NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
645117 | 6sai | 34419 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H2 PRO 1 HT1 PRO 1 -5.244 -4.107 13.231 2 H3 PRO 1 HT2 PRO 1 -5.598 -2.619 13.811 3 HA PRO 1 HA PRO 1 -6.278 -2.404 11.762 4 HB2 PRO 1 HB2 PRO 1 -4.129 -1.373 10.534 5 HB3 PRO 1 HB1 PRO 1 -4.877 -0.562 11.911 6 HG2 PRO 1 HG2 PRO 1 -2.324 -1.984 11.763 7 HG3 PRO 1 HG1 PRO 1 -2.902 -0.840 12.986 8 HD2 PRO 1 HD2 PRO 1 -2.902 -3.759 13.035 9 HD3 PRO 1 HD1 PRO 1 -3.229 -2.621 14.358 10 H SER 2 HN SER 2 -4.380 -2.458 9.422 11 HA SER 2 HA SER 2 -4.278 -5.194 8.696 12 HB2 SER 2 HB2 SER 2 -2.449 -2.977 7.746 13 HB3 SER 2 HB1 SER 2 -2.822 -4.473 6.905 14 HG SER 2 HG SER 2 -3.953 -2.320 6.419 15 H PHE 3 HN PHE 3 -1.953 -6.167 8.237 16 HA PHE 3 HA PHE 3 -0.325 -5.926 10.583 17 HB2 PHE 3 HB2 PHE 3 1.291 -7.002 8.593 18 HB3 PHE 3 HB1 PHE 3 0.345 -7.923 9.764 19 HD1 PHE 3 HD1 PHE 3 0.799 -6.949 6.333 20 HD2 PHE 3 HD2 PHE 3 -1.891 -8.799 9.074 21 HE1 PHE 3 HE1 PHE 3 -0.411 -7.989 4.474 22 HE2 PHE 3 HE2 PHE 3 -3.119 -9.815 7.202 23 HZ PHE 3 HZ PHE 3 -2.377 -9.409 4.890 24 H ASN 4 HN ASN 4 -0.168 -4.883 7.247 25 HA ASN 4 HA ASN 4 2.494 -3.849 7.597 26 HB2 ASN 4 HB2 ASN 4 2.373 -3.491 5.180 27 HB3 ASN 4 HB1 ASN 4 1.905 -5.132 5.616 28 HD21 ASN 4 HD21 ASN 4 0.659 -1.952 4.763 29 HD22 ASN 4 HD22 ASN 4 -0.848 -2.523 4.122 30 H THR 5 HN THR 5 -0.342 -2.432 8.369 31 HA THR 5 HA THR 5 -0.354 -0.039 6.832 32 HB THR 5 HB THR 5 -1.502 0.813 9.051 33 HG1 THR 5 HG1 THR 5 -1.298 -0.727 10.517 34 HG21 THR 5 HG21 THR 5 -3.605 -0.375 8.323 35 HG22 THR 5 HG22 THR 5 -2.608 -1.185 7.114 36 HG23 THR 5 HG23 THR 5 -2.772 0.570 7.089 37 H VAL 6 HN VAL 6 1.955 -1.120 8.983 38 HA VAL 6 HA VAL 6 2.601 1.383 10.167 39 HB VAL 6 HB VAL 6 4.427 0.323 11.178 40 HG11 VAL 6 HG11 VAL 6 3.479 -1.708 12.123 41 HG12 VAL 6 HG12 VAL 6 2.312 -1.777 10.801 42 HG13 VAL 6 HG13 VAL 6 2.256 -0.446 11.959 43 HG21 VAL 6 HG21 VAL 6 5.459 -1.723 10.474 44 HG22 VAL 6 HG22 VAL 6 5.368 -0.639 9.076 45 HG23 VAL 6 HG23 VAL 6 4.218 -1.972 9.238 46 H ARG 7 HN ARG 7 3.618 2.993 9.200 47 HA ARG 7 HA ARG 7 5.236 2.318 6.871 48 HB2 ARG 7 HB2 ARG 7 3.167 4.479 6.822 49 HB3 ARG 7 HB1 ARG 7 4.019 3.723 5.473 50 HG2 ARG 7 HG2 ARG 7 2.851 1.679 5.937 51 HG3 ARG 7 HG1 ARG 7 2.099 2.408 7.339 52 HD2 ARG 7 HD2 ARG 7 1.660 3.037 4.477 53 HD3 ARG 7 HD1 ARG 7 0.554 2.426 5.667 54 HE ARG 7 HE ARG 7 1.515 4.967 6.432 55 HH11 ARG 7 HH11 ARG 7 -0.808 3.394 4.311 56 HH12 ARG 7 HH12 ARG 7 -1.768 4.830 4.127 57 HH21 ARG 7 HH21 ARG 7 0.239 6.835 6.184 58 HH22 ARG 7 HH22 ARG 7 -1.179 6.785 5.185 59 H GLN 8 HN GLN 8 6.679 3.710 6.225 60 HA GLN 8 HA GLN 8 8.296 5.118 7.804 61 HB2 GLN 8 HB2 GLN 8 7.873 4.750 5.041 62 HB3 GLN 8 HB1 GLN 8 8.178 6.471 5.277 63 HG2 GLN 8 HG2 GLN 8 10.235 5.962 6.469 64 HG3 GLN 8 HG1 GLN 8 9.940 4.240 6.263 65 HE21 GLN 8 HE21 GLN 8 12.188 5.804 5.425 66 HE22 GLN 8 HE22 GLN 8 12.283 5.654 3.694 67 H GLY 9 HN GLY 9 7.859 6.653 9.208 68 HA2 GLY 9 HA3 GLY 9 6.061 8.848 8.583 69 HA3 GLY 9 HA2 GLY 9 6.993 8.635 10.059 70 H SER 10 HN SER 10 7.603 10.878 9.930 71 HA SER 10 HA SER 10 8.776 12.147 7.772 72 HB2 SER 10 HB2 SER 10 9.901 13.588 9.543 73 HB3 SER 10 HB1 SER 10 8.147 13.452 9.657 74 HG SER 10 HG SER 10 9.893 11.751 11.097 75 H LYS 11 HN LYS 11 10.272 11.190 6.597 76 HA LYS 11 HA LYS 11 12.046 9.941 5.948 77 HB2 LYS 11 HB2 LYS 11 14.166 10.905 6.454 78 HB3 LYS 11 HB1 LYS 11 13.022 12.210 6.267 79 HG2 LYS 11 HG2 LYS 11 12.884 12.418 8.676 80 HG3 LYS 11 HG1 LYS 11 14.023 11.098 8.881 81 HD2 LYS 11 HD2 LYS 11 15.681 12.445 7.594 82 HD3 LYS 11 HD1 LYS 11 14.535 13.786 7.625 83 HE2 LYS 11 HE2 LYS 11 16.168 14.049 9.393 84 HE3 LYS 11 HE1 LYS 11 14.574 13.742 10.081 85 HZ1 LYS 11 HZ1 LYS 11 16.340 12.477 11.181 86 HZ2 LYS 11 HZ2 LYS 11 16.695 11.694 9.727 87 HZ3 LYS 11 HZ3 LYS 11 15.194 11.460 10.468 88 H GLU 12 HN GLU 12 10.652 8.534 7.903 89 HA GLU 12 HA GLU 12 12.214 7.508 9.991 90 HB2 GLU 12 HB2 GLU 12 9.799 7.139 9.800 91 HB3 GLU 12 HB1 GLU 12 10.036 6.181 8.353 92 HG2 GLU 12 HG2 GLU 12 11.219 4.491 9.661 93 HG3 GLU 12 HG1 GLU 12 10.991 5.465 11.112 94 HA PRO 13 HA PRO 13 15.485 5.326 7.896 95 HB2 PRO 13 HB2 PRO 13 15.083 3.264 9.973 96 HB3 PRO 13 HB1 PRO 13 16.552 4.131 9.536 97 HG2 PRO 13 HG2 PRO 13 15.182 4.660 11.793 98 HG3 PRO 13 HG1 PRO 13 16.070 5.899 10.901 99 HD2 PRO 13 HD2 PRO 13 13.156 5.446 11.104 100 HD3 PRO 13 HD1 PRO 13 14.047 6.945 10.799 101 H TYR 14 HN TYR 14 15.237 4.053 6.174 102 HA TYR 14 HA TYR 14 12.640 3.059 5.768 103 HB2 TYR 14 HB2 TYR 14 13.876 4.137 3.964 104 HB3 TYR 14 HB1 TYR 14 15.032 2.810 3.954 105 HD1 TYR 14 HD1 TYR 14 14.012 0.462 3.661 106 HD2 TYR 14 HD2 TYR 14 12.050 4.032 2.521 107 HE1 TYR 14 HE1 TYR 14 12.604 -0.837 2.153 108 HE2 TYR 14 HE2 TYR 14 10.612 2.756 0.992 109 HH TYR 14 HH TYR 14 10.219 0.742 0.099 110 HA PRO 15 HA PRO 15 14.750 -1.338 5.401 111 HB2 PRO 15 HB2 PRO 15 16.879 -1.023 7.422 112 HB3 PRO 15 HB1 PRO 15 16.904 -1.899 5.894 113 HG2 PRO 15 HG2 PRO 15 18.194 0.423 6.215 114 HG3 PRO 15 HG1 PRO 15 17.472 -0.045 4.681 115 HD2 PRO 15 HD2 PRO 15 16.543 1.950 6.676 116 HD3 PRO 15 HD1 PRO 15 16.348 1.929 4.918 117 H ASP 16 HN ASP 16 14.466 0.746 8.027 118 HA ASP 16 HA ASP 16 13.730 -1.293 9.948 119 HB2 ASP 16 HB2 ASP 16 14.366 1.612 10.100 120 HB3 ASP 16 HB1 ASP 16 13.325 0.940 11.349 121 H PHE 17 HN PHE 17 12.302 1.420 8.201 122 HA PHE 17 HA PHE 17 9.721 1.329 9.249 123 HB2 PHE 17 HB2 PHE 17 9.542 3.028 7.751 124 HB3 PHE 17 HB1 PHE 17 11.029 2.525 6.962 125 HD1 PHE 17 HD1 PHE 17 7.408 1.753 7.080 126 HD2 PHE 17 HD2 PHE 17 10.959 1.748 4.776 127 HE1 PHE 17 HE1 PHE 17 6.094 1.141 5.091 128 HE2 PHE 17 HE2 PHE 17 9.666 1.116 2.783 129 HZ PHE 17 HZ PHE 17 7.230 0.821 2.940 130 H VAL 18 HN VAL 18 11.236 -0.484 6.661 131 HA VAL 18 HA VAL 18 8.871 -2.010 6.136 132 HB VAL 18 HB VAL 18 10.109 -1.641 4.205 133 HG11 VAL 18 HG11 VAL 18 12.533 -2.564 5.726 134 HG12 VAL 18 HG12 VAL 18 12.153 -0.899 5.269 135 HG13 VAL 18 HG13 VAL 18 12.503 -2.109 4.013 136 HG21 VAL 18 HG21 VAL 18 9.418 -3.888 4.162 137 HG22 VAL 18 HG22 VAL 18 10.694 -4.371 5.286 138 HG23 VAL 18 HG23 VAL 18 11.105 -3.888 3.635 139 H ALA 19 HN ALA 19 11.892 -2.533 7.901 140 HA ALA 19 HA ALA 19 11.645 -5.279 8.335 141 HB1 ALA 19 HB1 ALA 19 12.699 -3.259 10.318 142 HB2 ALA 19 HB2 ALA 19 13.626 -3.959 8.992 143 HB3 ALA 19 HB3 ALA 19 13.037 -4.989 10.297 144 H ARG 20 HN ARG 20 9.925 -2.621 9.925 145 HA ARG 20 HA ARG 20 8.704 -4.505 11.761 146 HB2 ARG 20 HB2 ARG 20 7.372 -2.592 12.569 147 HB3 ARG 20 HB1 ARG 20 9.098 -2.286 12.649 148 HG2 ARG 20 HG2 ARG 20 9.029 -0.683 11.003 149 HG3 ARG 20 HG1 ARG 20 7.551 -1.333 10.284 150 HD2 ARG 20 HD2 ARG 20 6.220 -0.501 12.051 151 HD3 ARG 20 HD1 ARG 20 7.624 -0.125 13.028 152 HE ARG 20 HE ARG 20 8.001 1.478 10.918 153 HH11 ARG 20 HH11 ARG 20 5.186 0.854 12.897 154 HH12 ARG 20 HH12 ARG 20 4.533 2.450 12.706 155 HH21 ARG 20 HH21 ARG 20 7.169 3.607 10.695 156 HH22 ARG 20 HH22 ARG 20 5.653 4.006 11.451 157 H LEU 21 HN LEU 21 8.152 -2.911 8.770 158 HA LEU 21 HA LEU 21 5.494 -3.467 8.271 159 HB2 LEU 21 HB2 LEU 21 7.300 -2.228 6.890 160 HB3 LEU 21 HB1 LEU 21 7.679 -3.798 6.224 161 HG LEU 21 HG LEU 21 5.658 -3.917 5.055 162 HD11 LEU 21 HD11 LEU 21 3.864 -2.205 5.368 163 HD12 LEU 21 HD12 LEU 21 4.729 -1.663 6.809 164 HD13 LEU 21 HD13 LEU 21 4.086 -3.303 6.729 165 HD21 LEU 21 HD21 LEU 21 7.192 -2.397 4.030 166 HD22 LEU 21 HD22 LEU 21 6.629 -1.079 5.056 167 HD23 LEU 21 HD23 LEU 21 5.555 -1.768 3.842 168 H GLN 22 HN GLN 22 8.373 -5.442 7.790 169 HA GLN 22 HA GLN 22 7.014 -7.754 6.905 170 HB2 GLN 22 HB2 GLN 22 9.740 -7.709 8.163 171 HB3 GLN 22 HB1 GLN 22 9.077 -8.830 6.968 172 HG2 GLN 22 HG2 GLN 22 8.989 -6.820 5.437 173 HG3 GLN 22 HG1 GLN 22 10.002 -6.023 6.604 174 HE21 GLN 22 HE21 GLN 22 11.383 -5.889 4.735 175 HE22 GLN 22 HE22 GLN 22 12.486 -7.186 4.444 176 H ASP 23 HN ASP 23 8.422 -6.700 9.925 177 HA ASP 23 HA ASP 23 8.216 -8.965 11.455 178 HB2 ASP 23 HB2 ASP 23 9.107 -6.718 12.132 179 HB3 ASP 23 HB1 ASP 23 7.430 -6.237 12.393 180 H VAL 24 HN VAL 24 5.690 -6.489 11.089 181 HA VAL 24 HA VAL 24 3.935 -8.072 12.718 182 HB VAL 24 HB VAL 24 3.834 -5.669 12.980 183 HG11 VAL 24 HG11 VAL 24 3.065 -5.602 10.078 184 HG12 VAL 24 HG12 VAL 24 4.572 -5.015 10.781 185 HG13 VAL 24 HG13 VAL 24 3.047 -4.217 11.168 186 HG21 VAL 24 HG21 VAL 24 1.391 -5.264 12.556 187 HG22 VAL 24 HG22 VAL 24 1.748 -6.772 13.406 188 HG23 VAL 24 HG23 VAL 24 1.359 -6.804 11.688 189 H ALA 25 HN ALA 25 4.605 -7.607 9.373 190 HA ALA 25 HA ALA 25 2.165 -8.690 8.353 191 HB1 ALA 25 HB1 ALA 25 3.708 -7.451 6.885 192 HB2 ALA 25 HB2 ALA 25 3.437 -9.083 6.280 193 HB3 ALA 25 HB3 ALA 25 4.935 -8.694 7.123 194 H GLN 26 HN GLN 26 5.051 -9.799 9.761 195 HA GLN 26 HA GLN 26 4.772 -12.549 8.985 196 HB2 GLN 26 HB2 GLN 26 6.955 -12.290 9.346 197 HB3 GLN 26 HB1 GLN 26 6.674 -10.793 10.217 198 HG2 GLN 26 HG2 GLN 26 7.637 -11.975 11.861 199 HG3 GLN 26 HG1 GLN 26 5.976 -12.487 12.130 200 HE21 GLN 26 HE21 GLN 26 5.883 -14.119 9.753 201 HE22 GLN 26 HE22 GLN 26 6.811 -15.531 10.076 202 H LYS 27 HN LYS 27 4.161 -10.554 11.773 203 HA LYS 27 HA LYS 27 3.391 -12.579 13.576 204 HB2 LYS 27 HB2 LYS 27 2.437 -9.711 13.463 205 HB3 LYS 27 HB1 LYS 27 2.401 -10.771 14.877 206 HG2 LYS 27 HG2 LYS 27 4.846 -9.715 13.478 207 HG3 LYS 27 HG1 LYS 27 4.240 -9.229 15.060 208 HD2 LYS 27 HD2 LYS 27 4.919 -11.192 16.064 209 HD3 LYS 27 HD1 LYS 27 4.904 -12.095 14.550 210 HE2 LYS 27 HE2 LYS 27 6.898 -11.112 13.815 211 HE3 LYS 27 HE1 LYS 27 6.815 -9.847 15.035 212 HZ1 LYS 27 HZ1 LYS 27 8.467 -11.533 15.588 213 HZ2 LYS 27 HZ2 LYS 27 7.278 -12.733 15.570 214 HZ3 LYS 27 HZ3 LYS 27 7.228 -11.512 16.738 215 H SER 28 HN SER 28 1.685 -10.954 11.011 216 HA SER 28 HA SER 28 -0.861 -11.951 12.061 217 HB2 SER 28 HB2 SER 28 -0.336 -9.814 10.001 218 HB3 SER 28 HB1 SER 28 -1.900 -10.207 10.722 219 HG SER 28 HG SER 28 0.319 -8.884 11.823 220 H ILE 29 HN ILE 29 1.478 -12.542 9.739 221 HA ILE 29 HA ILE 29 -0.474 -13.873 7.973 222 HB ILE 29 HB ILE 29 2.217 -12.696 7.309 223 HG12 ILE 29 HG12 ILE 29 -0.527 -12.005 6.254 224 HG13 ILE 29 HG11 ILE 29 0.357 -11.082 7.476 225 HG21 ILE 29 HG21 ILE 29 1.987 -14.734 6.079 226 HG22 ILE 29 HG22 ILE 29 1.793 -13.352 4.997 227 HG23 ILE 29 HG23 ILE 29 0.375 -14.264 5.533 228 HD11 ILE 29 HD11 ILE 29 2.077 -10.545 5.926 229 HD12 ILE 29 HD12 ILE 29 0.526 -10.165 5.172 230 HD13 ILE 29 HD13 ILE 29 1.398 -11.634 4.713 231 H ALA 30 HN ALA 30 -0.270 -16.021 7.663 232 HA ALA 30 HA ALA 30 2.003 -17.407 8.894 233 HB1 ALA 30 HB1 ALA 30 -0.578 -18.535 7.814 234 HB2 ALA 30 HB2 ALA 30 -0.271 -18.131 9.501 235 HB3 ALA 30 HB3 ALA 30 0.651 -19.415 8.721 236 H ASP 31 HN ASP 31 1.165 -16.166 5.996 237 HA ASP 31 HA ASP 31 2.405 -18.278 4.348 238 HB2 ASP 31 HB2 ASP 31 0.092 -17.300 3.842 239 HB3 ASP 31 HB1 ASP 31 0.947 -15.830 3.417 240 H GLU 32 HN GLU 32 4.527 -17.961 4.283 241 HA GLU 32 HA GLU 32 5.909 -15.592 4.683 242 HB2 GLU 32 HB2 GLU 32 7.803 -16.680 3.614 243 HB3 GLU 32 HB1 GLU 32 6.955 -17.839 4.628 244 HG2 GLU 32 HG2 GLU 32 6.886 -19.200 2.890 245 HG3 GLU 32 HG1 GLU 32 5.779 -18.080 2.099 246 H LYS 33 HN LYS 33 4.221 -16.734 1.850 247 HA LYS 33 HA LYS 33 5.705 -15.072 0.035 248 HB2 LYS 33 HB2 LYS 33 3.056 -16.443 -0.435 249 HB3 LYS 33 HB1 LYS 33 4.109 -15.758 -1.662 250 HG2 LYS 33 HG2 LYS 33 4.768 -17.901 -1.879 251 HG3 LYS 33 HG1 LYS 33 5.820 -17.480 -0.525 252 HD2 LYS 33 HD2 LYS 33 4.861 -19.473 0.162 253 HD3 LYS 33 HD1 LYS 33 3.861 -18.256 0.952 254 HE2 LYS 33 HE2 LYS 33 3.199 -19.717 -1.600 255 HE3 LYS 33 HE1 LYS 33 2.506 -20.034 -0.014 256 HZ1 LYS 33 HZ1 LYS 33 1.634 -17.738 -0.036 257 HZ2 LYS 33 HZ2 LYS 33 0.981 -18.708 -1.269 258 HZ3 LYS 33 HZ3 LYS 33 2.181 -17.570 -1.632 259 H ALA 34 HN ALA 34 2.420 -15.069 1.373 260 HA ALA 34 HA ALA 34 1.709 -12.524 0.420 261 HB1 ALA 34 HB1 ALA 34 0.089 -14.145 1.323 262 HB2 ALA 34 HB2 ALA 34 -0.060 -12.560 2.082 263 HB3 ALA 34 HB3 ALA 34 0.740 -13.875 2.940 264 H ARG 35 HN ARG 35 3.681 -13.546 3.095 265 HA ARG 35 HA ARG 35 3.673 -11.096 4.571 266 HB2 ARG 35 HB2 ARG 35 4.484 -13.503 5.246 267 HB3 ARG 35 HB1 ARG 35 6.003 -12.981 4.537 268 HG2 ARG 35 HG2 ARG 35 4.790 -11.128 6.494 269 HG3 ARG 35 HG1 ARG 35 5.370 -12.665 7.128 270 HD2 ARG 35 HD2 ARG 35 6.954 -10.614 5.595 271 HD3 ARG 35 HD1 ARG 35 7.117 -11.039 7.305 272 HE ARG 35 HE ARG 35 7.511 -13.288 5.587 273 HH11 ARG 35 HH11 ARG 35 9.064 -10.488 6.974 274 HH12 ARG 35 HH12 ARG 35 10.667 -11.117 6.790 275 HH21 ARG 35 HH21 ARG 35 9.633 -14.143 5.362 276 HH22 ARG 35 HH22 ARG 35 10.989 -13.192 5.878 277 H LYS 36 HN LYS 36 6.003 -12.572 2.337 278 HA LYS 36 HA LYS 36 7.747 -10.379 2.143 279 HB2 LYS 36 HB2 LYS 36 7.096 -12.397 0.010 280 HB3 LYS 36 HB1 LYS 36 8.534 -11.379 0.083 281 HG2 LYS 36 HG2 LYS 36 9.538 -12.668 1.596 282 HG3 LYS 36 HG1 LYS 36 8.017 -13.004 2.451 283 HD2 LYS 36 HD2 LYS 36 8.768 -15.043 1.452 284 HD3 LYS 36 HD1 LYS 36 7.354 -14.443 0.561 285 HE2 LYS 36 HE2 LYS 36 9.056 -13.310 -0.982 286 HE3 LYS 36 HE1 LYS 36 10.246 -14.367 -0.216 287 HZ1 LYS 36 HZ1 LYS 36 8.915 -16.288 -0.877 288 HZ2 LYS 36 HZ2 LYS 36 9.435 -15.396 -2.216 289 HZ3 LYS 36 HZ3 LYS 36 7.837 -15.270 -1.684 290 H VAL 37 HN VAL 37 5.155 -11.417 -0.033 291 HA VAL 37 HA VAL 37 5.556 -9.451 -1.929 292 HB VAL 37 HB VAL 37 3.316 -9.814 -2.776 293 HG11 VAL 37 HG11 VAL 37 3.345 -12.365 -2.838 294 HG12 VAL 37 HG12 VAL 37 4.775 -12.255 -1.800 295 HG13 VAL 37 HG13 VAL 37 4.789 -11.527 -3.411 296 HG21 VAL 37 HG21 VAL 37 2.813 -11.153 -0.135 297 HG22 VAL 37 HG22 VAL 37 1.777 -11.370 -1.544 298 HG23 VAL 37 HG23 VAL 37 1.972 -9.769 -0.830 299 H ILE 38 HN ILE 38 3.761 -9.264 1.100 300 HA ILE 38 HA ILE 38 2.797 -6.649 0.360 301 HB ILE 38 HB ILE 38 1.679 -8.513 1.992 302 HG12 ILE 38 HG12 ILE 38 1.200 -5.559 2.285 303 HG13 ILE 38 HG11 ILE 38 0.765 -6.428 0.820 304 HG21 ILE 38 HG21 ILE 38 3.363 -8.031 3.763 305 HG22 ILE 38 HG22 ILE 38 1.701 -7.707 4.265 306 HG23 ILE 38 HG23 ILE 38 2.762 -6.371 3.818 307 HD11 ILE 38 HD11 ILE 38 -0.399 -6.541 3.545 308 HD12 ILE 38 HD12 ILE 38 -0.565 -7.929 2.468 309 HD13 ILE 38 HD13 ILE 38 -1.200 -6.354 1.993 310 H VAL 39 HN VAL 39 5.351 -7.964 2.439 311 HA VAL 39 HA VAL 39 6.008 -5.411 3.470 312 HB VAL 39 HB VAL 39 7.994 -6.232 4.260 313 HG11 VAL 39 HG11 VAL 39 7.445 -8.425 5.254 314 HG12 VAL 39 HG12 VAL 39 6.086 -8.552 4.140 315 HG13 VAL 39 HG13 VAL 39 6.119 -7.262 5.343 316 HG21 VAL 39 HG21 VAL 39 9.035 -7.106 2.272 317 HG22 VAL 39 HG22 VAL 39 7.915 -8.466 2.246 318 HG23 VAL 39 HG23 VAL 39 9.099 -8.320 3.549 319 H GLU 40 HN GLU 40 7.326 -7.239 0.729 320 HA GLU 40 HA GLU 40 8.974 -5.254 -0.280 321 HB2 GLU 40 HB2 GLU 40 7.628 -7.625 -1.526 322 HB3 GLU 40 HB1 GLU 40 8.787 -6.632 -2.386 323 HG2 GLU 40 HG2 GLU 40 10.511 -7.173 -0.877 324 HG3 GLU 40 HG1 GLU 40 9.407 -7.900 0.251 325 H LEU 41 HN LEU 41 5.526 -5.686 -0.621 326 HA LEU 41 HA LEU 41 5.389 -3.749 -2.775 327 HB2 LEU 41 HB2 LEU 41 3.698 -5.747 -1.894 328 HB3 LEU 41 HB1 LEU 41 2.879 -4.274 -1.414 329 HG LEU 41 HG LEU 41 2.002 -4.664 -3.512 330 HD11 LEU 41 HD11 LEU 41 4.389 -3.008 -4.264 331 HD12 LEU 41 HD12 LEU 41 3.062 -2.399 -3.279 332 HD13 LEU 41 HD13 LEU 41 2.757 -2.943 -4.925 333 HD21 LEU 41 HD21 LEU 41 3.206 -5.495 -5.409 334 HD22 LEU 41 HD22 LEU 41 3.517 -6.543 -4.025 335 HD23 LEU 41 HD23 LEU 41 4.736 -5.377 -4.542 336 H MET 42 HN MET 42 4.317 -3.859 0.630 337 HA MET 42 HA MET 42 3.362 -1.192 0.689 338 HB2 MET 42 HB2 MET 42 4.297 -2.948 2.962 339 HB3 MET 42 HB1 MET 42 3.415 -1.429 3.157 340 HG2 MET 42 HG2 MET 42 2.464 -3.998 1.939 341 HG3 MET 42 HG1 MET 42 1.863 -3.173 3.370 342 HE1 MET 42 HE1 MET 42 -0.005 -4.278 1.113 343 HE2 MET 42 HE2 MET 42 -1.142 -2.939 0.935 344 HE3 MET 42 HE3 MET 42 -0.591 -3.424 2.542 345 H ALA 43 HN ALA 43 6.439 -2.633 0.923 346 HA ALA 43 HA ALA 43 8.038 -0.730 2.036 347 HB1 ALA 43 HB1 ALA 43 8.440 -2.391 -0.436 348 HB2 ALA 43 HB2 ALA 43 8.945 -2.762 1.212 349 HB3 ALA 43 HB3 ALA 43 9.720 -1.445 0.326 350 H TYR 44 HN TYR 44 6.273 -0.625 -0.985 351 HA TYR 44 HA TYR 44 7.400 2.029 -1.609 352 HB2 TYR 44 HB2 TYR 44 7.482 0.515 -3.487 353 HB3 TYR 44 HB1 TYR 44 5.808 0.059 -3.236 354 HD1 TYR 44 HD1 TYR 44 8.061 2.465 -4.771 355 HD2 TYR 44 HD2 TYR 44 3.989 1.626 -3.907 356 HE1 TYR 44 HE1 TYR 44 7.384 4.091 -6.474 357 HE2 TYR 44 HE2 TYR 44 3.290 3.264 -5.601 358 HH TYR 44 HH TYR 44 4.350 5.366 -6.692 359 H GLU 45 HN GLU 45 4.280 0.393 -1.987 360 HA GLU 45 HA GLU 45 2.650 2.536 -2.133 361 HB2 GLU 45 HB2 GLU 45 1.988 -0.013 -0.693 362 HB3 GLU 45 HB1 GLU 45 0.864 1.038 -1.542 363 HG2 GLU 45 HG2 GLU 45 3.107 -0.483 -2.847 364 HG3 GLU 45 HG1 GLU 45 1.446 -1.042 -2.771 365 H ASN 46 HN ASN 46 4.057 1.223 0.798 366 HA ASN 46 HA ASN 46 2.339 2.938 2.428 367 HB2 ASN 46 HB2 ASN 46 3.817 0.394 2.932 368 HB3 ASN 46 HB1 ASN 46 3.525 1.488 4.280 369 HD21 ASN 46 HD21 ASN 46 2.022 0.111 5.329 370 HD22 ASN 46 HD22 ASN 46 0.455 -0.147 4.697 371 H ALA 47 HN ALA 47 5.496 2.666 1.214 372 HA ALA 47 HA ALA 47 6.985 3.745 3.341 373 HB1 ALA 47 HB1 ALA 47 8.045 2.653 1.442 374 HB2 ALA 47 HB2 ALA 47 8.682 4.282 1.680 375 HB3 ALA 47 HB3 ALA 47 7.524 3.967 0.389 376 H ASN 48 HN ASN 48 8.246 5.833 2.951 377 HA ASN 48 HA ASN 48 6.567 8.071 3.074 378 