.064 1251 HG23 VAL 37 HG23 VAL 37 -9.333 -6.283 -1.321 1252 H ASN 38 HN ASN 38 -6.167 -9.344 -3.806 1253 HA ASN 38 HA ASN 38 -7.532 -11.516 -4.957 1254 HB2 ASN 38 HB2 ASN 38 -6.183 -9.871 -6.238 1255 HB3 ASN 38 HB1 ASN 38 -4.722 -10.583 -5.564 1256 HD21 ASN 38 HD21 ASN 38 -3.992 -12.528 -6.348 1257 HD22 ASN 38 HD22 ASN 38 -4.668 -13.311 -7.734 1258 H GLU 39 HN GLU 39 -4.644 -11.324 -2.936 1259 HA GLU 39 HA GLU 39 -3.768 -13.977 -3.241 1260 HB2 GLU 39 HB2 GLU 39 -3.522 -12.237 -0.781 1261 HB3 GLU 39 HB1 GLU 39 -2.553 -13.659 -1.149 1262 HG2 GLU 39 HG2 GLU 39 -2.217 -12.074 -3.367 1263 HG3 GLU 39 HG1 GLU 39 -2.266 -10.911 -2.044 1264 H ARG 40 HN ARG 40 -6.107 -12.512 -1.045 1265 HA ARG 40 HA ARG 40 -6.647 -14.900 0.419 1266 HB2 ARG 40 HB2 ARG 40 -8.281 -12.369 0.087 1267 HB3 ARG 40 HB1 ARG 40 -8.661 -13.658 1.220 1268 HG2 ARG 40 HG2 ARG 40 -6.032 -12.205 1.278 1269 HG3 ARG 40 HG1 ARG 40 -7.453 -11.629 2.147 1270 HD2 ARG 40 HD2 ARG 40 -6.592 -14.463 2.509 1271 HD3 ARG 40 HD1 ARG 40 -5.684 -13.187 3.315 1272 HE ARG 40 HE ARG 40 -7.812 -12.534 4.380 1273 HH11 ARG 40 HH11 ARG 40 -7.486 -15.789 3.103 1274 HH12 ARG 40 HH12 ARG 40 -8.702 -16.448 4.159 1275 HH21 ARG 40 HH21 ARG 40 -9.387 -13.425 5.784 1276 HH22 ARG 40 HH22 ARG 40 -9.766 -15.116 5.675 1277 H ARG 41 HN ARG 41 -7.877 -13.423 -2.480 1278 HA ARG 41 HA ARG 41 -10.210 -14.956 -2.841 1279 HB2 ARG 41 HB2 ARG 41 -8.459 -13.289 -4.559 1280 HB3 ARG 41 HB1 ARG 41 -9.475 -14.461 -5.387 1281 HG2 ARG 41 HG2 ARG 41 -10.646 -12.605 -3.362 1282 HG3 ARG 41 HG1 ARG 41 -10.357 -12.074 -5.020 1283 HD2 ARG 41 HD2 ARG 41 -11.926 -14.547 -4.304 1284 HD3 ARG 41 HD1 ARG 41 -12.665 -12.967 -4.564 1285 HE ARG 41 HE ARG 41 -11.219 -14.526 -6.617 1286 HH11 ARG 41 HH11 ARG 41 -13.581 -12.103 -5.708 1287 HH12 ARG 41 HH12 ARG 41 -14.186 -11.919 -7.330 1288 HH21 ARG 41 HH21 ARG 41 -11.999 -14.269 -8.746 1289 HH22 ARG 41 HH22 ARG 41 -13.279 -13.140 -9.059 1290 H GLU 42 HN GLU 42 -6.878 -15.434 -3.947 1291 HA GLU 42 HA GLU 42 -7.234 -17.745 -5.454 1292 HB2 GLU 42 HB2 GLU 42 -4.824 -17.191 -3.719 1293 HB3 GLU 42 HB1 GLU 42 -4.874 -18.122 -5.212 1294 HG2 GLU 42 HG2 GLU 42 -5.302 -16.134 -6.496 1295 HG3 GLU 42 HG1 GLU 42 -5.434 -15.164 -5.031 1296 H GLU 43 HN GLU 43 -6.826 -17.317 -1.996 1297 HA GLU 43 HA GLU 43 -6.483 -20.015 -1.274 1298 HB2 GLU 43 HB2 GLU 43 -7.739 -17.820 0.380 1299 HB3 GLU 43 HB1 GLU 43 -6.995 -19.293 0.982 1300 HG2 GLU 43 HG2 GLU 43 -4.828 -18.552 0.186 1301 HG3 GLU 43 HG1 GLU 43 -5.559 -17.107 -0.508 1302 H GLU 44 HN GLU 44 -9.385 -18.049 -1.711 1303 HA GLU 44 HA GLU 44 -11.157 -20.094 -0.752 1304 HB2 GLU 44 HB2 GLU 44 -11.369 -17.376 -1.177 1305 HB3 GLU 44 HB1 GLU 44 -12.348 -18.050 -2.471 1306 HG2 GLU 44 HG2 GLU 44 -13.907 -17.818 -0.802 1307 HG3 GLU 44 HG1 GLU 44 -13.386 -19.485 -0.563 1308 H SER 45 HN SER 45 -10.074 -18.946 -3.921 1309 HA SER 45 HA SER 45 -11.909 -20.539 -5.410 1310 HB2 SER 45 HB2 SER 45 -9.315 -19.352 -6.396 1311 HB3 SER 45 HB1 SER 45 -10.731 -19.785 -7.358 1312 HG SER 45 HG SER 45 -11.704 -18.188 -5.619 1313 H ALA 46 HN ALA 46 -8.895 -21.211 -3.906 1314 HA ALA 46 HA ALA 46 -8.577 -23.671 -5.475 1315 HB1 ALA 46 HB1 ALA 46 -6.558 -22.375 -5.354 1316 HB2 ALA 46 HB2 ALA 46 -6.354 -23.819 -4.362 1317 HB3 ALA 46 HB3 ALA 46 -6.680 -22.260 -3.596 Start of MODEL 10 1 H LEU 6 HT1 LEU 6 10.586 14.074 4.819 2 HA LEU 6 HA LEU 6 11.592 16.193 3.013 3 HB2 LEU 6 HB2 LEU 6 12.301 13.278 3.390 4 HB3 LEU 6 HB1 LEU 6 12.809 14.222 2.005 5 HG LEU 6 HG LEU 6 13.519 14.991 4.828 6 HD11 LEU 6 HD11 LEU 6 15.106 13.313 2.887 7 HD12 LEU 6 HD12 LEU 6 14.387 12.754 4.399 8 HD13 LEU 6 HD13 LEU 6 15.691 13.942 4.429 9 HD21 LEU 6 HD21 LEU 6 15.387 16.131 3.549 10 HD22 LEU 6 HD22 LEU 6 13.773 16.808 3.351 11 HD23 LEU 6 HD23 LEU 6 14.460 15.791 2.087 12 H THR 7 HN THR 7 11.510 15.087 0.676 13 HA THR 7 HA THR 7 8.678 14.657 0.199 14 HB THR 7 HB THR 7 10.575 14.522 -2.072 15 HG1 THR 7 HG1 THR 7 11.620 16.141 -0.952 16 HG21 THR 7 HG21 THR 7 8.067 16.131 -1.558 17 HG22 THR 7 HG22 THR 7 8.146 14.582 -2.397 18 HG23 THR 7 HG23 THR 7 8.917 16.004 -3.099 19 H LYS 8 HN LYS 8 7.944 12.912 -1.181 20 HA LYS 8 HA LYS 8 8.696 10.375 -0.344 21 HB2 LYS 8 HB2 LYS 8 6.530 11.092 -1.423 22 HB3 LYS 8 HB1 LYS 8 7.362 11.057 -2.968 23 HG2 LYS 8 HG2 LYS 8 7.671 8.708 -2.846 24 HG3 LYS 8 HG1 LYS 8 7.141 8.669 -1.160 25 HD2 LYS 8 HD2 LYS 8 4.925 8.926 -1.700 26 HD3 LYS 8 HD1 LYS 8 5.279 9.795 -3.196 27 HE2 LYS 8 HE2 LYS 8 6.019 7.713 -4.233 28 HE3 LYS 8 HE1 LYS 8 5.692 6.846 -2.731 29 HZ1 LYS 8 HZ1 LYS 8 3.732 8.125 -4.561 30 HZ2 LYS 8 HZ2 LYS 8 3.337 7.666 -2.979 31 HZ3 LYS 8 HZ3 LYS 8 3.829 6.491 -4.088 32 H THR 9 HN THR 9 9.803 12.274 -3.073 33 HA THR 9 HA THR 9 11.237 10.184 -4.361 34 HB THR 9 HB THR 9 12.375 12.650 -5.087 35 HG1 THR 9 HG1 THR 9 10.363 13.820 -5.520 36 HG21 THR 9 HG21 THR 9 10.045 11.276 -6.415 37 HG22 THR 9 HG22 THR 9 11.708 10.702 -6.524 38 HG23 THR 9 HG23 THR 9 11.276 12.282 -7.173 39 H ASP 10 HN ASP 10 11.960 12.441 -1.803 40 HA ASP 10 HA ASP 10 14.777 12.407 -1.943 41 HB2 ASP 10 HB2 ASP 10 12.837 12.970 0.284 42 HB3 ASP 10 HB1 ASP 10 14.564 12.886 0.605 43 H TYR 11 HN TYR 11 12.508 10.499 0.006 44 HA TYR 11 HA TYR 11 14.479 8.863 1.205 45 HB2 TYR 11 HB2 TYR 11 11.585 8.129 0.722 46 HB3 TYR 11 HB1 TYR 11 12.661 7.455 1.941 47 HD1 TYR 11 HD1 TYR 11 13.690 9.277 3.592 48 HD2 TYR 11 HD2 TYR 11 10.087 9.749 1.381 49 HE1 TYR 11 HE1 TYR 11 12.938 10.981 5.195 50 HE2 TYR 11 HE2 TYR 11 9.327 11.456 2.977 51 HH TYR 11 HH TYR 11 9.877 11.963 5.531 52 H LEU 12 HN LEU 12 12.546 8.578 -1.718 53 HA LEU 12 HA LEU 12 13.209 5.944 -2.403 54 HB2 LEU 12 HB2 LEU 12 11.412 7.216 -3.483 55 HB3 LEU 12 HB1 LEU 12 12.599 8.278 -4.217 56 HG LEU 12 HG LEU 12 13.523 6.236 -5.409 57 HD11 LEU 12 HD11 LEU 12 12.580 4.513 -4.001 58 HD12 LEU 12 HD12 LEU 12 11.972 4.336 -5.647 59 HD13 LEU 12 HD13 LEU 12 10.944 5.041 -4.401 60 HD21 LEU 12 HD21 LEU 12 10.711 7.170 -5.956 61 HD22 LEU 12 HD22 LEU 12 11.684 6.229 -7.085 62 HD23 LEU 12 HD23 LEU 12 12.208 7.842 -6.606 63 H MET 13 HN MET 13 14.783 9.020 -3.244 64 HA MET 13 HA MET 13 16.786 7.891 -4.877 65 HB2 MET 13 HB2 MET 13 16.562 10.500 -3.405 66 HB3 MET 13 HB1 MET 13 18.033 10.078 -4.269 67 HG2 MET 13 HG2 MET 13 15.288 10.569 -5.363 68 HG3 MET 13 HG1 MET 13 16.804 11.365 -5.777 69 HE1 MET 13 HE1 MET 13 18.772 10.114 -7.220 70 HE2 MET 13 HE2 MET 13 18.639 8.424 -7.696 71 HE3 MET 13 HE3 MET 13 18.734 8.852 -5.990 72 H ARG 14 HN ARG 14 16.490 8.194 -1.435 73 HA ARG 14 HA ARG 14 19.265 7.690 -0.883 74 HB2 ARG 14 HB2 ARG 14 17.548 8.909 0.618 75 HB3 ARG 14 HB1 ARG 14 16.994 7.301 1.060 76 HG2 ARG 14 HG2 ARG 14 19.891 7.950 1.317 77 HG3 ARG 14 HG1 ARG 14 18.757 8.574 2.514 78 HD2 ARG 14 HD2 ARG 14 18.175 5.821 2.067 79 HD3 ARG 14 HD1 ARG 14 19.904 5.984 2.347 80 HE ARG 14 HE ARG 14 17.793 6.865 4.211 81 HH11 ARG 14 HH11 ARG 14 21.108 5.933 3.584 82 HH12 ARG 14 HH12 ARG 14 21.522 5.794 5.259 83 HH21 ARG 14 HH21 ARG 14 18.332 6.680 6.417 84 HH22 ARG 14 HH22 ARG 14 19.945 6.217 6.876 85 H LEU 15 HN LEU 15 16.251 5.845 -0.800 86 HA LEU 15 HA LEU 15 17.495 3.409 0.015 87 HB2 LEU 15 HB2 LEU 15 14.781 3.904 -1.207 88 HB3 LEU 15 HB1 LEU 15 15.296 2.407 -0.449 89 HG LEU 15 HG LEU 15 15.010 5.070 0.951 90 HD11 LEU 15 HD11 LEU 15 13.291 2.601 1.120 91 HD12 LEU 15 HD12 LEU 15 12.869 4.087 0.272 92 HD13 LEU 15 HD13 LEU 15 13.071 4.100 2.023 93 HD21 LEU 15 HD21 LEU 15 16.711 3.831 2.043 94 HD22 LEU 15 HD22 LEU 15 15.783 2.337 1.942 95 HD23 LEU 15 HD23 LEU 15 15.243 3.638 2.998 96 H ARG 16 HN ARG 16 17.011 4.948 -3.042 97 HA ARG 16 HA ARG 16 17.144 2.578 -4.621 98 HB2 ARG 16 HB2 ARG 16 17.196 5.487 -5.162 99 HB3 ARG 16 HB1 ARG 16 17.954 4.457 -6.370 100 HG2 ARG 16 HG2 ARG 16 15.790 3.088 -6.286 101 HG3 ARG 16 HG1 ARG 16 15.102 4.483 -5.456 102 HD2 ARG 16 HD2 ARG 16 15.511 5.898 -7.317 103 HD3 ARG 16 HD1 ARG 16 16.507 4.678 -8.104 104 HE ARG 16 HE ARG 16 14.132 3.428 -7.925 105 HH11 ARG 16 HH11 ARG 16 15.048 6.604 -9.113 106 HH12 ARG 16 HH12 ARG 16 13.743 6.692 -10.254 107 HH21 ARG 16 HH21 ARG 16 12.425 3.529 -9.412 108 HH22 ARG 16 HH22 ARG 16 12.245 