HB2 ASN 48 HB2 ASN 48 9.481 7.575 2.818 379 HB3 ASN 48 HB1 ASN 48 8.910 9.170 2.338 380 HD21 ASN 48 HD21 ASN 48 10.561 8.215 4.623 381 HD22 ASN 48 HD22 ASN 48 9.758 8.846 6.022 382 HA PRO 49 HA PRO 49 5.399 8.787 -1.098 383 HB2 PRO 49 HB2 PRO 49 5.532 11.567 -1.043 384 HB3 PRO 49 HB1 PRO 49 4.143 10.594 -0.562 385 HG2 PRO 49 HG2 PRO 49 6.248 11.864 1.116 386 HG3 PRO 49 HG1 PRO 49 4.520 11.649 1.449 387 HD2 PRO 49 HD2 PRO 49 6.391 10.104 2.607 388 HD3 PRO 49 HD1 PRO 49 4.801 9.457 2.143 389 H GLU 50 HN GLU 50 8.324 10.148 0.180 390 HA GLU 50 HA GLU 50 9.500 10.686 -2.399 391 HB2 GLU 50 HB2 GLU 50 11.366 11.500 -1.162 392 HB3 GLU 50 HB1 GLU 50 9.928 12.007 -0.289 393 HG2 GLU 50 HG2 GLU 50 10.957 9.441 0.559 394 HG3 GLU 50 HG1 GLU 50 12.045 10.791 0.836 395 H CYS 51 HN CYS 51 9.446 8.225 0.046 396 HA CYS 51 HA CYS 51 11.905 7.001 -0.780 397 HB2 CYS 51 HB2 CYS 51 9.844 6.192 1.289 398 HB3 CYS 51 HB1 CYS 51 11.379 5.365 1.012 399 HG CYS 51 HG CYS 51 12.949 7.085 2.211 400 H GLN 52 HN GLN 52 8.461 6.335 -1.000 401 HA GLN 52 HA GLN 52 8.786 3.915 -2.468 402 HB2 GLN 52 HB2 GLN 52 6.479 4.069 -2.976 403 HB3 GLN 52 HB1 GLN 52 6.647 4.675 -1.337 404 HG2 GLN 52 HG2 GLN 52 6.628 6.980 -2.277 405 HG3 GLN 52 HG1 GLN 52 6.258 6.278 -3.849 406 HE21 GLN 52 HE21 GLN 52 4.735 4.138 -2.548 407 HE22 GLN 52 HE22 GLN 52 3.240 4.826 -2.085 408 H SER 53 HN SER 53 8.781 7.261 -3.043 409 HA SER 53 HA SER 53 8.733 7.163 -5.868 410 HB2 SER 53 HB2 SER 53 9.313 9.191 -3.771 411 HB3 SER 53 HB1 SER 53 9.674 9.562 -5.466 412 HG SER 53 HG SER 53 7.303 9.544 -4.193 413 H ALA 54 HN ALA 54 11.162 6.804 -3.437 414 HA ALA 54 HA ALA 54 13.347 6.837 -5.291 415 HB1 ALA 54 HB1 ALA 54 13.690 7.187 -2.905 416 HB2 ALA 54 HB2 ALA 54 14.599 5.784 -3.469 417 HB3 ALA 54 HB3 ALA 54 13.089 5.563 -2.578 418 H ILE 55 HN ILE 55 10.893 4.685 -4.392 419 HA ILE 55 HA ILE 55 12.304 2.314 -5.207 420 HB ILE 55 HB ILE 55 9.654 2.814 -3.934 421 HG12 ILE 55 HG12 ILE 55 11.854 1.118 -2.870 422 HG13 ILE 55 HG11 ILE 55 12.031 2.878 -2.837 423 HG21 ILE 55 HG21 ILE 55 9.416 0.372 -3.732 424 HG22 ILE 55 HG22 ILE 55 10.806 0.174 -4.799 425 HG23 ILE 55 HG23 ILE 55 9.331 0.926 -5.404 426 HD11 ILE 55 HD11 ILE 55 11.119 1.862 -0.773 427 HD12 ILE 55 HD12 ILE 55 9.670 1.415 -1.695 428 HD13 ILE 55 HD13 ILE 55 10.108 3.118 -1.495 429 H LYS 56 HN LYS 56 9.637 4.282 -6.520 430 HA LYS 56 HA LYS 56 8.247 2.490 -7.975 431 HB2 LYS 56 HB2 LYS 56 8.688 4.642 -9.812 432 HB3 LYS 56 HB1 LYS 56 7.233 4.184 -8.952 433 HG2 LYS 56 HG2 LYS 56 7.428 6.261 -8.126 434 HG3 LYS 56 HG1 LYS 56 8.548 5.485 -7.002 435 HD2 LYS 56 HD2 LYS 56 10.380 6.277 -8.050 436 HD3 LYS 56 HD1 LYS 56 9.590 6.424 -9.618 437 HE2 LYS 56 HE2 LYS 56 9.517 8.327 -7.267 438 HE3 LYS 56 HE1 LYS 56 9.921 8.643 -8.955 439 HZ1 LYS 56 HZ1 LYS 56 7.751 9.532 -8.387 440 HZ2 LYS 56 HZ2 LYS 56 7.196 7.993 -7.968 441 HZ3 LYS 56 HZ3 LYS 56 7.613 8.329 -9.570 442 HA PRO 57 HA PRO 57 11.516 2.366 -11.650 443 HB2 PRO 57 HB2 PRO 57 14.087 2.385 -10.764 444 HB3 PRO 57 HB1 PRO 57 13.254 3.843 -11.326 445 HG2 PRO 57 HG2 PRO 57 13.523 2.801 -8.516 446 HG3 PRO 57 HG1 PRO 57 13.929 4.423 -9.128 447 HD2 PRO 57 HD2 PRO 57 11.623 4.028 -7.923 448 HD3 PRO 57 HD1 PRO 57 11.629 4.967 -9.425 449 H LEU 58 HN LEU 58 12.054 1.154 -8.388 450 HA LEU 58 HA LEU 58 13.047 -1.418 -9.365 451 HB2 LEU 58 HB2 LEU 58 12.505 -0.936 -6.495 452 HB3 LEU 58 HB1 LEU 58 13.808 -1.862 -7.229 453 HG LEU 58 HG LEU 58 13.621 1.153 -7.057 454 HD11 LEU 58 HD11 LEU 58 13.981 0.153 -4.892 455 HD12 LEU 58 HD12 LEU 58 15.478 0.903 -5.453 456 HD13 LEU 58 HD13 LEU 58 15.282 -0.847 -5.538 457 HD21 LEU 58 HD21 LEU 58 15.957 1.121 -7.832 458 HD22 LEU 58 HD22 LEU 58 14.841 0.486 -9.039 459 HD23 LEU 58 HD23 LEU 58 15.835 -0.620 -8.089 460 H LYS 59 HN LYS 59 10.295 0.232 -8.342 461 HA LYS 59 HA LYS 59 8.761 -1.736 -7.126 462 HB2 LYS 59 HB2 LYS 59 8.016 0.571 -7.275 463 HB3 LYS 59 HB1 LYS 59 7.874 0.432 -9.018 464 HG2 LYS 59 HG2 LYS 59 5.712 0.056 -8.564 465 HG3 LYS 59 HG1 LYS 59 6.282 -1.575 -8.246 466 HD2 LYS 59 HD2 LYS 59 5.901 0.579 -6.197 467 HD3 LYS 59 HD1 LYS 59 4.816 -0.794 -6.450 468 HE2 LYS 59 HE2 LYS 59 7.708 -0.896 -5.563 469 HE3 LYS 59 HE1 LYS 59 6.298 -1.198 -4.557 470 HZ1 LYS 59 HZ1 LYS 59 5.785 -3.136 -5.925 471 HZ2 LYS 59 HZ2 LYS 59 7.331 -3.264 -5.246 472 HZ3 LYS 59 HZ3 LYS 59 7.153 -2.845 -6.869 473 H GLY 60 HN GLY 60 8.518 -3.736 -7.821 474 HA2 GLY 60 HA3 GLY 60 7.388 -5.284 -9.245 475 HA3 GLY 60 HA2 GLY 60 7.607 -4.163 -10.580 476 H LYS 61 HN LYS 61 10.443 -3.719 -9.618 477 HA LYS 61 HA LYS 61 11.555 -6.079 -10.971 478 HB2 LYS 61 HB2 LYS 61 13.197 -3.662 -10.444 479 HB3 LYS 61 HB1 LYS 61 13.155 -4.697 -11.858 480 HG2 LYS 61 HG2 LYS 61 11.010 -2.722 -11.166 481 HG3 LYS 61 HG1 LYS 61 12.354 -2.377 -12.242 482 HD2 LYS 61 HD2 LYS 61 10.359 -4.599 -12.652 483 HD3 LYS 61 HD1 LYS 61 10.264 -3.013 -13.425 484 HE2 LYS 61 HE2 LYS 61 12.453 -3.388 -14.444 485 HE3 LYS 61 HE1 LYS 61 12.528 -4.976 -13.692 486 HZ1 LYS 61 HZ1 LYS 61 11.816 -5.122 -15.988 487 HZ2 LYS 61 HZ2 LYS 61 10.501 -4.107 -15.675 488 HZ3 LYS 61 HZ3 LYS 61 10.582 -5.634 -14.953 489 H VAL 62 HN VAL 62 12.216 -7.534 -9.487 490 HA VAL 62 HA VAL 62 14.143 -6.515 -7.516 491 HB VAL 62 HB VAL 62 12.226 -7.464 -6.351 492 HG11 VAL 62 HG11 VAL 62 12.779 -10.012 -7.859 493 HG12 VAL 62 HG12 VAL 62 11.368 -8.968 -8.044 494 HG13 VAL 62 HG13 VAL 62 11.633 -9.833 -6.527 495 HG21 VAL 62 HG21 VAL 62 14.350 -7.756 -5.283 496 HG22 VAL 62 HG22 VAL 62 14.670 -9.215 -6.219 497 HG23 VAL 62 HG23 VAL 62 13.380 -9.204 -5.017 498 HA PRO 63 HA PRO 63 17.273 -8.992 -9.673 499 HB2 PRO 63 HB2 PRO 63 18.104 -9.512 -6.860 500 HB3 PRO 63 HB1 PRO 63 19.083 -9.042 -8.235 501 HG2 PRO 63 HG2 PRO 63 18.446 -7.261 -6.385 502 HG3 PRO 63 HG1 PRO 63 18.451 -6.813 -8.099 503 HD2 PRO 63 HD2 PRO 63 16.149 -7.338 -6.285 504 HD3 PRO 63 HD1 PRO 63 16.286 -6.198 -7.638 505 H ALA 64 HN ALA 64 17.386 -11.116 -10.183 506 HA ALA 64 HA ALA 64 15.337 -12.834 -9.312 507 HB1 ALA 64 HB1 ALA 64 17.846 -13.503 -10.843 508 HB2 ALA 64 HB2 ALA 64 16.315 -12.975 -11.541 509 HB3 ALA 64 HB3 ALA 64 16.415 -14.524 -10.704 510 H GLY 65 HN GLY 65 15.283 -13.466 -7.243 511 HA2 GLY 65 HA3 GLY 65 15.949 -15.252 -5.766 512 HA3 GLY 65 HA2 GLY 65 17.613 -14.975 -6.253 513 H SER 66 HN SER 66 16.761 -11.947 -5.980 514 HA SER 66 HA SER 66 17.654 -11.821 -3.204 515 HB2 SER 66 HB2 SER 66 17.343 -9.600 -5.236 516 HB3 SER 66 HB1 SER 66 18.131 -9.474 -3.663 517 HG SER 66 HG SER 66 19.232 -11.514 -4.943 518 H ASP 67 HN ASP 67 16.742 -9.995 -1.889 519 HA ASP 67 HA ASP 67 13.839 -10.148 -1.786 520 HB2 ASP 67 HB2 ASP 67 15.778 -9.980 0.131 521 HB3 ASP 67 HB1 ASP 67 15.334 -8.293 -0.028 522 H VAL 68 HN VAL 68 12.431 -8.324 -2.205 523 HA VAL 68 HA VAL 68 13.732 -6.334 -3.856 524 HB VAL 68 HB VAL 68 11.766 -5.742 -4.707 525 HG11 VAL 68 HG11 VAL 68 10.677 -8.087 -3.189 526 HG12 VAL 68 HG12 VAL 68 11.585 -8.175 -4.695 527 HG13 VAL 68 HG13 VAL 68 10.015 -7.375 -4.659 528 HG21 VAL 68 HG21 VAL 68 10.589 -5.776 -1.939 529 HG22 VAL 68 HG22 VAL 68 9.725 -5.289 -3.398 530 HG23 VAL 68 HG23 VAL 68 11.136 -4.374 -2.862 531 H ILE 69 HN ILE 69 12.645 -6.653 -0.619 532 HA ILE 69 HA ILE 69 12.463 -3.985 0.124 533 HB ILE 69 HB ILE 69 13.287 -6.410 1.692 534 HG12 ILE 69 HG12 ILE 69 11.013 -6.573 1.100 535 HG13 ILE 69 HG11 ILE 69 11.000 -5.948 2.736 536 HG21 ILE 69 HG21 ILE 69 14.329 -4.562 2.801 537 HG22 ILE 69 HG22 ILE 69 12.900 -5.004 3.739 538 HG23 ILE 69 HG23 ILE 69 12.865 -3.587 2.688 539 HD11 ILE 69 HD11 ILE 69 10.681 -3.681 1.842 540 HD12 ILE 69 HD12 ILE 69 9.373 -4.797 1.435 541 HD13 ILE 69 HD13 ILE 69 10.592 -4.375 0.224 542 H SER 70 HN SER 70 15.186 -6.153 0.161 543 HA SER 70 HA SER 70 17.201 -4.609 1.131 544 HB2 SER 70 HB2 SER 70 17.575 -6.904 0.491 545 HB3 SER 70 HB1 SER 70 17.256 -6.546 -1.201 546 HG SER 70 HG SER 70 19.481 -5.812 0.387 547 H GLU 71 HN GLU 71 15.730 -4.387 -2.056 548 HA GLU 71 HA GLU 71 17.620 -2.430 -3.032 549 HB2 GLU 71 HB2 GLU 71 15.049 -3.337 -4.295 550 HB3 GLU 71 HB1 GLU 71 16.474 -2.676 -5.092 551 HG2 GLU 71 HG2 GLU 71 16.886 -5.115 -3.517 552 HG3 GLU 71 HG1 GLU 71 15.906 -5.283 -4.968 553 H TYR 72 HN TYR 72 14.437 -2.600 -1.742 554 HA TYR 72 HA TYR 72 13.631 -0.008 -2.608 555 HB2 TYR 72 HB2 TYR 72 12.492 -2.069 -0.733 556 HB3 TYR 72 HB1 TYR 72 11.757 -0.481 -0.906 557 HD1 TYR 72 HD1 TYR 72 13.307 -1.868 -3.861 558 HD2 TYR 72 HD2 TYR 72 9.699 -1.667 -1.637 559 HE1 TYR 72 HE1 TYR 72 12.063 -2.666 -5.810 560 HE2 TYR 72 HE2 TYR 72 8.443 -2.481 -3.584 561 HH TYR 72 HH TYR 72 10.043 -3.744 -6.376 562 H VAL 73 HN VAL 73 14.950 -1.457 0.285 563 HA VAL 73 HA VAL 73 14.980 0.934 1.815 564 HB VAL 73 HB VAL 73 16.210 -0.102 3.445 565 HG11 VAL 73 HG11 VAL 73 14.177 -1.312 3.253 566 HG12 VAL 73 HG12 VAL 73 15.468 -2.424 3.697 567 HG13 VAL 73 HG13 VAL 73 14.875 -2.377 2.038 568 HG21 VAL 73 HG21 VAL 73 17.915 -1.644 3.262 569 HG22 VAL 73 HG22 VAL 73 18.099 -0.655 1.806 570 HG23 VAL 73 HG23 VAL 73 17.338 -2.244 1.702 571 H LYS 74 HN LYS 74 17.034 -0.619 -0.505 572 HA LYS 74 HA LYS 74 19.328 1.030 -0.280 573 HB2 LYS 74 HB2 LYS 74 18.575 -1.201 -1.741 574 HB3 LYS 74 HB1 LYS 74 18.702 0.061 -2.958 575 HG2 LYS 74 HG2 LYS 74 20.837 -0.671 -3.030 576 HG3 LYS 74 HG1 LYS 74 21.015 0.490 -1.714 577 HD2 LYS 74 HD2 LYS 74 20.406 -2.432 -1.300 578 HD3 LYS 74 HD1 LYS 74 22.038 -1.765 -1.294 579 HE2 LYS 74 HE2 LYS 74 19.830 -0.840 0.533 580 HE3 LYS 74 HE1 LYS 74 21.014 -2.072 0.969 581 HZ1 LYS 74 HZ1 LYS 74 21.601 0.162 1.771 582 HZ2 LYS 74 HZ2 LYS 74 21.697 0.706 0.175 583 HZ3 LYS 74 HZ3 LYS 74 22.769 -0.476 0.729 584 H ALA 75 HN ALA 75 16.281 1.226 -1.923 585 HA ALA 75 HA ALA 75 16.793 3.407 -3.633 586 HB1 ALA 75 HB1 ALA 75 14.836 1.997 -3.868 587 HB2 ALA 75 HB2 ALA 75 14.342 3.674 -3.640 588 HB3 ALA 75 HB3 ALA 75 14.235 2.530 -2.300 589 H CYS 76 HN CYS 76 15.417 3.247 -0.376 590 HA CYS 76 HA CYS 76 15.637 6.136 -0.089 591 HB2 CYS 76 HB2 CYS 76 13.645 5.167 0.755 592 HB3 CYS 76 HB1 CYS 76 14.523 3.971 1.692 593 HG CYS 76 HG CYS 76 15.711 6.326 3.156 594 H ASP 77 HN ASP 77 17.818 3.811 0.013 595 HA ASP 77 HA ASP 77 19.211 4.310 2.411 596 HB2 ASP 77 HB2 ASP 77 19.763 2.369 1.134 597 HB3 ASP 77 HB1 ASP 77 20.139 3.316 -0.298 598 H GLY 78 HN GLY 78 18.797 6.098 -0.487 599 HA2 GLY 78 HA3 GLY 78 20.865 8.023 0.273 600 HA3 GLY 78 HA2 GLY 78 19.911 8.054 -1.204 601 H ILE 79 HN ILE 79 17.624 7.421 0.960 602 HA ILE 79 HA ILE 79 16.961 10.234 1.278 603 HB ILE 79 HB ILE 79 15.292 7.764 1.590 604 HG12 ILE 79 HG12 ILE 79 15.176 9.955 -0.488 605 HG13 ILE 79 HG11 ILE 79 15.958 8.399 -0.731 606 HG21 ILE 79 HG21 ILE 79 14.417 10.642 1.761 607 HG22 ILE 79 HG22 ILE 79 14.561 9.531 3.123 608 HG23 ILE 79 HG23 ILE 79 13.373 9.222 1.858 609 HD11 ILE 79 HD11 ILE 79 13.903 7.250 -0.603 610 HD12 ILE 79 HD12 ILE 79 13.663 8.629 -1.683 611 HD13 ILE 79 HD13 ILE 79 13.063 8.691 -0.028 612 H GLY 80 HN GLY 80 17.119 11.207 3.160 613 HA2 GLY 80 HA3 GLY 80 16.084 10.488 5.536 614 HA3 GLY 80 HA2 GLY 80 17.673 9.746 5.566 615 H GLY 81 HN GLY 81 18.838 11.904 3.923 616 HA2 GLY 81 HA3 GLY 81 18.232 14.403 5.213 617 HA3 GLY 81 HA2 GLY 81 19.781 13.732 5.706 618 H ALA 82 HN ALA 82 18.788 16.088 4.051 619 HA ALA 82 HA ALA 82 19.594 17.376 2.378 620 HB1 ALA 82 HB1 ALA 82 21.777 16.728 3.271 621 HB2 ALA 82 HB2 ALA 82 21.819 16.974 1.524 622 HB3 ALA 82 HB3 ALA 82 21.798 15.339 2.186 623 H MET 83 HN MET 83 20.560 14.188 1.128 624 HA MET 83 HA MET 83 19.730 14.721 -1.497 625 HB2 MET 83 HB2 MET 83 20.100 12.059 -0.115 626 HB3 MET 83 HB1 MET 83 19.945 12.279 -1.853 627 HG2 MET 83 HG2 MET 83 21.975 13.699 -1.802 628 HG3 MET 83 HG1 MET 83 22.150 13.318 -0.093 629 HE1 MET 83 HE1 MET 83 21.368 10.316 0.152 630 HE2 MET 83 HE2 MET 83 22.842 10.977 0.859 631 HE3 MET 83 HE3 MET 83 22.912 9.508 -0.114 632 H HIS 84 HN HIS 84 18.060 13.266 1.222 633 HA HIS 84 HA HIS 84 15.693 12.391 0.102 634 HB2 HIS 84 HB2 HIS 84 15.967 12.088 2.431 635 HB3 HIS 84 HB1 HIS 84 16.323 13.785 2.702 636 HD1 HIS 84 HD1 HIS 84 14.541 14.305 4.386 637 HD2 HIS 84 HD2 HIS 84 13.021 12.477 0.984 638 HE1 HIS 84 HE1 HIS 84 12.046 14.412 4.620 639 HE2 HIS 84 HE2 HIS 84 11.184 13.006 2.723 640 H LYS 85 HN LYS 85 16.629 15.709 0.869 641 HA LYS 85 HA LYS 85 14.013 16.645 0.090 642 HB2 LYS 85 HB2 LYS 85 16.377 18.090 1.254 643 HB3 LYS 85 HB1 LYS 85 14.770 18.790 0.994 644 HG2 LYS 85 HG2 LYS 85 13.777 17.087 2.390 645 HG3 LYS 85 HG1 LYS 85 15.349 16.333 2.623 646 HD2 LYS 85 HD2 LYS 85 16.111 18.327 3.807 647 HD3 LYS 85 HD1 LYS 85 14.505 19.051 3.595 648 HE2 LYS 85 HE2 LYS 85 13.469 17.268 4.792 649 HE3 LYS 85 HE1 LYS 85 14.983 16.364 4.852 650 HZ1 LYS 85 HZ1 LYS 85 14.510 17.445 6.963 651 HZ2 LYS 85 HZ2 LYS 85 14.443 18.960 6.215 652 HZ3 LYS 85 HZ3 LYS 85 15.904 18.109 6.272 653 H ALA 86 HN ALA 86 17.179 16.423 -1.248 654 HA ALA 86 HA ALA 86 16.740 18.167 -3.463 655 HB1 ALA 86 HB1 ALA 86 18.640 17.055 -4.476 656 HB2 ALA 86 HB2 ALA 86 18.540 15.752 -3.292 657 HB3 ALA 86 HB3 ALA 86 18.987 17.381 -2.777 658 H MET 87 HN MET 87 16.358 14.736 -2.870 659 HA MET 87 HA MET 87 15.324 14.151 -5.472 660 HB2 MET 87 HB2 MET 87 15.408 12.529 -2.924 661 HB3 MET 87 HB1 MET 87 14.912 11.903 -4.499 662 HG2 MET 87 HG2 MET 87 17.114 12.394 -5.399 663 HG3 MET 87 HG1 MET 87 17.604 13.060 -3.849 664 HE1 MET 87 HE1 MET 87 19.263 10.788 -5.356 665 HE2 MET 87 HE2 MET 87 19.656 9.729 -4.003 666 HE3 MET 87 HE3 MET 87 19.728 11.480 -3.803 667 H LEU 88 HN LEU 88 14.000 15.451 -2.663 668 HA LEU 88 HA LEU 88 11.460 14.345 -2.540 669 HB2 LEU 88 HB2 LEU 88 12.791 16.206 -1.160 670 HB3 LEU 88 HB1 LEU 88 11.726 17.248 -2.074 671 HG LEU 88 HG LEU 88 9.983 16.780 -0.748 672 HD11 LEU 88 HD11 LEU 88 10.806 13.875 -0.743 673 HD12 LEU 88 HD12 LEU 88 9.616 14.607 -1.820 674 HD13 LEU 88 HD13 LEU 88 9.302 14.522 -0.090 675 HD21 LEU 88 HD21 LEU 88 10.560 15.889 1.468 676 HD22 LEU 88 HD22 LEU 88 11.716 17.095 0.900 677 HD23 LEU 88 HD23 LEU 88 12.121 15.379 0.824 678 H MET 89 HN MET 89 12.730 16.919 -4.597 679 HA MET 89 HA MET 89 10.116 17.506 -5.684 680 HB2 MET 89 HB2 MET 89 11.887 19.242 -5.353 681 HB3 MET 89 HB1 MET 89 12.816 18.474 -6.631 682 HG2 MET 89 HG2 MET 89 11.004 18.918 -8.211 683 HG3 MET 89 HG1 MET 89 10.084 19.700 -6.927 684 HE1 MET 89 HE1 MET 89 12.553 21.203 -5.374 685 HE2 MET 89 HE2 MET 89 10.937 21.855 -5.636 686 HE3 MET 89 HE3 MET 89 12.353 22.796 -6.103 687 H ALA 90 HN ALA 90 12.705 15.371 -6.359 688 HA ALA 90 HA ALA 90 12.064 15.124 -9.193 689 HB1 ALA 90 HB1 ALA 90 14.420 15.132 -8.393 690 HB2 ALA 90 HB2 ALA 90 14.002 13.682 -9.305 691 HB3 ALA 90 HB3 ALA 90 14.100 13.617 -7.542 692 H GLN 91 HN GLN 91 12.087 13.101 -6.303 693 HA GLN 91 HA GLN 91 11.029 10.872 -7.821 694 HB2 GLN 91 HB2 GLN 91 11.824 11.105 -4.925 695 HB3 GLN 91 HB1 GLN 91 11.378 9.615 -5.743 696 HG2 GLN 91 HG2 GLN 91 13.258 9.826 -7.226 697 HG3 GLN 91 HG1 GLN 91 13.692 11.351 -6.464 698 HE21 GLN 91 HE21 GLN 91 13.076 10.583 -3.823 699 HE22 GLN 91 HE22 GLN 91 14.227 9.418 -3.342 700 H LEU 92 HN LEU 92 10.109 12.599 -4.822 701 HA LEU 92 HA LEU 92 7.597 11.555 -4.423 702 HB2 LEU 92 HB2 LEU 92 8.998 13.482 -3.228 703 HB3 LEU 92 HB1 LEU 92 7.955 14.511 -4.179 704 HG LEU 92 HG LEU 92 7.308 12.792 -1.840 705 HD11 LEU 92 HD11 LEU 92 5.976 14.753 -1.227 706 HD12 LEU 92 HD12 LEU 92 6.446 15.528 -2.740 707 HD13 LEU 92 HD13 LEU 92 7.666 15.153 -1.525 708 HD21 LEU 92 HD21 LEU 92 5.769 11.893 -3.464 709 HD22 LEU 92 HD22 LEU 92 5.321 13.514 -3.990 710 HD23 LEU 92 HD23 LEU 92 4.889 12.963 -2.373 711 H GLU 93 HN GLU 93 8.812 13.922 -6.619 712 HA GLU 93 HA GLU 93 7.754 15.506 -7.947 713 HB2 GLU 93 HB2 GLU 93 7.161 14.250 -10.079 714 HB3 GLU 93 HB1 GLU 93 8.792 14.045 -9.433 715 HG2 GLU 93 HG2 GLU 93 8.307 11.885 -8.642 716 HG3 GLU 93 HG1 GLU 93 6.576 12.093 -8.856 717 H2 PRO 1 HT1 PRO 1 5.356 -4.144 -13.419 718 H3 PRO 1 HT2 PRO 1 5.719 -2.662 -14.004 719 HA PRO 1 HA PRO 1 6.408 -2.440 -11.963 720 HB2 PRO 1 HB2 PRO 1 4.269 -1.396 -10.728 721 HB3 PRO 1 HB1 PRO 1 5.019 -0.593 -12.108 722 HG2 PRO 1 HG2 PRO 1 2.456 -1.996 -11.952 723 HG3 PRO 1 HG1 PRO 1 3.042 -0.860 -13.178 724 HD2 PRO 1 HD2 PRO 1 3.019 -3.777 -13.221 725 HD3 PRO 1 HD1 PRO 1 3.353 -2.645 -14.547 726 H SER 2 HN SER 2 4.504 -2.479 -9.621 727 HA SER 2 HA SER 2 4.398 -5.217 -8.890 728 HB2 SER 2 HB2 SER 2 2.580 -2.990 -7.941 729 HB3 SER 2 HB1 SER 2 2.945 -4.488 -7.099 730 HG SER 2 HG SER 2 4.089 -2.339 -6.617 731 H PHE 3 HN PHE 3 2.062 -6.174 -8.424 732 HA PHE 3 HA PHE 3 0.435 -5.925 -10.770 733 HB2 PHE 3 HB2 PHE 3 -1.186 -6.991 -8.780 734 HB3 PHE 3 HB1 PHE 3 -0.244 -7.918 -9.949 735 HD1 PHE 3 HD1 PHE 3 -0.691 -6.938 -6.517 736 HD2 PHE 3 HD2 PHE 3 1.986 -8.806 -9.258 737 HE1 PHE 3 HE1 PHE 3 0.515 -7.983 -4.657 738 HE2 PHE 3 HE2 PHE 3 3.209 -9.826 -7.385 739 HZ PHE 3 HZ PHE 3 2.472 -9.414 -5.074 740 H ASN 4 HN ASN 4 0.287 -4.881 -7.433 741 HA ASN 4 HA ASN 4 -2.367 -3.828 -7.783 742 HB2 ASN 4 HB2 ASN 4 -2.243 -3.467 -5.367 743 HB3 ASN 4 HB1 ASN 4 -1.785 -5.111 -5.802 744 HD21 ASN 4 HD21 ASN 4 -0.517 -1.940 -4.953 745 HD22 ASN 4 HD22 ASN 4 0.986 -2.520 -4.315 746 H THR 5 HN THR 5 0.473 -2.427 -8.565 747 HA THR 5 HA THR 5 0.504 -0.032 -7.029 748 HB THR 5 HB THR 5 1.658 0.807 -9.248 749 HG1 THR 5 HG1 THR 5 1.438 -0.737 -10.710 750 HG21 THR 5 HG21 THR 5 3.753 -0.391 -8.517 751 HG22 THR 5 HG22 THR 5 2.751 -1.195 -7.307 752 HG23 THR 5 HG23 THR 5 2.925 0.559 -7.284 753 H VAL 6 HN VAL 6 -1.812 -1.102 -9.175 754 HA VAL 6 HA VAL 6 -2.448 1.401 -10.363 755 HB VAL 6 HB VAL 6 -4.280 0.346 -11.369 756 HG11 VAL 6 HG11 VAL 6 -3.346 -1.692 -12.308 757 HG12 VAL 6 HG12 VAL 6 -2.181 -1.768 -10.984 758 HG13 VAL 6 HG13 VAL 6 -2.113 -0.441 -12.143 759 HG21 VAL 6 HG21 VAL 6 -5.325 -1.689 -10.660 760 HG22 VAL 6 HG22 VAL 6 -5.224 -0.604 -9.262 761 HG23 VAL 6 HG23 VAL 6 -4.084 -1.946 -9.426 762 H ARG 7 HN ARG 7 -3.451 3.019 -9.398 763 HA ARG 7 HA ARG 7 -5.071 2.358 -7.063 764 HB2 ARG 7 HB2 ARG 7 -2.986 4.505 -7.022 765 HB3 ARG 7 HB1 ARG 7 -3.844 3.758 -5.672 766 HG2 ARG 7 HG2 ARG 7 -2.693 1.704 -6.129 767 HG3 ARG 7 HG1 ARG 7 -1.935 2.422 -7.534 768 HD2 ARG 7 HD2 ARG 7 -1.492 3.056 -4.674 769 HD3 ARG 7 HD1 ARG 7 -0.391 2.436 -5.861 770 HE ARG 7 HE ARG 7 -1.333 4.979 -6.638 771 HH11 ARG 7 HH11 ARG 7 0.975 3.398 -4.508 772 HH12 ARG 7 HH12 ARG 7 1.944 4.827 -4.323 773 HH21 ARG 7 HH21 ARG 7 -0.052 6.834 -6.397 774 HH22 ARG 7 HH22 ARG 7 1.365 6.787 -5.397 775 H GLN 8 HN GLN 8 -6.502 3.759 -6.416 776 HA GLN 8 HA GLN 8 -8.115 5.172 -7.999 777 HB2 GLN 8 HB2 GLN 8 -7.692 4.803 -5.235 778 HB3 GLN 8 HB1 GLN 8 -7.988 6.526 -5.472 779 HG2 GLN 8 HG2 GLN 8 -10.047 6.028 -6.661 780 HG3 GLN 8 HG1 GLN 8 -9.763 4.305 -6.454 781 HE21 GLN 8 HE21 GLN 8 -12.002 5.885 -5.614 782 HE22 GLN 8 HE22 GLN 8 -12.096 5.734 -3.884 783 H GLY 9 HN GLY 9 -7.675 6.706 -9.402 784 HA2 GLY 9 HA3 GLY 9 -5.863 8.890 -8.776 785 HA3 GLY 9 HA2 GLY 9 -6.790 8.683 -10.254 786 H SER 10 HN SER 10 -7.376 10.930 -10.116 787 HA SER 10 HA SER 10 -8.556 12.206 -7.975 788 HB2 SER 10 HB2 SER 10 -9.669 13.649 -9.754 789 HB3 SER 10 HB1 SER 10 -7.915 13.504 -9.860 790 HG SER 10 HG SER 10 -9.667 11.810 -11.302 791 H LYS 11 HN LYS 11 -10.052 11.264 -6.800 792 HA LYS 11 HA LYS 11 -11.828 10.022 -6.147 793 HB2 LYS 11 HB2 LYS 11 -13.947 10.997 -6.647 794 HB3 LYS 11 HB1 LYS 11 -12.795 12.294 -6.460 795 HG2 LYS 11 HG2 LYS 11 -12.663 12.508 -8.867 796 HG3 LYS 11 HG1 LYS 11 -13.808 11.194 -9.072 797 HD2 LYS 11 HD2 LYS 11 -15.461 12.543 -7.782 798 HD3 LYS 11 HD1 LYS 11 -14.311 13.880 -7.808 799 HE2 LYS 11 HE2 LYS 11 -15.939 14.154 -9.579 800 HE3 LYS 11 HE1 LYS 11 -14.346 13.842 -10.264 801 HZ1 LYS 11 HZ1 LYS 11 -16.114 12.586 -11.370 802 HZ2 LYS 11 HZ2 LYS 11 -16.473 11.798 -9.918 803 HZ3 LYS 11 HZ3 LYS 11 -14.969 11.565 -10.659 804 H GLU 12 HN GLU 12 -10.447 8.604 -8.100 805 HA GLU 12 HA GLU 12 -12.020 7.585 -10.185 806 HB2 GLU 12 HB2 GLU 12 -9.606 7.200 -9.996 807 HB3 GLU 12 HB1 GLU 12 -9.848 6.240 -8.550 808 HG2 GLU 12 HG2 GLU 12 -11.047 4.562 -9.857 809 HG3 GLU 12 HG1 GLU 12 -10.814 5.534 -11.310 810 HA PRO 13 HA PRO 13 -15.305 5.426 -8.085 811 HB2 PRO 13 HB2 PRO 13 -14.917 3.357 -10.159 812 HB3 PRO 13 HB1 PRO 13 -16.382 4.232 -9.723 813 HG2 PRO 13 HG2 PRO 13 -15.008 4.751 -11.980 814 HG3 PRO 13 HG1 PRO 13 -15.890 5.996 -11.090 815 HD2 PRO 13 HD2 PRO 13 -12.978 5.527 -11.296 816 HD3 PRO 13 HD1 PRO 13 -13.861 7.031 -10.992 817 H TYR 14 HN TYR 14 -15.068 4.150 -6.361 818 HA TYR 14 HA TYR 14 -12.473 3.146 -5.955 819 HB2 TYR 14 HB2 TYR 14 -13.702 4.231 -4.152 820 HB3 TYR 14 HB1 TYR 14 -14.863 2.908 -4.138 821 HD1 TYR 14 HD1 TYR 14 -13.857 0.557 -3.844 822 HD2 TYR 14 HD2 TYR 14 -11.870 4.116 -2.711 823 HE1 TYR 14 HE1 TYR 14 -12.458 -0.748 -2.336 824 HE2 TYR 14 HE2 TYR 14 -10.441 2.833 -1.181 825 HH TYR 14 HH TYR 14 -10.057 0.815 -0.288 826 HA PRO 15 HA PRO 15 -14.604 -1.244 -5.582 827 HB2 PRO 15 HB2 PRO 15 -16.733 -0.919 -7.600 828 HB3 PRO 15 HB1 PRO 15 -16.762 -1.795 -6.072 829 HG2 PRO 15 HG2 PRO 15 -18.040 0.534 -6.396 830 HG3 PRO 15 HG1 PRO 15 -17.321 0.063 -4.860 831 HD2 PRO 15 HD2 PRO 15 -16.381 2.051 -6.856 832 HD3 PRO 15 HD1 PRO 15 -16.184 2.030 -5.098 833 H ASP 16 HN ASP 16 -14.314 0.836 -8.211 834 HA ASP 16 HA ASP 16 -13.587 -1.206 -10.132 835 HB2 ASP 16 HB2 ASP 16 -14.210 1.702 -10.286 836 HB3 ASP 16 HB1 ASP 16 -13.177 1.022 -11.536 837 H PHE 17 HN PHE 17 -12.145 1.497 -8.386 838 HA PHE 17 HA PHE 17 -9.565 1.393 -9.435 839 HB2 PHE 17 HB2 PHE 17 -9.375 3.090 -7.940 840 HB3 PHE 17 HB1 PHE 17 -10.865 2.597 -7.148 841 HD1 PHE 17 HD1 PHE 17 -7.250 1.803 -7.271 842 HD2 PHE 17 HD2 PHE 17 -10.797 1.824 -4.961 843 HE1 PHE 17 HE1 PHE 17 -5.937 1.186 -5.284 844 HE2 PHE 17 HE2 PHE 17 -9.505 1.187 -2.969 845 HZ PHE 17 HZ PHE 17 -7.071 0.876 -3.130 846 H VAL 18 HN VAL 18 -11.088 -0.410 -6.845 847 HA VAL 18 HA VAL 18 -8.733 -1.950 -6.320 848 HB VAL 18 HB VAL 18 -9.967 -1.572 -4.389 849 HG11 VAL 18 HG11 VAL 18 -12.398 -2.478 -5.910 850 HG12 VAL 18 HG12 VAL 18 -12.006 -0.817 -5.451 851 HG13 VAL 18 HG13 VAL 18 -12.365 -2.025 -4.196 852 HG21 VAL 18 HG21 VAL 18 -9.290 -3.823 -4.346 853 HG22 VAL 18 HG22 VAL 18 -10.572 -4.300 -5.465 854 HG23 VAL 18 HG23 VAL 18 -10.974 -3.811 -3.814 855 H ALA 19 HN ALA 19 -11.758 -2.456 -8.085 856 HA ALA 19 HA ALA 19 -11.527 -5.202 -8.514 857 HB1 ALA 19 HB1 ALA 19 -12.567 -3.181 -10.503 858 HB2 ALA 19 HB2 ALA 19 -13.500 -3.872 -9.176 859 HB3 ALA 19 HB3 ALA 19 -12.917 -4.909 -10.478 860 H ARG 20 HN ARG 20 -9.793 -2.558 -10.108 861 HA ARG 20 HA ARG 20 -8.585 -4.452 -11.945 862 HB2 ARG 20 HB2 ARG 20 -7.247 -2.549 -12.760 863 HB3 ARG 20 HB1 ARG 20 -8.970 -2.230 -12.836 864 HG2 ARG 20 HG2 ARG 20 -8.881 -0.625 -11.192 865 HG3 ARG 20 HG1 ARG 20 -7.407 -1.288 -10.477 866 HD2 ARG 20 HD2 ARG 20 -6.071 -0.468 -12.250 867 HD3 ARG 20 HD1 ARG 20 -7.477 -0.078 -13.222 868 HE ARG 20 HE ARG 20 -7.831 1.522 -11.105 869 HH11 ARG 20 HH11 ARG 20 -5.025 0.898 -13.106 870 HH12 ARG 20 HH12 ARG 20 -4.370 2.491 -12.907 871 HH21 ARG 20 HH21 ARG 20 -6.988 3.643 -10.873 872 HH22 ARG 20 HH22 ARG 20 -5.474 4.038 -11.634 873 H LEU 21 HN LEU 21 -8.026 -2.868 -8.954 874 HA LEU 21 HA LEU 21 -5.366 -3.430 -8.460 875 HB2 LEU 21 HB2 LEU 21 -7.164 -2.179 -7.078 876 HB3 LEU 21 HB1 LEU 21 -7.549 -3.747 -6.409 877 HG LEU 21 HG LEU 21 -5.530 -3.873 -5.241 878 HD11 LEU 21 HD11 LEU 21 -3.726 -2.173 -5.557 879 HD12 LEU 21 HD12 LEU 21 -4.588 -1.629 -6.999 880 HD13 LEU 21 HD13 LEU 21 -3.956 -3.273 -6.916 881 HD21 LEU 21 HD21 LEU 21 -7.055 -2.344 -4.219 882 HD22 LEU 21 HD22 LEU 21 -6.484 -1.030 -5.247 883 HD23 LEU 21 HD23 LEU 21 -5.415 -1.723 -4.031 884 H GLN 22 HN GLN 22 -8.256 -5.387 -7.967 885 HA GLN 22 HA GLN 22 -6.908 -7.706 -7.084 886 HB2 GLN 22 HB2 GLN 22 -9.632 -7.646 -8.341 887 HB3 GLN 22 HB1 GLN 22 -8.978 -8.770 -7.145 888 HG2 GLN 22 HG2 GLN 22 -8.880 -6.756 -5.616 889 HG3 GLN 22 HG1 GLN 22 -9.892 -5.958 -6.786 890 HE21 GLN 22 HE21 GLN 22 -11.272 -5.820 -4.912 891 HE22 GLN 22 HE22 GLN 22 -12.371 -7.118 -4.614 892 H ASP 23 HN ASP 23 -8.324 -6.655 -10.101 893 HA ASP 23 HA ASP 23 -8.126 -8.914 -11.635 894 HB2 ASP 23 HB2 ASP 23 -8.995 -6.656 -12.312 895 HB3 ASP 23 HB1 ASP 23 -7.314 -6.191 -12.570 896 H VAL 24 HN VAL 24 -5.582 -6.456 -11.264 897 HA VAL 24 HA VAL 24 -3.839 -8.049 -12.897 898 HB VAL 24 HB VAL 24 -3.723 -5.645 -13.160 899 HG11 VAL 24 HG11 VAL 24 -2.949 -5.584 -10.258 900 HG12 VAL 24 HG12 VAL 24 -4.454 -4.989 -10.959 901 HG13 VAL 24 HG13 VAL 24 -2.926 -4.200 -11.349 902 HG21 VAL 24 HG21 VAL 24 -1.277 -5.261 -12.743 903 HG22 VAL 24 HG22 VAL 24 -1.647 -6.768 -13.587 904 HG23 VAL 24 HG23 VAL 24 -1.254 -6.797 -11.869 905 H ALA 25 HN ALA 25 -4.500 -7.578 -9.551 906 HA ALA 25 HA ALA 25 -2.069 -8.679 -8.533 907 HB1 ALA 25 HB1 ALA 25 -3.604 -7.423 -7.069 908 HB2 ALA 25 HB2 ALA 25 -3.344 -9.055 -6.458 909 HB3 ALA 25 HB3 ALA 25 -4.838 -8.659 -7.304 910 H GLN 26 HN GLN 26 -4.962 -9.769 -9.943 911 HA GLN 26 HA GLN 26 -4.699 -12.520 -9.162 912 HB2 GLN 26 HB2 GLN 26 -6.882 -12.247 -9.519 913 HB3 GLN 26 HB1 GLN 26 -6.594 -10.752 -10.390 914 HG2 GLN 26 HG2 GLN 26 -7.565 -11.924 -12.034 915 HG3 GLN 26 HG1 GLN 26 -5.908 -12.452 -12.303 916 HE21 GLN 26 HE21 GLN 26 -5.821 -14.083 -9.932 917 HE22 GLN 26 HE22 GLN 26 -6.757 -15.489 -10.253 918 H LYS 27 HN LYS 27 -4.074 -10.527 -11.948 919 HA LYS 27 HA LYS 27 -3.323 -12.559 -13.750 920 HB2 LYS 27 HB2 LYS 27 -2.350 -9.698 -13.647 921 HB3 LYS 27 HB1 LYS 27 -2.325 -10.763 -15.057 922 HG2 LYS 27 HG2 LYS 27 -4.761 -9.688 -13.657 923 HG3 LYS 27 HG1 LYS 27 -4.153 -9.209 -15.241 924 HD2 LYS 27 HD2 LYS 27 -4.848 -11.167 -16.241 925 HD3 LYS 27 HD1 LYS 27 -4.835 -12.069 -14.728 926 HE2 LYS 27 HE2 LYS 27 -6.819 -11.068 -13.986 927 HE3 LYS 27 HE1 LYS 27 -6.735 -9.812 -15.215 928 HZ1 LYS 27 HZ1 LYS 27 -8.402 -11.490 -15.746 929 HZ2 LYS 27 HZ2 LYS 27 -7.219 -12.699 -15.721 930 HZ3 LYS 27 HZ3 LYS 27 -7.167 -11.490 -16.901 931 H SER 28 HN SER 28 -1.603 -10.947 -11.190 932 HA SER 28 HA SER 28 0.933 -11.961 -12.244 933 HB2 SER 28 HB2 SER 28 0.426 -9.819 -10.185 934 HB3 SER 28 HB1 SER 28 1.984 -10.216 -10.916 935 HG SER 28 HG SER 28 -0.232 -8.881 -11.992 936 H ILE 29 HN ILE 29 -1.406 -12.530 -9.913 937 HA ILE 29 HA ILE 29 0.540 -13.873 -8.151 938 HB ILE 29 HB ILE 29 -2.143 -12.679 -7.488 939 HG12 ILE 29 HG12 ILE 29 0.604 -12.002 -6.432 940 HG13 ILE 29 HG11 ILE 29 -0.274 -11.075 -7.654 941 HG21 ILE 29 HG21 ILE 29 -1.928 -14.715 -6.257 942 HG22 ILE 29 HG22 ILE 29 -1.723 -13.334 -5.175 943 HG23 ILE 29 HG23 ILE 29 -0.313 -14.256 -5.711 944 HD11 ILE 29 HD11 ILE 29 -1.992 -10.527 -6.106 945 HD12 ILE 29 HD12 ILE 29 -0.439 -10.154 -5.352 946 HD13 ILE 29 HD13 ILE 29 -1.319 -11.618 -4.891 947 H ALA 30 HN ALA 30 0.318 -16.022 -7.824 948 HA ALA 30 HA ALA 30 -1.960 -17.394 -9.064 949 HB1 ALA 30 HB1 ALA 30 0.621 -18.533 -7.992 950 HB2 ALA 30 HB2 ALA 30 0.302 -18.137 -9.680 951 HB3 ALA 30 HB3 ALA 30 -0.619 -19.414 -8.886 952 H ASP 31 HN ASP 31 -1.112 -16.154 -6.169 953 HA ASP 31 HA ASP 31 -2.365 -18.256 -4.519 954 HB2 ASP 31 HB2 ASP 31 -0.047 -17.298 -4.007 955 HB3 ASP 31 HB1 ASP 31 -0.886 -15.818 -3.589 956 H GLU 32 HN GLU 32 -4.483 -17.930 -4.441 957 HA GLU 32 HA GLU 32 -5.853 -15.551 -4.852 958 HB2 GLU 32 HB2 GLU 32 -7.753 -16.624 -3.779 959 HB3 GLU 32 HB1 GLU 32 -6.913 -17.791 -4.788 960 HG2 GLU 32 HG2 GLU 32 -6.856 -19.145 -3.048 961 HG3 GLU 32 HG1 GLU 32 -5.738 -18.033 -2.264 962 H LYS 33 HN LYS 33 -4.170 -16.697 -2.019 963 HA LYS 33 HA LYS 33 -5.643 -15.021 -0.204 964 HB2 LYS 33 HB2 LYS 33 -3.003 -16.410 0.272 965 HB3 LYS 33 HB1 LYS 33 -4.054 -15.716 1.498 966 HG2 LYS 33 HG2 LYS 33 -4.721 -17.857 1.714 967 HG3 LYS 33 HG1 LYS 33 -5.773 -17.429 0.363 968 HD2 LYS 33 HD2 LYS 33 -4.826 -19.421 -0.334 969 HD3 LYS 33 HD1 LYS 33 -3.820 -18.209 -1.120 970 HE2 LYS 33 HE2 LYS 33 -3.165 -19.680 1.428 971 HE3 LYS 33 HE1 LYS 33 -2.476 -19.999 -0.160 972 HZ1 LYS 33 HZ1 LYS 33 -1.587 -17.709 -0.131 973 HZ2 LYS 33 HZ2 LYS 33 -0.941 -18.689 1.097 974 HZ3 LYS 33 HZ3 LYS 33 -2.130 -17.542 1.467 975 H ALA 34 HN ALA 34 -2.359 -15.043 -1.547 976 HA ALA 34 HA ALA 34 -1.632 -12.501 -0.597 977 HB1 ALA 34 HB1 ALA 34 -0.023 -14.133 -1.499 978 HB2 ALA 34 HB2 ALA 34 0.136 -12.550 -2.260 979 HB3 ALA 34 HB3 ALA 34 -0.674 -13.861 -3.115 980 H ARG 35 HN ARG 35 -3.612 -13.514 -3.270 981 HA ARG 35 HA ARG 35 -3.589 -11.066 -4.749 982 HB2 ARG 35 HB2 ARG 35 -4.415 -13.470 -5.417 983 HB3 ARG 35 HB1 ARG 35 -5.930 -12.936 -4.709 984 HG2 ARG 35 HG2 ARG 35 -4.705 -11.099 -6.674 985 HG3 ARG 35 HG1 ARG 35 -5.302 -12.634 -7.301 986 HD2 ARG 35 HD2 ARG 35 -6.864 -10.562 -5.770 987 HD3 ARG 35 HD1 ARG 35 -7.033 -10.987 -7.480 988 HE ARG 35 HE ARG 35 -7.447 -13.234 -5.760 989 HH11 ARG 35 HH11 ARG 35 -8.975 -10.421 -7.152 990 HH12 ARG 35 HH12 ARG 35 -10.581 -11.037 -6.966 991 HH21 ARG 35 HH21 ARG 35 -9.563 -14.069 -5.531 992 HH22 ARG 35 HH22 ARG 35 -10.917 -13.117 -6.052 993 H LYS 36 HN LYS 36 -5.929 -12.524 -2.516 994 HA LYS 36 HA LYS 36 -7.656 -10.318 -2.319 995 HB2 LYS 36 HB2 LYS 36 -7.019 -12.338 -0.183 996 HB3 LYS 36 HB1 LYS 36 -8.449 -11.308 -0.256 997 HG2 LYS 36 HG2 LYS 36 -9.466 -12.594 -1.761 998 HG3 LYS 36 HG1 LYS 36 -7.950 -12.941 -2.621 999 HD2 LYS 36 HD2 LYS 36 -8.707 -14.973 -1.614 1000 HD3 LYS 36 HD1 LYS 36 -7.288 -14.379 -0.728 1001 HE2 LYS 36 HE2 LYS 36 -8.985 -13.233 0.818 1002 HE3 LYS 36 HE1 LYS 36 -10.178 -14.296 0.060 1003 HZ1 LYS 36 HZ1 LYS 36 -8.833 -16.214 0.716 1004 HZ2 LYS 36 HZ2 LYS 36 -9.356 -15.324 2.058 1005 HZ3 LYS 36 HZ3 LYS 36 -7.759 -15.189 1.526 1006 H VAL 37 HN VAL 37 -5.066 -11.371 -0.147 1007 HA VAL 37 HA VAL 37 -5.457 -9.402 1.750 1008 HB VAL 37 HB VAL 37 -3.222 -9.779 2.598 1009 HG11 VAL 37 HG11 VAL 37 -3.264 -12.329 2.662 1010 HG12 VAL 37 HG12 VAL 37 -4.696 -12.213 1.627 1011 HG13 VAL 37 HG13 VAL 37 -4.702 -11.481 3.237 1012 HG21 VAL 37 HG21 VAL 37 -2.724 -11.122 -0.043 1013 HG22 VAL 37 HG22 VAL 37 -1.689 -11.344 1.367 1014 HG23 VAL 37 HG23 VAL 37 -1.875 -9.742 0.652 1015 H ILE 38 HN ILE 38 -3.661 -9.228 -1.278 1016 HA ILE 38 HA ILE 38 -2.682 -6.617 -0.543 1017 HB ILE 38 HB ILE 38 -1.577 -8.490 -2.174 1018 HG12 ILE 38 HG12 ILE 38 -1.079 -5.541 -2.471 1019 HG13 ILE 38 HG11 ILE 38 -0.649 -6.408 -1.004 1020 HG21 ILE 38 HG21 ILE 38 -3.259 -8.001 -3.944 1021 HG22 ILE 38 HG22 ILE 38 -1.596 -7.684 -4.449 1022 HG23 ILE 38 HG23 ILE 38 -2.650 -6.344 -4.000 1023 HD11 ILE 38 HD11 ILE 38 0.513 -6.532 -3.729 1024 HD12 ILE 38 HD12 ILE 38 0.667 -7.923 -2.653 1025 HD13 ILE 38 HD13 ILE 38 1.315 -6.353 -2.178 1026 H VAL 39 HN VAL 39 -5.247 -7.920 -2.616 1027 HA VAL 39 HA VAL 39 -5.887 -5.364 -3.653 1028 HB VAL 39 HB VAL 39 -7.878 -6.175 -4.442 1029 HG11 VAL 39 HG11 VAL 39 -7.343 -8.371 -5.433 1030 HG12 VAL 39 HG12 VAL 39 -5.987 -8.508 -4.318 1031 HG13 VAL 39 HG13 VAL 39 -6.008 -7.219 -5.522 1032 HG21 VAL 39 HG21 VAL 39 -8.924 -7.040 -2.452 1033 HG22 VAL 39 HG22 VAL 39 -7.813 -8.407 -2.425 1034 HG23 VAL 39 HG23 VAL 39 -8.994 -8.256 -3.727 1035 H GLU 40 HN GLU 40 -7.220 -7.180 -0.913 1036 HA GLU 40 HA GLU 40 -8.854 -5.185 0.097 1037 HB2 GLU 40 HB2 GLU 40 -7.519 -7.562 1.343 1038 HB3 GLU 40 HB1 GLU 40 -8.672 -6.563 2.203 1039 HG2 GLU 40 HG2 GLU 40 -10.404 -7.105 0.706 1040 HG3 GLU 40 HG1 GLU 40 -9.305 -7.825 -0.433 1041 H LEU 41 HN LEU 41 -5.408 -5.636 0.437 1042 HA LEU 41 HA LEU 41 -5.255 -3.699 2.591 1043 HB2 LEU 41 HB2 LEU 41 -3.579 -5.710 1.713 1044 HB3 LEU 41 HB1 LEU 41 -2.751 -4.244 1.225 1045 HG LEU 41 HG LEU 41 -1.870 -4.629 3.321 1046 HD11 LEU 41 HD11 LEU 41 -4.247 -2.961 4.075 1047 HD12 LEU 41 HD12 LEU 41 -2.918 -2.361 3.088 1048 HD13 LEU 41 HD13 LEU 41 -2.614 -2.903 4.734 1049 HD21 LEU 41 HD21 LEU 41 -3.061 -5.456 5.222 1050 HD22 LEU 41 HD22 LEU 41 -3.399 -6.499 3.841 1051 HD23 LEU 41 HD23 LEU 41 -4.598 -5.318 4.371 1052 H MET 42 HN MET 42 -4.190 -3.820 -0.817 1053 HA MET 42 HA MET 42 -3.216 -1.161 -0.878 1054 HB2 MET 42 HB2 MET 42 -4.162 -2.911 -3.150 1055 HB3 MET 42 HB1 MET 42 -3.269 -1.398 -3.346 1056 HG2 MET 42 HG2 MET 42 -2.335 -3.974 -2.127 1057 HG3 MET 42 HG1 MET 42 -1.729 -3.154 -3.558 1058 HE1 MET 42 HE1 MET 42 0.135 -4.268 -1.300 1059 HE2 MET 42 HE2 MET 42 1.280 -2.935 -1.126 1060 HE3 MET 42 HE3 MET 42 0.724 -3.420 -2.732 1061 H ALA 43 HN ALA 43 -6.301 -2.583 -1.107 1062 HA ALA 43 HA ALA 43 -7.888 -0.670 -2.223 1063 HB1 ALA 43 HB1 ALA 43 -8.300 -2.326 0.251 1064 HB2 ALA 43 HB2 ALA 43 -8.809 -2.694 -1.397 1065 HB3 ALA 43 HB3 ALA 43 -9.573 -1.371 -0.512 1066 H TYR 44 HN TYR 44 -6.120 -0.573 0.798 1067 HA TYR 44 HA TYR 44 -7.230 2.088 1.418 1068 HB2 TYR 44 HB2 TYR 44 -7.323 0.579 3.300 1069 HB3 TYR 44 HB1 TYR 44 -5.651 0.111 3.048 1070 HD1 TYR 44 HD1 TYR 44 -7.889 2.531 4.580 1071 HD2 TYR 44 HD2 TYR 44 -3.822 1.670 3.715 1072 HE1 TYR 44 HE1 TYR 44 -7.202 4.157 6.277 1073 HE2 TYR 44 HE2 TYR 44 -3.113 3.309 5.405 1074 HH TYR 44 HH TYR 44 -4.139 5.395 6.502 1075 H GLU 45 HN GLU 45 -4.121 0.431 1.792 1076 HA GLU 45 HA GLU 45 -2.477 2.564 1.939 1077 HB2 GLU 45 HB2 GLU 45 -1.831 0.010 0.502 1078 HB3 GLU 45 HB1 GLU 45 -0.701 1.057 1.350 1079 HG2 GLU 45 HG2 GLU 45 -2.954 -0.447 2.658 1080 HG3 GLU 45 HG1 GLU 45 -1.298 -1.020 2.580 1081 H ASN 46 HN ASN 46 -3.897 1.264 -0.990 1082 HA ASN 46 HA ASN 46 -2.167 2.966 -2.623 1083 HB2 ASN 46 HB2 ASN 46 -3.658 0.430 -3.121 1084 HB3 ASN 46 HB1 ASN 46 -3.365 1.519 -4.470 1085 HD21 ASN 46 HD21 ASN 46 -1.867 0.138 -5.523 1086 HD22 ASN 46 HD22 ASN 46 -0.302 -0.135 -4.892 1087 H ALA 47 HN ALA 47 -5.323 2.718 -1.402 1088 HA ALA 47 HA ALA 47 -6.809 3.796 -3.533 1089 HB1 ALA 47 HB1 ALA 47 -7.874 2.716 -1.632 1090 HB2 ALA 47 HB2 ALA 47 -8.502 4.348 -1.873 1091 HB3 ALA 47 HB3 ALA 47 -7.345 4.029 -0.582 1092 H ASN 48 HN ASN 48 -8.062 5.891 -3.140 1093 HA ASN 48 HA ASN 48 -6.369 8.120 -3.271 1094 HB2 ASN 48 HB2 ASN 48 -9.285 7.642 -3.014 1095 HB3 ASN 48 HB1 ASN 48 -8.705 9.234 -2.537 1096 HD21 ASN 48 HD21 ASN 48 -10.361 8.289 -4.821 1097 HD22 ASN 48 HD22 ASN 48 -9.552 8.913 -6.220 1098 HA PRO 49 HA PRO 49 -5.189 8.830 0.900 1099 HB2 PRO 49 HB2 PRO 49 -5.306 11.611 0.840 1100 HB3 PRO 49 HB1 PRO 49 -3.923 10.628 0.363 1101 HG2 PRO 49 HG2 PRO 49 -6.019 11.907 -1.318 1102 HG3 PRO 49 HG1 PRO 49 -4.292 11.683 -1.651 1103 HD2 PRO 49 HD2 PRO 49 -6.171 10.147 -2.806 1104 HD3 PRO 49 HD1 PRO 49 -4.586 9.490 -2.341 1105 H GLU 50 HN GLU 50 -8.105 10.213 -0.378 1106 HA GLU 50 HA GLU 50 -9.277 10.760 2.199 1107 HB2 GLU 50 HB2 GLU 50 -11.138 11.585 0.959 1108 HB3 GLU 50 HB1 GLU 50 -9.695 12.084 0.089 1109 HG2 GLU 50 HG2 GLU 50 -10.734 9.523 -0.760 1110 HG3 GLU 50 HG1 GLU 50 -11.818 10.876 -1.037 