4.936 -10.431 109 H ARG 17 HN ARG 17 19.453 4.172 -2.789 110 HA ARG 17 HA ARG 17 21.683 3.420 -4.504 111 HB2 ARG 17 HB2 ARG 17 21.710 4.592 -1.714 112 HB3 ARG 17 HB1 ARG 17 23.105 4.392 -2.762 113 HG2 ARG 17 HG2 ARG 17 21.521 5.851 -4.370 114 HG3 ARG 17 HG1 ARG 17 20.997 6.438 -2.789 115 HD2 ARG 17 HD2 ARG 17 23.816 6.387 -3.854 116 HD3 ARG 17 HD1 ARG 17 22.810 7.812 -3.617 117 HE ARG 17 HE ARG 17 23.934 6.137 -1.462 118 HH11 ARG 17 HH11 ARG 17 22.582 9.178 -2.583 119 HH12 ARG 17 HH12 ARG 17 22.935 10.019 -1.108 120 HH21 ARG 17 HH21 ARG 17 24.394 7.241 0.468 121 HH22 ARG 17 HH22 ARG 17 23.975 8.917 0.630 122 H CYS 18 HN CYS 18 19.689 2.025 -2.237 123 HA CYS 18 HA CYS 18 21.678 0.124 -1.264 124 HB2 CYS 18 HB2 CYS 18 18.722 0.304 -0.618 125 HB3 CYS 18 HB1 CYS 18 19.915 -0.693 0.210 126 HG CYS 18 HG CYS 18 21.345 1.922 0.757 127 H GLN 19 HN GLN 19 21.759 -1.978 -1.933 128 HA GLN 19 HA GLN 19 19.757 -2.834 -3.904 129 HB2 GLN 19 HB2 GLN 19 22.662 -2.507 -4.212 130 HB3 GLN 19 HB1 GLN 19 22.043 -4.052 -4.779 131 HG2 GLN 19 HG2 GLN 19 20.740 -1.491 -5.608 132 HG3 GLN 19 HG1 GLN 19 22.189 -2.076 -6.422 133 HE21 GLN 19 HE21 GLN 19 20.849 -2.190 -8.306 134 HE22 GLN 19 HE22 GLN 19 19.850 -3.581 -8.559 135 H THR 20 HN THR 20 20.447 -5.281 -4.475 136 HA THR 20 HA THR 20 20.563 -7.452 -3.830 137 HB THR 20 HB THR 20 21.580 -6.745 -1.102 138 HG1 THR 20 HG1 THR 20 22.978 -5.495 -2.143 139 HG21 THR 20 HG21 THR 20 23.065 -8.698 -1.600 140 HG22 THR 20 HG22 THR 20 22.181 -8.921 -3.106 141 HG23 THR 20 HG23 THR 20 21.346 -9.088 -1.564 142 H ILE 21 HN ILE 21 18.624 -5.206 -2.340 143 HA ILE 21 HA ILE 21 16.576 -5.335 -1.359 144 HB ILE 21 HB ILE 21 16.889 -8.338 -1.528 145 HG12 ILE 21 HG12 ILE 21 15.351 -6.460 -3.340 146 HG13 ILE 21 HG11 ILE 21 16.927 -7.147 -3.723 147 HG21 ILE 21 HG21 ILE 21 14.487 -6.618 -0.946 148 HG22 ILE 21 HG22 ILE 21 15.272 -7.756 0.145 149 HG23 ILE 21 HG23 ILE 21 14.423 -8.347 -1.281 150 HD11 ILE 21 HD11 ILE 21 14.293 -8.549 -3.462 151 HD12 ILE 21 HD12 ILE 21 15.823 -9.420 -3.420 152 HD13 ILE 21 HD13 ILE 21 15.379 -8.487 -4.850 153 H ASP 22 HN ASP 22 18.691 -7.874 -0.083 154 HA ASP 22 HA ASP 22 17.790 -7.973 2.532 155 HB2 ASP 22 HB2 ASP 22 19.279 -9.656 1.858 156 HB3 ASP 22 HB1 ASP 22 20.469 -8.497 1.274 157 H THR 23 HN THR 23 20.322 -5.860 1.167 158 HA THR 23 HA THR 23 21.014 -4.636 3.609 159 HB THR 23 HB THR 23 21.232 -3.186 0.988 160 HG1 THR 23 HG1 THR 23 22.820 -5.399 1.856 161 HG21 THR 23 HG21 THR 23 23.458 -2.599 1.957 162 HG22 THR 23 HG22 THR 23 22.991 -3.457 3.427 163 HG23 THR 23 HG23 THR 23 22.090 -2.029 2.915 164 H LEU 24 HN LEU 24 18.507 -3.980 1.248 165 HA LEU 24 HA LEU 24 17.792 -1.402 2.184 166 HB2 LEU 24 HB2 LEU 24 17.150 -2.193 -0.032 167 HB3 LEU 24 HB1 LEU 24 16.158 -3.449 0.682 168 HG LEU 24 HG LEU 24 14.820 -1.551 1.763 169 HD11 LEU 24 HD11 LEU 24 14.933 0.603 0.715 170 HD12 LEU 24 HD12 LEU 24 16.179 0.042 -0.396 171 HD13 LEU 24 HD13 LEU 24 16.535 0.188 1.328 172 HD21 LEU 24 HD21 LEU 24 13.466 -1.241 -0.231 173 HD22 LEU 24 HD22 LEU 24 14.001 -2.916 -0.102 174 HD23 LEU 24 HD23 LEU 24 14.790 -1.826 -1.240 175 H GLU 25 HN GLU 25 16.376 -4.622 2.751 176 HA GLU 25 HA GLU 25 14.387 -3.760 4.557 177 HB2 GLU 25 HB2 GLU 25 15.687 -6.470 4.243 178 HB3 GLU 25 HB1 GLU 25 14.268 -6.158 5.228 179 HG2 GLU 25 HG2 GLU 25 13.221 -5.242 3.068 180 HG3 GLU 25 HG1 GLU 25 14.537 -6.079 2.249 181 H ARG 26 HN ARG 26 17.737 -4.055 4.951 182 HA ARG 26 HA ARG 26 17.628 -4.495 7.816 183 HB2 ARG 26 HB2 ARG 26 19.453 -5.426 6.356 184 HB3 ARG 26 HB1 ARG 26 20.029 -3.780 6.131 185 HG2 ARG 26 HG2 ARG 26 20.401 -3.582 8.540 186 HG3 ARG 26 HG1 ARG 26 19.836 -5.239 8.758 187 HD2 ARG 26 HD2 ARG 26 21.963 -4.907 6.759 188 HD3 ARG 26 HD1 ARG 26 22.439 -4.515 8.408 189 HE ARG 26 HE ARG 26 22.158 -6.745 9.006 190 HH11 ARG 26 HH11 ARG 26 21.201 -6.215 5.681 191 HH12 ARG 26 HH12 ARG 26 21.183 -7.902 5.279 192 HH21 ARG 26 HH21 ARG 26 22.164 -8.967 8.475 193 HH22 ARG 26 HH22 ARG 26 21.745 -9.465 6.868 194 H VAL 27 HN VAL 27 18.457 -1.854 5.587 195 HA VAL 27 HA VAL 27 19.083 -0.030 7.698 196 HB VAL 27 HB VAL 27 20.067 0.141 5.427 197 HG11 VAL 27 HG11 VAL 27 18.062 -0.352 4.114 198 HG12 VAL 27 HG12 VAL 27 18.822 1.160 3.614 199 HG13 VAL 27 HG13 VAL 27 17.364 1.194 4.609 200 HG21 VAL 27 HG21 VAL 27 20.315 2.045 6.791 201 HG22 VAL 27 HG22 VAL 27 18.629 2.511 6.578 202 HG23 VAL 27 HG23 VAL 27 19.757 2.652 5.232 203 H ILE 28 HN ILE 28 16.149 -0.725 5.836 204 HA ILE 28 HA ILE 28 14.759 1.617 6.637 205 HB ILE 28 HB ILE 28 12.704 0.491 5.926 206 HG12 ILE 28 HG12 ILE 28 14.446 -1.929 5.410 207 HG13 ILE 28 HG11 ILE 28 13.324 -1.784 6.760 208 HG21 ILE 28 HG21 ILE 28 13.195 0.464 3.647 209 HG22 ILE 28 HG22 ILE 28 14.825 -0.159 3.911 210 HG23 ILE 28 HG23 ILE 28 14.435 1.507 4.342 211 HD11 ILE 28 HD11 ILE 28 12.616 -1.802 3.833 212 HD12 ILE 28 HD12 ILE 28 11.472 -1.549 5.154 213 HD13 ILE 28 HD13 ILE 28 12.324 -3.088 5.008 214 H GLU 29 HN GLU 29 15.056 -1.587 8.064 215 HA GLU 29 HA GLU 29 13.057 -1.252 10.037 216 HB2 GLU 29 HB2 GLU 29 14.015 -3.443 9.331 217 HB3 GLU 29 HB1 GLU 29 15.514 -3.013 10.140 218 HG2 GLU 29 HG2 GLU 29 14.282 -4.466 11.570 219 HG3 GLU 29 HG1 GLU 29 14.257 -2.851 12.272 220 H LYS 30 HN LYS 30 16.510 -0.572 9.927 221 HA LYS 30 HA LYS 30 16.768 0.148 12.658 222 HB2 LYS 30 HB2 LYS 30 18.429 0.830 10.231 223 HB3 LYS 30 HB1 LYS 30 18.861 1.316 11.864 224 HG2 LYS 30 HG2 LYS 30 18.883 -1.080 12.513 225 HG3 LYS 30 HG1 LYS 30 18.623 -1.492 10.816 226 HD2 LYS 30 HD2 LYS 30 20.685 -0.355 10.206 227 HD3 LYS 30 HD1 LYS 30 20.936 0.117 11.886 228 HE2 LYS 30 HE2 LYS 30 21.182 -2.183 12.547 229 HE3 LYS 30 HE1 LYS 30 20.758 -2.733 10.926 230 HZ1 LYS 30 HZ1 LYS 30 22.759 -1.810 10.069 231 HZ2 LYS 30 HZ2 LYS 30 23.173 -2.758 11.404 232 HZ3 LYS 30 HZ3 LYS 30 23.135 -1.071 11.539 233 H ASN 31 HN ASN 31 16.190 1.999 9.696 234 HA ASN 31 HA ASN 31 16.206 4.544 10.939 235 HB2 ASN 31 HB2 ASN 31 16.266 3.804 8.380 236 HB3 ASN 31 HB1 ASN 31 14.534 4.081 8.511 237 HD21 ASN 31 HD21 ASN 31 14.679 6.235 10.396 238 HD22 ASN 31 HD22 ASN 31 15.333 7.601 9.559 239 H LYS 32 HN LYS 32 13.823 2.048 10.660 240 HA LYS 32 HA LYS 32 11.479 3.529 11.094 241 HB2 LYS 32 HB2 LYS 32 11.548 1.141 10.385 242 HB3 LYS 32 HB1 LYS 32 12.096 0.704 11.997 243 HG2 LYS 32 HG2 LYS 32 9.940 1.804 12.829 244 HG3 LYS 32 HG1 LYS 32 9.412 1.731 11.148 245 HD2 LYS 32 HD2 LYS 32 10.424 -0.688 12.624 246 HD3 LYS 32 HD1 LYS 32 8.730 -0.201 12.660 247 HE2 LYS 32 HE2 LYS 32 8.521 -0.487 10.304 248 HE3 LYS 32 HE1 LYS 32 10.260 -0.694 10.118 249 HZ1 LYS 32 HZ1 LYS 32 10.204 -2.813 10.895 250 HZ2 LYS 32 HZ2 LYS 32 8.663 -2.748 10.190 251 HZ3 LYS 32 HZ3 LYS 32 8.834 -2.562 11.861 252 H TYR 33 HN TYR 33 13.915 2.260 13.280 253 HA TYR 33 HA TYR 33 12.425 2.964 15.657 254 HB2 TYR 33 HB2 TYR 33 15.326 2.143 15.425 255 HB3 TYR 33 HB1 TYR 33 14.357 2.169 16.891 256 HD1 TYR 33 HD1 TYR 33 11.848 0.870 15.843 257 HD2 TYR 33 HD2 TYR 33 15.950 -0.100 15.277 258 HE1 TYR 33 HE1 TYR 33 11.236 -1.484 15.468 259 HE2 TYR 33 HE2 TYR 33 15.351 -2.451 14.898 260 HH TYR 33 HH TYR 33 12.584 -3.553 14.054 261 H GLU 34 HN GLU 34 13.928 4.828 13.460 262 HA GLU 34 HA GLU 34 14.761 6.783 15.496 263 HB2 GLU 34 HB2 GLU 34 16.166 6.083 12.920 264 HB3 GLU 34 HB1 GLU 34 16.497 7.557 13.823 265 HG2 GLU 34 HG2 GLU 34 17.183 6.232 15.754 266 HG3 GLU 34 HG1 GLU 34 16.834 4.750 14.867 267 H LEU 35 HN LEU 35 12.277 6.361 13.813 268 HA LEU 35 HA LEU 35 12.309 8.943 12.395 269 HB2 LEU 35 HB2 LEU 35 10.750 6.425 11.949 270 HB3 LEU 35 HB1 LEU 35 10.091 7.961 11.422 271 HG LEU 35 HG LEU 35 12.796 6.950 10.558 272 HD11 LEU 35 HD11 LEU 35 11.124 5.385 9.781 273 HD12 LEU 35 HD12 LEU 35 11.718 6.358 8.434 274 HD13 LEU 35 HD13 LEU 35 10.143 6.710 9.150 275 HD21 LEU 35 HD21 LEU 35 12.601 9.325 10.338 276 HD22 LEU 35 HD22 LEU 35 11.005 9.178 9.600 277 HD23 LEU 35 HD23 LEU 35 12.433 8.610 8.734 278 H SER 36 HN SER 36 10.321 10.240 12.523 279 HA SER 36 HA SER 36 9.357 10.285 15.274 280 HB2 SER 36 HB2 SER 36 8.501 12.277 13.218 281 HB3 SER 36 HB1 SER 36 8.863 12.513 14.925 282 HG SER 36 HG SER 36 10.680 12.169 12.765 283 H ASP 37 H ASP 37 8.468 8.539 12.794 284 HA ASP 37 HA ASP 37 6.638 7.240 12.363 285 HB2 ASP 37 3HB ASP 37 5.400 8.925 14.642 286 HB3 ASP 37 2HB ASP 37 4.479 7.712 13.762 287 H ASN 38 HN ASN 38 6.216 10.755 12.481 288 HA ASN 38 HA ASN 38 3.947 10.830 10.776 289 HB2 ASN 38 HB2 ASN 38 4.063 12.840 11.815 290 HB3 ASN 38 HB1 ASN 38 5.810 12.763 11.984 291 HD21 ASN 38 HD21 ASN 38 3.181 13.605 9.829 292 HD22 ASN 38 HD22 ASN 38 4.105 14.643 8.804 293 H GLU 39 HN GLU 39 7.430 11.162 10.158 294 HA GLU 39 HA GLU 39 7.092 11.655 7.354 295 HB2 GLU 39 HB2 GLU 39 9.699 10.608 8.222 296 HB3 GLU 39 HB1 GLU 39 9.312 12.063 7.321 297 HG2 GLU 39 HG2 GLU 39 10.178 12.959 9.228 298 HG3 GLU 39 HG1 GLU 39 8.464 12.922 9.639 299 H LEU 40 HN LEU 40 6.980 8.926 9.302 300 HA LEU 40 HA LEU 40 8.038 6.966 7.564 301 HB2 LEU 40 HB2 LEU 40 7.683 6.617 9.971 302 HB3 LEU 40 HB1 LEU 40 5.951 6.701 9.724 303 HG LEU 40 HG LEU 40 6.138 4.668 8.260 304 HD11 LEU 40 HD11 LEU 40 8.420 4.704 7.617 305 HD12 LEU 40 HD12 LEU 40 8.206 3.285 8.640 306 HD13 LEU 40 HD13 LEU 40 8.966 4.738 9.291 307 HD21 LEU 40 HD21 LEU 40 5.604 4.759 10.788 308 HD22 LEU 40 HD22 LEU 40 7.213 4.061 10.984 309 HD23 LEU 40 HD23 LEU 40 5.988 3.205 10.049 310 H ALA 41 HN ALA 41 5.143 8.776 7.524 311 HA ALA 41 HA ALA 41 3.390 6.986 6.246 312 HB1 ALA 41 HB1 ALA 41 3.445 9.979 5.892 313 HB2 ALA 41 HB2 ALA 41 2.758 9.168 7.299 314 HB3 ALA 41 HB3 ALA 41 2.065 8.899 5.700 315 H VAL 42 HN VAL 42 5.696 9.346 4.940 316 HA VAL 42 HA VAL 42 5.120 8.515 2.217 317 HB VAL 42 HB VAL 42 7.189 10.138 1.826 318 HG11 VAL 42 HG11 VAL 42 5.027 10.566 0.912 319 HG12 VAL 42 HG12 VAL 42 5.551 12.029 1.743 320 HG13 VAL 42 HG13 VAL 42 4.373 10.958 2.499 321 HG21 VAL 42 HG21 VAL 42 7.201 11.954 3.470 322 HG22 VAL 42 HG22 VAL 42 7.727 10.426 4.175 323 HG23 VAL 42 HG23 VAL 42 6.099 11.030 4.491 324 H PHE 43 HN PHE 43 7.378 7.834 4.717 325 HA PHE 43 HA PHE 43 9.522 6.866 3.137 326 HB2 PHE 43 HB2 PHE 43 9.644 7.493 5.576 327 HB3 PHE 43 HB1 PHE 43 8.780 6.005 5.939 328 HD1 PHE 43 HD1 PHE 43 11.888 7.329 4.410 329 HD2 PHE 43 HD2 PHE 43 9.929 3.971 6.159 330 HE1 PHE 43 HE1 PHE 43 14.028 6.112 4.470 331 HE2 PHE 43 HE2 PHE 43 12.066 2.754 6.221 332 HZ PHE 43 HZ PHE 43 14.117 3.825 5.375 333 H TYR 44 HN TYR 44 6.590 5.406 4.419 334 HA TYR 44 HA TYR 44 7.176 2.710 3.946 335 HB2 TYR 44 HB2 TYR 44 4.748 4.316 4.394 336 HB3 TYR 44 HB1 TYR 44 4.484 2.835 3.484 337 HD1 TYR 44 HD1 TYR 44 6.487 1.047 4.790 338 HD2 TYR 44 HD2 TYR 44 3.760 3.860 6.452 339 HE1 TYR 44 HE1 TYR 44 6.444 -0.241 6.886 340 HE2 TYR 44 HE2 TYR 44 3.713 2.579 8.551 341 HH TYR 44 HH TYR 44 4.242 -0.156 9.046 342 H SER 45 HN SER 45 5.435 5.035 1.884 343 HA SER 45 HA SER 45 5.095 3.326 -0.315 344 HB2 SER 45 HB2 SER 45 5.387 6.301 -0.589 345 HB3 SER 45 HB1 SER 45 4.297 5.210 -1.444 346 HG SER 45 HG SER 45 3.217 4.887 0.592 347 H ALA 46 HN ALA 46 7.782 5.345 0.674 348 HA ALA 46 HA ALA 46 9.182 5.354 -1.789 349 HB1 ALA 46 HB1 ALA 46 9.652 6.909 0.069 350 HB2 ALA 46 HB2 ALA 46 11.098 6.075 -0.508 351 HB3 ALA 46 HB3 ALA 46 10.323 5.563 0.994 352 H ALA 47 HN ALA 47 9.472 3.314 1.112 353 HA ALA 47 HA ALA 47 11.489 1.620 0.063 354 HB1 ALA 47 HB1 ALA 47 11.148 1.727 2.441 355 HB2 ALA 47 HB2 ALA 47 10.821 0.080 1.902 356 HB3 ALA 47 HB3 ALA 47 9.484 1.169 2.269 357 H ASP 48 HN ASP 48 7.964 1.397 0.200 358 HA ASP 48 HA ASP 48 7.621 -1.161 -0.865 359 HB2 ASP 48 HB2 ASP 48 5.987 1.112 -0.258 360 HB3 ASP 48 HB1 ASP 48 5.536 0.508 -1.846 361 H HIS 49 HN HIS 49 7.657 1.987 -2.522 362 HA HIS 49 HA HIS 49 7.338 1.019 -5.138 363 HB2 HIS 49 HB2 HIS 49 7.252 3.452 -4.172 364 HB3 HIS 49 HB1 HIS 49 8.965 3.477 -4.567 365 HD1 HIS 49 HD1 HIS 49 5.656 4.021 -6.012 366 HD2 HIS 49 HD2 HIS 49 9.453 3.011 -7.431 367 HE1 HIS 49 HE1 HIS 49 5.624 4.511 -8.482 368 HE2 HIS 49 HE2 HIS 49 7.928 3.909 -9.317 369 H ARG 50 HN ARG 50 10.221 1.516 -3.175 370 HA ARG 50 HA ARG 50 12.105 1.040 -5.252 371 HB2 ARG 50 HB2 ARG 50 12.778 2.266 -3.287 372 HB3 ARG 50 HB1 ARG 50 12.354 0.917 -2.243 373 HG2 ARG 50 HG2 ARG 50 14.765 1.100 -2.526 374 HG3 ARG 50 HG1 ARG 50 14.159 -0.412 -3.204 375 HD2 ARG 50 HD2 ARG 50 14.260 0.511 -5.437 376 HD3 ARG 50 HD1 ARG 50 14.752 2.079 -4.794 377 HE ARG 50 HE ARG 50 16.669 0.453 -3.853 378 HH11 ARG 50 HH11 ARG 50 15.331 0.904 -7.066 379 HH12 ARG 50 HH12 ARG 50 16.804 0.448 -7.875 380 HH21 ARG 50 HH21 ARG 50 18.611 -0.140 -4.920 381 HH22 ARG 50 HH22 ARG 50 18.663 -0.140 -6.659 382 H LEU 51 HN LEU 51 10.529 -1.024 -2.860 383 HA LEU 51 HA LEU 51 12.109 -3.317 -3.340 384 HB2 LEU 51 HB2 LEU 51 10.653 -2.938 -1.348 385 HB3 LEU 51 HB1 LEU 51 9.254 -3.228 -2.361 386 HG LEU 51 HG LEU 51 9.962 -5.527 -2.739 387 HD11 LEU 51 HD11 LEU 51 12.326 -4.803 -1.012 388 HD12 LEU 51 HD12 LEU 51 12.360 -5.266 -2.714 389 HD13 LEU 51 HD13 LEU 51 11.888 -6.442 -1.490 390 HD21 LEU 51 HD21 LEU 51 8.582 -5.026 -0.785 391 HD22 LEU 51 HD22 LEU 51 10.038 -4.778 0.178 392 HD23 LEU 51 HD23 LEU 51 9.675 -6.373 -0.473 393 H ALA 52 HN ALA 52 9.103 -2.148 -4.771 394 HA ALA 52 HA ALA 52 8.415 -4.392 -6.266 395 HB1 ALA 52 HB1 ALA 52 6.953 -3.013 -7.465 396 HB2 ALA 52 HB2 ALA 52 7.987 -1.598 -7.280 397 HB3 ALA 52 HB3 ALA 52 7.098 -2.226 -5.895 398 H GLU 53 HN GLU 53 10.431 -1.620 -7.227 399 HA GLU 53 HA GLU 53 10.986 -2.674 -9.817 400 HB2 GLU 53 HB2 GLU 53 12.793 -0.876 -9.819 401 HB3 GLU 53 HB1 GLU 53 11.134 -0.327 -9.640 402 HG2 GLU 53 HG2 GLU 53 11.459 -0.077 -7.247 403 HG3 GLU 53 HG1 GLU 53 13.106 -0.681 -7.393 404 H LEU 54 HN LEU 54 12.508 -2.939 -6.694 405 HA LEU 54 HA LEU 54 15.009 -3.929 -7.651 406 HB2 LEU 54 HB2 LEU 54 14.220 -2.899 -5.311 407 HB3 LEU 54 HB1 LEU 54 14.082 -4.602 -4.918 408 HG LEU 54 HG LEU 54 16.417 -4.968 -5.347 409 HD11 LEU 54 HD11 LEU 54 17.822 -2.862 -5.862 410 HD12 LEU 54 HD12 LEU 54 16.308 -2.198 -6.475 411 HD13 LEU 54 HD13 LEU 54 16.981 -3.665 -7.184 412 HD21 LEU 54 HD21 LEU 54 15.958 -4.185 -3.138 413 HD22 LEU 54 HD22 LEU 54 15.888 -2.510 -3.685 414 HD23 LEU 54 HD23 LEU 54 17.424 -3.381 -3.694 415 H THR 55 HN THR 55 12.172 -5.495 -6.161 416 HA THR 55 HA THR 55 13.172 -8.111 -6.244 417 HB THR 55 HB THR 55 10.300 -7.177 -6.327 418 HG1 THR 55 HG1 THR 55 10.599 -7.854 -3.997 419 HG21 THR 55 HG21 THR 55 9.711 -9.380 -5.496 420 HG22 THR 55 HG22 THR 55 11.404 -9.874 -5.521 421 HG23 THR 55 HG23 THR 55 10.563 -9.539 -7.035 422 H MET 56 HN MET 56 11.346 -6.268 -8.661 423 HA MET 56 HA MET 56 11.203 -8.569 -10.417 424 HB2 MET 56 HB2 MET 56 10.050 -5.849 -10.392 425 HB3 MET 56 HB1 MET 56 10.353 -6.546 -11.982 426 HG2 MET 56 HG2 MET 56 8.732 -7.817 -9.790 427 HG3 MET 56 HG1 MET 56 8.085 -6.989 -11.205 428 HE1 MET 56 HE1 MET 56 9.629 -7.863 -13.674 429 HE2 MET 56 HE2 MET 56 7.874 -7.969 -13.533 430 HE3 MET 56 HE3 MET 56 8.795 -9.347 -14.129 431 H ASN 57 HN ASN 57 13.554 -6.397 -9.668 432 HA ASN 57 HA ASN 57 15.481 -5.683 -10.634 433 HB2 ASN 57 HB2 ASN 57 15.524 -8.270 -10.927 434 HB3 ASN 57 HB1 ASN 57 15.236 -7.919 -12.627 435 HD21 ASN 57 HD21 ASN 57 16.882 -7.226 -13.876 436 HD22 ASN 57 HD22 ASN 57 18.499 -6.983 -13.305 437 H LYS 58 HN LYS 58 13.341 -4.271 -11.470 438 HA LYS 58 HA LYS 58 14.245 -3.247 -13.983 439 HB2 LYS 58 HB2 LYS 58 12.694 -5.228 -14.536 440 HB3 LYS 58 HB1 LYS 58 11.390 -4.200 -13.957 441 HG2 LYS 58 HG2 LYS 58 11.743 -2.622 -15.679 442 HG3 LYS 58 HG1 LYS 58 13.289 -3.350 -16.119 443 HD2 LYS 58 HD2 LYS 58 12.012 -5.439 -16.696 444 HD3 LYS 58 HD1 LYS 58 10.536 -4.492 -16.517 445 HE2 LYS 58 HE2 LYS 58 11.085 -4.497 -18.831 446 HE3 LYS 58 HE1 LYS 58 11.468 -2.891 -18.206 447 HZ1 LYS 58 HZ1 LYS 58 13.183 -3.948 -19.705 448 HZ2 LYS 58 HZ2 LYS 58 13.516 -5.020 -18.441 449 HZ3 LYS 58 HZ3 LYS 58 13.755 -3.367 -18.227 450 H LEU 59 HN LEU 59 14.157 -1.128 -13.666 451 HA LEU 59 HA LEU 59 12.565 0.009 -11.583 452 HB2 LEU 59 HB2 LEU 59 14.343 1.243 -13.678 453 HB3 LEU 59 HB1 LEU 59 13.505 2.175 -12.451 454 HG LEU 59 HG LEU 59 14.803 0.297 -10.935 455 HD11 LEU 59 HD11 LEU 59 15.973 -0.431 -13.048 456 HD12 LEU 59 HD12 LEU 59 17.016 0.008 -11.696 457 HD13 LEU 59 HD13 LEU 59 16.782 1.134 -13.034 458 HD21 LEU 59 HD21 LEU 59 14.612 2.783 -10.652 459 