1111 H CYS 51 HN CYS 51 -9.241 8.294 -0.242 1112 HA CYS 51 HA CYS 51 -11.707 7.087 0.586 1113 HB2 CYS 51 HB2 CYS 51 -9.652 6.262 -1.483 1114 HB3 CYS 51 HB1 CYS 51 -11.193 5.446 -1.204 1115 HG CYS 51 HG CYS 51 -12.752 7.174 -2.400 1116 H GLN 52 HN GLN 52 -8.268 6.401 0.803 1117 HA GLN 52 HA GLN 52 -8.604 3.984 2.274 1118 HB2 GLN 52 HB2 GLN 52 -6.295 4.125 2.776 1119 HB3 GLN 52 HB1 GLN 52 -6.464 4.734 1.137 1120 HG2 GLN 52 HG2 GLN 52 -6.429 7.037 2.076 1121 HG3 GLN 52 HG1 GLN 52 -6.064 6.335 3.650 1122 HE21 GLN 52 HE21 GLN 52 -4.553 4.187 2.350 1123 HE22 GLN 52 HE22 GLN 52 -3.055 4.865 1.883 1124 H SER 53 HN SER 53 -8.577 7.332 2.847 1125 HA SER 53 HA SER 53 -8.531 7.236 5.672 1126 HB2 SER 53 HB2 SER 53 -9.096 9.267 3.574 1127 HB3 SER 53 HB1 SER 53 -9.451 9.642 5.271 1128 HG SER 53 HG SER 53 -7.089 9.632 4.003 1129 H ALA 54 HN ALA 54 -10.965 6.890 3.244 1130 HA ALA 54 HA ALA 54 -13.146 6.940 5.104 1131 HB1 ALA 54 HB1 ALA 54 -13.489 7.290 2.715 1132 HB2 ALA 54 HB2 ALA 54 -14.407 5.892 3.282 1133 HB3 ALA 54 HB3 ALA 54 -12.899 5.661 2.390 1134 H ILE 55 HN ILE 55 -10.706 4.773 4.203 1135 HA ILE 55 HA ILE 55 -12.130 2.410 5.017 1136 HB ILE 55 HB ILE 55 -9.478 2.891 3.742 1137 HG12 ILE 55 HG12 ILE 55 -11.691 1.209 2.683 1138 HG13 ILE 55 HG11 ILE 55 -11.856 2.970 2.648 1139 HG21 ILE 55 HG21 ILE 55 -9.256 0.447 3.544 1140 HG22 ILE 55 HG22 ILE 55 -10.646 0.259 4.614 1141 HG23 ILE 55 HG23 ILE 55 -9.165 1.004 5.215 1142 HD11 ILE 55 HD11 ILE 55 -10.952 1.945 0.585 1143 HD12 ILE 55 HD12 ILE 55 -9.505 1.490 1.506 1144 HD13 ILE 55 HD13 ILE 55 -9.933 3.196 1.303 1145 H LYS 56 HN LYS 56 -9.448 4.362 6.329 1146 HA LYS 56 HA LYS 56 -8.070 2.563 7.786 1147 HB2 LYS 56 HB2 LYS 56 -8.494 4.721 9.618 1148 HB3 LYS 56 HB1 LYS 56 -7.043 4.252 8.759 1149 HG2 LYS 56 HG2 LYS 56 -7.225 6.330 7.932 1150 HG3 LYS 56 HG1 LYS 56 -8.348 5.559 6.808 1151 HD2 LYS 56 HD2 LYS 56 -10.177 6.363 7.848 1152 HD3 LYS 56 HD1 LYS 56 -9.392 6.508 9.419 1153 HE2 LYS 56 HE2 LYS 56 -9.305 8.409 7.067 1154 HE3 LYS 56 HE1 LYS 56 -9.707 8.727 8.754 1155 HZ1 LYS 56 HZ1 LYS 56 -7.531 9.602 8.182 1156 HZ2 LYS 56 HZ2 LYS 56 -6.988 8.056 7.770 1157 HZ3 LYS 56 HZ3 LYS 56 -7.405 8.404 9.371 1158 HA PRO 57 HA PRO 57 -11.337 2.468 11.461 1159 HB2 PRO 57 HB2 PRO 57 -13.909 2.501 10.579 1160 HB3 PRO 57 HB1 PRO 57 -13.067 3.956 11.135 1161 HG2 PRO 57 HG2 PRO 57 -13.344 2.908 8.329 1162 HG3 PRO 57 HG1 PRO 57 -13.740 4.535 8.935 1163 HD2 PRO 57 HD2 PRO 57 -11.436 4.124 7.731 1164 HD3 PRO 57 HD1 PRO 57 -11.436 5.064 9.232 1165 H LEU 58 HN LEU 58 -11.884 1.253 8.204 1166 HA LEU 58 HA LEU 58 -12.894 -1.311 9.185 1167 HB2 LEU 58 HB2 LEU 58 -12.350 -0.835 6.313 1168 HB3 LEU 58 HB1 LEU 58 -13.657 -1.754 7.048 1169 HG LEU 58 HG LEU 58 -13.458 1.260 6.873 1170 HD11 LEU 58 HD11 LEU 58 -13.819 0.258 4.709 1171 HD12 LEU 58 HD12 LEU 58 -15.313 1.015 5.267 1172 HD13 LEU 58 HD13 LEU 58 -15.126 -0.735 5.353 1173 HD21 LEU 58 HD21 LEU 58 -15.790 1.239 7.649 1174 HD22 LEU 58 HD22 LEU 58 -14.679 0.595 8.856 1175 HD23 LEU 58 HD23 LEU 58 -15.681 -0.504 7.904 1176 H LYS 59 HN LYS 59 -10.133 0.320 8.155 1177 HA LYS 59 HA LYS 59 -8.613 -1.660 6.939 1178 HB2 LYS 59 HB2 LYS 59 -7.852 0.642 7.084 1179 HB3 LYS 59 HB1 LYS 59 -7.709 0.505 8.827 1180 HG2 LYS 59 HG2 LYS 59 -5.550 0.114 8.371 1181 HG3 LYS 59 HG1 LYS 59 -6.132 -1.515 8.059 1182 HD2 LYS 59 HD2 LYS 59 -5.739 0.631 6.003 1183 HD3 LYS 59 HD1 LYS 59 -4.662 -0.748 6.257 1184 HE2 LYS 59 HE2 LYS 59 -7.556 -0.832 5.378 1185 HE3 LYS 59 HE1 LYS 59 -6.152 -1.144 4.367 1186 HZ1 LYS 59 HZ1 LYS 59 -5.648 -3.085 5.740 1187 HZ2 LYS 59 HZ2 LYS 59 -7.193 -3.205 5.057 1188 HZ3 LYS 59 HZ3 LYS 59 -7.017 -2.787 6.680 1189 H GLY 60 HN GLY 60 -8.376 -3.664 7.635 1190 HA2 GLY 60 HA3 GLY 60 -7.258 -5.215 9.064 1191 HA3 GLY 60 HA2 GLY 60 -7.470 -4.088 10.395 1192 H LYS 61 HN LYS 61 -10.302 -3.630 9.434 1193 HA LYS 61 HA LYS 61 -11.429 -5.981 10.796 1194 HB2 LYS 61 HB2 LYS 61 -13.058 -3.554 10.267 1195 HB3 LYS 61 HB1 LYS 61 -13.022 -4.588 11.683 1196 HG2 LYS 61 HG2 LYS 61 -10.865 -2.627 10.985 1197 HG3 LYS 61 HG1 LYS 61 -12.205 -2.273 12.064 1198 HD2 LYS 61 HD2 LYS 61 -10.223 -4.505 12.470 1199 HD3 LYS 61 HD1 LYS 61 -10.117 -2.921 13.241 1200 HE2 LYS 61 HE2 LYS 61 -12.301 -3.281 14.274 1201 HE3 LYS 61 HE1 LYS 61 -12.398 -4.866 13.517 1202 HZ1 LYS 61 HZ1 LYS 61 -11.670 -5.024 15.812 1203 HZ2 LYS 61 HZ2 LYS 61 -10.347 -4.022 15.488 1204 HZ3 LYS 61 HZ3 LYS 61 -10.448 -5.547 14.764 1205 H VAL 62 HN VAL 62 -12.098 -7.434 9.309 1206 HA VAL 62 HA VAL 62 -14.020 -6.404 7.337 1207 HB VAL 62 HB VAL 62 -12.109 -7.369 6.174 1208 HG11 VAL 62 HG11 VAL 62 -12.677 -9.912 7.686 1209 HG12 VAL 62 HG12 VAL 62 -11.261 -8.877 7.873 1210 HG13 VAL 62 HG13 VAL 62 -11.530 -9.741 6.356 1211 HG21 VAL 62 HG21 VAL 62 -14.237 -7.649 5.107 1212 HG22 VAL 62 HG22 VAL 62 -14.564 -9.105 6.046 1213 HG23 VAL 62 HG23 VAL 62 -13.275 -9.104 4.843 1214 HA PRO 63 HA PRO 63 -17.161 -8.857 9.495 1215 HB2 PRO 63 HB2 PRO 63 -18.005 -9.380 6.689 1216 HB3 PRO 63 HB1 PRO 63 -18.976 -8.899 8.067 1217 HG2 PRO 63 HG2 PRO 63 -18.333 -7.127 6.208 1218 HG3 PRO 63 HG1 PRO 63 -18.332 -6.674 7.920 1219 HD2 PRO 63 HD2 PRO 63 -16.035 -7.218 6.105 1220 HD3 PRO 63 HD1 PRO 63 -16.163 -6.075 7.456 1221 H ALA 64 HN ALA 64 -17.276 -10.977 10.021 1222 HA ALA 64 HA ALA 64 -15.250 -12.714 9.142 1223 HB1 ALA 64 HB1 ALA 64 -17.762 -13.367 10.674 1224 HB2 ALA 64 HB2 ALA 64 -16.229 -12.848 11.372 1225 HB3 ALA 64 HB3 ALA 64 -16.337 -14.397 10.537 1226 H GLY 65 HN GLY 65 -15.211 -13.337 7.066 1227 HA2 GLY 65 HA3 GLY 65 -15.886 -15.137 5.604 1228 HA3 GLY 65 HA2 GLY 65 -17.547 -14.846 6.091 1229 H SER 66 HN SER 66 -16.686 -11.828 5.807 1230 HA SER 66 HA SER 66 -17.580 -11.696 3.030 1231 HB2 SER 66 HB2 SER 66 -17.242 -9.483 5.066 1232 HB3 SER 66 HB1 SER 66 -18.037 -9.347 3.498 1233 HG SER 66 HG SER 66 -19.133 -11.389 4.802 1234 H ASP 67 HN ASP 67 -16.658 -9.858 1.725 1235 HA ASP 67 HA ASP 67 -13.753 -10.043 1.615 1236 HB2 ASP 67 HB2 ASP 67 -15.700 -9.856 -0.297 1237 HB3 ASP 67 HB1 ASP 67 -15.219 -8.176 -0.154 1238 H VAL 68 HN VAL 68 -12.328 -8.233 2.035 1239 HA VAL 68 HA VAL 68 -13.612 -6.230 3.682 1240 HB VAL 68 HB VAL 68 -11.640 -5.654 4.528 1241 HG11 VAL 68 HG11 VAL 68 -10.568 -8.008 3.011 1242 HG12 VAL 68 HG12 VAL 68 -11.473 -8.087 4.520 1243 HG13 VAL 68 HG13 VAL 68 -9.897 -7.297 4.479 1244 HG21 VAL 68 HG21 VAL 68 -10.462 -5.696 1.760 1245 HG22 VAL 68 HG22 VAL 68 -9.599 -5.209 3.221 1246 HG23 VAL 68 HG23 VAL 68 -11.006 -4.290 2.678 1247 H ILE 69 HN ILE 69 -12.526 -6.559 0.444 1248 HA ILE 69 HA ILE 69 -12.331 -3.893 -0.302 1249 HB ILE 69 HB ILE 69 -13.173 -6.315 -1.864 1250 HG12 ILE 69 HG12 ILE 69 -10.899 -6.493 -1.279 1251 HG13 ILE 69 HG11 ILE 69 -10.885 -5.868 -2.915 1252 HG21 ILE 69 HG21 ILE 69 -14.203 -4.465 -2.977 1253 HG22 ILE 69 HG22 ILE 69 -12.776 -4.914 -3.915 1254 HG23 ILE 69 HG23 ILE 69 -12.734 -3.497 -2.865 1255 HD11 ILE 69 HD11 ILE 69 -10.550 -3.602 -2.021 1256 HD12 ILE 69 HD12 ILE 69 -9.248 -4.727 -1.619 1257 HD13 ILE 69 HD13 ILE 69 -10.460 -4.299 -0.403 1258 H SER 70 HN SER 70 -15.069 -6.045 -0.335 1259 HA SER 70 HA SER 70 -17.074 -4.487 -1.307 1260 HB2 SER 70 HB2 SER 70 -17.479 -6.775 -0.668 1261 HB3 SER 70 HB1 SER 70 -17.136 -6.426 1.022 1262 HG SER 70 HG SER 70 -19.382 -5.715 -0.532 1263 H GLU 71 HN GLU 71 -15.599 -4.273 1.879 1264 HA GLU 71 HA GLU 71 -17.477 -2.304 2.856 1265 HB2 GLU 71 HB2 GLU 71 -14.910 -3.227 4.116 1266 HB3 GLU 71 HB1 GLU 71 -16.328 -2.552 4.915 1267 HG2 GLU 71 HG2 GLU 71 -16.772 -4.991 3.351 1268 HG3 GLU 71 HG1 GLU 71 -15.778 -5.166 4.791 1269 H TYR 72 HN TYR 72 -14.297 -2.496 1.562 1270 HA TYR 72 HA TYR 72 -13.474 0.093 2.424 1271 HB2 TYR 72 HB2 TYR 72 -12.349 -1.977 0.551 1272 HB3 TYR 72 HB1 TYR 72 -11.604 -0.394 0.723 1273 HD1 TYR 72 HD1 TYR 72 -13.161 -1.768 3.679 1274 HD2 TYR 72 HD2 TYR 72 -9.553 -1.593 1.453 1275 HE1 TYR 72 HE1 TYR 72 -11.920 -2.572 5.629 1276 HE2 TYR 72 HE2 TYR 72 -8.301 -2.414 3.400 1277 HH TYR 72 HH TYR 72 -9.897 -3.668 6.191 1278 H VAL 73 HN VAL 73 -14.809 -1.352 -0.464 1279 HA VAL 73 HA VAL 73 -14.823 1.038 -1.999 1280 HB VAL 73 HB VAL 73 -16.059 0.007 -3.628 1281 HG11 VAL 73 HG11 VAL 73 -14.035 -1.216 -3.436 1282 HG12 VAL 73 HG12 VAL 73 -15.333 -2.321 -3.877 1283 HG13 VAL 73 HG13 VAL 73 -14.738 -2.275 -2.218 1284 HG21 VAL 73 HG21 VAL 73 -17.776 -1.523 -3.445 1285 HG22 VAL 73 HG22 VAL 73 -17.952 -0.532 -1.989 1286 HG23 VAL 73 HG23 VAL 73 -17.202 -2.126 -1.884 1287 H LYS 74 HN LYS 74 -16.881 -0.500 0.326 1288 HA LYS 74 HA LYS 74 -19.166 1.162 0.097 1289 HB2 LYS 74 HB2 LYS 74 -18.423 -1.071 1.563 1290 HB3 LYS 74 HB1 LYS 74 -18.542 0.195 2.776 1291 HG2 LYS 74 HG2 LYS 74 -20.679 -0.529 2.855 1292 HG3 LYS 74 HG1 LYS 74 -20.852 0.632 1.539 1293 HD2 LYS 74 HD2 LYS 74 -20.265 -2.296 1.127 1294 HD3 LYS 74 HD1 LYS 74 -21.891 -1.614 1.118 1295 HE2 LYS 74 HE2 LYS 74 -19.674 -0.707 -0.706 1296 HE3 LYS 74 HE1 LYS 74 -20.865 -1.930 -1.142 1297 HZ1 LYS 74 HZ1 LYS 74 -21.436 0.307 -1.944 1298 HZ2 LYS 74 HZ2 LYS 74 -21.539 0.848 -0.344 1299 HZ3 LYS 74 HZ3 LYS 74 -22.609 -0.330 -0.908 1300 H ALA 75 HN ALA 75 -16.119 1.344 1.741 1301 HA ALA 75 HA ALA 75 -16.615 3.532 3.445 1302 HB1 ALA 75 HB1 ALA 75 -14.667 2.108 3.681 1303 HB2 ALA 75 HB2 ALA 75 -14.162 3.782 3.453 1304 HB3 ALA 75 HB3 ALA 75 -14.062 2.637 2.113 1305 H CYS 76 HN CYS 76 -15.235 3.355 0.190 1306 HA CYS 76 HA CYS 76 -15.444 6.243 -0.103 1307 HB2 CYS 76 HB2 CYS 76 -13.459 5.263 -0.947 1308 HB3 CYS 76 HB1 CYS 76 -14.345 4.070 -1.880 1309 HG CYS 76 HG CYS 76 -15.521 6.438 -3.340 1310 H ASP 77 HN ASP 77 -17.642 3.937 -0.192 1311 HA ASP 77 HA ASP 77 -19.033 4.446 -2.591 1312 HB2 ASP 77 HB2 ASP 77 -19.589 2.500 -1.314 1313 HB3 ASP 77 HB1 ASP 77 -19.980 3.451 0.114 1314 H GLY 78 HN GLY 78 -18.598 6.233 0.299 1315 HA2 GLY 78 HA3 GLY 78 -20.659 8.166 -0.463 1316 HA3 GLY 78 HA2 GLY 78 -19.704 8.198 1.013 1317 H ILE 79 HN ILE 79 -17.423 7.543 -1.154 1318 HA ILE 79 HA ILE 79 -16.743 10.351 -1.475 1319 HB ILE 79 HB ILE 79 -15.091 7.870 -1.784 1320 HG12 ILE 79 HG12 ILE 79 -14.961 10.063 0.292 1321 HG13 ILE 79 HG11 ILE 79 -15.752 8.511 0.537 1322 HG21 ILE 79 HG21 ILE 79 -14.199 10.742 -1.959 1323 HG22 ILE 79 HG22 ILE 79 -14.350 9.630 -3.319 1324 HG23 ILE 79 HG23 ILE 79 -13.163 9.315 -2.053 1325 HD11 ILE 79 HD11 ILE 79 -13.702 7.350 0.408 1326 HD12 ILE 79 HD12 ILE 79 -13.456 8.727 1.489 1327 HD13 ILE 79 HD13 ILE 79 -12.854 8.787 -0.166 1328 H GLY 80 HN GLY 80 -16.901 11.324 -3.357 1329 HA2 GLY 80 HA3 GLY 80 -15.869 10.591 -5.733 1330 HA3 GLY 80 HA2 GLY 80 -17.464 9.862 -5.761 1331 H GLY 81 HN GLY 81 -18.613 12.031 -4.126 1332 HA2 GLY 81 HA3 GLY 81 -17.973 14.519 -5.410 1333 HA3 GLY 81 HA2 GLY 81 -19.528 13.868 -5.913 1334 H ALA 82 HN ALA 82 -18.546 16.222 -4.261 1335 HA ALA 82 HA ALA 82 -19.336 17.506 -2.582 1336 HB1 ALA 82 HB1 ALA 82 -21.522 16.871 -3.471 1337 HB2 ALA 82 HB2 ALA 82 -21.560 17.117 -1.724 1338 HB3 ALA 82 HB3 ALA 82 -21.550 15.482 -2.387 1339 H MET 83 HN MET 83 -20.325 14.332 -1.321 1340 HA MET 83 HA MET 83 -19.483 14.858 1.299 1341 HB2 MET 83 HB2 MET 83 -19.871 12.197 -0.080 1342 HB3 MET 83 HB1 MET 83 -19.708 12.416 1.658 1343 HG2 MET 83 HG2 MET 83 -21.732 13.848 1.611 1344 HG3 MET 83 HG1 MET 83 -21.914 13.462 -0.097 1345 HE1 MET 83 HE1 MET 83 -21.153 10.456 -0.342 1346 HE2 MET 83 HE2 MET 83 -22.623 11.133 -1.042 1347 HE3 MET 83 HE3 MET 83 -22.704 9.663 -0.072 1348 H HIS 84 HN HIS 84 -17.825 13.386 -1.417 1349 HA HIS 84 HA HIS 84 -15.461 12.499 -0.299 1350 HB2 HIS 84 HB2 HIS 84 -15.740 12.194 -2.628 1351 HB3 HIS 84 HB1 HIS 84 -16.085 13.893 -2.902 1352 HD1 HIS 84 HD1 HIS 84 -14.292 14.401 -4.586 1353 HD2 HIS 84 HD2 HIS 84 -12.794 12.567 -1.179 1354 HE1 HIS 84 HE1 HIS 84 -11.800 14.485 -4.816 1355 HE2 HIS 84 HE2 HIS 84 -10.953 13.082 -2.915 1356 H LYS 85 HN LYS 85 -16.380 15.821 -1.069 1357 HA LYS 85 HA LYS 85 -13.757 16.747 -0.300 1358 HB2 LYS 85 HB2 LYS 85 -16.118 18.200 -1.463 1359 HB3 LYS 85 HB1 LYS 85 -14.506 18.890 -1.209 1360 HG2 LYS 85 HG2 LYS 85 -13.524 17.178 -2.601 1361 HG3 LYS 85 HG1 LYS 85 -15.100 16.431 -2.828 1362 HD2 LYS 85 HD2 LYS 85 -15.853 18.426 -4.020 1363 HD3 LYS 85 HD1 LYS 85 -14.242 19.138 -3.813 1364 HE2 LYS 85 HE2 LYS 85 -13.221 17.345 -5.009 1365 HE3 LYS 85 HE1 LYS 85 -14.742 16.449 -5.067 1366 HZ1 LYS 85 HZ1 LYS 85 -14.267 17.525 -7.184 1367 HZ2 LYS 85 HZ2 LYS 85 -14.177 19.039 -6.439 1368 HZ3 LYS 85 HZ3 LYS 85 -15.649 18.210 -6.490 1369 H ALA 86 HN ALA 86 -16.917 16.542 1.047 1370 HA ALA 86 HA ALA 86 -16.471 18.289 3.260 1371 HB1 ALA 86 HB1 ALA 86 -18.374 17.186 4.274 1372 HB2 ALA 86 HB2 ALA 86 -18.282 15.884 3.088 1373 HB3 ALA 86 HB3 ALA 86 -18.720 17.515 2.576 1374 H MET 87 HN MET 87 -16.104 14.855 2.672 1375 HA MET 87 HA MET 87 -15.078 14.264 5.276 1376 HB2 MET 87 HB2 MET 87 -15.174 12.642 2.727 1377 HB3 MET 87 HB1 MET 87 -14.682 12.012 4.301 1378 HG2 MET 87 HG2 MET 87 -16.881 12.517 5.201 1379 HG3 MET 87 HG1 MET 87 -17.366 13.189 3.655 1380 HE1 MET 87 HE1 MET 87 -19.039 10.928 5.172 1381 HE2 MET 87 HE2 MET 87 -19.448 9.873 3.819 1382 HE3 MET 87 HE3 MET 87 -19.508 11.625 3.621 1383 H LEU 88 HN LEU 88 -13.751 15.548 2.464 1384 HA LEU 88 HA LEU 88 -11.217 14.429 2.337 1385 HB2 LEU 88 HB2 LEU 88 -12.537 16.299 0.955 1386 HB3 LEU 88 HB1 LEU 88 -11.466 17.335 1.869 1387 HG LEU 88 HG LEU 88 -9.724 16.857 0.543 1388 HD11 LEU 88 HD11 LEU 88 -10.565 13.955 0.540 1389 HD12 LEU 88 HD12 LEU 88 -9.371 14.681 1.616 1390 HD13 LEU 88 HD13 LEU 88 -9.058 14.593 -0.114 1391 HD21 LEU 88 HD21 LEU 88 -10.306 15.969 -1.674 1392 HD22 LEU 88 HD22 LEU 88 -11.459 17.177 -1.106 1393 HD23 LEU 88 HD23 LEU 88 -11.867 15.463 -1.029 1394 H MET 89 HN MET 89 -12.466 17.014 4.393 1395 HA MET 89 HA MET 89 -9.847 17.586 5.479 1396 HB2 MET 89 HB2 MET 89 -11.604 19.336 5.139 1397 HB3 MET 89 HB1 MET 89 -12.541 18.578 6.418 1398 HG2 MET 89 HG2 MET 89 -10.725 19.014 7.998 1399 HG3 MET 89 HG1 MET 89 -9.804 19.793 6.712 1400 HE1 MET 89 HE1 MET 89 -12.260 21.311 5.158 1401 HE2 MET 89 HE2 MET 89 -10.641 21.954 5.427 1402 HE3 MET 89 HE3 MET 89 -12.054 22.901 5.892 1403 H ALA 90 HN ALA 90 -12.449 15.469 6.151 1404 HA ALA 90 HA ALA 90 -11.812 15.216 8.984 1405 HB1 ALA 90 HB1 ALA 90 -14.169 15.238 8.186 1406 HB2 ALA 90 HB2 ALA 90 -13.758 13.785 9.097 1407 HB3 ALA 90 HB3 ALA 90 -13.858 13.721 7.334 1408 H GLN 91 HN GLN 91 -11.849 13.191 6.098 1409 HA GLN 91 HA GLN 91 -10.800 10.961 7.619 1410 HB2 GLN 91 HB2 GLN 91 -11.596 11.194 4.723 1411 HB3 GLN 91 HB1 GLN 91 -11.158 9.703 5.543 1412 HG2 GLN 91 HG2 GLN 91 -13.033 9.929 7.028 1413 HG3 GLN 91 HG1 GLN 91 -13.459 11.454 6.264 1414 HE21 GLN 91 HE21 GLN 91 -12.856 10.679 3.624 1415 HE22 GLN 91 HE22 GLN 91 -14.011 9.517 3.147 1416 H LEU 92 HN LEU 92 -9.873 12.675 4.614 1417 HA LEU 92 HA LEU 92 -7.364 11.625 4.222 1418 HB2 LEU 92 HB2 LEU 92 -8.758 13.551 3.019 1419 HB3 LEU 92 HB1 LEU 92 -7.711 14.579 3.968 1420 HG LEU 92 HG LEU 92 -7.071 12.850 1.632 1421 HD11 LEU 92 HD11 LEU 92 -5.728 14.800 1.018 1422 HD12 LEU 92 HD12 LEU 92 -6.190 15.580 2.531 1423 HD13 LEU 92 HD13 LEU 92 -7.415 15.213 1.318 1424 HD21 LEU 92 HD21 LEU 92 -5.538 11.943 3.257 1425 HD22 LEU 92 HD22 LEU 92 -5.083 13.561 3.786 1426 HD23 LEU 92 HD23 LEU 92 -4.651 13.010 2.168 1427 H GLU 93 HN GLU 93 -8.570 14.000 6.415 1428 HA GLU 93 HA GLU 93 -7.504 15.585 7.739 1429 HB2 GLU 93 HB2 GLU 93 -6.917 14.328 9.872 1430 HB3 GLU 93 HB1 GLU 93 -8.549 14.135 9.226 1431 HG2 GLU 93 HG2 GLU 93 -8.076 11.972 8.429 1432 HG3 GLU 93 HG1 GLU 93 -6.345 12.166 8.657 Start of MODEL 2 1 H2 PRO 1 HT1 PRO 1 -5.258 -3.900 13.127 2 H3 PRO 1 HT2 PRO 1 -5.570 -2.410 13.725 3 HA PRO 1 HA PRO 1 -6.266 -2.168 11.679 4 HB2 PRO 1 HB2 PRO 1 -4.106 -1.146 10.461 5 HB3 PRO 1 HB1 PRO 1 -4.841 -0.347 11.851 6 HG2 PRO 1 HG2 PRO 1 -2.302 -1.789 11.680 7 HG3 PRO 1 HG1 PRO 1 -2.874 -0.671 12.928 8 HD2 PRO 1 HD2 PRO 1 -2.908 -3.594 12.894 9 HD3 PRO 1 HD1 PRO 1 -3.199 -2.488 14.252 10 H SER 2 HN SER 2 -4.364 -2.218 9.336 11 HA SER 2 HA SER 2 -4.294 -4.946 8.582 12 HB2 SER 2 HB2 SER 2 -2.402 -2.759 7.667 13 HB3 SER 2 HB1 SER 2 -2.812 -4.239 6.810 14 HG SER 2 HG SER 2 -3.881 -2.039 6.352 15 H PHE 3 HN PHE 3 -2.047 -6.037 8.207 16 HA PHE 3 HA PHE 3 -0.406 -5.827 10.536 17 HB2 PHE 3 HB2 PHE 3 1.196 -6.941 8.571 18 HB3 PHE 3 HB1 PHE 3 0.177 -7.845 9.689 19 HD1 PHE 3 HD1 PHE 3 0.805 -6.858 6.301 20 HD2 PHE 3 HD2 PHE 3 -2.105 -8.555 8.912 21 HE1 PHE 3 HE1 PHE 3 -0.390 -7.810 4.382 22 HE2 PHE 3 HE2 PHE 3 -3.313 -9.484 6.983 23 HZ PHE 3 HZ PHE 3 -2.453 -9.110 4.708 24 H ASN 4 HN ASN 4 -0.204 -4.800 7.205 25 HA ASN 4 HA ASN 4 2.455 -3.766 7.546 26 HB2 ASN 4 HB2 ASN 4 2.325 -3.398 5.141 27 HB3 ASN 4 HB1 ASN 4 1.824 -5.034 5.558 28 HD21 ASN 4 HD21 ASN 4 0.622 -1.814 4.762 29 HD22 ASN 4 HD22 ASN 4 -0.897 -2.351 4.119 30 H THR 5 HN THR 5 -0.350 -2.359 8.380 31 HA THR 5 HA THR 5 -0.433 0.015 6.839 32 HB THR 5 HB THR 5 -1.451 0.767 9.227 33 HG1 THR 5 HG1 THR 5 -1.264 -1.059 10.379 34 HG21 THR 5 HG21 THR 5 -3.632 0.001 8.328 35 HG22 THR 5 HG22 THR 5 -2.750 -0.854 7.063 36 HG23 THR 5 HG23 THR 5 -2.655 0.904 7.172 37 H VAL 6 HN VAL 6 1.916 -1.019 8.999 38 HA VAL 6 HA VAL 6 2.655 1.533 10.051 39 HB VAL 6 HB VAL 6 4.459 0.465 11.067 40 HG11 VAL 6 HG11 VAL 6 2.385 -0.435 