HD22 LEU 59 HD22 LEU 59 15.996 2.937 -11.734 460 HD23 LEU 59 HD23 LEU 59 16.167 2.085 -10.198 461 H TYR 60 HN TYR 60 10.717 1.081 -11.678 462 HA TYR 60 HA TYR 60 9.555 1.788 -14.275 463 HB2 TYR 60 HB2 TYR 60 8.333 0.036 -12.153 464 HB3 TYR 60 HB1 TYR 60 7.318 0.981 -13.234 465 HD1 TYR 60 HD1 TYR 60 7.634 0.589 -15.768 466 HD2 TYR 60 HD2 TYR 60 9.087 -2.063 -12.779 467 HE1 TYR 60 HE1 TYR 60 7.725 -1.225 -17.429 468 HE2 TYR 60 HE2 TYR 60 9.187 -3.881 -14.434 469 HH TYR 60 HH TYR 60 8.259 -4.510 -16.518 470 H ASP 61 HN ASP 61 8.544 3.744 -14.240 471 HA ASP 61 HA ASP 61 8.669 5.318 -11.848 472 HB2 ASP 61 HB2 ASP 61 7.845 5.789 -14.669 473 HB3 ASP 61 HB1 ASP 61 7.157 6.857 -13.449 474 H LYS 62 HN LYS 62 6.158 3.767 -13.745 475 HA LYS 62 HA LYS 62 4.222 4.301 -11.596 476 HB2 LYS 62 HB2 LYS 62 2.474 3.762 -13.228 477 HB3 LYS 62 HB1 LYS 62 3.505 5.047 -13.840 478 HG2 LYS 62 HG2 LYS 62 4.692 3.425 -15.235 479 HG3 LYS 62 HG1 LYS 62 3.646 2.144 -14.623 480 HD2 LYS 62 HD2 LYS 62 1.715 3.164 -15.608 481 HD3 LYS 62 HD1 LYS 62 2.645 4.594 -16.059 482 HE2 LYS 62 HE2 LYS 62 2.353 3.230 -18.010 483 HE3 LYS 62 HE1 LYS 62 4.043 3.162 -17.521 484 HZ1 LYS 62 HZ1 LYS 62 3.151 0.983 -18.135 485 HZ2 LYS 62 HZ2 LYS 62 2.013 1.086 -16.889 486 HZ3 LYS 62 HZ3 LYS 62 3.663 1.022 -16.526 487 H ILE 63 HN ILE 63 3.159 2.545 -10.617 488 HA ILE 63 HA ILE 63 4.461 -0.042 -11.127 489 HB ILE 63 HB ILE 63 3.147 0.973 -8.603 490 HG12 ILE 63 HG12 ILE 63 5.344 1.975 -9.032 491 HG13 ILE 63 HG11 ILE 63 5.413 0.882 -7.654 492 HG21 ILE 63 HG21 ILE 63 2.802 -1.441 -8.942 493 HG22 ILE 63 HG22 ILE 63 3.838 -1.095 -7.557 494 HG23 ILE 63 HG23 ILE 63 4.548 -1.651 -9.072 495 HD11 ILE 63 HD11 ILE 63 6.346 -0.854 -9.180 496 HD12 ILE 63 HD12 ILE 63 7.372 0.566 -8.965 497 HD13 ILE 63 HD13 ILE 63 6.424 0.378 -10.440 498 HA PRO 64 HA PRO 64 0.361 -1.335 -12.353 499 HB2 PRO 64 HB2 PRO 64 1.116 -3.692 -13.453 500 HB3 PRO 64 HB1 PRO 64 1.378 -2.143 -14.275 501 HG2 PRO 64 HG2 PRO 64 3.310 -3.882 -12.880 502 HG3 PRO 64 HG1 PRO 64 3.550 -2.801 -14.260 503 HD2 PRO 64 HD2 PRO 64 4.238 -2.252 -11.604 504 HD3 PRO 64 HD1 PRO 64 4.142 -1.076 -12.927 505 H SER 65 HN SER 65 -1.133 -2.496 -11.246 506 HA SER 65 HA SER 65 -0.572 -3.600 -8.758 507 HB2 SER 65 HB2 SER 65 -2.972 -4.647 -10.120 508 HB3 SER 65 HB1 SER 65 -2.827 -3.803 -8.577 509 HG SER 65 HG SER 65 -3.422 -2.066 -9.580 510 H SER 66 H SER 66 -0.411 -5.105 -11.887 511 HA SER 66 HA SER 66 -0.623 -7.834 -10.904 512 HB2 SER 66 3HB SER 66 -0.135 -8.505 -13.225 513 HB3 SER 66 2HB SER 66 -1.347 -7.236 -13.254 514 HG SER 66 HG SER 66 0.361 -5.743 -13.739 515 H VAL 67 HN VAL 67 1.789 -5.636 -10.451 516 HA VAL 67 HA VAL 67 3.909 -7.634 -10.821 517 HB VAL 67 HB VAL 67 4.039 -5.156 -11.667 518 HG11 VAL 67 HG11 VAL 67 5.101 -4.840 -8.865 519 HG12 VAL 67 HG12 VAL 67 3.580 -4.163 -9.448 520 HG13 VAL 67 HG13 VAL 67 5.109 -3.627 -10.145 521 HG21 VAL 67 HG21 VAL 67 5.824 -6.652 -12.060 522 HG22 VAL 67 HG22 VAL 67 6.253 -6.702 -10.348 523 HG23 VAL 67 HG23 VAL 67 6.541 -5.235 -11.287 524 H TRP 68 HN TRP 68 1.957 -6.313 -8.388 525 HA TRP 68 HA TRP 68 3.856 -6.409 -6.256 526 HB2 TRP 68 HB2 TRP 68 0.879 -6.110 -6.396 527 HB3 TRP 68 HB1 TRP 68 1.678 -6.356 -4.845 528 HD1 TRP 68 HD1 TRP 68 0.466 -3.627 -6.842 529 HE1 TRP 68 HE1 TRP 68 1.695 -1.406 -6.326 530 HE3 TRP 68 HE3 TRP 68 4.500 -5.514 -4.334 531 HZ2 TRP 68 HZ2 TRP 68 4.079 -0.597 -5.031 532 HZ3 TRP 68 HZ3 TRP 68 6.207 -3.958 -3.493 533 HH2 TRP 68 HH2 TRP 68 6.000 -1.554 -3.830 534 H LYS 69 HN LYS 69 2.456 -8.850 -7.989 535 HA LYS 69 HA LYS 69 1.880 -10.722 -5.920 536 HB2 LYS 69 HB2 LYS 69 0.847 -11.253 -7.936 537 HB3 LYS 69 HB1 LYS 69 2.260 -10.838 -8.891 538 HG2 LYS 69 HG2 LYS 69 1.821 -13.223 -8.969 539 HG3 LYS 69 HG1 LYS 69 3.362 -12.895 -8.182 540 HD2 LYS 69 HD2 LYS 69 2.143 -14.639 -7.006 541 HD3 LYS 69 HD1 LYS 69 2.312 -13.209 -5.993 542 HE2 LYS 69 HE2 LYS 69 0.009 -12.549 -6.632 543 HE3 LYS 69 HE1 LYS 69 -0.136 -14.061 -7.529 544 HZ1 LYS 69 HZ1 LYS 69 0.173 -13.688 -4.606 545 HZ2 LYS 69 HZ2 LYS 69 0.433 -15.183 -5.362 546 HZ3 LYS 69 HZ3 LYS 69 -1.094 -14.454 -5.445 547 H PHE 70 HN PHE 70 4.768 -9.724 -7.577 548 HA PHE 70 HA PHE 70 6.327 -11.996 -6.752 549 HB2 PHE 70 HB2 PHE 70 7.246 -9.345 -7.880 550 HB3 PHE 70 HB1 PHE 70 8.207 -10.814 -7.756 551 HD1 PHE 70 HD1 PHE 70 7.639 -12.785 -9.149 552 HD2 PHE 70 HD2 PHE 70 5.723 -9.017 -9.667 553 HE1 PHE 70 HE1 PHE 70 6.843 -13.497 -11.366 554 HE2 PHE 70 HE2 PHE 70 4.931 -9.722 -11.889 555 HZ PHE 70 HZ PHE 70 5.491 -11.965 -12.739 556 H ILE 71 HN ILE 71 5.244 -9.221 -5.196 557 HA ILE 71 HA ILE 71 7.540 -9.181 -3.367 558 HB ILE 71 HB ILE 71 5.326 -7.187 -3.825 559 HG12 ILE 71 HG12 ILE 71 7.491 -5.718 -4.055 560 HG13 ILE 71 HG11 ILE 71 8.280 -7.268 -4.329 561 HG21 ILE 71 HG21 ILE 71 7.367 -7.256 -1.613 562 HG22 ILE 71 HG22 ILE 71 5.612 -7.226 -1.456 563 HG23 ILE 71 HG23 ILE 71 6.467 -5.809 -2.064 564 HD11 ILE 71 HD11 ILE 71 6.093 -6.007 -5.960 565 HD12 ILE 71 HD12 ILE 71 6.637 -7.668 -6.172 566 HD13 ILE 71 HD13 ILE 71 7.757 -6.334 -6.446 567 H ARG 72 HN ARG 72 7.348 -10.443 -1.665 568 HA ARG 72 HA ARG 72 4.734 -10.662 -0.361 569 HB2 ARG 72 HB2 ARG 72 6.662 -12.902 -0.997 570 HB3 ARG 72 HB1 ARG 72 5.339 -13.063 0.152 571 HG2 ARG 72 HG2 ARG 72 3.712 -12.693 -1.560 572 HG3 ARG 72 HG1 ARG 72 4.968 -12.289 -2.732 573 HD2 ARG 72 HD2 ARG 72 4.059 -14.578 -2.999 574 HD3 ARG 72 HD1 ARG 72 5.796 -14.541 -2.699 575 HE ARG 72 HE ARG 72 4.171 -14.880 -0.337 576 HH11 ARG 72 HH11 ARG 72 5.866 -16.484 -2.941 577 HH12 ARG 72 HH12 ARG 72 6.049 -17.976 -2.083 578 HH21 ARG 72 HH21 ARG 72 4.399 -16.836 0.811 579 HH22 ARG 72 HH22 ARG 72 5.193 -18.187 0.063 580 H GLU 3 HN GLU 3 -5.058 6.873 10.809 581 HA GLU 3 HA GLU 3 -2.613 5.400 11.474 582 HB2 GLU 3 HB2 GLU 3 -3.755 4.584 13.419 583 HB3 GLU 3 HB1 GLU 3 -4.049 6.311 13.326 584 HG2 GLU 3 HG2 GLU 3 -6.001 4.217 12.392 585 HG3 GLU 3 HG1 GLU 3 -6.021 4.951 13.995 586 H ALA 4 HN ALA 4 -5.843 5.027 10.166 587 HA ALA 4 HA ALA 4 -5.567 2.180 9.792 588 HB1 ALA 4 HB1 ALA 4 -7.664 4.070 8.725 589 HB2 ALA 4 HB2 ALA 4 -7.753 3.195 10.256 590 HB3 ALA 4 HB3 ALA 4 -7.751 2.306 8.733 591 H LEU 5 HN LEU 5 -5.692 5.020 7.667 592 HA LEU 5 HA LEU 5 -5.307 3.598 5.258 593 HB2 LEU 5 HB2 LEU 5 -4.870 6.494 5.959 594 HB3 LEU 5 HB1 LEU 5 -4.646 5.860 4.343 595 HG LEU 5 HG LEU 5 -6.771 6.716 4.198 596 HD11 LEU 5 HD11 LEU 5 -8.322 4.917 4.061 597 HD12 LEU 5 HD12 LEU 5 -7.407 3.960 5.222 598 HD13 LEU 5 HD13 LEU 5 -6.735 4.290 3.626 599 HD21 LEU 5 HD21 LEU 5 -7.405 5.701 6.967 600 HD22 LEU 5 HD22 LEU 5 -8.432 6.712 5.954 601 HD23 LEU 5 HD23 LEU 5 -6.914 7.350 6.582 602 H LYS 6 HN LYS 6 -3.143 4.339 7.746 603 HA LYS 6 HA LYS 6 -0.782 4.553 6.121 604 HB2 LYS 6 HB2 LYS 6 -1.167 5.511 8.481 605 HB3 LYS 6 HB1 LYS 6 -0.840 3.880 9.053 606 HG2 LYS 6 HG2 LYS 6 1.354 3.978 7.883 607 HG3 LYS 6 HG1 LYS 6 1.015 5.668 7.503 608 HD2 LYS 6 HD2 LYS 6 0.664 5.981 10.004 609 HD3 LYS 6 HD1 LYS 6 1.432 4.403 10.190 610 HE2 LYS 6 HE2 LYS 6 3.396 5.238 8.983 611 HE3 LYS 6 HE1 LYS 6 2.632 6.823 8.854 612 HZ1 LYS 6 HZ1 LYS 6 2.521 6.778 11.345 613 HZ2 LYS 6 HZ2 LYS 6 4.066 6.943 10.679 614 HZ3 LYS 6 HZ3 LYS 6 3.562 5.445 11.300 615 H ILE 7 HN ILE 7 -2.564 2.013 7.690 616 HA ILE 7 HA ILE 7 -0.475 0.055 7.586 617 HB ILE 7 HB ILE 7 -3.424 -0.540 7.792 618 HG12 ILE 7 HG12 ILE 7 -1.597 0.094 10.114 619 HG13 ILE 7 HG11 ILE 7 -2.689 1.275 9.402 620 HG21 ILE 7 HG21 ILE 7 -1.052 -1.942 9.007 621 HG22 ILE 7 HG22 ILE 7 -1.825 -2.417 7.493 622 HG23 ILE 7 HG23 ILE 7 -2.731 -2.483 9.006 623 HD11 ILE 7 HD11 ILE 7 -3.608 -1.353 10.526 624 HD12 ILE 7 HD12 ILE 7 -4.597 0.028 10.057 625 HD13 ILE 7 HD13 ILE 7 -3.535 0.139 11.461 626 H LEU 8 HN LEU 8 -2.913 1.204 5.437 627 HA LEU 8 HA LEU 8 -2.849 -1.070 3.666 628 HB2 LEU 8 HB2 LEU 8 -4.208 1.595 3.653 629 HB3 LEU 8 HB1 LEU 8 -4.112 0.669 2.170 630 HG LEU 8 HG LEU 8 -5.244 -1.227 3.386 631 HD11 LEU 8 HD11 LEU 8 -4.775 -0.606 5.659 632 HD12 LEU 8 HD12 LEU 8 -6.522 -0.629 5.405 633 HD13 LEU 8 HD13 LEU 8 -5.656 0.910 5.468 634 HD21 LEU 8 HD21 LEU 8 -6.540 0.022 1.874 635 HD22 LEU 8 HD22 LEU 8 -6.611 1.415 2.954 636 HD23 LEU 8 HD23 LEU 8 -7.490 -0.061 3.358 637 H ASN 9 HN ASN 9 -0.849 1.555 4.200 638 HA ASN 9 HA ASN 9 -0.066 2.164 1.524 639 HB2 ASN 9 HB2 ASN 9 0.259 3.549 3.702 640 HB3 ASN 9 HB1 ASN 9 1.685 2.549 3.941 641 HD21 ASN 9 HD21 ASN 9 1.359 5.432 3.440 642 HD22 ASN 9 HD22 ASN 9 2.347 5.783 2.066 643 H ASN 10 HN ASN 10 1.308 0.150 4.098 644 HA ASN 10 HA ASN 10 3.165 -1.023 2.152 645 HB2 ASN 10 HB2 ASN 10 4.322 -0.139 4.064 646 HB3 ASN 10 HB1 ASN 10 3.217 -0.942 5.172 647 HD21 ASN 10 HD21 ASN 10 5.508 -1.676 2.549 648 HD22 ASN 10 HD22 ASN 10 6.123 -3.116 3.294 649 H ILE 11 HN ILE 11 2.952 -3.051 1.520 650 HA ILE 11 HA ILE 11 0.604 -4.505 2.062 651 HB ILE 11 HB ILE 11 3.125 -5.599 0.819 652 HG12 ILE 11 HG12 ILE 11 0.803 -4.231 -0.556 653 HG13 ILE 11 HG11 ILE 11 2.336 -3.441 -0.208 654 HG21 ILE 11 HG21 ILE 11 1.565 -7.343 1.311 655 HG22 ILE 11 HG22 ILE 11 1.467 -7.020 -0.421 656 HG23 ILE 11 HG23 ILE 11 0.222 -6.402 0.667 657 HD11 ILE 11 HD11 ILE 11 2.246 -4.181 -2.503 658 HD12 ILE 11 HD12 ILE 11 1.942 -5.838 -1.977 659 HD13 ILE 11 HD13 ILE 11 3.486 -5.067 -1.614 660 H ARG 12 HN ARG 12 3.837 -4.720 3.449 661 HA ARG 12 HA ARG 12 3.561 -7.286 4.590 662 HB2 ARG 12 HB2 ARG 12 5.310 -4.938 5.308 663 HB3 ARG 12 HB1 ARG 12 5.373 -6.455 6.195 664 HG2 ARG 12 HG2 ARG 12 5.622 -6.562 3.241 665 HG3 ARG 12 HG1 ARG 12 6.990 -5.946 4.170 666 HD2 ARG 12 HD2 ARG 12 7.159 -7.980 5.406 667 HD3 ARG 12 HD1 ARG 12 5.634 -8.573 4.753 668 HE ARG 12 HE ARG 12 6.723 -9.251 2.848 669 HH11 ARG 12 HH11 ARG 12 8.889 -7.203 4.728 670 HH12 ARG 12 HH12 ARG 12 10.278 -7.535 3.732 671 HH21 ARG 12 HH21 ARG 12 8.559 -9.710 1.568 672 HH22 ARG 12 HH22 ARG 12 10.079 -8.949 1.939 673 H THR 13 HN THR 13 2.739 -4.068 5.809 674 HA THR 13 HA THR 13 1.929 -5.043 8.384 675 HB THR 13 HB THR 13 0.758 -2.653 8.340 676 HG1 THR 13 HG1 THR 13 1.156 -2.175 6.166 677 HG21 THR 13 HG21 THR 13 2.944 -1.677 9.063 678 HG22 THR 13 HG22 THR 13 3.725 -3.173 8.546 679 HG23 THR 13 HG23 THR 13 2.541 -3.200 9.853 680 H LEU 14 HN LEU 14 0.371 -4.300 5.337 681 HA LEU 14 HA LEU 14 -2.307 -4.413 6.260 682 HB2 LEU 14 HB2 LEU 14 -1.620 -3.290 4.188 683 HB3 LEU 14 HB1 LEU 14 -1.201 -4.840 3.486 684 HG LEU 14 HG LEU 14 -3.559 -5.527 3.575 685 HD11 LEU 14 HD11 LEU 14 -4.011 -2.752 4.666 686 HD12 LEU 14 HD12 LEU 14 -4.292 -4.273 5.511 687 HD13 LEU 14 HD13 LEU 14 -5.283 -3.841 4.117 688 HD21 LEU 14 HD21 LEU 14 -3.183 -2.844 2.257 689 HD22 LEU 14 HD22 LEU 14 -4.361 -4.077 1.818 690 HD23 LEU 14 HD23 LEU 14 -2.641 -4.383 1.597 691 H ARG 15 HN ARG 15 -0.157 -6.828 4.826 692 HA ARG 15 HA ARG 15 -2.001 -8.873 4.420 693 HB2 ARG 15 HB2 ARG 15 0.941 -8.741 4.823 694 HB3 ARG 15 HB1 ARG 15 0.182 -10.316 5.025 695 HG2 ARG 15 HG2 ARG 15 -0.754 -10.160 2.776 696 HG3 ARG 15 HG1 ARG 15 -0.007 -8.576 2.571 697 HD2 ARG 15 HD2 ARG 15 2.197 -9.547 2.757 698 HD3 ARG 15 HD1 ARG 15 1.506 -11.129 3.119 699 HE ARG 15 HE ARG 15 0.553 -11.061 0.822 700 HH11 ARG 15 HH11 ARG 15 3.403 -9.176 1.588 701 HH12 ARG 15 HH12 ARG 15 3.943 -9.099 -0.054 702 HH21 ARG 15 HH21 ARG 15 1.284 -10.982 -1.337 703 HH22 ARG 15 HH22 ARG 15 2.761 -10.124 -1.710 704 H ALA 16 HN ALA 16 -0.253 -7.962 7.345 705 HA ALA 16 HA ALA 16 -0.982 -10.192 8.910 706 HB1 ALA 16 HB1 ALA 16 0.857 -8.612 9.441 707 HB2 ALA 16 HB2 ALA 16 -0.233 -8.908 10.795 708 HB3 ALA 16 HB3 ALA 16 -0.355 -7.406 9.878 709 H GLN 17 HN GLN 17 -2.500 -7.029 8.436 710 HA GLN 17 HA GLN 17 -4.527 -7.405 10.399 711 HB2 GLN 17 HB2 GLN 17 -3.614 -5.261 9.037 712 HB3 GLN 17 HB1 GLN 17 -5.074 -5.608 8.120 713 HG2 GLN 17 HG2 GLN 17 -5.720 -4.059 9.743 714 HG3 GLN 17 HG1 GLN 17 -6.292 -5.616 10.341 715 HE21 GLN 17 HE21 GLN 17 -5.575 -6.348 12.274 716 HE22 GLN 17 HE22 GLN 17 -4.418 -5.513 13.257 717 H ALA 18 HN ALA 18 -4.264 -8.125 6.991 718 HA ALA 18 HA ALA 18 -7.014 -8.606 6.505 719 HB1 ALA 18 HB1 ALA 18 -4.679 -9.754 4.992 720 HB2 ALA 18 HB2 ALA 18 -5.315 -8.125 4.757 721 HB3 ALA 18 HB3 ALA 18 -6.328 -9.526 4.415 722 H ARG 19 HN ARG 19 -4.806 -10.354 8.321 723 HA ARG 19 HA ARG 19 -5.848 -12.971 7.699 724 HB2 ARG 19 HB2 ARG 19 -3.941 -12.022 9.832 725 HB3 ARG 19 HB1 ARG 19 -4.371 -13.707 9.562 726 HG2 ARG 19 HG2 ARG 19 -3.167 -11.981 7.417 727 HG3 ARG 19 HG1 ARG 19 -2.192 -12.911 8.557 728 HD2 ARG 19 HD2 ARG 19 -4.315 -14.099 6.781 729 HD3 ARG 19 HD1 ARG 19 -2.600 -14.048 6.369 730 HE ARG 19 HE ARG 19 -2.993 -15.221 8.919 731 HH11 ARG 19 HH11 ARG 19 -3.384 -15.915 5.512 732 HH12 ARG 19 HH12 ARG 19 -3.094 -17.613 5.697 733 HH21 ARG 19 HH21 ARG 19 -2.632 -17.458 9.163 734 HH22 ARG 19 HH22 ARG 19 -2.676 -18.493 7.765 735 H GLU 20 HN GLU 20 -6.941 -10.421 9.595 736 HA GLU 20 HA GLU 20 -8.254 -12.230 11.492 737 HB2 GLU 20 HB2 GLU 20 -8.680 -10.363 12.880 738 HB3 GLU 20 HB1 GLU 20 -7.029 -10.179 12.309 739 HG2 GLU 20 HG2 GLU 20 -7.851 -8.591 10.599 740 HG3 GLU 20 HG1 GLU 20 -9.462 -8.734 11.300 741 H CYS 21 H CYS 21 -8.869 -11.143 8.513 742 HA CYS 21 HA CYS 21 -11.801 -11.161 8.968 743 HB2 CYS 21 3HB CYS 21 -10.196 -9.273 7.109 744 HB3 CYS 21 2HB CYS 21 -11.958 -9.417 7.066 745 HG CYS 21 HG CYS 21 -12.475 -8.078 8.961 746 H THR 22 HN THR 22 -13.044 -12.008 7.289 747 HA THR 22 HA THR 22 -11.739 -14.133 5.857 748 HB THR 22 HB THR 22 -14.466 -13.834 5.062 749 HG1 THR 22 HG1 THR 22 -15.282 -12.906 6.782 750 HG21 THR 22 HG21 THR 22 -13.227 -15.944 5.300 751 HG22 THR 22 HG22 THR 22 -14.715 -15.960 6.241 752 HG23 THR 22 HG23 THR 22 -13.168 -15.710 7.048 753 H LEU 23 HN LEU 23 -12.256 -14.526 3.532 754 HA LEU 23 HA LEU 23 -11.286 -12.515 1.883 755 HB2 LEU 23 HB2 LEU 23 -11.258 -14.833 1.210 756 HB3 LEU 23 HB1 LEU 23 -13.007 -14.903 1.229 757 HG LEU 23 HG LEU 23 -13.011 -13.237 -0.659 758 HD11 LEU 23 HD11 LEU 23 -10.836 -12.268 -0.401 759 HD12 LEU 23 HD12 LEU 23 -10.906 -13.081 -1.963 760 HD13 LEU 23 HD13 LEU 23 -10.062 -13.838 -0.613 761 HD21 LEU 23 HD21 LEU 23 -13.402 -15.570 -1.095 762 HD22 LEU 23 HD22 LEU 23 -11.671 -15.910 -1.071 763 HD23 LEU 23 HD23 LEU 23 -12.359 -14.922 -2.359 764 H GLU 24 HN GLU 24 -14.648 -13.504 2.413 765 HA GLU 24 HA GLU 24 -15.866 -11.790 0.601 766 HB2 GLU 24 HB2 GLU 24 -16.880 -12.865 3.234 767 HB3 GLU 24 HB1 GLU 24 -17.894 -12.040 2.060 768 HG2 GLU 24 HG2 GLU 24 -17.520 -13.756 0.436 769 HG3 GLU 24 HG1 GLU 24 -16.320 -14.530 1.465 770 H THR 25 HN THR 25 -15.035 -11.231 4.007 771 HA THR 25 HA THR 25 -16.184 -8.677 4.234 772 HB THR 25 HB THR 25 -13.738 -9.260 5.812 773 HG1 THR 25 HG1 THR 25 -16.151 -10.749 6.175 774 HG21 THR 25 HG21 THR 25 -15.224 -7.351 6.302 775 HG22 THR 25 HG22 THR 25 -15.150 -8.491 7.645 776 HG23 THR 25 HG23 THR 25 -16.555 -8.470 6.578 777 H LEU 26 HN LEU 26 -12.921 -9.730 3.363 778 HA LEU 26 HA LEU 26 -11.816 -7.123 3.149 779 HB2 LEU 26 HB2 LEU 26 -10.930 -9.731 1.915 780 HB3 LEU 26 HB1 LEU 26 -9.986 -8.254 1.910 781 HG LEU 26 HG LEU 26 -10.855 -9.676 4.429 782 HD11 LEU 26 HD11 LEU 26 -8.140 -9.750 3.130 783 HD12 LEU 26 HD12 LEU 26 -9.337 -11.039 2.985 784 HD13 LEU 26 HD13 LEU 26 -8.671 -10.624 4.566 785 HD21 LEU 26 HD21 LEU 26 -9.074 -8.278 5.445 786 HD22 LEU 26 HD22 LEU 26 -10.408 -7.328 4.785 787 HD23 LEU 26 HD23 LEU 26 -8.886 -7.452 3.899 788 H GLU 27 HN GLU 27 -13.248 -9.364 0.818 789 HA GLU 27 HA GLU 27 -12.723 -7.844 -1.495 790 HB2 GLU 27 HB2 GLU 27 -13.342 -10.213 -1.562 791 HB3 GLU 27 HB1 GLU 27 -14.930 -9.828 -0.917 792 HG2 GLU 27 HG2 GLU 27 -15.644 -8.863 -2.888 793 HG3 GLU 27 HG1 GLU 27 -14.002 -8.590 -3.465 794 H GLU 28 HN GLU 28 -15.454 -7.905 0.749 795 HA GLU 28 HA GLU 28 -17.156 -6.172 -0.656 796 HB2 GLU 28 HB2 GLU 28 -17.590 -7.643 1.439 797 HB3 GLU 28 HB1 GLU 28 -17.030 -6.245 2.346 798 HG2 GLU 28 HG2 GLU 28 -18.790 -4.912 1.114 799 HG3 GLU 28 HG1 GLU 28 -19.431 -6.457 0.557 800 H MET 29 HN MET 29 -14.755 -5.470 1.893 801 HA MET 29 HA MET 29 -15.258 -2.665 1.824 802 HB2 MET 29 HB2 MET 29 -13.362 -2.425 3.291 803 HB3 MET 29 HB1 MET 29 -14.319 -3.803 3.806 804 HG2 MET 29 HG2 MET 29 -12.298 -4.764 3.965 805 HG3 MET 29 HG1 MET 29 -12.574 -5.079 2.255 806 HE1 MET 29 HE1 MET 29 -9.876 -1.713 3.896 807 HE2 MET 29 HE2 MET 29 -10.909 -2.754 4.878 808 HE3 MET 29 HE3 MET 29 -11.626 -1.516 3.843 