11.921 41 HG12 VAL 6 HG12 VAL 6 3.647 -1.666 11.956 42 HG13 VAL 6 HG13 VAL 6 2.411 -1.706 10.698 43 HG21 VAL 6 HG21 VAL 6 5.406 -0.422 8.924 44 HG22 VAL 6 HG22 VAL 6 4.344 -1.825 9.115 45 HG23 VAL 6 HG23 VAL 6 5.596 -1.491 10.322 46 H ARG 7 HN ARG 7 4.007 3.034 9.090 47 HA ARG 7 HA ARG 7 5.698 2.136 6.955 48 HB2 ARG 7 HB2 ARG 7 4.731 3.720 5.289 49 HB3 ARG 7 HB1 ARG 7 3.816 2.286 5.696 50 HG2 ARG 7 HG2 ARG 7 2.936 4.318 7.397 51 HG3 ARG 7 HG1 ARG 7 2.978 4.963 5.755 52 HD2 ARG 7 HD2 ARG 7 1.581 3.218 4.944 53 HD3 ARG 7 HD1 ARG 7 1.745 2.306 6.441 54 HE ARG 7 HE ARG 7 0.663 4.756 7.151 55 HH11 ARG 7 HH11 ARG 7 -0.279 2.108 5.075 56 HH12 ARG 7 HH12 ARG 7 -1.970 2.326 5.354 57 HH21 ARG 7 HH21 ARG 7 -1.561 5.070 7.512 58 HH22 ARG 7 HH22 ARG 7 -2.711 4.035 6.732 59 H GLN 8 HN GLN 8 6.995 3.689 5.996 60 HA GLN 8 HA GLN 8 8.635 5.020 7.660 61 HB2 GLN 8 HB2 GLN 8 8.398 4.605 4.909 62 HB3 GLN 8 HB1 GLN 8 8.560 6.349 5.080 63 HG2 GLN 8 HG2 GLN 8 10.584 5.978 6.454 64 HG3 GLN 8 HG1 GLN 8 10.442 4.251 6.131 65 HE21 GLN 8 HE21 GLN 8 12.631 5.950 5.468 66 HE22 GLN 8 HE22 GLN 8 12.789 5.917 3.733 67 H GLY 9 HN GLY 9 8.168 6.557 9.051 68 HA2 GLY 9 HA3 GLY 9 6.401 8.761 8.364 69 HA3 GLY 9 HA2 GLY 9 7.234 8.515 9.891 70 H SER 10 HN SER 10 7.972 10.659 9.979 71 HA SER 10 HA SER 10 9.195 12.118 7.977 72 HB2 SER 10 HB2 SER 10 9.861 12.173 10.930 73 HB3 SER 10 HB1 SER 10 10.173 13.464 9.769 74 HG SER 10 HG SER 10 7.649 12.951 9.489 75 H LYS 11 HN LYS 11 10.635 11.128 6.705 76 HA LYS 11 HA LYS 11 12.270 9.708 6.012 77 HB2 LYS 11 HB2 LYS 11 14.468 10.580 6.365 78 HB3 LYS 11 HB1 LYS 11 13.366 11.916 6.162 79 HG2 LYS 11 HG2 LYS 11 13.423 12.390 8.481 80 HG3 LYS 11 HG1 LYS 11 14.334 10.931 8.832 81 HD2 LYS 11 HD2 LYS 11 16.195 11.826 7.465 82 HD3 LYS 11 HD1 LYS 11 15.278 13.318 7.245 83 HE2 LYS 11 HE2 LYS 11 16.893 13.612 9.016 84 HE3 LYS 11 HE1 LYS 11 15.264 13.637 9.689 85 HZ1 LYS 11 HZ1 LYS 11 17.109 11.309 9.728 86 HZ2 LYS 11 HZ2 LYS 11 15.556 11.345 10.389 87 HZ3 LYS 11 HZ3 LYS 11 16.772 12.318 11.041 88 H GLU 12 HN GLU 12 10.934 8.408 7.997 89 HA GLU 12 HA GLU 12 12.421 7.344 10.099 90 HB2 GLU 12 HB2 GLU 12 9.988 7.037 9.737 91 HB3 GLU 12 HB1 GLU 12 10.326 5.991 8.371 92 HG2 GLU 12 HG2 GLU 12 11.381 4.373 9.869 93 HG3 GLU 12 HG1 GLU 12 11.050 5.437 11.240 94 HA PRO 13 HA PRO 13 15.685 5.070 8.071 95 HB2 PRO 13 HB2 PRO 13 15.250 3.017 10.146 96 HB3 PRO 13 HB1 PRO 13 16.723 3.893 9.741 97 HG2 PRO 13 HG2 PRO 13 15.295 4.401 11.975 98 HG3 PRO 13 HG1 PRO 13 16.216 5.641 11.119 99 HD2 PRO 13 HD2 PRO 13 13.291 5.208 11.236 100 HD3 PRO 13 HD1 PRO 13 14.202 6.705 10.980 101 H TYR 14 HN TYR 14 15.401 3.803 6.344 102 HA TYR 14 HA TYR 14 12.775 2.847 5.970 103 HB2 TYR 14 HB2 TYR 14 13.979 3.960 4.176 104 HB3 TYR 14 HB1 TYR 14 15.133 2.632 4.116 105 HD1 TYR 14 HD1 TYR 14 14.171 0.308 3.693 106 HD2 TYR 14 HD2 TYR 14 12.080 3.875 2.866 107 HE1 TYR 14 HE1 TYR 14 12.740 -0.927 2.145 108 HE2 TYR 14 HE2 TYR 14 10.628 2.687 1.292 109 HH TYR 14 HH TYR 14 10.358 0.741 0.178 110 HA PRO 15 HA PRO 15 14.870 -1.542 5.482 111 HB2 PRO 15 HB2 PRO 15 17.047 -1.285 7.452 112 HB3 PRO 15 HB1 PRO 15 17.040 -2.099 5.892 113 HG2 PRO 15 HG2 PRO 15 18.328 0.218 6.288 114 HG3 PRO 15 HG1 PRO 15 17.593 -0.200 4.745 115 HD2 PRO 15 HD2 PRO 15 16.676 1.714 6.821 116 HD3 PRO 15 HD1 PRO 15 16.460 1.760 5.064 117 H ASP 16 HN ASP 16 14.607 0.507 8.115 118 HA ASP 16 HA ASP 16 13.859 -1.527 10.034 119 HB2 ASP 16 HB2 ASP 16 14.481 1.386 10.173 120 HB3 ASP 16 HB1 ASP 16 13.436 0.712 11.415 121 H PHE 17 HN PHE 17 12.456 1.234 8.324 122 HA PHE 17 HA PHE 17 9.867 1.146 9.342 123 HB2 PHE 17 HB2 PHE 17 9.763 2.898 7.900 124 HB3 PHE 17 HB1 PHE 17 11.206 2.343 7.065 125 HD1 PHE 17 HD1 PHE 17 11.072 1.466 4.914 126 HD2 PHE 17 HD2 PHE 17 7.535 1.870 7.229 127 HE1 PHE 17 HE1 PHE 17 9.723 0.882 2.949 128 HE2 PHE 17 HE2 PHE 17 6.175 1.300 5.259 129 HZ PHE 17 HZ PHE 17 7.269 0.807 3.117 130 H VAL 18 HN VAL 18 11.360 -0.612 6.688 131 HA VAL 18 HA VAL 18 8.979 -2.081 6.117 132 HB VAL 18 HB VAL 18 10.294 -1.749 4.215 133 HG11 VAL 18 HG11 VAL 18 12.666 -2.364 4.067 134 HG12 VAL 18 HG12 VAL 18 12.641 -2.832 5.779 135 HG13 VAL 18 HG13 VAL 18 12.386 -1.146 5.322 136 HG21 VAL 18 HG21 VAL 18 10.736 -4.521 5.289 137 HG22 VAL 18 HG22 VAL 18 11.110 -4.042 3.628 138 HG23 VAL 18 HG23 VAL 18 9.447 -3.963 4.213 139 H ALA 19 HN ALA 19 11.965 -2.728 7.923 140 HA ALA 19 HA ALA 19 11.603 -5.476 8.298 141 HB1 ALA 19 HB1 ALA 19 12.772 -3.547 10.308 142 HB2 ALA 19 HB2 ALA 19 13.647 -4.251 8.949 143 HB3 ALA 19 HB3 ALA 19 13.038 -5.290 10.237 144 H ARG 20 HN ARG 20 9.993 -2.778 9.918 145 HA ARG 20 HA ARG 20 8.714 -4.624 11.754 146 HB2 ARG 20 HB2 ARG 20 7.441 -2.678 12.568 147 HB3 ARG 20 HB1 ARG 20 9.172 -2.406 12.632 148 HG2 ARG 20 HG2 ARG 20 9.121 -0.811 10.974 149 HG3 ARG 20 HG1 ARG 20 7.618 -1.427 10.281 150 HD2 ARG 20 HD2 ARG 20 6.341 -0.571 12.104 151 HD3 ARG 20 HD1 ARG 20 7.790 -0.164 13.002 152 HE ARG 20 HE ARG 20 8.082 1.368 10.835 153 HH11 ARG 20 HH11 ARG 20 5.339 0.820 12.933 154 HH12 ARG 20 HH12 ARG 20 4.663 2.396 12.683 155 HH21 ARG 20 HH21 ARG 20 7.223 3.474 10.531 156 HH22 ARG 20 HH22 ARG 20 5.730 3.905 11.314 157 H LEU 21 HN LEU 21 8.219 -3.035 8.751 158 HA LEU 21 HA LEU 21 5.531 -3.511 8.285 159 HB2 LEU 21 HB2 LEU 21 7.389 -2.298 6.900 160 HB3 LEU 21 HB1 LEU 21 7.635 -3.864 6.167 161 HG LEU 21 HG LEU 21 5.585 -3.808 5.056 162 HD11 LEU 21 HD11 LEU 21 4.793 -1.595 6.933 163 HD12 LEU 21 HD12 LEU 21 4.093 -3.210 6.827 164 HD13 LEU 21 HD13 LEU 21 3.857 -2.059 5.509 165 HD21 LEU 21 HD21 LEU 21 5.524 -1.580 3.979 166 HD22 LEU 21 HD22 LEU 21 7.127 -2.313 4.043 167 HD23 LEU 21 HD23 LEU 21 6.698 -1.029 5.173 168 H GLN 22 HN GLN 22 8.371 -5.536 7.706 169 HA GLN 22 HA GLN 22 6.999 -7.833 6.831 170 HB2 GLN 22 HB2 GLN 22 9.652 -7.912 8.204 171 HB3 GLN 22 HB1 GLN 22 9.046 -8.906 6.878 172 HG2 GLN 22 HG2 GLN 22 9.179 -6.917 5.450 173 HG3 GLN 22 HG1 GLN 22 9.887 -6.035 6.785 174 HE21 GLN 22 HE21 GLN 22 10.968 -6.486 4.274 175 HE22 GLN 22 HE22 GLN 22 12.431 -7.386 4.447 176 H ASP 23 HN ASP 23 8.423 -6.880 9.877 177 HA ASP 23 HA ASP 23 8.082 -9.181 11.343 178 HB2 ASP 23 HB2 ASP 23 9.057 -6.911 12.043 179 HB3 ASP 23 HB1 ASP 23 7.401 -6.518 12.505 180 H VAL 24 HN VAL 24 5.671 -6.592 10.949 181 HA VAL 24 HA VAL 24 3.800 -8.068 12.570 182 HB VAL 24 HB VAL 24 3.833 -5.633 12.762 183 HG11 VAL 24 HG11 VAL 24 4.555 -5.099 10.518 184 HG12 VAL 24 HG12 VAL 24 3.080 -4.218 10.915 185 HG13 VAL 24 HG13 VAL 24 3.007 -5.638 9.872 186 HG21 VAL 24 HG21 VAL 24 1.715 -6.656 13.259 187 HG22 VAL 24 HG22 VAL 24 1.293 -6.722 11.550 188 HG23 VAL 24 HG23 VAL 24 1.398 -5.161 12.370 189 H ALA 25 HN ALA 25 4.574 -7.649 9.242 190 HA ALA 25 HA ALA 25 2.109 -8.665 8.184 191 HB1 ALA 25 HB1 ALA 25 3.359 -8.956 6.087 192 HB2 ALA 25 HB2 ALA 25 4.865 -8.610 6.936 193 HB3 ALA 25 HB3 ALA 25 3.641 -7.352 6.766 194 H GLN 26 HN GLN 26 4.845 -9.828 9.733 195 HA GLN 26 HA GLN 26 4.553 -12.556 8.854 196 HB2 GLN 26 HB2 GLN 26 6.724 -12.414 9.328 197 HB3 GLN 26 HB1 GLN 26 6.473 -10.895 10.171 198 HG2 GLN 26 HG2 GLN 26 7.303 -12.111 11.861 199 HG3 GLN 26 HG1 GLN 26 5.599 -12.502 12.065 200 HE21 GLN 26 HE21 GLN 26 5.540 -14.185 9.694 201 HE22 GLN 26 HE22 GLN 26 6.325 -15.650 10.130 202 H LYS 27 HN LYS 27 3.871 -10.542 11.614 203 HA LYS 27 HA LYS 27 2.987 -12.538 13.398 204 HB2 LYS 27 HB2 LYS 27 2.123 -9.645 13.275 205 HB3 LYS 27 HB1 LYS 27 2.037 -10.709 14.682 206 HG2 LYS 27 HG2 LYS 27 4.540 -9.748 13.320 207 HG3 LYS 27 HG1 LYS 27 3.910 -9.190 14.869 208 HD2 LYS 27 HD2 LYS 27 4.503 -11.138 15.953 209 HD3 LYS 27 HD1 LYS 27 4.488 -12.091 14.469 210 HE2 LYS 27 HE2 LYS 27 6.521 -11.181 13.735 211 HE3 LYS 27 HE1 LYS 27 6.459 -9.889 14.926 212 HZ1 LYS 27 HZ1 LYS 27 8.054 -11.617 15.521 213 HZ2 LYS 27 HZ2 LYS 27 6.820 -12.772 15.543 214 HZ3 LYS 27 HZ3 LYS 27 6.817 -11.507 16.666 215 H SER 28 HN SER 28 1.305 -10.727 10.882 216 HA SER 28 HA SER 28 -1.239 -11.791 11.867 217 HB2 SER 28 HB2 SER 28 -0.679 -9.571 9.910 218 HB3 SER 28 HB1 SER 28 -2.276 -10.039 10.495 219 HG SER 28 HG SER 28 -0.253 -9.359 12.326 220 H ILE 29 HN ILE 29 1.108 -12.339 9.574 221 HA ILE 29 HA ILE 29 -0.829 -13.607 7.762 222 HB ILE 29 HB ILE 29 1.947 -12.596 7.223 223 HG12 ILE 29 HG12 ILE 29 -0.704 -11.794 6.027 224 HG13 ILE 29 HG11 ILE 29 0.176 -10.896 7.265 225 HG21 ILE 29 HG21 ILE 29 1.724 -14.622 5.997 226 HG22 ILE 29 HG22 ILE 29 1.579 -13.258 4.884 227 HG23 ILE 29 HG23 ILE 29 0.134 -14.142 5.397 228 HD11 ILE 29 HD11 ILE 29 0.477 -10.052 4.943 229 HD12 ILE 29 HD12 ILE 29 1.325 -11.564 4.580 230 HD13 ILE 29 HD13 ILE 29 1.966 -10.455 5.800 231 H ALA 30 HN ALA 30 -0.796 -15.754 7.554 232 HA ALA 30 HA ALA 30 1.205 -17.256 9.047 233 HB1 ALA 30 HB1 ALA 30 -1.162 -17.779 9.386 234 HB2 ALA 30 HB2 ALA 30 -0.274 -19.162 8.745 235 HB3 ALA 30 HB3 ALA 30 -1.308 -18.208 7.681 236 H ASP 31 HN ASP 31 1.018 -16.060 6.008 237 HA ASP 31 HA ASP 31 2.431 -18.377 4.867 238 HB2 ASP 31 HB2 ASP 31 0.076 -17.372 3.916 239 HB3 ASP 31 HB1 ASP 31 1.270 -16.507 2.947 240 H GLU 32 HN GLU 32 4.425 -18.057 4.286 241 HA GLU 32 HA GLU 32 5.854 -15.672 4.500 242 HB2 GLU 32 HB2 GLU 32 7.601 -16.828 3.246 243 HB3 GLU 32 HB1 GLU 32 6.864 -17.930 4.402 244 HG2 GLU 32 HG2 GLU 32 5.437 -18.808 2.528 245 HG3 GLU 32 HG1 GLU 32 6.404 -17.818 1.433 246 H LYS 33 HN LYS 33 3.939 -16.936 1.858 247 HA LYS 33 HA LYS 33 5.052 -15.413 -0.249 248 HB2 LYS 33 HB2 LYS 33 2.210 -16.402 0.066 249 HB3 LYS 33 HB1 LYS 33 2.939 -15.844 -1.422 250 HG2 LYS 33 HG2 LYS 33 3.966 -17.768 -1.791 251 HG3 LYS 33 HG1 LYS 33 4.335 -18.030 -0.091 252 HD2 LYS 33 HD2 LYS 33 2.134 -18.792 0.341 253 HD3 LYS 33 HD1 LYS 33 1.581 -18.306 -1.267 254 HE2 LYS 33 HE2 LYS 33 3.318 -19.962 -2.151 255 HE3 LYS 33 HE1 LYS 33 3.385 -20.567 -0.497 256 HZ1 LYS 33 HZ1 LYS 33 1.111 -21.159 -0.579 257 HZ2 LYS 33 HZ2 LYS 33 1.824 -21.771 -1.984 258 HZ3 LYS 33 HZ3 LYS 33 0.875 -20.368 -2.059 259 H ALA 34 HN ALA 34 2.036 -14.989 1.530 260 HA ALA 34 HA ALA 34 1.486 -12.414 0.588 261 HB1 ALA 34 HB1 ALA 34 -0.109 -12.320 2.504 262 HB2 ALA 34 HB2 ALA 34 0.556 -13.853 3.076 263 HB3 ALA 34 HB3 ALA 34 -0.263 -13.772 1.517 264 H ARG 35 HN ARG 35 3.634 -13.581 3.034 265 HA ARG 35 HA ARG 35 3.746 -11.178 4.596 266 HB2 ARG 35 HB2 ARG 35 4.554 -13.662 5.131 267 HB3 ARG 35 HB1 ARG 35 6.064 -13.059 4.463 268 HG2 ARG 35 HG2 ARG 35 4.688 -11.500 6.615 269 HG3 ARG 35 HG1 ARG 35 5.605 -12.944 7.034 270 HD2 ARG 35 HD2 ARG 35 6.639 -10.476 5.638 271 HD3 ARG 35 HD1 ARG 35 6.984 -10.996 7.293 272 HE ARG 35 HE ARG 35 7.793 -12.656 4.997 273 HH11 ARG 35 HH11 ARG 35 8.586 -10.883 7.912 274 HH12 ARG 35 HH12 ARG 35 10.237 -11.408 7.931 275 HH21 ARG 35 HH21 ARG 35 9.963 -13.333 5.018 276 HH22 ARG 35 HH22 ARG 35 11.023 -12.788 6.279 277 H LYS 36 HN LYS 36 5.956 -12.693 2.240 278 HA LYS 36 HA LYS 36 7.745 -10.549 1.985 279 HB2 LYS 36 HB2 LYS 36 6.868 -12.383 -0.235 280 HB3 LYS 36 HB1 LYS 36 8.378 -11.486 -0.135 281 HG2 LYS 36 HG2 LYS 36 9.332 -12.972 1.236 282 HG3 LYS 36 HG1 LYS 36 7.804 -13.366 2.055 283 HD2 LYS 36 HD2 LYS 36 8.524 -15.253 0.721 284 HD3 LYS 36 HD1 LYS 36 7.056 -14.520 0.031 285 HE2 LYS 36 HE2 LYS 36 8.695 -13.143 -1.426 286 HE3 LYS 36 HE1 LYS 36 9.908 -14.321 -0.925 287 HZ1 LYS 36 HZ1 LYS 36 8.580 -16.090 -1.859 288 HZ2 LYS 36 HZ2 LYS 36 8.904 -14.926 -3.039 289 HZ3 LYS 36 HZ3 LYS 36 7.378 -14.993 -2.320 290 H VAL 37 HN VAL 37 4.957 -11.425 -0.024 291 HA VAL 37 HA VAL 37 5.361 -9.504 -1.957 292 HB VAL 37 HB VAL 37 3.071 -9.779 -2.684 293 HG11 VAL 37 HG11 VAL 37 4.402 -12.301 -1.722 294 HG12 VAL 37 HG12 VAL 37 4.502 -11.556 -3.323 295 HG13 VAL 37 HG13 VAL 37 2.992 -12.293 -2.783 296 HG21 VAL 37 HG21 VAL 37 1.524 -11.244 -1.362 297 HG22 VAL 37 HG22 VAL 37 1.836 -9.655 -0.664 298 HG23 VAL 37 HG23 VAL 37 2.643 -11.078 -0.007 299 H ILE 38 HN ILE 38 3.684 -9.199 1.136 300 HA ILE 38 HA ILE 38 2.817 -6.557 0.360 301 HB ILE 38 HB ILE 38 1.629 -8.362 1.997 302 HG12 ILE 38 HG12 ILE 38 1.268 -5.395 2.282 303 HG13 ILE 38 HG11 ILE 38 0.822 -6.240 0.805 304 HG21 ILE 38 HG21 ILE 38 1.686 -7.540 4.268 305 HG22 ILE 38 HG22 ILE 38 2.798 -6.250 3.805 306 HG23 ILE 38 HG23 ILE 38 3.335 -7.933 3.764 307 HD11 ILE 38 HD11 ILE 38 -1.148 -6.102 1.941 308 HD12 ILE 38 HD12 ILE 38 -0.388 -6.314 3.505 309 HD13 ILE 38 HD13 ILE 38 -0.582 -7.701 2.425 310 H VAL 39 HN VAL 39 5.371 -7.945 2.347 311 HA VAL 39 HA VAL 39 6.037 -5.423 3.477 312 HB VAL 39 HB VAL 39 8.013 -6.336 4.301 313 HG11 VAL 39 HG11 VAL 39 7.364 -8.531 5.220 314 HG12 VAL 39 HG12 VAL 39 6.011 -8.566 4.093 315 HG13 VAL 39 HG13 VAL 39 6.089 -7.313 5.331 316 HG21 VAL 39 HG21 VAL 39 9.068 -8.414 3.552 317 HG22 VAL 39 HG22 VAL 39 9.010 -7.212 2.263 318 HG23 VAL 39 HG23 VAL 39 7.867 -8.555 2.266 319 H GLU 40 HN GLU 40 7.354 -7.251 0.746 320 HA GLU 40 HA GLU 40 9.033 -5.304 -0.282 321 HB2 GLU 40 HB2 GLU 40 7.614 -7.639 -1.511 322 HB3 GLU 40 HB1 GLU 40 8.781 -6.671 -2.386 323 HG2 GLU 40 HG2 GLU 40 10.524 -7.279 -0.954 324 HG3 GLU 40 HG1 GLU 40 9.442 -7.919 0.246 325 H LEU 41 HN LEU 41 5.587 -5.638 -0.518 326 HA LEU 41 HA LEU 41 5.415 -3.718 -2.684 327 HB2 LEU 41 HB2 LEU 41 3.668 -5.629 -1.557 328 HB3 LEU 41 HB1 LEU 41 2.908 -4.061 -1.361 329 HG LEU 41 HG LEU 41 2.103 -4.826 -3.406 330 HD11 LEU 41 HD11 LEU 41 4.488 -3.253 -4.298 331 HD12 LEU 41 HD12 LEU 41 3.154 -2.529 -3.405 332 HD13 LEU 41 HD13 LEU 41 2.860 -3.275 -4.969 333 HD21 LEU 41 HD21 LEU 41 3.502 -5.784 -5.164 334 HD22 LEU 41 HD22 LEU 41 3.572 -6.730 -3.677 335 HD23 LEU 41 HD23 LEU 41 4.908 -5.662 -4.106 336 H MET 42 HN MET 42 4.310 -3.743 0.720 337 HA MET 42 HA MET 42 3.435 -1.061 0.733 338 HB2 MET 42 HB2 MET 42 4.326 -2.787 3.039 339 HB3 MET 42 HB1 MET 42 3.458 -1.254 3.204 340 HG2 MET 42 HG2 MET 42 2.494 -3.829 1.989 341 HG3 MET 42 HG1 MET 42 1.894 -3.008 3.420 342 HE1 MET 42 HE1 MET 42 -0.554 -3.345 2.503 343 HE2 MET 42 HE2 MET 42 0.102 -4.125 1.061 344 HE3 MET 42 HE3 MET 42 -1.071 -2.817 0.897 345 H ALA 43 HN ALA 43 6.486 -2.540 1.057 346 HA ALA 43 HA ALA 43 8.128 -0.659 2.119 347 HB1 ALA 43 HB1 ALA 43 8.470 -2.353 -0.342 348 HB2 ALA 43 HB2 ALA 43 8.977 -2.721 1.307 349 HB3 ALA 43 HB3 ALA 43 9.777 -1.431 0.404 350 H TYR 44 HN TYR 44 6.321 -0.539 -0.881 351 HA TYR 44 HA TYR 44 7.458 2.117 -1.516 352 HB2 TYR 44 HB2 TYR 44 7.615 0.610 -3.414 353 HB3 TYR 44 HB1 TYR 44 5.945 0.128 -3.190 354 HD1 TYR 44 HD1 TYR 44 8.142 2.378 -4.911 355 HD2 TYR 44 HD2 TYR 44 4.126 1.889 -3.642 356 HE1 TYR 44 HE1 TYR 44 7.423 4.011 -6.591 357 HE2 TYR 44 HE2 TYR 44 3.393 3.528 -5.305 358 HH TYR 44 HH TYR 44 5.310 4.551 -7.852 359 H GLU 45 HN GLU 45 4.409 0.377 -1.972 360 HA GLU 45 HA GLU 45 2.717 2.424 -2.255 361 HB2 GLU 45 HB2 GLU 45 1.883 0.117 -0.586 362 HB3 GLU 45 HB1 GLU 45 0.978 0.954 -1.835 363 HG2 GLU 45 HG2 GLU 45 3.328 -0.830 -2.265 364 HG3 GLU 45 HG1 GLU 45 1.661 -1.302 -2.488 365 H ASN 46 HN ASN 46 4.067 1.323 0.808 366 HA ASN 46 HA ASN 46 2.276 3.128 2.241 367 HB2 ASN 46 HB2 ASN 46 3.680 0.600 2.918 368 HB3 ASN 46 HB1 ASN 46 3.457 1.779 4.202 369 HD21 ASN 46 HD21 ASN 46 1.993 0.429 5.331 370 HD22 ASN 46 HD22 ASN 46 0.403 0.153 4.749 371 H ALA 47 HN ALA 47 5.539 2.758 1.222 372 HA ALA 47 HA ALA 47 6.942 3.873 3.377 373 HB1 ALA 47 HB1 ALA 47 7.665 4.006 0.464 374 HB2 ALA 47 HB2 ALA 47 8.029 2.666 1.553 375 HB3 ALA 47 HB3 ALA 47 8.755 4.252 1.827 376 H ASN 48 HN ASN 48 8.388 5.850 2.871 377 HA ASN 48 HA ASN 48 6.856 8.171 3.088 378 HB2 ASN 48 HB2 ASN 48 9.722 7.499 2.756 379 HB3 ASN 48 HB1 ASN 48 9.265 9.114 2.213 380 HD21 ASN 48 HD21 ASN 48 10.758 7.918 4.657 381 HD22 ASN 48 HD22 ASN 48 10.014 8.726 5.992 382 HA PRO 49 HA PRO 49 5.385 8.917 -0.962 383 HB2 PRO 49 HB2 PRO 49 5.576 11.700 -0.913 384 HB3 PRO 49 HB1 PRO 49 4.209 10.753 -0.326 385 HG2 PRO 49 HG2 PRO 49 6.466 11.977 1.185 386 HG3 PRO 49 HG1 PRO 49 4.767 11.788 1.655 387 HD2 PRO 49 HD2 PRO 49 6.697 10.207 2.654 388 HD3 PRO 49 HD1 PRO 49 5.066 9.587 2.317 389 H GLU 50 HN GLU 50 8.383 10.254 0.095 390 HA GLU 50 HA GLU 50 9.401 10.768 -2.544 391 HB2 GLU 50 HB2 GLU 50 10.380 12.280 -1.165 392 HB3 GLU 50 HB1 GLU 50 10.252 11.247 0.248 393 HG2 GLU 50 HG2 GLU 50 12.409 10.867 0.048 394 HG3 GLU 50 HG1 GLU 50 12.053 9.981 -1.412 395 H CYS 51 HN CYS 51 9.394 8.236 -0.139 396 HA CYS 51 HA CYS 51 11.846 7.122 -1.100 397 HB2 CYS 51 HB2 CYS 51 11.343 7.094 1.257 398 HB3 CYS 51 HB1 CYS 51 9.926 6.089 0.978 399 HG CYS 51 HG CYS 51 11.757 4.211 -0.440 400 H GLN 52 HN GLN 52 8.427 6.386 -1.193 401 HA GLN 52 HA GLN 52 8.773 3.991 -2.694 402 HB2 GLN 52 HB2 GLN 52 6.438 4.189 -3.251 403 HB3 GLN 52 HB1 GLN 52 6.651 4.570 -1.551 404 HG2 GLN 52 HG2 GLN 52 6.567 6.979 -2.158 405 HG3 GLN 52 HG1 GLN 52 6.163 6.495 -3.805 406 HE21 GLN 52 HE21 GLN 52 4.743 4.157 -2.815 407 HE22 GLN 52 HE22 GLN 52 3.239 4.700 -2.206 408 H SER 53 HN SER 53 8.657 7.331 -3.233 409 HA SER 53 HA SER 53 8.724 7.326 -6.046 410 HB2 SER 53 HB2 SER 53 9.322 9.263 -3.865 411 HB3 SER 53 HB1 SER 53 9.641 9.691 -5.556 412 HG SER 53 HG SER 53 7.310 9.662 -4.224 413 H ALA 54 HN ALA 54 11.129 6.836 -3.565 414 HA ALA 54 HA ALA 54 13.295 6.885 -5.476 415 HB1 ALA 54 HB1 ALA 54 14.491 5.639 -3.592 416 HB2 ALA 54 HB2 ALA 54 13.023 5.935 -2.649 417 HB3 ALA 54 HB3 ALA 54 13.963 7.290 -3.277 418 H ILE 55 HN ILE 55 10.875 4.726 -4.519 419 HA ILE 55 HA ILE 55 12.351 2.365 -5.250 420 HB ILE 55 HB ILE 55 9.675 2.802 -3.995 421 HG12 ILE 55 HG12 ILE 55 11.952 1.240 -2.873 422 HG13 ILE 55 HG11 ILE 55 12.038 3.005 -2.879 423 HG21 ILE 55 HG21 ILE 55 9.537 0.362 -3.722 424 HG22 ILE 55 HG22 ILE 55 10.951 0.187 -4.760 425 HG23 ILE 55 HG23 ILE 55 9.454 0.855 -5.412 426 HD11 ILE 55 HD11 ILE 55 11.183 2.040 -0.784 427 HD12 ILE 55 HD12 ILE 55 9.784 1.409 -1.679 428 HD13 ILE 55 HD13 ILE 55 10.056 3.158 -1.567 429 H LYS 56 HN LYS 56 9.699 4.276 -6.656 430 HA LYS 56 HA LYS 56 8.356 2.445 -8.116 431 HB2 LYS 56 HB2 LYS 56 8.894 4.535 -10.002 432 HB3 LYS 56 HB1 LYS 56 7.396 4.103 -9.205 433 HG2 LYS 56 HG2 LYS 56 7.611 6.265 -8.557 434 HG3 LYS 56 HG1 LYS 56 8.455 5.471 -7.225 435 HD2 LYS 56 HD2 LYS 56 10.456 6.216 -7.858 436 HD3 LYS 56 HD1 LYS 56 10.090 6.121 -9.582 437 HE2 LYS 56 HE2 LYS 56 9.355 8.344 -7.647 438 HE3 LYS 56 HE1 LYS 56 10.397 8.427 -9.063 439 HZ1 LYS 56 HZ1 LYS 56 8.320 9.390 -9.630 440 HZ2 LYS 56 HZ2 LYS 56 7.458 8.044 -9.068 441 HZ3 LYS 56 HZ3 LYS 56 8.430 7.911 -10.446 442 HA PRO 57 HA PRO 57 11.763 2.229 -11.674 443 HB2 PRO 57 HB2 PRO 57 14.303 2.258 -10.688 444 HB3 PRO 57 HB1 PRO 57 13.496 3.706 -11.312 445 HG2 PRO 57 HG2 PRO 57 13.649 2.721 -8.474 446 HG3 PRO 57 HG1 PRO 57 14.083 4.332 -9.101 447 HD2 PRO 57 HD2 PRO 57 11.734 3.973 -7.983 448 HD3 PRO 57 HD1 PRO 57 11.804 4.868 -9.510 449 H LEU 58 HN LEU 58 12.085 1.062 -8.392 450 HA LEU 58 HA LEU 58 13.047 -1.565 -9.292 451 HB2 LEU 58 HB2 LEU 58 12.546 -1.023 -6.432 452 HB3 LEU 58 HB1 LEU 58 13.859 -1.925 -7.173 453 HG LEU 58 HG LEU 58 13.637 1.087 -7.028 454 HD11 LEU 58 HD11 LEU 58 13.969 0.171 -4.842 455 HD12 LEU 58 HD12 LEU 58 15.505 0.839 -5.403 456 HD13 LEU 58 HD13 LEU 58 15.235 -0.904 -5.432 457 HD21 LEU 58 HD21 LEU 58 15.922 -0.663 -7.939 458 HD22 LEU 58 HD22 LEU 58 15.944 1.096 -7.803 459 HD23 LEU 58 HD23 LEU 58 14.893 0.317 -8.985 460 H LYS 59 HN LYS 59 10.355 0.211 -8.359 461 HA LYS 59 HA LYS 59 8.796 -1.572 -6.940 462 HB2 LYS 59 HB2 LYS 59 8.077 0.694 -7.257 463 HB3 LYS 59 HB1 LYS 59 7.965 0.457 -8.992 464 HG2 LYS 59 HG2 LYS 59 5.778 0.194 -8.522 465 HG3 LYS 59 HG1 LYS 59 6.300 -1.449 -8.183 466 HD2 LYS 59 HD2 LYS 59 6.000 0.733 -6.156 467 HD3 LYS 59 HD1 LYS 59 4.843 -0.579 -6.412 468 HE2 LYS 59 HE2 LYS 59 7.716 -0.843 -5.498 469 HE3 LYS 59 HE1 LYS 59 6.286 -1.048 -4.504 470 HZ1 LYS 59 HZ1 LYS 59 5.669 -2.960 -5.862 471 HZ2 LYS 59 HZ2 LYS 59 7.187 -3.173 -5.137 472 HZ3 LYS 59 HZ3 LYS 59 7.079 -2.774 -6.775 473 H GLY 60 HN GLY 60 8.496 -3.609 -7.404 474 HA2 GLY 60 HA3 GLY 60 7.284 -5.302 -8.508 475 HA3 GLY 60 HA2 GLY 60 7.235 -4.295 -9.948 476 H LYS 61 HN LYS 61 10.206 -3.746 -9.422 477 HA LYS 61 HA LYS 61 11.137 -6.140 -10.852 478 HB2 LYS 61 HB2 LYS 61 12.853 -3.728 -10.648 479 HB3 LYS 61 HB1 LYS 61 12.537 -4.763 -12.034 480 HG2 LYS 61 HG2 LYS 61 10.650 -2.688 -10.966 481 HG3 LYS 61 HG1 LYS 61 11.729 -2.460 -12.330 482 HD2 LYS 61 HD2 LYS 61 9.613 -4.598 -12.204 483 HD3 LYS 61 HD1 LYS 61 9.356 -3.008 -12.925 484 HE2 LYS 61 HE2 LYS 61 11.176 -3.427 -14.492 485 HE3 LYS 61 HE1 LYS 61 11.433 -5.013 -13.773 486 HZ1 LYS 61 HZ1 LYS 61 8.901 -4.155 -15.060 487 HZ2 LYS 61 HZ2 LYS 61 9.272 -5.704 -14.494 488 HZ3 LYS 61 HZ3 LYS 61 10.094 -5.072 -15.828 489 H VAL 62 HN VAL 62 12.048 -7.546 -9.481 490 HA VAL 62 HA VAL 62 14.055 -6.481 -7.613 491 HB VAL 62 HB VAL 62 12.210 -7.459 -6.354 492 HG11 VAL 62 HG11 VAL 62 11.657 -9.847 -6.508 493 HG12 VAL 62 HG12 VAL 62 12.723 -9.988 -7.909 494 HG13 VAL 62 HG13 VAL 62 11.285 -8.971 -7.995 495 HG21 VAL 62 HG21 VAL 62 14.382 -7.724 -5.382 496 HG22 VAL 62 HG22 VAL 62 14.682 -9.176 -6.337 497 HG23 VAL 62 HG23 VAL 62 13.445 -9.189 -5.080 498 HA PRO 63 HA PRO 63 17.186 -8.930 -9.816 499 HB2 PRO 63 HB2 PRO 63 17.873 -9.579 -6.986 500 HB3 PRO 63 HB1 PRO 63 18.937 -9.158 -8.311 501 HG2 PRO 63 HG2 PRO 63 18.329 -7.356 -6.461 502 HG3 PRO 63 HG1 PRO 63 18.447 -6.891 -8.166 503 HD2 PRO 63 HD2 PRO 63 16.042 -7.224 -6.461 504 HD3 PRO 63 HD1 PRO 63 16.300 -6.160 -7.858 505 H ALA 64 HN ALA 64 17.243 -11.042 -10.416 506 HA ALA 64 HA ALA 64 15.014 -12.625 -9.842 507 HB1 ALA 64 HB1 ALA 64 16.052 -14.313 -11.243 508 HB2 ALA 64 HB2 ALA 64 17.599 -13.472 -11.139 509 HB3 ALA 64 HB3 ALA 64 16.236 -12.713 -11.961 510 H GLY 65 HN GLY 65 14.783 -13.152 -7.705 511 HA2 GLY 65 HA3 GLY 65 14.955 -15.085 -6.297 512 HA3 GLY 65 HA2 GLY 65 16.637 -15.237 -6.776 513 H SER 66 HN SER 66 16.300 -12.032 -6.296 514 HA SER 66 HA SER 66 17.341 -12.263 -3.574 515 HB2 SER 66 HB2 SER 66 17.241 -9.818 -5.347 516 HB3 SER 66 HB1 SER 66 18.213 -10.043 -3.895 517 HG SER 66 HG SER 66 18.836 -12.048 -5.427 518 H ASP 67 HN ASP 67 16.807 -10.137 -2.276 519 HA ASP 67 HA ASP 67 13.939 -10.174 -1.773 520 HB2 ASP 67 HB2 ASP 67 15.936 -10.190 -0.054 521 HB3 ASP 67 HB1 ASP 67 15.951 -8.464 -0.345 522 H VAL 68 HN VAL 68 12.531 -8.376 -2.211 523 HA VAL 68 HA VAL 68 13.765 -6.361 -3.888 524 HB VAL 68 HB VAL 68 11.773 -5.821 -4.697 525 HG11 VAL 68 HG11 VAL 68 10.017 -7.463 -4.546 526 HG12 VAL 68 HG12 VAL 68 10.768 -8.161 -3.112 527 HG13 VAL 68 HG13 VAL 68 11.594 -8.242 -4.667 528 HG21 VAL 68 HG21 VAL 68 9.759 -5.360 -3.336 529 HG22 VAL 68 HG22 VAL 68 11.176 -4.419 -2.862 530 HG23 VAL 68 HG23 VAL 68 10.675 -5.804 -1.896 531 H ILE 69 HN ILE 69 12.773 -6.729 -0.621 532 HA ILE 69 HA ILE 69 12.545 -4.044 0.099 533 HB ILE 69 HB ILE 69 13.332 -6.464 1.693 534 HG12 ILE 69 HG12 ILE 69 11.067 -6.620 1.060 535 HG13 ILE 69 HG11 ILE 69 11.036 -5.992 2.698 536 HG21 ILE 69 HG21 ILE 69 14.363 -4.608 2.796 537 HG22 ILE 69 HG22 ILE 69 12.931 -5.061 3.725 538 HG23 ILE 69 HG23 ILE 69 12.894 -3.644 2.673 539 HD11 ILE 69 HD11 ILE 69 9.440 -4.818 1.397 540 HD12 ILE 69 HD12 ILE 69 10.659 -4.441 0.170 541 HD13 ILE 69 HD13 ILE 69 10.773 -3.720 1.775 542 H SER 70 HN SER 70 15.242 -6.237 0.189 543 HA SER 70 HA SER 70 17.278 -4.733 1.153 544 HB2 SER 70 HB2 SER 70 17.608 -7.030 0.474 545 HB3 SER 70 HB1 SER 70 17.294 -6.635 -1.211 546 HG SER 70 HG SER 70 19.527 -5.937 0.388 547 H GLU 71 HN GLU 71 15.825 -4.468 -2.035 548 HA GLU 71 HA GLU 71 17.695 -2.515 -3.006 549 HB2 GLU 71 HB2 GLU 71 15.111 -3.442 -4.227 550 HB3 GLU 71 HB1 GLU 71 16.504 -2.740 -5.050 551 HG2 GLU 71 HG2 GLU 71 16.939 -5.204 -3.497 552 HG3 GLU 71 HG1 GLU 71 16.029 -5.340 -4.992 553 H TYR 72 HN TYR 72 14.515 -2.664 -1.682 554 HA TYR 72 HA TYR 72 13.720 -0.067 -2.551 555 HB2 TYR 72 HB2 TYR 72 12.584 -2.121 -0.670 556 HB3 TYR 72 HB1 TYR 72 11.861 -0.525 -0.822 557 HD1 TYR 72 HD1 TYR 72 13.359 -1.936 -3.797 558 HD2 TYR 72 HD2 TYR 72 9.777 -1.655 -1.537 559 HE1 TYR 72 HE1 TYR 72 12.078 -2.712 -5.732 560 HE2 TYR 72 HE2 TYR 72 8.484 -2.450 -3.470 561 HH TYR 72 HH TYR 72 10.071 -3.671 -6.332 562 H VAL 73 HN VAL 73 15.044 -1.515 0.343 563 HA VAL 73 HA VAL 73 15.101 0.877 1.881 564 HB VAL 73 HB VAL 73 16.317 -0.196 3.504 565 HG11 VAL 73 HG11 VAL 73 15.568 -2.505 3.722 566 HG12 VAL 73 HG12 VAL 73 15.039 -2.472 2.041 567 HG13 VAL 73 HG13 VAL 73 14.278 -1.415 3.224 568 HG21 VAL 73 HG21 VAL 73 18.023 -1.748 3.297 569 HG22 VAL 73 HG22 VAL 73 18.227 -0.714 1.876 570 HG23 VAL 73 HG23 VAL 73 17.460 -2.296 1.713 571 H LYS 74 HN LYS 74 17.113 -0.680 -0.460 572 HA LYS 74 HA LYS 74 19.406 0.980 -0.209 573 HB2 LYS 74 HB2 LYS 74 19.566 -1.202 -1.145 574 HB3 LYS 74 HB1 LYS 74 18.327 -0.853 -2.334 575 HG2 LYS 74 HG2 LYS 74 20.138 1.036 -2.937 576 HG3 LYS 74 HG1 LYS 74 21.192 -0.240 -2.328 577 HD2 LYS 74 HD2 LYS 74 20.906 -0.492 -4.725 578 HD3 LYS 74 HD1 LYS 74 20.132 -1.832 -3.876 579 HE2 LYS 74 HE2 LYS 74 17.959 -0.705 -4.088 580 HE3 LYS 74 HE1 LYS 74 18.745 0.615 -4.957 581 HZ1 LYS 74 HZ1 LYS 74 17.749 -0.883 -6.525 582 HZ2 LYS 74 HZ2 LYS 74 18.563 -2.215 -5.868 583 HZ3 LYS 74 HZ3 LYS 74 19.428 -0.996 -6.663 584 H ALA 75 HN ALA 75 16.357 1.141 -1.840 585 HA ALA 75 HA ALA 75 16.898 3.270 -3.620 586 HB1 ALA 75 HB1 ALA 75 14.898 1.895 -3.790 587 HB2 ALA 75 HB2 ALA 75 14.465 3.595 -3.626 588 HB3 ALA 75 HB3 ALA 75 14.324 2.510 -2.242 589 H CYS 76 HN CYS 76 15.645 3.185 -0.303 590 HA CYS 76 HA CYS 76 15.814 6.085 -0.109 591 HB2 CYS 76 HB2 CYS 76 13.939 5.053 0.929 592 HB3 CYS 76 HB1 CYS 76 14.952 3.973 1.866 593 HG CYS 76 HG CYS 76 15.948 5.957 3.531 594 H ASP 77 HN ASP 77 18.020 3.678 0.077 595 HA ASP 77 HA ASP 77 19.564 4.472 2.306 596 HB2 ASP 77 HB2 ASP 77 19.953 2.332 1.259 597 HB3 ASP 77 HB1 ASP 77 20.362 3.088 -0.275 598 H GLY 78 HN GLY 78 18.897 5.943 -0.665 599 HA2 GLY 78 HA3 GLY 78 21.101 7.849 -0.319 600 HA3 GLY 78 HA2 GLY 78 20.096 7.701 -1.750 601 H ILE 79 HN ILE 79 17.784 7.489 0.439 602 HA ILE 79 HA ILE 79 17.090 10.261 0.172 603 HB ILE 79 HB ILE 79 15.652 7.955 1.456 604 HG12 ILE 79 HG12 ILE 79 15.163 9.444 -1.124 605 HG13 ILE 79 HG11 ILE 79 15.900 7.845 -0.985 606 HG21 ILE 79 HG21 ILE 79 13.681 9.317 1.622 607 HG22 ILE 79 HG22 ILE 79 14.516 10.689 0.890 608 HG23 ILE 79 HG23 ILE 79 14.992 10.118 2.492 609 HD11 ILE 79 HD11 ILE 79 13.145 8.497 -0.006 610 HD12 ILE 79 HD12 ILE 79 13.880 6.903 -0.205 611 HD13 ILE 79 HD13 ILE 79 13.495 7.884 -1.617 612 H GLY 80 HN GLY 80 16.466 8.440 3.127 613 HA2 GLY 80 HA3 GLY 80 16.466 9.199 5.303 614 HA3 GLY 80 HA2 GLY 80 18.181 9.385 4.973 615 H GLY 81 HN GLY 81 19.020 11.349 5.132 616 HA2 GLY 81 HA3 GLY 81 17.168 13.653 5.159 617 HA3 GLY 81 HA2 GLY 81 18.492 13.496 6.307 618 H ALA 82 HN ALA 82 18.281 15.743 4.794 619 HA ALA 82 HA ALA 82 19.529 17.158 3.543 620 HB1 ALA 82 HB1 ALA 82 21.445 16.091 4.660 621 HB2 ALA 82 HB2 ALA 82 21.822 16.641 3.029 622 HB3 ALA 82 HB3 ALA 82 21.540 14.928 3.340 623 H MET 83 HN MET 83 20.308 14.057 1.971 624 HA MET 83 HA MET 83 19.979 15.108 -0.644 625 HB2 MET 83 HB2 MET 83 19.944 12.221 0.262 626 HB3 MET 83 HB1 MET 83 20.188 12.784 -1.386 627 HG2 MET 83 HG2 MET 83 22.256 13.871 -0.729 628 HG3 MET 83 HG1 MET 83 22.005 13.371 0.938 629 HE1 MET 83 HE1 MET 83 22.710 12.190 -2.722 630 HE2 MET 83 HE2 MET 83 21.294 11.220 -2.317 631 HE3 MET 83 HE3 MET 83 22.862 10.444 -2.529 632 H HIS 84 HN HIS 84 17.870 13.462 1.591 633 HA HIS 84 HA HIS 84 15.641 12.974 -0.017 634 HB2 HIS 84 HB2 HIS 84 15.656 12.114 2.202 635 HB3 HIS 84 HB1 HIS 84 15.973 13.693 2.899 636 HD1 HIS 84 HD1 HIS 84 14.012 14.068 4.357 637 HD2 HIS 84 HD2 HIS 84 12.897 12.724 0.591 638 HE1 HIS 84 HE1 HIS 84 11.507 14.204 4.310 639 HE2 HIS 84 HE2 HIS 84 10.848 13.222 2.085 640 H LYS 85 HN LYS 85 16.871 15.981 1.303 641 HA LYS 85 HA LYS 85 14.411 17.397 0.741 642 HB2 LYS 85 HB2 LYS 85 17.110 18.471 1.581 643 HB3 LYS 85 HB1 LYS 85 15.594 19.364 1.575 644 HG2 LYS 85 HG2 LYS 85 16.213 16.953 3.278 645 HG3 LYS 85 HG1 LYS 85 16.181 18.632 3.823 646 HD2 LYS 85 HD2 LYS 85 13.812 18.775 3.308 647 HD3 LYS 85 HD1 LYS 85 13.832 17.135 2.661 648 HE2 LYS 85 HE2 LYS 85 12.927 17.081 4.887 649 HE3 LYS 85 HE1 LYS 85 14.511 16.304 4.891 650 HZ1 LYS 85 HZ1 LYS 85 13.985 19.106 5.740 651 HZ2 LYS 85 HZ2 LYS 85 15.471 18.302 5.817 652 HZ3 LYS 85 HZ3 LYS 85 14.184 17.797 6.788 653 H ALA 86 HN ALA 86 17.242 16.521 -0.896 654 HA ALA 86 HA ALA 86 17.059 18.563 -2.941 655 HB1 ALA 86 HB1 ALA 86 18.663 16.008 -2.989 656 HB2 ALA 86 HB2 ALA 86 19.219 17.501 -2.228 657 HB3 ALA 86 HB3 ALA 86 18.917 17.458 -3.966 658 H MET 87 HN MET 87 16.407 15.124 -2.566 659 HA MET 87 HA MET 87 15.556 14.830 -5.311 660 HB2 MET 87 HB2 MET 87 15.479 12.828 -3.045 661 HB3 MET 87 HB1 MET 87 15.322 12.475 -4.766 662 HG2 MET 87 HG2 MET 87 17.686 13.754 -4.760 663 HG3 MET 87 HG1 MET 87 17.713 13.047 -3.150 664 HE1 MET 87 HE1 MET 87 19.859 12.344 -5.444 665 HE2 MET 87 HE2 MET 87 20.002 10.604 -5.194 666 HE3 MET 87 HE3 MET 87 19.898 11.689 -3.809 667 H LEU 88 HN LEU 88 14.091 15.639 -2.382 668 HA LEU 88 HA LEU 88 11.599 14.540 -2.428 669 HB2 LEU 88 HB2 LEU 88 12.763 16.275 -0.876 670 HB3 LEU 88 HB1 LEU 88 11.916 17.447 -1.863 671 HG LEU 88 HG LEU 88 9.912 16.996 -0.902 672 HD11 LEU 88 HD11 LEU 88 10.777 14.121 -0.560 673 HD12 LEU 88 HD12 LEU 88 9.718 14.737 -1.831 674 HD13 LEU 88 HD13 LEU 88 9.189 14.767 -0.151 675 HD21 LEU 88 HD21 LEU 88 10.202 16.267 1.435 676 HD22 LEU 88 HD22 LEU 88 11.392 17.470 0.932 677 HD23 LEU 88 HD23 LEU 88 11.845 15.769 1.027 678 H MET 89 HN MET 89 12.804 17.188 -4.423 679 HA MET 89 HA MET 89 10.192 17.736 -5.539 680 HB2 MET 89 HB2 MET 89 11.808 19.553 -5.196 681 HB3 MET 89 HB1 MET 89 12.921 18.782 -6.315 682 HG2 MET 89 HG2 MET 89 11.356 19.111 -8.138 683 HG3 MET 89 HG1 MET 89 10.188 19.823 -7.026 684 HE1 MET 89 HE1 MET 89 11.954 21.631 -5.138 685 HE2 MET 89 HE2 MET 89 10.442 22.148 -5.883 686 HE3 MET 89 HE3 MET 89 11.877 23.166 -6.003 687 H ALA 90 HN ALA 90 12.730 15.565 -6.153 688 HA ALA 90 HA ALA 90 12.159 15.386 -9.023 689 HB1 ALA 90 HB1 ALA 90 14.169 14.041 -9.149 690 HB2 ALA 90 HB2 ALA 90 14.277 13.977 -7.389 691 HB3 ALA 90 HB3 ALA 90 14.512 15.510 -8.236 692 H GLN 91 HN GLN 91 12.421 13.211 -6.224 693 HA GLN 91 HA GLN 91 11.380 11.025 -7.783 694 HB2 GLN 91 HB2 GLN 91 12.124 11.259 -4.874 695 HB3 GLN 91 HB1 GLN 91 11.624 9.763 -5.656 696 HG2 GLN 91 HG2 GLN 91 13.517 9.816 -7.106 697 HG3 GLN 91 HG1 GLN 91 13.977 11.411 -6.519 698 HE21 GLN 91 HE21 GLN 91 13.348 10.851 -3.792 699 HE22 GLN 91 HE22 GLN 91 14.590 9.800 -3.211 700 H LEU 92 HN LEU 92 10.317 12.644 -4.776 701 HA LEU 92 HA LEU 92 7.797 11.611 -4.490 702 HB2 LEU 92 HB2 LEU 92 9.150 13.515 -3.234 703 HB3 LEU 92 HB1 LEU 92 8.162 14.563 -4.220 704 HG LEU 92 HG LEU 92 7.426 12.904 -1.879 705 HD11 LEU 92 HD11 LEU 92 6.520 15.564 -2.949 706 HD12 LEU 92 HD12 LEU 92 7.702 15.288 -1.670 707 HD13 LEU 92 HD13 LEU 92 6.012 14.851 -1.418 708 HD21 LEU 92 HD21 LEU 92 5.031 12.961 -2.505 709 HD22 LEU 92 HD22 LEU 92 5.982 11.880 -3.521 710 HD23 LEU 92 HD23 LEU 92 5.496 13.462 -4.131 711 H GLU 93 HN GLU 93 9.055 13.883 -6.734 712 HA GLU 93 HA GLU 93 8.040 15.526 -8.042 713 HB2 GLU 93 HB2 GLU 93 7.411 14.305 -10.164 714 HB3 GLU 93 HB1 GLU 93 9.013 13.967 -9.497 715 HG2 GLU 93 HG2 GLU 93 8.288 11.872 -8.640 716 HG3 GLU 93 HG1 GLU 93 6.605 12.233 -8.991 717 H2 PRO 1 HT1 PRO 1 5.376 -3.938 -13.324 718 H3 PRO 1 HT2 PRO 1 5.700 -2.451 -13.926 719 HA PRO 1 HA PRO 1 6.399 -2.212 -11.881 720 HB2 PRO 1 HB2 PRO 1 4.248 -1.174 -10.661 721 HB3 PRO 1 HB1 PRO 1 4.985 -0.379 -12.052 722 HG2 PRO 1 HG2 PRO 1 2.438 -1.806 -11.874 723 HG3 PRO 1 HG1 PRO 1 3.014 -0.693 -13.126 724 HD2 PRO 1 HD2 PRO 1 3.030 -3.617 -13.088 725 HD3 PRO 1 HD1 PRO 1 3.324 -2.516 -14.448 726 H SER 2 HN SER 2 4.498 -2.249 -9.535 727 HA SER 2 HA SER 2 4.408 -4.975 -8.781 728 HB2 SER 2 HB2 SER 2 2.531 -2.776 -7.863 729 HB3 SER 2 HB1 SER 2 2.946 -4.255 -7.003 730 HG SER 2 HG SER 2 4.020 -2.068 -6.543 731 H PHE 3 HN PHE 3 2.160 -6.051 -8.402 732 HA PHE 3 HA PHE 3 0.516 -5.832 -10.726 733 HB2 PHE 3 HB2 PHE 3 -1.091 -6.930 -8.755 734 HB3 PHE 3 HB1 PHE 3 -0.081 -7.844 -9.874 735 HD1 PHE 3 HD1 PHE 3 -0.697 -6.849 -6.489 736 HD2 PHE 3 HD2 PHE 3 2.198 -8.566 -9.100 737 HE1 PHE 3 HE1 PHE 3 0.494 -7.805 -4.570 738 HE2 PHE 3 HE2 PHE 3 3.404 -9.500 -7.172 739 HZ PHE 3 HZ PHE 3 2.548 -9.119 -4.895 740 H ASN 4 HN ASN 4 0.327 -4.796 -7.396 741 HA ASN 4 HA ASN 4 -2.328 -3.747 -7.737 742 HB2 ASN 4 HB2 ASN 4 -2.195 -3.377 -5.332 743 HB3 ASN 4 HB1 ASN 4 -1.703 -5.018 -5.749 744 HD21 ASN 4 HD21 ASN 4 -0.481 -1.803 -4.956 745 HD22 ASN 4 HD22 ASN 4 1.035 -2.351 -4.316 746 H THR 5 HN THR 5 0.483 -2.359 -8.573 747 HA THR 5 HA THR 5 0.582 0.018 -7.037 748 HB THR 5 HB THR 5 1.602 0.760 -9.427 749 HG1 THR 5 HG1 THR 5 1.380 -1.081 -10.569 750 HG21 THR 5 HG21 THR 5 3.780 -0.016 -8.529 751 HG22 THR 5 HG22 THR 5 2.894 -0.866 -7.264 752 HG23 THR 5 HG23 THR 5 2.807 0.891 -7.371 753 H VAL 6 HN VAL 6 -1.774 -1.004 -9.199 754 HA VAL 6 HA VAL 6 -2.500 1.551 -10.249 755 HB VAL 6 HB VAL 6 -4.311 0.493 -11.260 756 HG11 VAL 6 HG11 VAL 6 -2.242 -0.423 -12.111 757 HG12 VAL 6 HG12 VAL 6 -3.512 -1.647 -12.142 758 HG13 VAL 6 HG13 VAL 6 -2.277 -1.690 -10.883 759 HG21 VAL 6 HG21 VAL 6 -5.262 -0.384 -9.114 760 HG22 VAL 6 HG22 VAL 6 -4.211 -1.793 -9.304 761 HG23 VAL 6 HG23 VAL 6 -5.461 -1.452 -10.509 762 H ARG 7 HN ARG 7 -3.858 3.062 -9.295 763 HA ARG 7 HA ARG 7 -5.536 2.178 -7.149 764 HB2 ARG 7 HB2 ARG 7 -4.555 3.757 -5.485 765 HB3 ARG 7 HB1 ARG 7 -3.653 2.316 -5.891 766 HG2 ARG 7 HG2 ARG 7 -2.761 4.340 -7.598 767 HG3 ARG 7 HG1 ARG 7 -2.794 4.985 -5.956 768 HD2 ARG 7 HD2 ARG 7 -1.405 3.234 -5.147 769 HD3 ARG 7 HD1 ARG 7 -1.582 2.318 -6.640 770 HE ARG 7 HE ARG 7 -0.482 4.752 -7.368 771 HH11 ARG 7 HH11 ARG 7 0.446 2.112 -5.279 772 HH12 ARG 7 HH12 ARG 7 2.139 2.328 -5.546 773 HH21 ARG 7 HH21 ARG 7 1.744 5.059 -7.722 774 HH22 ARG 7 HH22 ARG 7 2.888 4.031 -6.928 775 H GLN 8 HN GLN 8 -6.829 3.730 -6.194 776 HA GLN 8 HA GLN 8 -8.459 5.075 -7.853 777 HB2 GLN 8 HB2 GLN 8 -8.218 4.664 -5.101 778 HB3 GLN 8 HB1 GLN 8 -8.371 6.408 -5.277 779 HG2 GLN 8 HG2 GLN 8 -10.398 6.047 -6.645 780 HG3 GLN 8 HG1 GLN 8 -10.267 4.319 -6.321 781 HE21 GLN 8 HE21 GLN 8 -12.443 6.034 -5.655 782 HE22 GLN 8 HE22 GLN 8 -12.596 6.003 -3.921 783 H GLY 9 HN GLY 9 -7.985 6.607 -9.247 784 HA2 GLY 9 HA3 GLY 9 -6.201 8.803 -8.570 785 HA3 GLY 9 HA2 GLY 9 -7.036 8.556 -10.095 786 H SER 10 HN SER 10 -7.756 10.712 -10.185 787 HA SER 10 HA SER 10 -8.975 12.177 -8.186 788 HB2 SER 10 HB2 SER 10 -9.634 12.238 -11.139 789 HB3 SER 10 HB1 SER 10 -9.954 