809 H LEU 30 HN LEU 30 -13.201 -4.806 0.014 810 HA LEU 30 HA LEU 30 -11.372 -2.937 -1.012 811 HB2 LEU 30 HB2 LEU 30 -10.950 -5.276 -1.323 812 HB3 LEU 30 HB1 LEU 30 -12.472 -5.501 -2.165 813 HG LEU 30 HG LEU 30 -11.578 -4.038 -4.002 814 HD11 LEU 30 HD11 LEU 30 -9.867 -2.870 -2.747 815 HD12 LEU 30 HD12 LEU 30 -9.159 -3.718 -4.120 816 HD13 LEU 30 HD13 LEU 30 -8.994 -4.379 -2.494 817 HD21 LEU 30 HD21 LEU 30 -11.610 -6.440 -4.248 818 HD22 LEU 30 HD22 LEU 30 -10.093 -6.586 -3.363 819 HD23 LEU 30 HD23 LEU 30 -10.121 -5.797 -4.939 820 H GLU 31 HN GLU 31 -14.499 -4.059 -2.238 821 HA GLU 31 HA GLU 31 -14.519 -2.439 -4.547 822 HB2 GLU 31 HB2 GLU 31 -16.864 -3.556 -2.999 823 HB3 GLU 31 HB1 GLU 31 -16.926 -2.932 -4.644 824 HG2 GLU 31 HG2 GLU 31 -15.083 -4.739 -5.069 825 HG3 GLU 31 HG1 GLU 31 -15.767 -5.471 -3.618 826 H LYS 32 HN LYS 32 -15.467 -1.876 -1.224 827 HA LYS 32 HA LYS 32 -16.936 0.506 -1.642 828 HB2 LYS 32 HB2 LYS 32 -15.407 -0.468 0.780 829 HB3 LYS 32 HB1 LYS 32 -16.453 0.943 0.779 830 HG2 LYS 32 HG2 LYS 32 -18.353 -0.503 0.156 831 HG3 LYS 32 HG1 LYS 32 -17.289 -1.905 0.262 832 HD2 LYS 32 HD2 LYS 32 -16.854 -0.709 2.673 833 HD3 LYS 32 HD1 LYS 32 -18.552 -0.324 2.392 834 HE2 LYS 32 HE2 LYS 32 -18.209 -3.020 1.671 835 HE3 LYS 32 HE1 LYS 32 -17.364 -2.803 3.198 836 HZ1 LYS 32 HZ1 LYS 32 -19.356 -1.950 4.187 837 HZ2 LYS 32 HZ2 LYS 32 -19.711 -3.441 3.457 838 HZ3 LYS 32 HZ3 LYS 32 -20.178 -1.997 2.707 839 H LEU 33 HN LEU 33 -13.518 -0.090 -0.841 840 HA LEU 33 HA LEU 33 -12.832 2.668 -0.798 841 HB2 LEU 33 HB2 LEU 33 -11.522 0.923 0.355 842 HB3 LEU 33 HB1 LEU 33 -11.058 0.258 -1.198 843 HG LEU 33 HG LEU 33 -9.879 2.366 -1.730 844 HD11 LEU 33 HD11 LEU 33 -11.209 3.865 -0.312 845 HD12 LEU 33 HD12 LEU 33 -9.479 4.015 -0.007 846 HD13 LEU 33 HD13 LEU 33 -10.499 3.119 1.118 847 HD21 LEU 33 HD21 LEU 33 -7.989 1.991 -0.323 848 HD22 LEU 33 HD22 LEU 33 -8.738 0.432 -0.668 849 HD23 LEU 33 HD23 LEU 33 -8.989 1.204 0.898 850 H GLU 34 HN GLU 34 -12.708 0.141 -3.258 851 HA GLU 34 HA GLU 34 -11.276 1.469 -5.235 852 HB2 GLU 34 HB2 GLU 34 -11.765 -0.865 -5.463 853 HB3 GLU 34 HB1 GLU 34 -13.498 -0.562 -5.439 854 HG2 GLU 34 HG2 GLU 34 -12.854 -1.056 -7.677 855 HG3 GLU 34 HG1 GLU 34 -13.257 0.656 -7.585 856 H VAL 35 HN VAL 35 -14.827 1.492 -4.710 857 HA VAL 35 HA VAL 35 -15.341 3.187 -6.913 858 HB VAL 35 HB VAL 35 -17.553 3.635 -5.923 859 HG11 VAL 35 HG11 VAL 35 -16.712 0.747 -5.858 860 HG12 VAL 35 HG12 VAL 35 -17.220 1.658 -7.279 861 HG13 VAL 35 HG13 VAL 35 -18.369 1.335 -5.982 862 HG21 VAL 35 HG21 VAL 35 -16.567 1.971 -3.609 863 HG22 VAL 35 HG22 VAL 35 -18.227 2.517 -3.856 864 HG23 VAL 35 HG23 VAL 35 -16.943 3.693 -3.567 865 H VAL 36 HN VAL 36 -14.535 3.870 -3.556 866 HA VAL 36 HA VAL 36 -15.145 6.632 -3.609 867 HB VAL 36 HB VAL 36 -13.169 5.114 -1.887 868 HG11 VAL 36 HG11 VAL 36 -14.193 7.936 -1.567 869 HG12 VAL 36 HG12 VAL 36 -12.550 7.479 -2.023 870 HG13 VAL 36 HG13 VAL 36 -13.167 7.071 -0.420 871 HG21 VAL 36 HG21 VAL 36 -14.875 5.229 -0.184 872 HG22 VAL 36 HG22 VAL 36 -15.562 4.509 -1.643 873 HG23 VAL 36 HG23 VAL 36 -15.908 6.191 -1.240 874 H VAL 37 HN VAL 37 -12.173 4.806 -4.273 875 HA VAL 37 HA VAL 37 -10.581 7.090 -4.826 876 HB VAL 37 HB VAL 37 -10.176 4.272 -5.859 877 HG11 VAL 37 HG11 VAL 37 -8.230 6.553 -5.523 878 HG12 VAL 37 HG12 VAL 37 -8.860 5.949 -7.055 879 HG13 VAL 37 HG13 VAL 37 -7.827 4.925 -6.061 880 HG21 VAL 37 HG21 VAL 37 -8.435 4.382 -3.882 881 HG22 VAL 37 HG22 VAL 37 -10.110 3.917 -3.589 882 HG23 VAL 37 HG23 VAL 37 -9.576 5.562 -3.239 883 H ASN 38 HN ASN 38 -12.602 4.964 -6.784 884 HA ASN 38 HA ASN 38 -11.926 5.961 -9.310 885 HB2 ASN 38 HB2 ASN 38 -13.373 3.920 -8.773 886 HB3 ASN 38 HB1 ASN 38 -14.706 5.050 -8.558 887 HD21 ASN 38 HD21 ASN 38 -15.890 4.317 -10.273 888 HD22 ASN 38 HD22 ASN 38 -15.408 4.540 -11.920 889 H GLU 39 HN GLU 39 -14.299 7.060 -6.929 890 HA GLU 39 HA GLU 39 -15.508 9.076 -8.450 891 HB2 GLU 39 HB2 GLU 39 -15.017 8.855 -5.473 892 HB3 GLU 39 HB1 GLU 39 -15.947 10.160 -6.189 893 HG2 GLU 39 HG2 GLU 39 -17.515 8.481 -7.109 894 HG3 GLU 39 HG1 GLU 39 -16.604 7.224 -6.273 895 H ARG 40 HN ARG 40 -12.684 9.140 -6.315 896 HA ARG 40 HA ARG 40 -12.060 11.862 -6.589 897 HB2 ARG 40 HB2 ARG 40 -10.554 9.427 -5.755 898 HB3 ARG 40 HB1 ARG 40 -9.643 10.892 -6.097 899 HG2 ARG 40 HG2 ARG 40 -11.914 10.700 -4.133 900 HG3 ARG 40 HG1 ARG 40 -10.201 10.615 -3.712 901 HD2 ARG 40 HD2 ARG 40 -11.546 12.946 -5.081 902 HD3 ARG 40 HD1 ARG 40 -11.166 12.865 -3.364 903 HE ARG 40 HE ARG 40 -9.152 12.919 -5.526 904 HH11 ARG 40 HH11 ARG 40 -10.132 13.598 -2.245 905 HH12 ARG 40 HH12 ARG 40 -8.700 14.498 -1.864 906 HH21 ARG 40 HH21 ARG 40 -7.265 14.090 -5.048 907 HH22 ARG 40 HH22 ARG 40 -7.064 14.779 -3.458 908 H ARG 41 HN ARG 41 -11.064 9.022 -8.445 909 HA ARG 41 HA ARG 41 -9.179 10.220 -10.118 910 HB2 ARG 41 HB2 ARG 41 -11.115 7.964 -10.687 911 HB3 ARG 41 HB1 ARG 41 -9.822 8.434 -11.780 912 HG2 ARG 41 HG2 ARG 41 -8.174 7.900 -10.044 913 HG3 ARG 41 HG1 ARG 41 -9.486 7.393 -8.973 914 HD2 ARG 41 HD2 ARG 41 -10.160 5.757 -10.780 915 HD3 ARG 41 HD1 ARG 41 -8.643 6.152 -11.585 916 HE ARG 41 HE ARG 41 -7.498 5.318 -9.551 917 HH11 ARG 41 HH11 ARG 41 -10.793 4.252 -10.207 918 HH12 ARG 41 HH12 ARG 41 -10.623 2.781 -9.293 919 HH21 ARG 41 HH21 ARG 41 -7.297 3.395 -8.361 920 HH22 ARG 41 HH22 ARG 41 -8.651 2.299 -8.268 921 H GLU 42 HN GLU 42 -12.675 9.947 -10.417 922 HA GLU 42 HA GLU 42 -12.882 11.241 -12.937 923 HB2 GLU 42 HB2 GLU 42 -14.574 9.710 -11.751 924 HB3 GLU 42 HB1 GLU 42 -15.043 11.138 -10.844 925 HG2 GLU 42 HG2 GLU 42 -16.575 11.050 -12.585 926 HG3 GLU 42 HG1 GLU 42 -15.392 12.247 -13.123 927 H GLU 43 HN GLU 43 -13.352 12.349 -9.587 928 HA GLU 43 HA GLU 43 -14.188 14.946 -10.174 929 HB2 GLU 43 HB2 GLU 43 -12.704 13.870 -7.774 930 HB3 GLU 43 HB1 GLU 43 -13.356 15.498 -7.860 931 HG2 GLU 43 HG2 GLU 43 -15.597 14.653 -8.041 932 HG3 GLU 43 HG1 GLU 43 -15.008 12.996 -8.147 933 H GLU 44 HN GLU 44 -10.927 13.616 -9.942 934 HA GLU 44 HA GLU 44 -9.720 16.230 -10.154 935 HB2 GLU 44 HB2 GLU 44 -8.578 13.449 -10.089 936 HB3 GLU 44 HB1 GLU 44 -7.582 14.877 -10.348 937 HG2 GLU 44 HG2 GLU 44 -8.612 15.760 -8.182 938 HG3 GLU 44 HG1 GLU 44 -9.138 14.099 -7.908 939 H SER 45 HN SER 45 -10.441 13.561 -12.352 940 HA SER 45 HA SER 45 -8.836 14.671 -14.470 941 HB2 SER 45 HB2 SER 45 -9.991 12.907 -15.869 942 HB3 SER 45 HB1 SER 45 -9.088 12.297 -14.484 943 HG SER 45 HG SER 45 -10.907 11.768 -13.485 944 H ALA 46 HN ALA 46 -12.094 14.970 -13.358 945 HA ALA 46 HA ALA 46 -13.207 16.036 -15.755 946 HB1 ALA 46 HB1 ALA 46 -14.757 15.154 -14.244 947 HB2 ALA 46 HB2 ALA 46 -14.982 16.900 -14.132 948 HB3 ALA 46 HB3 ALA 46 -14.081 16.046 -12.884 949 H GLU 3 HN GLU 3 -10.252 -2.726 15.134 950 HA GLU 3 HA GLU 3 -12.675 -1.144 15.324 951 HB2 GLU 3 HB2 GLU 3 -10.405 0.473 15.854 952 HB3 GLU 3 HB1 GLU 3 -11.562 -0.179 17.002 953 HG2 GLU 3 HG2 GLU 3 -9.497 -0.875 17.806 954 HG3 GLU 3 HG1 GLU 3 -10.134 -2.294 16.977 955 H ALA 4 HN ALA 4 -9.486 -0.638 13.808 956 HA ALA 4 HA ALA 4 -10.240 1.594 12.278 957 HB1 ALA 4 HB1 ALA 4 -8.044 -0.419 11.806 958 HB2 ALA 4 HB2 ALA 4 -7.920 1.097 12.703 959 HB3 ALA 4 HB3 ALA 4 -8.200 1.123 10.964 960 H LEU 5 HN LEU 5 -10.325 -1.843 11.553 961 HA LEU 5 HA LEU 5 -10.925 -1.608 8.798 962 HB2 LEU 5 HB2 LEU 5 -10.930 -3.745 10.832 963 HB3 LEU 5 HB1 LEU 5 -11.984 -4.015 9.459 964 HG LEU 5 HG LEU 5 -9.725 -5.052 9.246 965 HD11 LEU 5 HD11 LEU 5 -10.359 -2.923 7.210 966 HD12 LEU 5 HD12 LEU 5 -11.066 -4.541 7.273 967 HD13 LEU 5 HD13 LEU 5 -9.345 -4.342 6.952 968 HD21 LEU 5 HD21 LEU 5 -7.812 -3.601 8.736 969 HD22 LEU 5 HD22 LEU 5 -8.415 -3.328 10.373 970 HD23 LEU 5 HD23 LEU 5 -8.798 -2.183 9.088 971 H LYS 6 HN LYS 6 -12.870 -1.349 11.653 972 HA LYS 6 HA LYS 6 -15.372 -1.932 10.412 973 HB2 LYS 6 HB2 LYS 6 -14.947 -2.098 12.861 974 HB3 LYS 6 HB1 LYS 6 -14.855 -0.344 12.927 975 HG2 LYS 6 HG2 LYS 6 -17.040 -1.180 13.643 976 HG3 LYS 6 HG1 LYS 6 -17.165 -0.161 12.205 977 HD2 LYS 6 HD2 LYS 6 -17.535 -2.006 10.799 978 HD3 LYS 6 HD1 LYS 6 -16.960 -3.155 12.008 979 HE2 LYS 6 HE2 LYS 6 -19.491 -1.521 12.159 980 HE3 LYS 6 HE1 