13.526 -9.979 790 HG SER 10 HG SER 10 -7.414 12.960 -9.716 791 H LYS 11 HN LYS 11 -10.416 11.192 -6.909 792 HA LYS 11 HA LYS 11 -12.062 9.783 -6.213 793 HB2 LYS 11 HB2 LYS 11 -14.257 10.669 -6.562 794 HB3 LYS 11 HB1 LYS 11 -13.146 11.999 -6.360 795 HG2 LYS 11 HG2 LYS 11 -13.203 12.473 -8.677 796 HG3 LYS 11 HG1 LYS 11 -14.121 11.020 -9.028 797 HD2 LYS 11 HD2 LYS 11 -15.978 11.927 -7.663 798 HD3 LYS 11 HD1 LYS 11 -15.055 13.413 -7.446 799 HE2 LYS 11 HE2 LYS 11 -16.666 13.709 -9.220 800 HE3 LYS 11 HE1 LYS 11 -15.036 13.727 -9.890 801 HZ1 LYS 11 HZ1 LYS 11 -16.889 11.406 -9.920 802 HZ2 LYS 11 HZ2 LYS 11 -15.333 11.433 -10.580 803 HZ3 LYS 11 HZ3 LYS 11 -16.543 12.407 -11.241 804 H GLU 12 HN GLU 12 -10.736 8.476 -8.191 805 HA GLU 12 HA GLU 12 -12.227 7.418 -10.294 806 HB2 GLU 12 HB2 GLU 12 -9.796 7.097 -9.927 807 HB3 GLU 12 HB1 GLU 12 -10.144 6.056 -8.561 808 HG2 GLU 12 HG2 GLU 12 -11.203 4.440 -10.058 809 HG3 GLU 12 HG1 GLU 12 -10.862 5.500 -11.430 810 HA PRO 13 HA PRO 13 -15.505 5.170 -8.259 811 HB2 PRO 13 HB2 PRO 13 -15.088 3.112 -10.332 812 HB3 PRO 13 HB1 PRO 13 -16.555 3.998 -9.924 813 HG2 PRO 13 HG2 PRO 13 -15.127 4.494 -12.162 814 HG3 PRO 13 HG1 PRO 13 -16.039 5.741 -11.305 815 HD2 PRO 13 HD2 PRO 13 -13.117 5.288 -11.425 816 HD3 PRO 13 HD1 PRO 13 -14.015 6.791 -11.171 817 H TYR 14 HN TYR 14 -15.237 3.894 -6.537 818 HA TYR 14 HA TYR 14 -12.612 2.931 -6.157 819 HB2 TYR 14 HB2 TYR 14 -13.804 4.054 -4.364 820 HB3 TYR 14 HB1 TYR 14 -14.968 2.735 -4.299 821 HD1 TYR 14 HD1 TYR 14 -14.017 0.404 -3.875 822 HD2 TYR 14 HD2 TYR 14 -11.905 3.960 -3.055 823 HE1 TYR 14 HE1 TYR 14 -12.592 -0.838 -2.328 824 HE2 TYR 14 HE2 TYR 14 -10.457 2.765 -1.480 825 HH TYR 14 HH TYR 14 -10.198 0.815 -0.364 826 HA PRO 15 HA PRO 15 -14.729 -1.448 -5.664 827 HB2 PRO 15 HB2 PRO 15 -16.911 -1.176 -7.631 828 HB3 PRO 15 HB1 PRO 15 -16.905 -1.991 -6.069 829 HG2 PRO 15 HG2 PRO 15 -18.178 0.337 -6.465 830 HG3 PRO 15 HG1 PRO 15 -17.446 -0.088 -4.922 831 HD2 PRO 15 HD2 PRO 15 -16.516 1.823 -6.996 832 HD3 PRO 15 HD1 PRO 15 -16.297 1.863 -5.240 833 H ASP 16 HN ASP 16 -14.456 0.602 -8.297 834 HA ASP 16 HA ASP 16 -13.723 -1.438 -10.212 835 HB2 ASP 16 HB2 ASP 16 -14.321 1.479 -10.362 836 HB3 ASP 16 HB1 ASP 16 -13.296 0.785 -11.611 837 H PHE 17 HN PHE 17 -12.300 1.317 -8.512 838 HA PHE 17 HA PHE 17 -9.711 1.209 -9.530 839 HB2 PHE 17 HB2 PHE 17 -9.594 2.963 -8.089 840 HB3 PHE 17 HB1 PHE 17 -11.042 2.420 -7.253 841 HD1 PHE 17 HD1 PHE 17 -10.912 1.542 -5.100 842 HD2 PHE 17 HD2 PHE 17 -7.376 1.923 -7.420 843 HE1 PHE 17 HE1 PHE 17 -9.564 0.952 -3.135 844 HE2 PHE 17 HE2 PHE 17 -6.016 1.345 -5.451 845 HZ PHE 17 HZ PHE 17 -7.111 0.860 -3.307 846 H VAL 18 HN VAL 18 -11.213 -0.533 -6.870 847 HA VAL 18 HA VAL 18 -8.842 -2.018 -6.300 848 HB VAL 18 HB VAL 18 -10.153 -1.678 -4.397 849 HG11 VAL 18 HG11 VAL 18 -12.528 -2.279 -4.246 850 HG12 VAL 18 HG12 VAL 18 -12.509 -2.748 -5.958 851 HG13 VAL 18 HG13 VAL 18 -12.244 -1.064 -5.502 852 HG21 VAL 18 HG21 VAL 18 -10.614 -4.447 -5.469 853 HG22 VAL 18 HG22 VAL 18 -10.983 -3.965 -3.808 854 HG23 VAL 18 HG23 VAL 18 -9.319 -3.898 -4.395 855 H ALA 19 HN ALA 19 -11.836 -2.647 -8.099 856 HA ALA 19 HA ALA 19 -11.485 -5.396 -8.472 857 HB1 ALA 19 HB1 ALA 19 -12.655 -3.469 -10.480 858 HB2 ALA 19 HB2 ALA 19 -13.529 -4.165 -9.115 859 HB3 ALA 19 HB3 ALA 19 -12.926 -5.210 -10.402 860 H ARG 20 HN ARG 20 -9.861 -2.710 -10.093 861 HA ARG 20 HA ARG 20 -8.603 -4.567 -11.935 862 HB2 ARG 20 HB2 ARG 20 -7.321 -2.632 -12.757 863 HB3 ARG 20 HB1 ARG 20 -9.050 -2.347 -12.817 864 HG2 ARG 20 HG2 ARG 20 -8.980 -0.750 -11.164 865 HG3 ARG 20 HG1 ARG 20 -7.481 -1.378 -10.472 866 HD2 ARG 20 HD2 ARG 20 -6.200 -0.536 -12.298 867 HD3 ARG 20 HD1 ARG 20 -7.646 -0.122 -13.196 868 HE ARG 20 HE ARG 20 -7.929 1.416 -11.033 869 HH11 ARG 20 HH11 ARG 20 -5.184 0.856 -13.127 870 HH12 ARG 20 HH12 ARG 20 -4.506 2.430 -12.882 871 HH21 ARG 20 HH21 ARG 20 -7.066 3.513 -10.734 872 HH22 ARG 20 HH22 ARG 20 -5.568 3.937 -11.510 873 H LEU 21 HN LEU 21 -8.092 -2.983 -8.933 874 HA LEU 21 HA LEU 21 -5.406 -3.474 -8.472 875 HB2 LEU 21 HB2 LEU 21 -7.256 -2.251 -7.085 876 HB3 LEU 21 HB1 LEU 21 -7.508 -3.814 -6.351 877 HG LEU 21 HG LEU 21 -5.456 -3.767 -5.242 878 HD11 LEU 21 HD11 LEU 21 -4.654 -1.561 -7.124 879 HD12 LEU 21 HD12 LEU 21 -3.961 -3.180 -7.015 880 HD13 LEU 21 HD13 LEU 21 -3.720 -2.026 -5.699 881 HD21 LEU 21 HD21 LEU 21 -5.382 -1.536 -4.169 882 HD22 LEU 21 HD22 LEU 21 -6.988 -2.261 -4.228 883 HD23 LEU 21 HD23 LEU 21 -6.555 -0.981 -5.362 884 H GLN 22 HN GLN 22 -8.256 -5.481 -7.881 885 HA GLN 22 HA GLN 22 -6.900 -7.785 -7.010 886 HB2 GLN 22 HB2 GLN 22 -9.556 -7.849 -8.381 887 HB3 GLN 22 HB1 GLN 22 -8.954 -8.845 -7.053 888 HG2 GLN 22 HG2 GLN 22 -9.070 -6.855 -5.628 889 HG3 GLN 22 HG1 GLN 22 -9.768 -5.965 -6.964 890 HE21 GLN 22 HE21 GLN 22 -10.850 -6.409 -4.448 891 HE22 GLN 22 HE22 GLN 22 -12.323 -7.295 -4.621 892 H ASP 23 HN ASP 23 -8.316 -6.829 -10.055 893 HA ASP 23 HA ASP 23 -7.994 -9.134 -11.518 894 HB2 ASP 23 HB2 ASP 23 -8.954 -6.851 -12.209 895 HB3 ASP 23 HB1 ASP 23 -7.299 -6.480 -12.689 896 H VAL 24 HN VAL 24 -5.567 -6.560 -11.127 897 HA VAL 24 HA VAL 24 -3.707 -8.050 -12.753 898 HB VAL 24 HB VAL 24 -3.727 -5.616 -12.949 899 HG11 VAL 24 HG11 VAL 24 -4.443 -5.070 -10.707 900 HG12 VAL 24 HG12 VAL 24 -2.962 -4.200 -11.104 901 HG13 VAL 24 HG13 VAL 24 -2.900 -5.620 -10.059 902 HG21 VAL 24 HG21 VAL 24 -1.615 -6.649 -13.446 903 HG22 VAL 24 HG22 VAL 24 -1.190 -6.712 -11.739 904 HG23 VAL 24 HG23 VAL 24 -1.288 -5.153 -12.561 905 H ALA 25 HN ALA 25 -4.472 -7.619 -9.423 906 HA ALA 25 HA ALA 25 -2.015 -8.649 -8.362 907 HB1 ALA 25 HB1 ALA 25 -3.268 -8.929 -6.268 908 HB2 ALA 25 HB2 ALA 25 -4.771 -8.574 -7.115 909 HB3 ALA 25 HB3 ALA 25 -3.539 -7.325 -6.949 910 H GLN 26 HN GLN 26 -4.759 -9.800 -9.910 911 HA GLN 26 HA GLN 26 -4.485 -12.529 -9.029 912 HB2 GLN 26 HB2 GLN 26 -6.655 -12.372 -9.502 913 HB3 GLN 26 HB1 GLN 26 -6.394 -10.855 -10.346 914 HG2 GLN 26 HG2 GLN 26 -7.234 -12.069 -12.036 915 HG3 GLN 26 HG1 GLN 26 -5.531 -12.468 -12.239 916 HE21 GLN 26 HE21 GLN 26 -5.487 -14.145 -9.863 917 HE22 GLN 26 HE22 GLN 26 -6.277 -15.607 -10.293 918 H LYS 27 HN LYS 27 -3.792 -10.521 -11.792 919 HA LYS 27 HA LYS 27 -2.921 -12.523 -13.575 920 HB2 LYS 27 HB2 LYS 27 -2.043 -9.635 -13.455 921 HB3 LYS 27 HB1 LYS 27 -1.962 -10.702 -14.860 922 HG2 LYS 27 HG2 LYS 27 -4.459 -9.729 -13.497 923 HG3 LYS 27 HG1 LYS 27 -3.827 -9.175 -15.048 924 HD2 LYS 27 HD2 LYS 27 -4.426 -11.122 -16.129 925 HD3 LYS 27 HD1 LYS 27 -4.420 -12.073 -14.643 926 HE2 LYS 27 HE2 LYS 27 -6.450 -11.148 -13.917 927 HE3 LYS 27 HE1 LYS 27 -6.375 -9.858 -15.110 928 HZ1 LYS 27 HZ1 LYS 27 -7.979 -11.572 -15.706 929 HZ2 LYS 27 HZ2 LYS 27 -6.756 -12.739 -15.717 930 HZ3 LYS 27 HZ3 LYS 27 -6.736 -11.482 -16.848 931 H SER 28 HN SER 28 -1.230 -10.729 -11.059 932 HA SER 28 HA SER 28 1.309 -11.796 -12.055 933 HB2 SER 28 HB2 SER 28 0.760 -9.577 -10.092 934 HB3 SER 28 HB1 SER 28 2.356 -10.053 -10.677 935 HG SER 28 HG SER 28 0.334 -9.358 -12.510 936 H ILE 29 HN ILE 29 -1.034 -12.336 -9.755 937 HA ILE 29 HA ILE 29 0.900 -13.613 -7.939 938 HB ILE 29 HB ILE 29 -1.872 -12.580 -7.403 939 HG12 ILE 29 HG12 ILE 29 0.784 -11.790 -6.208 940 HG13 ILE 29 HG11 ILE 29 -0.093 -10.889 -7.448 941 HG21 ILE 29 HG21 ILE 29 -1.665 -14.602 -6.172 942 HG22 ILE 29 HG22 ILE 29 -1.508 -13.239 -5.062 943 HG23 ILE 29 HG23 ILE 29 -0.071 -14.135 -5.574 944 HD11 ILE 29 HD11 ILE 29 -0.387 -10.040 -5.126 945 HD12 ILE 29 HD12 ILE 29 -1.246 -11.547 -4.761 946 HD13 ILE 29 HD13 ILE 29 -1.878 -10.434 -5.983 947 H ALA 30 HN ALA 30 0.846 -15.757 -7.728 948 HA ALA 30 HA ALA 30 -1.164 -17.245 -9.218 949 HB1 ALA 30 HB1 ALA 30 1.198 -17.788 -9.562 950 HB2 ALA 30 HB2 ALA 30 0.303 -19.164 -8.918 951 HB3 ALA 30 HB3 ALA 30 1.347 -18.216 -7.860 952 H ASP 31 HN ASP 31 -0.971 -16.042 -6.181 953 HA ASP 31 HA ASP 31 -2.396 -18.350 -5.040 954 HB2 ASP 31 HB2 ASP 31 -0.035 -17.352 -4.090 955 HB3 ASP 31 HB1 ASP 31 -1.229 -16.491 -3.117 956 H GLU 32 HN GLU 32 -4.384 -18.019 -4.449 957 HA GLU 32 HA GLU 32 -5.798 -15.625 -4.669 958 HB2 GLU 32 HB2 GLU 32 -7.554 -16.769 -3.417 959 HB3 GLU 32 HB1 GLU 32 -6.821 -17.877 -4.571 960 HG2 GLU 32 HG2 GLU 32 -5.405 -18.766 -2.698 961 HG3 GLU 32 HG1 GLU 32 -6.357 -17.762 -1.603 962 H LYS 33 HN LYS 33 -3.889 -16.897 -2.027 963 HA LYS 33 HA LYS 33 -4.992 -15.367 0.079 964 HB2 LYS 33 HB2 LYS 33 -2.155 -16.374 -0.239 965 HB3 LYS 33 HB1 LYS 33 -2.878 -15.810 1.249 966 HG2 LYS 33 HG2 LYS 33 -3.915 -17.727 1.624 967 HG3 LYS 33 HG1 LYS 33 -4.290 -17.990 -0.076 968 HD2 LYS 33 HD2 LYS 33 -2.097 -18.768 -0.511 969 HD3 LYS 33 HD1 LYS 33 -1.534 -18.280 1.094 970 HE2 LYS 33 HE2 LYS 33 -3.288 -19.917 1.987 971 HE3 LYS 33 HE1 LYS 33 -3.353 -20.531 0.336 972 HZ1 LYS 33 HZ1 LYS 33 -1.087 -21.138 0.427 973 HZ2 LYS 33 HZ2 LYS 33 -1.799 -21.732 1.837 974 HZ3 LYS 33 HZ3 LYS 33 -0.842 -20.333 1.897 975 H ALA 34 HN ALA 34 -1.975 -14.966 -1.709 976 HA ALA 34 HA ALA 34 -1.407 -12.393 -0.766 977 HB1 ALA 34 HB1 ALA 34 0.188 -12.308 -2.683 978 HB2 ALA 34 HB2 ALA 34 -0.487 -13.837 -3.254 979 HB3 ALA 34 HB3 ALA 34 0.334 -13.762 -1.696 980 H ARG 35 HN ARG 35 -3.563 -13.548 -3.210 981 HA ARG 35 HA ARG 35 -3.663 -11.147 -4.773 982 HB2 ARG 35 HB2 ARG 35 -4.486 -13.624 -5.304 983 HB3 ARG 35 HB1 ARG 35 -5.992 -13.013 -4.637 984 HG2 ARG 35 HG2 ARG 35 -4.606 -11.462 -6.788 985 HG3 ARG 35 HG1 ARG 35 -5.527 -12.902 -7.208 986 HD2 ARG 35 HD2 ARG 35 -6.553 -10.427 -5.818 987 HD3 ARG 35 HD1 ARG 35 -6.904 -10.954 -7.470 988 HE ARG 35 HE ARG 35 -7.712 -12.598 -5.164 989 HH11 ARG 35 HH11 ARG 35 -8.501 -10.836 -8.082 990 HH12 ARG 35 HH12 ARG 35 -10.149 -11.365 -8.108 991 HH21 ARG 35 HH21 ARG 35 -9.897 -13.278 -5.182 992 HH22 ARG 35 HH22 ARG 35 -10.945 -12.745 -6.457 993 H LYS 36 HN LYS 36 -5.879 -12.644 -2.409 994 HA LYS 36 HA LYS 36 -7.656 -10.489 -2.158 995 HB2 LYS 36 HB2 LYS 36 -6.791 -12.327 0.062 996 HB3 LYS 36 HB1 LYS 36 -8.294 -11.419 -0.039 997 HG2 LYS 36 HG2 LYS 36 -9.261 -12.901 -1.400 998 HG3 LYS 36 HG1 LYS 36 -7.739 -13.306 -2.228 999 HD2 LYS 36 HD2 LYS 36 -8.465 -15.189 -0.889 1000 HD3 LYS 36 HD1 LYS 36 -6.990 -14.465 -0.203 1001 HE2 LYS 36 HE2 LYS 36 -8.620 -13.077 1.254 1002 HE3 LYS 36 HE1 LYS 36 -9.840 -14.251 0.762 1003 HZ1 LYS 36 HZ1 LYS 36 -8.515 -16.024 1.707 1004 HZ2 LYS 36 HZ2 LYS 36 -8.837 -14.850 2.878 1005 HZ3 LYS 36 HZ3 LYS 36 -7.312 -14.927 2.161 1006 H VAL 37 HN VAL 37 -4.871 -11.381 -0.154 1007 HA VAL 37 HA VAL 37 -5.263 -9.457 1.778 1008 HB VAL 37 HB VAL 37 -2.974 -9.747 2.505 1009 HG11 VAL 37 HG11 VAL 37 -4.321 -12.261 1.545 1010 HG12 VAL 37 HG12 VAL 37 -4.417 -11.514 3.146 1011 HG13 VAL 37 HG13 VAL 37 -2.910 -12.259 2.607 1012 HG21 VAL 37 HG21 VAL 37 -1.437 -11.220 1.181 1013 HG22 VAL 37 HG22 VAL 37 -1.739 -9.629 0.484 1014 HG23 VAL 37 HG23 VAL 37 -2.554 -11.048 -0.173 1015 H ILE 38 HN ILE 38 -3.584 -9.163 -1.314 1016 HA ILE 38 HA ILE 38 -2.700 -6.525 -0.546 1017 HB ILE 38 HB ILE 38 -1.527 -8.341 -2.184 1018 HG12 ILE 38 HG12 ILE 38 -1.146 -5.378 -2.474 1019 HG13 ILE 38 HG11 ILE 38 -0.705 -6.222 -0.995 1020 HG21 ILE 38 HG21 ILE 38 -1.582 -7.521 -4.454 1021 HG22 ILE 38 HG22 ILE 38 -2.682 -6.222 -3.993 1022 HG23 ILE 38 HG23 ILE 38 -3.233 -7.899 -3.949 1023 HD11 ILE 38 HD11 ILE 38 1.265 -6.102 -2.131 1024 HD12 ILE 38 HD12 ILE 38 0.502 -6.307 -3.695 1025 HD13 ILE 38 HD13 ILE 38 0.686 -7.696 -2.615 1026 H VAL 39 HN VAL 39 -5.263 -7.902 -2.529 1027 HA VAL 39 HA VAL 39 -5.919 -5.379 -3.661 1028 HB VAL 39 HB VAL 39 -7.900 -6.280 -4.480 1029 HG11 VAL 39 HG11 VAL 39 -7.265 -8.479 -5.397 1030 HG12 VAL 39 HG12 VAL 39 -5.913 -8.523 -4.272 1031 HG13 VAL 39 HG13 VAL 39 -5.983 -7.271 -5.512 1032 HG21 VAL 39 HG21 VAL 39 -8.968 -8.351 -3.729 1033 HG22 VAL 39 HG22 VAL 39 -8.902 -7.148 -2.442 1034 HG23 VAL 39 HG23 VAL 39 -7.767 -8.498 -2.444 1035 H GLU 40 HN GLU 40 -7.245 -7.195 -0.926 1036 HA GLU 40 HA GLU 40 -8.909 -5.235 0.102 1037 HB2 GLU 40 HB2 GLU 40 -7.503 -7.578 1.333 1038 HB3 GLU 40 HB1 GLU 40 -8.663 -6.602 2.208 1039 HG2 GLU 40 HG2 GLU 40 -10.411 -7.201 0.778 1040 HG3 GLU 40 HG1 GLU 40 -9.334 -7.845 -0.426 1041 H LEU 41 HN LEU 41 -5.465 -5.587 0.332 1042 HA LEU 41 HA LEU 41 -5.278 -3.667 2.498 1043 HB2 LEU 41 HB2 LEU 41 -3.548 -5.592 1.370 1044 HB3 LEU 41 HB1 LEU 41 -2.775 -4.030 1.170 1045 HG LEU 41 HG LEU 41 -1.972 -4.797 3.216 1046 HD11 LEU 41 HD11 LEU 41 -4.347 -3.210 4.110 1047 HD12 LEU 41 HD12 LEU 41 -3.012 -2.493 3.212 1048 HD13 LEU 41 HD13 LEU 41 -2.718 -3.238 4.777 1049 HD21 LEU 41 HD21 LEU 41 -3.375 -5.747 4.975 1050 HD22 LEU 41 HD22 LEU 41 -3.454 -6.692 3.487 1051 HD23 LEU 41 HD23 LEU 41 -4.782 -5.614 3.919 1052 H MET 42 HN MET 42 -4.179 -3.704 -0.907 1053 HA MET 42 HA MET 42 -3.285 -1.028 -0.924 1054 HB2 MET 42 HB2 MET 42 -4.190 -2.750 -3.227 1055 HB3 MET 42 HB1 MET 42 -3.312 -1.224 -3.396 1056 HG2 MET 42 HG2 MET 42 -2.362 -3.802 -2.178 1057 HG3 MET 42 HG1 MET 42 -1.762 -2.989 -3.612 1058 HE1 MET 42 HE1 MET 42 0.686 -3.338 -2.699 1059 HE2 MET 42 HE2 MET 42 0.026 -4.111 -1.255 1060 HE3 MET 42 HE3 MET 42 1.210 -2.812 -1.095 1061 H ALA 43 HN ALA 43 -6.346 -2.489 -1.248 1062 HA ALA 43 HA ALA 43 -7.978 -0.598 -2.306 1063 HB1 ALA 43 HB1 ALA 43 -8.327 -2.285 0.158 1064 HB2 ALA 43 HB2 ALA 43 -8.839 -2.655 -1.488 1065 HB3 ALA 43 HB3 ALA 43 -9.630 -1.357 -0.588 1066 H TYR 44 HN TYR 44 -6.167 -0.486 0.692 1067 HA TYR 44 HA TYR 44 -7.287 2.178 1.322 1068 HB2 TYR 44 HB2 TYR 44 -7.454 0.676 3.222 1069 HB3 TYR 44 HB1 TYR 44 -5.787 0.180 2.998 1070 HD1 TYR 44 HD1 TYR 44 -7.964 2.447 4.719 1071 HD2 TYR 44 HD2 TYR 44 -3.952 1.931 3.445 1072 HE1 TYR 44 HE1 TYR 44 -7.233 4.077 6.396 1073 HE2 TYR 44 HE2 TYR 44 -3.207 3.568 5.104 1074 HH TYR 44 HH TYR 44 -5.115 4.602 7.652 1075 H GLU 45 HN GLU 45 -4.249 0.418 1.775 1076 HA GLU 45 HA GLU 45 -2.545 2.454 2.060 1077 HB2 GLU 45 HB2 GLU 45 -1.726 0.144 0.389 1078 HB3 GLU 45 HB1 GLU 45 -0.815 0.975 1.639 1079 HG2 GLU 45 HG2 GLU 45 -3.176 -0.796 2.066 1080 HG3 GLU 45 HG1 GLU 45 -1.512 -1.279 2.289 1081 H ASN 46 HN ASN 46 -3.901 1.357 -1.003 1082 HA ASN 46 HA ASN 46 -2.105 3.154 -2.438 1083 HB2 ASN 46 HB2 ASN 46 -3.518 0.631 -3.111 1084 HB3 ASN 46 HB1 ASN 46 -3.296 1.805 -4.396 1085 HD21 ASN 46 HD21 ASN 46 -1.841 0.442 -5.525 1086 HD22 ASN 46 HD22 ASN 46 -0.251 0.162 -4.945 1087 H ALA 47 HN ALA 47 -5.369 2.800 -1.418 1088 HA ALA 47 HA ALA 47 -6.770 3.925 -3.570 1089 HB1 ALA 47 HB1 ALA 47 -7.484 4.067 -0.655 1090 HB2 ALA 47 HB2 ALA 47 -7.858 2.726 -1.742 1091 HB3 ALA 47 HB3 ALA 47 -8.576 4.317 -2.016 1092 H ASN 48 HN ASN 48 -8.202 5.912 -3.065 1093 HA ASN 48 HA ASN 48 -6.653 8.222 -3.287 1094 HB2 ASN 48 HB2 ASN 48 -9.526 7.572 -2.956 1095 HB3 ASN 48 HB1 ASN 48 -9.057 9.184 -2.415 1096 HD21 ASN 48 HD21 ASN 48 -10.559 7.999 -4.858 1097 HD22 ASN 48 HD22 ASN 48 -9.807 8.803 -6.194 1098 HA PRO 49 HA PRO 49 -5.175 8.965 0.764 1099 HB2 PRO 49 HB2 PRO 49 -5.349 11.748 0.709 1100 HB3 PRO 49 HB1 PRO 49 -3.988 10.793 0.122 1101 HG2 PRO 49 HG2 PRO 49 -6.239 12.028 -1.388 1102 HG3 PRO 49 HG1 PRO 49 -4.541 11.827 -1.860 1103 HD2 PRO 49 HD2 PRO 49 -6.482 10.258 -2.855 1104 HD3 PRO 49 HD1 PRO 49 -4.855 9.628 -2.518 1105 H GLU 50 HN GLU 50 -8.164 10.317 -0.296 1106 HA GLU 50 HA GLU 50 -9.178 10.840 2.342 1107 HB2 GLU 50 HB2 GLU 50 -10.148 12.356 0.959 1108 HB3 GLU 50 HB1 GLU 50 -10.030 11.318 -0.452 1109 HG2 GLU 50 HG2 GLU 50 -12.190 10.955 -0.246 1110 HG3 GLU 50 HG1 GLU 50 -11.836 10.068 1.214 1111 H CYS 51 HN CYS 51 -9.189 8.307 -0.061 1112 HA CYS 51 HA CYS 51 -11.642 7.208 0.907 1113 HB2 CYS 51 HB2 CYS 51 -11.146 7.174 -1.451 1114 HB3 CYS 51 HB1 CYS 51 -9.735 6.159 -1.172 1115 HG CYS 51 HG CYS 51 -11.572 4.297 0.253 1116 H GLN 52 HN GLN 52 -8.229 6.456 1.001 1117 HA GLN 52 HA GLN 52 -8.591 4.062 2.504 1118 HB2 GLN 52 HB2 GLN 52 -6.253 4.247 3.058 1119 HB3 GLN 52 HB1 GLN 52 -6.468 4.623 1.357 1120 HG2 GLN 52 HG2 GLN 52 -6.370 7.033 1.955 1121 HG3 GLN 52 HG1 GLN 52 -5.964 6.552 3.604 1122 HE21 GLN 52 HE21 GLN 52 -4.558 4.204 2.622 1123 HE22 GLN 52 HE22 GLN 52 -3.055 4.737 2.004 1124 H SER 53 HN SER 53 -8.453 7.402 3.038 1125 HA SER 53 HA SER 53 -8.515 7.401 5.851 1126 HB2 SER 53 HB2 SER 53 -9.099 9.337 3.664 1127 HB3 SER 53 HB1 SER 53 -9.431 9.771 5.349 1128 HG SER 53 HG SER 53 -7.083 9.729 4.040 1129 H ALA 54 HN ALA 54 -10.927 6.919 3.373 1130 HA ALA 54 HA ALA 54 -13.093 6.984 5.285 1131 HB1 ALA 54 HB1 ALA 54 -14.293 5.744 3.401 1132 HB2 ALA 54 HB2 ALA 54 -12.823 6.027 2.458 1133 HB3 ALA 54 HB3 ALA 54 -13.755 7.391 3.083 1134 H ILE 55 HN ILE 55 -10.685 4.810 4.329 1135 HA ILE 55 HA ILE 55 -12.173 2.458 5.063 1136 HB ILE 55 HB ILE 55 -9.496 2.879 3.806 1137 HG12 ILE 55 HG12 ILE 55 -11.784 1.327 2.688 1138 HG13 ILE 55 HG11 ILE 55 -11.860 3.094 2.692 1139 HG21 ILE 55 HG21 ILE 55 -9.377 0.437 3.532 1140 HG22 ILE 55 HG22 ILE 55 -10.787 0.273 4.578 1141 HG23 ILE 55 HG23 ILE 55 -9.284 0.932 5.223 1142 HD11 ILE 55 HD11 ILE 55 -11.015 2.121 0.597 1143 HD12 ILE 55 HD12 ILE 55 -9.618 1.485 1.489 1144 HD13 ILE 55 HD13 ILE 55 -9.881 3.234 1.377 1145 H LYS 56 HN LYS 56 -9.508 4.357 6.466 1146 HA LYS 56 HA LYS 56 -8.174 2.522 7.928 1147 HB2 LYS 56 HB2 LYS 56 -8.696 4.621 9.812 1148 HB3 LYS 56 HB1 LYS 56 -7.202 4.177 9.016 1149 HG2 LYS 56 HG2 LYS 56 -7.401 6.341 