LYS 6 -19.387 -3.241 11.787 981 HZ1 LYS 6 HZ1 LYS 6 -18.639 -1.941 14.350 982 HZ2 LYS 6 HZ2 LYS 6 -18.403 -3.577 14.004 983 HZ3 LYS 6 HZ3 LYS 6 -19.967 -2.948 14.082 984 H ILE 7 HN ILE 7 -13.545 1.015 11.047 985 HA ILE 7 HA ILE 7 -15.575 2.838 10.276 986 HB ILE 7 HB ILE 7 -12.642 3.411 9.953 987 HG12 ILE 7 HG12 ILE 7 -14.138 3.611 12.572 988 HG13 ILE 7 HG11 ILE 7 -13.099 2.246 12.165 989 HG21 ILE 7 HG21 ILE 7 -14.001 5.199 9.243 990 HG22 ILE 7 HG22 ILE 7 -13.449 5.641 10.861 991 HG23 ILE 7 HG23 ILE 7 -15.083 5.029 10.627 992 HD11 ILE 7 HD11 ILE 7 -12.002 3.939 13.585 993 HD12 ILE 7 HD12 ILE 7 -12.192 5.112 12.282 994 HD13 ILE 7 HD13 ILE 7 -11.179 3.688 12.048 995 H LEU 8 HN LEU 8 -13.128 1.064 8.555 996 HA LEU 8 HA LEU 8 -13.465 2.463 6.065 997 HB2 LEU 8 HB2 LEU 8 -11.833 0.198 7.064 998 HB3 LEU 8 HB1 LEU 8 -12.167 0.227 5.344 999 HG LEU 8 HG LEU 8 -11.129 2.427 5.149 1000 HD11 LEU 8 HD11 LEU 8 -10.179 3.608 6.930 1001 HD12 LEU 8 HD12 LEU 8 -10.268 2.221 8.014 1002 HD13 LEU 8 HD13 LEU 8 -11.740 3.072 7.549 1003 HD21 LEU 8 HD21 LEU 8 -8.797 1.733 5.873 1004 HD22 LEU 8 HD22 LEU 8 -9.647 0.654 4.768 1005 HD23 LEU 8 HD23 LEU 8 -9.547 0.260 6.485 1006 H ASN 9 HN ASN 9 -15.336 0.243 7.668 1007 HA ASN 9 HA ASN 9 -16.202 -1.252 5.330 1008 HB2 ASN 9 HB2 ASN 9 -16.092 -1.996 7.891 1009 HB3 ASN 9 HB1 ASN 9 -17.731 -1.350 7.884 1010 HD21 ASN 9 HD21 ASN 9 -15.833 -4.025 7.263 1011 HD22 ASN 9 HD22 ASN 9 -16.993 -4.965 6.396 1012 H ASN 10 HN ASN 10 -16.898 1.687 6.810 1013 HA ASN 10 HA ASN 10 -19.622 1.778 5.713 1014 HB2 ASN 10 HB2 ASN 10 -19.072 2.426 8.162 1015 HB3 ASN 10 HB1 ASN 10 -18.396 3.890 7.464 1016 HD21 ASN 10 HD21 ASN 10 -20.910 3.000 9.070 1017 HD22 ASN 10 HD22 ASN 10 -22.173 3.907 8.316 1018 H ILE 11 HN ILE 11 -19.797 2.605 3.768 1019 HA ILE 11 HA ILE 11 -17.753 3.857 2.347 1020 HB ILE 11 HB ILE 11 -19.788 2.698 1.399 1021 HG12 ILE 11 HG12 ILE 11 -19.961 4.458 -0.531 1022 HG13 ILE 11 HG11 ILE 11 -18.698 5.291 0.366 1023 HG21 ILE 11 HG21 ILE 11 -21.561 3.792 2.577 1024 HG22 ILE 11 HG22 ILE 11 -21.727 4.164 0.862 1025 HG23 ILE 11 HG23 ILE 11 -21.060 5.367 1.965 1026 HD11 ILE 11 HD11 ILE 11 -18.499 2.431 -0.524 1027 HD12 ILE 11 HD12 ILE 11 -17.218 3.447 0.135 1028 HD13 ILE 11 HD13 ILE 11 -17.892 3.798 -1.457 1029 H ARG 12 HN ARG 12 -20.137 5.253 4.478 1030 HA ARG 12 HA ARG 12 -19.967 7.912 3.488 1031 HB2 ARG 12 HB2 ARG 12 -20.887 6.779 6.123 1032 HB3 ARG 12 HB1 ARG 12 -20.911 8.500 5.774 1033 HG2 ARG 12 HG2 ARG 12 -22.342 6.409 4.149 1034 HG3 ARG 12 HG1 ARG 12 -23.086 7.391 5.415 1035 HD2 ARG 12 HD2 ARG 12 -22.450 9.424 4.138 1036 HD3 ARG 12 HD1 ARG 12 -21.842 8.387 2.849 1037 HE ARG 12 HE ARG 12 -24.224 7.510 2.780 1038 HH11 ARG 12 HH11 ARG 12 -23.420 10.793 3.716 1039 HH12 ARG 12 HH12 ARG 12 -24.917 11.456 3.149 1040 HH21 ARG 12 HH21 ARG 12 -26.206 8.371 2.057 1041 HH22 ARG 12 HH22 ARG 12 -26.514 10.073 2.210 1042 H THR 13 HN THR 13 -18.560 6.402 6.396 1043 HA THR 13 HA THR 13 -16.956 8.648 7.035 1044 HB THR 13 HB THR 13 -15.661 6.796 8.385 1045 HG1 THR 13 HG1 THR 13 -16.431 4.885 7.829 1046 HG21 THR 13 HG21 THR 13 -18.540 7.427 9.046 1047 HG22 THR 13 HG22 THR 13 -17.200 8.551 9.276 1048 HG23 THR 13 HG23 THR 13 -17.243 7.038 10.179 1049 H LEU 14 HN LEU 14 -16.433 5.756 5.111 1050 HA LEU 14 HA LEU 14 -13.655 5.887 4.848 1051 HB2 LEU 14 HB2 LEU 14 -15.095 3.984 4.131 1052 HB3 LEU 14 HB1 LEU 14 -15.650 4.954 2.782 1053 HG LEU 14 HG LEU 14 -13.429 4.963 1.815 1054 HD11 LEU 14 HD11 LEU 14 -11.678 3.494 2.876 1055 HD12 LEU 14 HD12 LEU 14 -12.666 3.526 4.338 1056 HD13 LEU 14 HD13 LEU 14 -12.002 5.025 3.687 1057 HD21 LEU 14 HD21 LEU 14 -14.761 3.121 1.145 1058 HD22 LEU 14 HD22 LEU 14 -14.452 2.258 2.649 1059 HD23 LEU 14 HD23 LEU 14 -13.155 2.483 1.480 1060 H ARG 15 HN ARG 15 -16.206 7.248 2.750 1061 HA ARG 15 HA ARG 15 -14.432 8.534 0.965 1062 HB2 ARG 15 HB2 ARG 15 -16.799 8.079 0.429 1063 HB3 ARG 15 HB1 ARG 15 -17.292 9.249 1.647 1064 HG2 ARG 15 HG2 ARG 15 -16.050 10.994 0.347 1065 HG3 ARG 15 HG1 ARG 15 -15.824 9.791 -0.926 1066 HD2 ARG 15 HD2 ARG 15 -18.539 10.493 0.153 1067 HD3 ARG 15 HD1 ARG 15 -17.793 11.399 -1.159 1068 HE ARG 15 HE ARG 15 -17.834 9.386 -2.500 1069 HH11 ARG 15 HH11 ARG 15 -19.722 9.286 0.464 1070 HH12 ARG 15 HH12 ARG 15 -20.770 8.026 -0.101 1071 HH21 ARG 15 HH21 ARG 15 -19.209 7.739 -3.247 1072 HH22 ARG 15 HH22 ARG 15 -20.476 7.140 -2.214 1073 H ALA 16 HN ALA 16 -15.922 9.517 3.997 1074 HA ALA 16 HA ALA 16 -15.270 12.266 3.884 1075 HB1 ALA 16 HB1 ALA 16 -15.686 12.269 6.294 1076 HB2 ALA 16 HB2 ALA 16 -15.693 10.509 6.296 1077 HB3 ALA 16 HB3 ALA 16 -16.940 11.392 5.422 1078 H GLN 17 HN GLN 17 -13.583 9.505 5.371 1079 HA GLN 17 HA GLN 17 -11.420 11.107 6.343 1080 HB2 GLN 17 HB2 GLN 17 -11.697 8.120 5.999 1081 HB3 GLN 17 HB1 GLN 17 -10.331 8.899 6.784 1082 HG2 GLN 17 HG2 GLN 17 -11.779 9.784 8.508 1083 HG3 GLN 17 HG1 GLN 17 -13.193 9.121 7.691 1084 HE21 GLN 17 HE21 GLN 17 -12.198 8.628 10.383 1085 HE22 GLN 17 HE22 GLN 17 -11.931 6.926 10.496 1086 H ALA 18 HN ALA 18 -11.914 9.067 3.501 1087 HA ALA 18 HA ALA 18 -9.244 9.165 2.560 1088 HB1 ALA 18 HB1 ALA 18 -10.901 7.487 1.834 1089 HB2 ALA 18 HB2 ALA 18 -10.102 8.295 0.488 1090 HB3 ALA 18 HB3 ALA 18 -11.746 8.748 0.937 1091 H ARG 19 HN ARG 19 -11.916 11.379 2.271 1092 HA ARG 19 HA ARG 19 -10.928 12.800 0.022 1093 HB2 ARG 19 HB2 ARG 19 -13.163 13.033 1.841 1094 HB3 ARG 19 HB1 ARG 19 -12.453 14.610 1.504 1095 HG2 ARG 19 HG2 ARG 19 -12.604 14.066 -0.928 1096 HG3 ARG 19 HG1 ARG 19 -13.495 12.611 -0.483 1097 HD2 ARG 19 HD2 ARG 19 -15.267 13.901 0.465 1098 HD3 ARG 19 HD1 ARG 19 -14.352 15.398 0.282 1099 HE ARG 19 HE ARG 19 -14.926 13.910 -2.154 1100 HH11 ARG 19 HH11 ARG 19 -15.806 16.563 -0.054 1101 HH12 ARG 19 HH12 ARG 19 -16.717 17.395 -1.264 1102 HH21 ARG 19 HH21 ARG 19 -16.091 15.019 -3.780 1103 HH22 ARG 19 HH22 ARG 19 -16.885 16.511 -3.384 1104 H GLU 20 HN GLU 20 -9.836 12.678 3.216 1105 HA GLU 20 HA GLU 20 -8.699 15.360 3.121 1106 HB2 GLU 20 HB2 GLU 20 -8.559 13.216 5.248 1107 HB3 GLU 20 HB1 GLU 20 -7.840 14.817 5.393 1108 HG2 GLU 20 HG2 GLU 20 -10.244 15.654 4.896 1109 HG3 GLU 20 HG1 GLU 20 -10.719 14.026 5.386 1110 H CYS 21 H CYS 21 -7.958 12.448 1.857 1111 HA CYS 21 HA CYS 21 -5.026 12.874 2.096 1112 HB2 CYS 21 3HB CYS 21 -6.638 10.292 1.514 1113 HB3 CYS 21 2HB CYS 21 -4.872 10.378 1.487 1114 HG CYS 21 HG CYS 21 -4.473 10.286 3.830 1115 H THR 22 HN THR 22 -3.752 12.592 0.257 1116 HA THR 22 HA THR 22 -4.901 13.736 -2.104 1117 HB THR 22 HB THR 22 -2.298 12.847 -2.680 1118 HG1 THR 22 HG1 THR 22 -1.132 13.235 -0.844 1119 HG21 THR 22 HG21 THR 22 -3.042 14.988 -3.378 1120 HG22 THR 22 HG22 THR 22 -1.738 15.285 -2.230 1121 HG23 THR 22 HG23 THR 22 -3.416 15.477 -1.728 1122 H LEU 23 HN LEU 23 -4.899 12.792 -4.212 1123 HA LEU 23 HA LEU 23 -5.765 10.112 -4.298 1124 HB2 LEU 23 HB2 LEU 23 -6.314 11.942 -5.958 1125 HB3 LEU 23 HB1 LEU 23 -4.719 11.704 -6.639 1126 HG LEU 23 HG LEU 23 -5.277 9.464 -7.340 1127 HD11 LEU 23 HD11 LEU 23 -7.736 9.918 -5.694 1128 HD12 LEU 23 HD12 LEU 23 -6.617 8.555 -5.675 1129 HD13 LEU 23 HD13 LEU 23 -7.738 8.757 -7.020 1130 HD21 LEU 23 HD21 LEU 23 -6.817 9.948 -9.041 1131 HD22 LEU 23 HD22 LEU 23 -6.070 11.501 -8.671 1132 HD23 LEU 23 HD23 LEU 23 -7.676 11.124 -8.051 1133 H GLU 24 HN GLU 24 -2.649 11.615 -4.793 1134 HA GLU 24 HA GLU 24 -1.202 9.586 -5.991 1135 HB2 GLU 24 HB2 GLU 24 -0.018 11.570 -5.750 1136 HB3 GLU 24 HB1 GLU 24 -0.551 11.805 -4.095 1137 HG2 GLU 24 HG2 GLU 24 1.588 11.265 -3.652 1138 HG3 GLU 24 HG1 GLU 24 0.947 9.624 -3.743 1139 H THR 25 HN THR 25 -1.952 10.101 -2.575 1140 HA THR 25 HA THR 25 -0.536 7.764 -1.708 1141 HB THR 25 HB THR 25 -2.584 8.930 0.068 1142 HG1 THR 25 HG1 THR 25 -0.277 10.441 -0.654 1143 HG21 THR 25 HG21 THR 25 -0.933 7.319 0.873 1144 HG22 THR 25 HG22 THR 25 -0.728 8.883 1.666 1145 HG23 THR 25 HG23 THR 25 0.372 8.395 0.376 1146 H LEU 26 HN LEU 26 -3.900 8.621 -2.336 1147 HA LEU 26 HA LEU 26 -5.080 6.288 -1.280 1148 HB2 LEU 26 HB2 LEU 26 -6.032 8.169 -3.434 1149 HB3 LEU 26 HB1 LEU 26 -7.019 6.898 -2.738 1150 HG LEU 26 HG LEU 26 -5.857 9.228 -1.207 1151 HD11 LEU 26 HD11 LEU 26 -8.713 8.698 -2.004 1152 HD12 LEU 26 HD12 LEU 26 -7.647 9.848 -2.805 1153 HD13 LEU 26 HD13 LEU 26 -8.101 10.094 -1.118 1154 HD21 LEU 26 HD21 LEU 26 -6.091 7.256 0.188 1155 HD22 LEU 26 HD22 LEU 26 -7.751 7.034 -0.364 1156 HD23 LEU 26 HD23 LEU 26 -7.326 8.442 0.606 1157 H GLU 27 HN GLU 27 -4.038 7.059 -4.598 1158 HA GLU 27 HA GLU 27 -4.964 4.636 -5.723 1159 HB2 GLU 27 HB2 GLU 27 -4.331 6.763 -6.962 1160 HB3 GLU 27 HB1 GLU 27 -2.656 6.264 -6.773 1161 HG2 GLU 27 HG2 GLU 27 -3.343 5.590 -8.930 1162 HG3 GLU 27 HG1 GLU 27 -3.260 4.132 -7.941 1163 H GLU 28 HN GLU 28 -1.684 5.611 -4.652 1164 HA GLU 28 HA GLU 28 -0.540 3.070 -5.220 1165 HB2 GLU 28 HB2 GLU 28 0.525 5.527 -4.684 1166 HB3 GLU 28 HB1 GLU 28 0.841 4.679 -3.176 1167 HG2 GLU 28 HG2 GLU 28 1.850 2.824 -4.573 1168 HG3 GLU 28 HG1 GLU 28 1.755 3.928 -5.942 1169 H MET 29 HN MET 29 -2.693 3.900 -2.828 1170 HA MET 29 HA MET 29 -1.614 1.860 -1.010 1171 HB2 MET 29 HB2 MET 29 -2.594 2.894 0.768 1172 HB3 MET 29 HB1 MET 29 -2.437 4.292 -0.282 1173 HG2 MET 29 HG2 MET 29 -4.722 4.228 -0.868 1174 HG3 MET 29 HG1 MET 29 -4.931 2.625 -0.167 1175 HE1 MET 29 HE1 MET 29 -3.829 6.240 0.604 1176 HE2 MET 29 HE2 MET 29 -2.827 5.424 1.805 1177 HE3 MET 29 HE3 MET 29 -4.180 6.431 2.322 1178 H LEU 30 HN LEU 30 -4.323 2.685 -3.057 1179 HA LEU 30 HA LEU 30 -6.021 0.563 -2.204 1180 HB2 LEU 30 HB2 LEU 30 -7.027 2.415 -3.336 1181 HB3 LEU 30 HB1 LEU 30 -5.957 2.232 -4.713 1182 HG LEU 30 HG LEU 30 -7.067 0.009 -5.158 1183 HD11 LEU 30 HD11 LEU 30 -9.431 -0.097 -4.177 1184 HD12 LEU 30 HD12 LEU 30 -8.821 0.995 -2.934 1185 HD13 LEU 30 HD13 LEU 30 -8.086 -0.594 -3.151 1186 HD21 LEU 30 HD21 LEU 30 -8.773 2.495 -5.245 1187 HD22 LEU 30 HD22 LEU 30 -9.056 1.023 -6.178 1188 HD23 LEU 30 HD23 LEU 30 -7.601 1.981 -6.458 1189 H GLU 31 HN GLU 31 -3.571 0.947 -4.698 1190 HA GLU 31 HA GLU 31 -3.996 -1.446 -6.074 1191 HB2 GLU 31 HB2 GLU 31 -1.675 -1.208 -6.867 1192 HB3 GLU 31 HB1 GLU 31 -2.568 0.303 -6.971 1193 HG2 GLU 31 HG2 GLU 31 -1.471 1.148 -5.011 1194 HG3 GLU 31 HG1 GLU 31 -0.664 -0.398 -4.750 1195 H LYS 32 HN LYS 32 -2.467 -0.787 -3.030 1196 HA LYS 32 HA LYS 32 -1.110 -3.306 -2.829 1197 HB2 LYS 32 HB2 LYS 32 -1.860 -1.522 -0.519 1198 HB3 LYS 32 HB1 LYS 32 -0.522 -2.653 -0.622 1199 HG2 LYS 32 HG2 LYS 32 -0.781 -0.080 -2.163 1200 HG3 LYS 32 HG1 LYS 32 0.243 -0.353 -0.748 1201 HD2 LYS 32 HD2 LYS 32 1.488 -2.064 -2.002 1202 HD3 LYS 32 HD1 LYS 32 0.478 -1.746 -3.418 1203 HE2 LYS 32 HE2 LYS 32 2.567 -0.559 -3.630 1204 HE3 LYS 32 HE1 LYS 32 1.255 0.595 -3.408 1205 HZ1 LYS 32 HZ1 LYS 32 3.036 1.273 -2.038 1206 HZ2 LYS 32 HZ2 LYS 32 3.255 -0.282 -1.399 1207 HZ3 LYS 32 HZ3 LYS 32 1.870 0.616 -1.004 1208 H LEU 33 HN LEU 33 -4.197 -2.001 -1.851 1209 HA LEU 33 HA LEU 33 -4.905 -4.207 -0.184 1210 HB2 LEU 33 HB2 LEU 33 -5.854 -1.985 0.150 1211 HB3 LEU 33 HB1 LEU 33 -6.611 -2.056 -1.429 1212 HG LEU 33 HG LEU 33 -7.970 -3.997 -0.627 1213 HD11 LEU 33 HD11 LEU 33 -8.106 -4.438 1.752 1214 HD12 LEU 33 HD12 LEU 33 -6.851 -3.243 2.071 1215 HD13 LEU 33 HD13 LEU 33 -6.463 -4.712 1.177 1216 HD21 LEU 33 HD21 LEU 33 -8.238 -1.469 0.985 1217 HD22 LEU 33 HD22 LEU 33 -9.507 -2.652 0.683 1218 HD23 LEU 33 HD23 LEU 33 -8.849 -1.704 -0.652 1219 H GLU 34 HN GLU 34 -5.754 -3.251 -3.515 1220 HA GLU 34 HA GLU 34 -7.569 -5.357 -3.949 1221 HB2 GLU 34 HB2 GLU 34 -7.225 -4.925 -6.373 1222 HB3 GLU 34 HB1 GLU 34 -7.584 -3.481 -5.440 1223 HG2 GLU 34 HG2 GLU 34 -5.264 -2.833 -5.480 1224 HG3 GLU 34 HG1 GLU 34 -4.837 -4.322 -6.322 1225 H VAL 35 HN VAL 35 -4.059 -5.238 -4.341 1226 HA VAL 35 HA VAL 35 -3.948 -7.808 -5.600 1227 HB VAL 35 HB VAL 35 -1.532 -7.719 -5.296 1228 HG11 VAL 35 HG11 VAL 35 -2.515 -6.530 -7.169 1229 HG12 VAL 35 HG12 VAL 35 -1.091 -5.676 -6.570 1230 HG13 VAL 35 HG13 VAL 35 -2.702 -5.086 -6.171 1231 HG21 VAL 35 HG21 VAL 35 -0.455 -5.818 -4.192 1232 HG22 VAL 35 HG22 VAL 35 -1.440 -6.744 -3.061 1233 HG23 VAL 35 HG23 VAL 35 -2.034 -5.211 -3.696 1234 H VAL 36 HN VAL 36 -3.860 -6.627 -2.313 1235 HA VAL 36 HA VAL 36 -2.901 -9.006 -1.113 1236 HB VAL 36 HB VAL 36 -3.569 -6.435 -0.218 1237 HG11 VAL 36 HG11 VAL 36 -5.821 -7.110 0.331 1238 HG12 VAL 36 HG12 VAL 36 -4.896 -6.855 1.814 1239 HG13 VAL 36 HG13 VAL 36 -5.215 -8.494 1.239 1240 HG21 VAL 36 HG21 VAL 36 -2.487 -7.138 1.847 1241 HG22 VAL 36 HG22 VAL 36 -1.622 -7.741 0.436 1242 HG23 VAL 36 HG23 VAL 36 -2.657 -8.828 1.365 1243 H VAL 37 HN VAL 37 -6.064 -7.857 -2.073 1244 HA VAL 37 HA VAL 37 -7.494 -10.013 -0.820 1245 HB VAL 37 HB VAL 37 -8.419 -8.109 -2.985 1246 HG11 VAL 37 HG11 VAL 37 -9.952 -9.996 -1.197 1247 HG12 VAL 37 HG12 VAL 37 -9.842 -10.047 -2.959 1248 HG13 VAL 37 HG13 VAL 37 -10.697 -8.722 -2.162 1249 HG21 VAL 37 HG21 VAL 37 -9.638 -7.074 -0.987 1250 HG22 VAL 37 HG22 VAL 37 -7.909 -6.765 -1.138 1251 HG23 VAL 37 HG23 VAL 37 -8.493 -7.970 0.013 1252 H ASN 38 HN ASN 38 -6.190 -9.313 -4.003 1253 HA ASN 38 HA ASN 38 -7.390 -11.406 -5.433 1254 HB2 ASN 38 HB2 ASN 38 -5.936 -9.405 -6.264 1255 HB3 ASN 38 HB1 ASN 38 -4.589 -10.513 -6.035 1256 HD21 ASN 38 HD21 ASN 38 -4.457 -12.384 -7.340 1257 HD22 ASN 38 HD22 ASN 38 -5.354 -12.512 -8.815 1258 H GLU 39 HN GLU 39 -4.423 -11.281 -3.517 1259 HA GLU 39 HA GLU 39 -3.462 -13.842 -4.132 1260 HB2 GLU 39 HB2 GLU 39 -3.145 -12.190 -1.628 1261 HB3 GLU 39 HB1 GLU 39 -2.251 -13.668 -1.951 1262 HG2 GLU 39 HG2 GLU 39 -1.693 -12.343 -4.195 1263 HG3 GLU 39 HG1 GLU 39 -1.934 -10.974 -3.107 1264 H ARG 40 HN ARG 40 -5.747 -12.723 -1.699 1265 HA ARG 40 HA ARG 40 -6.065 -15.220 -0.392 1266 HB2 ARG 40 HB2 ARG 40 -8.019 -12.914 -0.583 1267 HB3 ARG 40 HB1 ARG 40 -8.084 -14.226 0.585 1268 HG2 ARG 40 HG2 ARG 40 -5.721 -12.389 0.394 1269 HG3 ARG 40 HG1 ARG 40 -7.144 -11.990 1.360 1270 HD2 ARG 40 HD2 ARG 40 -5.689 -14.597 1.687 1271 HD3 ARG 40 HD1 ARG 40 -5.172 -13.139 2.528 1272 HE ARG 40 HE ARG 40 -7.414 -13.097 3.545 1273 HH11 ARG 40 HH11 ARG 40 -6.171 -16.117 2.265 1274 HH12 ARG 40 HH12 ARG 40 -7.207 -17.096 3.259 1275 HH21 ARG 40 HH21 ARG 40 -8.741 -14.405 4.888 1276 HH22 ARG 40 HH22 ARG 40 -8.649 -16.132 4.751 1277 H ARG 41 HN ARG 41 -7.528 -13.697 -3.184 1278 HA ARG 41 HA ARG 41 -9.679 -15.483 -3.572 1279 HB2 ARG 41 HB2 ARG 41 -8.101 -13.791 -5.528 1280 HB3 ARG 41 HB1 ARG 41 -9.524 -14.716 -5.985 1281 HG2 ARG 41 HG2 ARG 41 -9.707 -12.760 -3.739 1282 HG3 ARG 41 HG1 ARG 41 -9.717 -12.180 -5.405 1283 HD2 ARG 41 HD2 ARG 41 -11.651 -14.099 -4.111 1284 HD3 ARG 41 HD1 ARG 41 -11.988 -12.472 -4.701 1285 HE ARG 41 HE ARG 41 -11.222 -14.677 -6.498 1286 HH11 ARG 41 HH11 ARG 41 -13.336 -11.981 -5.678 1287 HH12 ARG 41 HH12 ARG 41 -14.226 -12.106 -7.165 1288 HH21 ARG 41 HH21 ARG 41 -12.411 -14.801 -8.433 1289 HH22 ARG 41 HH22 ARG 41 -13.701 -13.677 -8.721 1290 H GLU 42 HN GLU 42 -6.345 -15.424 -4.728 1291 HA GLU 42 HA GLU 42 -6.431 -17.695 -6.360 1292 HB2 GLU 42 HB2 GLU 42 -4.103 -16.602 -4.763 1293 HB3 GLU 42 HB1 GLU 42 -3.980 -17.751 -6.086 1294 HG2 GLU 42 HG2 GLU 42 -4.407 -16.174 -7.684 1295 HG3 GLU 42 HG1 GLU 42 -5.321 -15.142 -6.581 1296 H GLU 43 HN GLU 43 -5.694 -17.325 -2.906 1297 HA GLU 43 HA GLU 43 -4.953 -19.948 -2.318 1298 HB2 GLU 43 HB2 GLU 43 -6.451 -17.963 -0.595 1299 HB3 GLU 43 HB1 GLU 43 -5.737 -19.453 -0.000 1300 HG2 GLU 43 HG2 GLU 43 -3.526 -18.636 -0.716 1301 HG3 GLU 43 HG1 GLU 43 -4.273 -17.109 -1.190 1302 H GLU 44 HN GLU 44 -8.152 -18.441 -2.304 1303 HA GLU 44 HA GLU 44 -9.584 -20.713 -1.450 1304 HB2 GLU 44 HB2 GLU 44 -10.138 -18.044 -1.929 1305 HB3 GLU 44 HB1 GLU 44 -11.093 -18.882 -3.141 1306 HG2 GLU 44 HG2 GLU 44 -12.401 -18.497 -1.148 1307 HG3 GLU 44 HG1 GLU 44 -12.141 -20.225 -1.393 1308 H SER 45 HN SER 45 -9.014 -19.381 -4.708 1309 HA SER 45 HA SER 45 -10.530 -21.392 -6.024 1310 HB2 SER 45 HB2 SER 45 -8.433 -19.498 -7.097 1311 HB3 SER 45 HB1 SER 45 -9.470 -20.518 -8.093 1312 HG SER 45 HG SER 45 -10.967 -19.092 -7.892 1313 H ALA 46 HN ALA 46 -7.352 -21.371 -4.746 1314 HA ALA 46 HA ALA 46 -6.245 -23.334 -6.522 1315 HB1 ALA 46 HB1 ALA 46 -4.821 -21.755 -5.306 1316 HB2 ALA 46 HB2 ALA 46 -4.383 -23.428 -4.965 1317 HB3 ALA 46 HB3 ALA 46 -5.301 -22.498 -3.780
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