8.361 1150 HG3 LYS 56 HG1 LYS 56 -8.253 5.548 7.033 1151 HD2 LYS 56 HD2 LYS 56 -10.248 6.307 7.667 1152 HD3 LYS 56 HD1 LYS 56 -9.883 6.209 9.390 1153 HE2 LYS 56 HE2 LYS 56 -9.137 8.429 7.455 1154 HE3 LYS 56 HE1 LYS 56 -10.177 8.518 8.872 1155 HZ1 LYS 56 HZ1 LYS 56 -8.096 9.471 9.443 1156 HZ2 LYS 56 HZ2 LYS 56 -7.238 8.128 8.870 1157 HZ3 LYS 56 HZ3 LYS 56 -8.205 7.988 10.251 1158 HA PRO 57 HA PRO 57 -11.584 2.331 11.488 1159 HB2 PRO 57 HB2 PRO 57 -14.123 2.375 10.502 1160 HB3 PRO 57 HB1 PRO 57 -13.308 3.818 11.126 1161 HG2 PRO 57 HG2 PRO 57 -13.467 2.833 8.287 1162 HG3 PRO 57 HG1 PRO 57 -13.890 4.446 8.914 1163 HD2 PRO 57 HD2 PRO 57 -11.543 4.070 7.795 1164 HD3 PRO 57 HD1 PRO 57 -11.607 4.969 9.321 1165 H LEU 58 HN LEU 58 -11.905 1.158 8.210 1166 HA LEU 58 HA LEU 58 -12.888 -1.459 9.111 1167 HB2 LEU 58 HB2 LEU 58 -12.389 -0.926 6.250 1168 HB3 LEU 58 HB1 LEU 58 -13.707 -1.817 6.996 1169 HG LEU 58 HG LEU 58 -13.466 1.193 6.844 1170 HD11 LEU 58 HD11 LEU 58 -13.805 0.277 4.659 1171 HD12 LEU 58 HD12 LEU 58 -15.337 0.953 5.222 1172 HD13 LEU 58 HD13 LEU 58 -15.077 -0.790 5.252 1173 HD21 LEU 58 HD21 LEU 58 -15.761 -0.541 7.759 1174 HD22 LEU 58 HD22 LEU 58 -15.771 1.217 7.619 1175 HD23 LEU 58 HD23 LEU 58 -14.724 0.435 8.802 1176 H LYS 59 HN LYS 59 -10.187 0.298 8.172 1177 HA LYS 59 HA LYS 59 -8.642 -1.498 6.754 1178 HB2 LYS 59 HB2 LYS 59 -7.908 0.765 7.070 1179 HB3 LYS 59 HB1 LYS 59 -7.795 0.528 8.806 1180 HG2 LYS 59 HG2 LYS 59 -5.612 0.247 8.334 1181 HG3 LYS 59 HG1 LYS 59 -6.146 -1.391 7.991 1182 HD2 LYS 59 HD2 LYS 59 -5.833 0.793 5.970 1183 HD3 LYS 59 HD1 LYS 59 -4.684 -0.526 6.222 1184 HE2 LYS 59 HE2 LYS 59 -7.560 -0.770 5.306 1185 HE3 LYS 59 HE1 LYS 59 -6.129 -0.985 4.315 1186 HZ1 LYS 59 HZ1 LYS 59 -5.527 -2.897 5.675 1187 HZ2 LYS 59 HZ2 LYS 59 -7.046 -3.101 4.946 1188 HZ3 LYS 59 HZ3 LYS 59 -6.938 -2.701 6.584 1189 H GLY 60 HN GLY 60 -8.352 -3.532 7.218 1190 HA2 GLY 60 HA3 GLY 60 -7.154 -5.238 8.324 1191 HA3 GLY 60 HA2 GLY 60 -7.098 -4.228 9.765 1192 H LYS 61 HN LYS 61 -10.066 -3.657 9.235 1193 HA LYS 61 HA LYS 61 -11.008 -6.042 10.672 1194 HB2 LYS 61 HB2 LYS 61 -12.709 -3.621 10.470 1195 HB3 LYS 61 HB1 LYS 61 -12.397 -4.657 11.855 1196 HG2 LYS 61 HG2 LYS 61 -10.496 -2.597 10.782 1197 HG3 LYS 61 HG1 LYS 61 -11.569 -2.360 12.149 1198 HD2 LYS 61 HD2 LYS 61 -9.475 -4.518 12.022 1199 HD3 LYS 61 HD1 LYS 61 -9.198 -2.928 12.733 1200 HE2 LYS 61 HE2 LYS 61 -11.020 -3.318 14.305 1201 HE3 LYS 61 HE1 LYS 61 -11.291 -4.908 13.597 1202 HZ1 LYS 61 HZ1 LYS 61 -8.760 -4.052 14.892 1203 HZ2 LYS 61 HZ2 LYS 61 -9.122 -5.600 14.313 1204 HZ3 LYS 61 HZ3 LYS 61 -9.957 -4.978 15.645 1205 H VAL 62 HN VAL 62 -11.929 -7.445 9.305 1206 HA VAL 62 HA VAL 62 -13.930 -6.372 7.436 1207 HB VAL 62 HB VAL 62 -12.093 -7.365 6.178 1208 HG11 VAL 62 HG11 VAL 62 -11.556 -9.756 6.338 1209 HG12 VAL 62 HG12 VAL 62 -12.620 -9.887 7.741 1210 HG13 VAL 62 HG13 VAL 62 -11.174 -8.880 7.821 1211 HG21 VAL 62 HG21 VAL 62 -14.267 -7.618 5.210 1212 HG22 VAL 62 HG22 VAL 62 -14.575 -9.065 6.170 1213 HG23 VAL 62 HG23 VAL 62 -13.341 -9.088 4.910 1214 HA PRO 63 HA PRO 63 -17.070 -8.796 9.646 1215 HB2 PRO 63 HB2 PRO 63 -17.770 -9.446 6.820 1216 HB3 PRO 63 HB1 PRO 63 -18.828 -9.014 8.148 1217 HG2 PRO 63 HG2 PRO 63 -18.212 -7.221 6.293 1218 HG3 PRO 63 HG1 PRO 63 -18.324 -6.752 7.998 1219 HD2 PRO 63 HD2 PRO 63 -15.922 -7.102 6.291 1220 HD3 PRO 63 HD1 PRO 63 -16.172 -6.035 7.686 1221 H ALA 64 HN ALA 64 -17.158 -10.914 10.243 1222 HA ALA 64 HA ALA 64 -14.922 -12.501 9.677 1223 HB1 ALA 64 HB1 ALA 64 -15.968 -14.187 11.082 1224 HB2 ALA 64 HB2 ALA 64 -17.508 -13.334 10.981 1225 HB3 ALA 64 HB3 ALA 64 -16.137 -12.584 11.799 1226 H GLY 65 HN GLY 65 -14.696 -13.037 7.538 1227 HA2 GLY 65 HA3 GLY 65 -14.885 -14.967 6.129 1228 HA3 GLY 65 HA2 GLY 65 -16.566 -15.108 6.616 1229 H SER 66 HN SER 66 -16.206 -11.904 6.135 1230 HA SER 66 HA SER 66 -17.259 -12.140 3.416 1231 HB2 SER 66 HB2 SER 66 -17.148 -9.695 5.184 1232 HB3 SER 66 HB1 SER 66 -18.106 -9.908 3.720 1233 HG SER 66 HG SER 66 -18.744 -11.910 5.269 1234 H ASP 67 HN ASP 67 -16.713 -10.028 2.100 1235 HA ASP 67 HA ASP 67 -13.846 -10.075 1.607 1236 HB2 ASP 67 HB2 ASP 67 -15.843 -10.084 -0.113 1237 HB3 ASP 67 HB1 ASP 67 -15.841 -8.355 0.168 1238 H VAL 68 HN VAL 68 -12.427 -8.283 2.035 1239 HA VAL 68 HA VAL 68 -13.645 -6.259 3.714 1240 HB VAL 68 HB VAL 68 -11.648 -5.731 4.519 1241 HG11 VAL 68 HG11 VAL 68 -9.903 -7.382 4.371 1242 HG12 VAL 68 HG12 VAL 68 -10.657 -8.079 2.938 1243 HG13 VAL 68 HG13 VAL 68 -11.483 -8.155 4.493 1244 HG21 VAL 68 HG21 VAL 68 -9.634 -5.286 3.156 1245 HG22 VAL 68 HG22 VAL 68 -11.046 -4.335 2.685 1246 HG23 VAL 68 HG23 VAL 68 -10.556 -5.724 1.718 1247 H ILE 69 HN ILE 69 -12.656 -6.633 0.449 1248 HA ILE 69 HA ILE 69 -12.414 -3.954 -0.280 1249 HB ILE 69 HB ILE 69 -13.221 -6.374 -1.863 1250 HG12 ILE 69 HG12 ILE 69 -10.955 -6.541 -1.237 1251 HG13 ILE 69 HG11 ILE 69 -10.923 -5.914 -2.876 1252 HG21 ILE 69 HG21 ILE 69 -14.243 -4.518 -2.975 1253 HG22 ILE 69 HG22 ILE 69 -12.811 -4.978 -3.902 1254 HG23 ILE 69 HG23 ILE 69 -12.770 -3.559 -2.853 1255 HD11 ILE 69 HD11 ILE 69 -9.318 -4.747 -1.579 1256 HD12 ILE 69 HD12 ILE 69 -10.531 -4.362 -0.349 1257 HD13 ILE 69 HD13 ILE 69 -10.645 -3.642 -1.954 1258 H SER 70 HN SER 70 -15.122 -6.131 -0.368 1259 HA SER 70 HA SER 70 -17.157 -4.621 -1.323 1260 HB2 SER 70 HB2 SER 70 -17.490 -6.917 -0.643 1261 HB3 SER 70 HB1 SER 70 -17.159 -6.524 1.041 1262 HG SER 70 HG SER 70 -19.393 -5.753 -0.530 1263 H GLU 71 HN GLU 71 -15.691 -4.354 1.859 1264 HA GLU 71 HA GLU 71 -17.552 -2.391 2.831 1265 HB2 GLU 71 HB2 GLU 71 -14.972 -3.330 4.051 1266 HB3 GLU 71 HB1 GLU 71 -16.361 -2.622 4.874 1267 HG2 GLU 71 HG2 GLU 71 -16.816 -5.082 3.324 1268 HG3 GLU 71 HG1 GLU 71 -15.895 -5.226 4.811 1269 H TYR 72 HN TYR 72 -14.374 -2.557 1.502 1270 HA TYR 72 HA TYR 72 -13.562 0.037 2.368 1271 HB2 TYR 72 HB2 TYR 72 -12.442 -2.029 0.491 1272 HB3 TYR 72 HB1 TYR 72 -11.707 -0.439 0.637 1273 HD1 TYR 72 HD1 TYR 72 -13.210 -1.835 3.619 1274 HD2 TYR 72 HD2 TYR 72 -9.630 -1.579 1.354 1275 HE1 TYR 72 HE1 TYR 72 -11.931 -2.621 5.552 1276 HE2 TYR 72 HE2 TYR 72 -8.340 -2.383 3.283 1277 HH TYR 72 HH TYR 72 -9.933 -3.586 6.153 1278 H VAL 73 HN VAL 73 -14.902 -1.411 -0.516 1279 HA VAL 73 HA VAL 73 -14.939 0.978 -2.064 1280 HB VAL 73 HB VAL 73 -16.164 -0.089 -3.685 1281 HG11 VAL 73 HG11 VAL 73 -15.430 -2.402 -3.902 1282 HG12 VAL 73 HG12 VAL 73 -14.901 -2.373 -2.220 1283 HG13 VAL 73 HG13 VAL 73 -14.133 -1.322 -3.404 1284 HG21 VAL 73 HG21 VAL 73 -17.877 -1.631 -3.472 1285 HG22 VAL 73 HG22 VAL 73 -18.075 -0.591 -2.054 1286 HG23 VAL 73 HG23 VAL 73 -17.318 -2.179 -1.886 1287 H LYS 74 HN LYS 74 -16.962 -0.560 0.281 1288 HA LYS 74 HA LYS 74 -19.245 1.113 0.032 1289 HB2 LYS 74 HB2 LYS 74 -19.413 -1.067 0.973 1290 HB3 LYS 74 HB1 LYS 74 -18.171 -0.721 2.158 1291 HG2 LYS 74 HG2 LYS 74 -19.971 1.176 2.761 1292 HG3 LYS 74 HG1 LYS 74 -21.030 -0.096 2.155 1293 HD2 LYS 74 HD2 LYS 74 -20.746 -0.346 4.549 1294 HD3 LYS 74 HD1 LYS 74 -19.977 -1.691 3.703 1295 HE2 LYS 74 HE2 LYS 74 -17.800 -0.571 3.915 1296 HE3 LYS 74 HE1 LYS 74 -18.580 0.752 4.786 1297 HZ1 LYS 74 HZ1 LYS 74 -17.593 -0.750 6.355 1298 HZ2 LYS 74 HZ2 LYS 74 -18.407 -2.079 5.692 1299 HZ3 LYS 74 HZ3 LYS 74 -19.274 -0.861 6.490 1300 H ALA 75 HN ALA 75 -16.195 1.258 1.660 1301 HA ALA 75 HA ALA 75 -16.720 3.392 3.436 1302 HB1 ALA 75 HB1 ALA 75 -14.728 2.003 3.604 1303 HB2 ALA 75 HB2 ALA 75 -14.282 3.700 3.442 1304 HB3 ALA 75 HB3 ALA 75 -14.152 2.614 2.055 1305 H CYS 76 HN CYS 76 -15.473 3.293 0.118 1306 HA CYS 76 HA CYS 76 -15.620 6.193 -0.080 1307 HB2 CYS 76 HB2 CYS 76 -13.755 5.152 -1.119 1308 HB3 CYS 76 HB1 CYS 76 -14.773 4.072 -2.049 1309 HG CYS 76 HG CYS 76 -15.779 6.073 -3.707 1310 H ASP 77 HN ASP 77 -17.843 3.798 -0.262 1311 HA ASP 77 HA ASP 77 -19.382 4.603 -2.490 1312 HB2 ASP 77 HB2 ASP 77 -19.787 2.466 -1.441 1313 HB3 ASP 77 HB1 ASP 77 -20.195 3.227 0.092 1314 H GLY 78 HN GLY 78 -18.707 6.065 0.488 1315 HA2 GLY 78 HA3 GLY 78 -20.897 7.990 0.140 1316 HA3 GLY 78 HA2 GLY 78 -19.887 7.836 1.570 1317 H ILE 79 HN ILE 79 -17.581 7.609 -0.621 1318 HA ILE 79 HA ILE 79 -16.875 10.377 -0.364 1319 HB ILE 79 HB ILE 79 -15.450 8.060 -1.644 1320 HG12 ILE 79 HG12 ILE 79 -14.949 9.552 0.933 1321 HG13 ILE 79 HG11 ILE 79 -15.696 7.958 0.799 1322 HG21 ILE 79 HG21 ILE 79 -13.473 9.413 -1.813 1323 HG22 ILE 79 HG22 ILE 79 -14.302 10.790 -1.085 1324 HG23 ILE 79 HG23 ILE 79 -14.781 10.216 -2.685 1325 HD11 ILE 79 HD11 ILE 79 -12.940 8.593 -0.187 1326 HD12 ILE 79 HD12 ILE 79 -13.682 7.004 0.010 1327 HD13 ILE 79 HD13 ILE 79 -13.289 7.979 1.423 1328 H GLY 80 HN GLY 80 -16.259 8.552 -3.318 1329 HA2 GLY 80 HA3 GLY 80 -16.264 9.304 -5.495 1330 HA3 GLY 80 HA2 GLY 80 -17.978 9.501 -5.162 1331 H GLY 81 HN GLY 81 -18.806 11.470 -5.316 1332 HA2 GLY 81 HA3 GLY 81 -16.936 13.756 -5.350 1333 HA3 GLY 81 HA2 GLY 81 -18.264 13.610 -6.496 1334 H ALA 82 HN ALA 82 -18.042 15.855 -4.997 1335 HA ALA 82 HA ALA 82 -19.271 17.286 -3.744 1336 HB1 ALA 82 HB1 ALA 82 -21.201 16.241 -4.853 1337 HB2 ALA 82 HB2 ALA 82 -21.569 16.782 -3.216 1338 HB3 ALA 82 HB3 ALA 82 -21.298 15.070 -3.539 1339 H MET 83 HN MET 83 -20.068 14.193 -2.166 1340 HA MET 83 HA MET 83 -19.731 15.247 0.449 1341 HB2 MET 83 HB2 MET 83 -19.709 12.357 -0.452 1342 HB3 MET 83 HB1 MET 83 -19.951 12.924 1.195 1343 HG2 MET 83 HG2 MET 83 -22.017 14.015 0.536 1344 HG3 MET 83 HG1 MET 83 -21.766 13.513 -1.132 1345 HE1 MET 83 HE1 MET 83 -22.476 12.343 2.527 1346 HE2 MET 83 HE2 MET 83 -21.063 11.365 2.131 1347 HE3 MET 83 HE3 MET 83 -22.637 10.597 2.341 1348 H HIS 84 HN HIS 84 -17.634 13.585 -1.789 1349 HA HIS 84 HA HIS 84 -15.407 13.083 -0.182 1350 HB2 HIS 84 HB2 HIS 84 -15.427 12.219 -2.399 1351 HB3 HIS 84 HB1 HIS 84 -15.735 13.799 -3.098 1352 HD1 HIS 84 HD1 HIS 84 -13.773 14.171 -4.554 1353 HD2 HIS 84 HD2 HIS 84 -12.667 12.809 -0.788 1354 HE1 HIS 84 HE1 HIS 84 -11.270 14.294 -4.502 1355 HE2 HIS 84 HE2 HIS 84 -10.613 13.293 -2.286 1356 H LYS 85 HN LYS 85 -16.612 16.094 -1.512 1357 HA LYS 85 HA LYS 85 -14.148 17.498 -0.946 1358 HB2 LYS 85 HB2 LYS 85 -16.843 18.590 -1.783 1359 HB3 LYS 85 HB1 LYS 85 -15.319 19.472 -1.780 1360 HG2 LYS 85 HG2 LYS 85 -15.959 17.063 -3.478 1361 HG3 LYS 85 HG1 LYS 85 -15.915 18.742 -4.026 1362 HD2 LYS 85 HD2 LYS 85 -13.548 18.868 -3.508 1363 HD3 LYS 85 HD1 LYS 85 -13.578 17.227 -2.865 1364 HE2 LYS 85 HE2 LYS 85 -12.672 17.177 -5.090 1365 HE3 LYS 85 HE1 LYS 85 -14.259 16.408 -5.093 1366 HZ1 LYS 85 HZ1 LYS 85 -13.716 19.206 -5.940 1367 HZ2 LYS 85 HZ2 LYS 85 -15.210 18.421 -6.005 1368 HZ3 LYS 85 HZ3 LYS 85 -13.938 17.900 -6.990 1369 H ALA 86 HN ALA 86 -16.982 16.634 0.691 1370 HA ALA 86 HA ALA 86 -16.785 18.679 2.732 1371 HB1 ALA 86 HB1 ALA 86 -18.412 16.140 2.789 1372 HB2 ALA 86 HB2 ALA 86 -18.958 17.637 2.025 1373 HB3 ALA 86 HB3 ALA 86 -18.651 17.595 3.762 1374 H MET 87 HN MET 87 -16.149 15.237 2.362 1375 HA MET 87 HA MET 87 -15.306 14.945 5.109 1376 HB2 MET 87 HB2 MET 87 -15.240 12.941 2.845 1377 HB3 MET 87 HB1 MET 87 -15.084 12.587 4.566 1378 HG2 MET 87 HG2 MET 87 -17.440 13.879 4.565 1379 HG3 MET 87 HG1 MET 87 -17.473 13.172 2.953 1380 HE1 MET 87 HE1 MET 87 -19.616 12.484 5.257 1381 HE2 MET 87 HE2 MET 87 -19.773 10.745 5.005 1382 HE3 MET 87 HE3 MET 87 -19.666 11.832 3.620 1383 H LEU 88 HN LEU 88 -13.838 15.742 2.181 1384 HA LEU 88 HA LEU 88 -11.354 14.627 2.224 1385 HB2 LEU 88 HB2 LEU 88 -12.508 16.365 0.670 1386 HB3 LEU 88 HB1 LEU 88 -11.654 17.534 1.656 1387 HG LEU 88 HG LEU 88 -9.651 17.070 0.696 1388 HD11 LEU 88 HD11 LEU 88 -10.535 14.199 0.357 1389 HD12 LEU 88 HD12 LEU 88 -9.472 14.810 1.627 1390 HD13 LEU 88 HD13 LEU 88 -8.943 14.835 -0.054 1391 HD21 LEU 88 HD21 LEU 88 -9.945 16.343 -1.644 1392 HD22 LEU 88 HD22 LEU 88 -11.127 17.554 -1.138 1393 HD23 LEU 88 HD23 LEU 88 -11.592 15.855 -1.234 1394 H MET 89 HN MET 89 -12.542 17.287 4.219 1395 HA MET 89 HA MET 89 -9.924 17.817 5.331 1396 HB2 MET 89 HB2 MET 89 -11.525 19.646 4.989 1397 HB3 MET 89 HB1 MET 89 -12.644 18.886 6.110 1398 HG2 MET 89 HG2 MET 89 -11.073 19.202 7.931 1399 HG3 MET 89 HG1 MET 89 -9.899 19.898 6.816 1400 HE1 MET 89 HE1 MET 89 -11.664 21.720 4.933 1401 HE2 MET 89 HE2 MET 89 -10.142 22.232 5.662 1402 HE3 MET 89 HE3 MET 89 -11.570 23.259 5.791 1403 H ALA 90 HN ALA 90 -12.483 15.665 5.954 1404 HA ALA 90 HA ALA 90 -11.902 15.479 8.820 1405 HB1 ALA 90 HB1 ALA 90 -13.917 14.146 8.963 1406 HB2 ALA 90 HB2 ALA 90 -14.034 14.077 7.203 1407 HB3 ALA 90 HB3 ALA 90 -14.257 15.614 8.045 1408 H GLN 91 HN GLN 91 -12.176 13.308 6.023 1409 HA GLN 91 HA GLN 91 -11.148 11.115 7.581 1410 HB2 GLN 91 HB2 GLN 91 -11.895 11.352 4.672 1411 HB3 GLN 91 HB1 GLN 91 -11.404 9.854 5.456 1412 HG2 GLN 91 HG2 GLN 91 -13.298 9.920 6.904 1413 HG3 GLN 91 HG1 GLN 91 -13.746 11.517 6.320 1414 HE21 GLN 91 HE21 GLN 91 -13.120 10.949 3.593 1415 HE22 GLN 91 HE22 GLN 91 -14.373 9.911 3.013 1416 H LEU 92 HN LEU 92 -10.078 12.729 4.574 1417 HA LEU 92 HA LEU 92 -7.563 11.679 4.288 1418 HB2 LEU 92 HB2 LEU 92 -8.909 13.587 3.031 1419 HB3 LEU 92 HB1 LEU 92 -7.911 14.633 4.012 1420 HG LEU 92 HG LEU 92 -7.191 12.962 1.672 1421 HD11 LEU 92 HD11 LEU 92 -6.267 15.617 2.733 1422 HD12 LEU 92 HD12 LEU 92 -7.451 15.345 1.457 1423 HD13 LEU 92 HD13 LEU 92 -5.765 14.897 1.203 1424 HD21 LEU 92 HD21 LEU 92 -4.792 13.008 2.293 1425 HD22 LEU 92 HD22 LEU 92 -5.747 11.933 3.312 1426 HD23 LEU 92 HD23 LEU 92 -5.253 13.513 3.920 1427 H GLU 93 HN GLU 93 -8.804 13.962 6.531 1428 HA GLU 93 HA GLU 93 -7.769 15.603 7.835 1429 HB2 GLU 93 HB2 GLU 93 -7.156 14.378 9.958 1430 HB3 GLU 93 HB1 GLU 93 -8.762 14.053 9.291 1431 HG2 GLU 93 HG2 GLU 93 -8.054 11.954 8.432 1432 HG3 GLU 93 HG1 GLU 93 -6.369 12.301 8.788 Start of MODEL 3 1 H2 PRO 1 HT1 PRO 1 -5.386 -3.769 13.088 2 H3 PRO 1 HT2 PRO 1 -5.714 -2.277 13.662 3 HA PRO 1 HA PRO 1 -6.380 -2.054 11.610 4 HB2 PRO 1 HB2 PRO 1 -4.201 -1.058 10.399 5 HB3 PRO 1 HB1 PRO 1 -4.951 -0.232 11.766 6 HG2 PRO 1 HG2 PRO 1 -2.415 -1.683 11.650 7 HG3 PRO 1 HG1 PRO 1 -2.999 -0.539 12.871 8 HD2 PRO 1 HD2 PRO 1 -3.034 -3.459 12.901 9 HD3 PRO 1 HD1 PRO 1 -3.351 -2.325 14.229 10 H SER 2 HN SER 2 -4.428 -2.156 9.294 11 HA SER 2 HA SER 2 -4.371 -4.893 8.581 12 HB2 SER 2 HB2 SER 2 -2.451 -2.726 7.688 13 HB3 SER 2 HB1 SER 2 -2.823 -4.222 6.842 14 HG SER 2 HG SER 2 -3.885 -2.092 6.236 15 H PHE 3 HN PHE 3 -2.052 -5.916 8.188 16 HA PHE 3 HA PHE 3 -0.462 -5.689 10.563 17 HB2 PHE 3 HB2 PHE 3 1.169 -6.795 8.601 18 HB3 PHE 3 HB1 PHE 3 0.190 -7.700 9.755 19 HD1 PHE 3 HD1 PHE 3 0.750 -6.800 6.332 20 HD2 PHE 3 HD2 PHE 3 -2.093 -8.469 9.030 21 HE1 PHE 3 HE1 PHE 3 -0.452 -7.829 4.458 22 HE2 PHE 3 HE2 PHE 3 -3.308 -9.476 7.147 23 HZ PHE 3 HZ PHE 3 -2.485 -9.156 4.850 24 H ASN 4 HN ASN 4 -0.282 -4.657 7.235 25 HA ASN 4 HA ASN 4 2.390 -3.646 7.582 26 HB2 ASN 4 HB2 ASN 4 2.293 -3.337 5.163 27 HB3 ASN 4 HB1 ASN 4 1.798 -4.964 5.624 28 HD21 ASN 4 HD21 ASN 4 0.589 -1.782 4.709 29 HD22 ASN 4 HD22 ASN 4 -0.918 -2.349 4.064 30 H THR 5 HN THR 5 -0.414 -2.173 8.349 31 HA THR 5 HA THR 5 -0.413 0.155 6.729 32 HB THR 5 HB THR 5 -1.516 1.102 8.943 33 HG1 THR 5 HG1 THR 5 -1.479 -0.390 10.441 34 HG21 THR 5 HG21 THR 5 -2.742 0.833 6.919 35 HG22 THR 5 HG22 THR 5 -3.664 0.078 8.223 36 HG23 THR 5 HG23 THR 5 -2.744 -0.920 7.099 37 H VAL 6 HN VAL 6 1.854 -0.879 8.956 38 HA VAL 6 HA VAL 6 2.642 1.675 9.976 39 HB VAL 6 HB VAL 6 4.364 0.565 11.087 40 HG11 VAL 6 HG11 VAL 6 2.192 -0.232 11.852 41 HG12 VAL 6 HG12 VAL 6 3.425 -1.481 12.021 42 HG13 VAL 6 HG13 VAL 6 2.266 -1.559 10.692 43 HG21 VAL 6 HG21 VAL 6 5.439 -1.461 10.420 44 HG22 VAL 6 HG22 VAL 6 5.343 -0.408 8.998 45 HG23 VAL 6 HG23 VAL 6 4.215 -1.757 9.177 46 H ARG 7 HN ARG 7 4.023 3.111 8.988 47 HA ARG 7 HA ARG 7 5.776 2.125 6.942 48 HB2 ARG 7 HB2 ARG 7 4.827 3.606 5.180 49 HB3 ARG 7 HB1 ARG 7 3.894 2.198 5.643 50 HG2 ARG 7 HG2 ARG 7 2.947 4.242 7.259 51 HG3 ARG 7 HG1 ARG 7 3.126 4.938 5.646 52 HD2 ARG 7 HD2 ARG 7 1.829 3.139 4.688 53 HD3 ARG 7 HD1 ARG 7 1.719 2.342 6.253 54 HE ARG 7 HE ARG 7 0.597 4.672 6.831 55 HH11 ARG 7 HH11 ARG 7 0.125 2.597 4.057 56 HH12 ARG 7 HH12 ARG 7 -1.468 3.179 3.736 57 HH21 ARG 7 HH21 ARG 7 -1.499 5.454 6.406 58 HH22 ARG 7 HH22 ARG 7 -2.393 4.829 5.061 59 H GLN 8 HN GLN 8 7.172 3.595 6.062 60 HA GLN 8 HA GLN 8 8.630 5.220 7.550 61 HB2 GLN 8 HB2 GLN 8 8.301 4.721 4.774 62 HB3 GLN 8 HB1 GLN 8 8.547 6.452 4.974 63 HG2 GLN 8 HG2 GLN 8 10.583 6.016 6.238 64 HG3 GLN 8 HG1 GLN 8 10.335 4.282 6.040 65 HE21 GLN 8 HE21 GLN 8 12.581 5.842 5.202 66 HE22 GLN 8 HE22 GLN 8 12.684 5.660 3.475 67 H GLY 9 HN GLY 9 8.138 6.825 8.821 68 HA2 GLY 9 HA3 GLY 9 6.335 8.958 7.943 69 HA3 GLY 9 HA2 GLY 9 7.093 8.814 9.525 70 H SER 10 HN SER 10 7.785 11.033 9.379 71 HA SER 10 HA SER 10 9.107 12.269 7.319 72 HB2 SER 10 HB2 SER 10 9.734 12.626 10.256 73 HB3 SER 10 HB1 SER 10 9.990 13.809 8.972 74 HG SER 10 HG SER 10 7.648 13.654 8.630 75 H LYS 11 HN LYS 11 10.646 11.318 6.178 76 HA LYS 11 HA LYS 11 12.352 9.921 5.611 77 HB2 LYS 11 HB2 LYS 11 14.531 10.792 6.189 78 HB3 LYS 11 HB1 LYS 11 13.458 12.104 5.771 79 HG2 LYS 11 HG2 LYS 11 13.530 12.986 7.829 80 HG3 LYS 11 HG1 LYS 11 13.633 11.426 8.638 81 HD2 LYS 11 HD2 LYS 11 15.979 11.250 7.958 82 HD3 LYS 11 HD1 LYS 11 15.861 12.819 7.163 83 HE2 LYS 11 HE2 LYS 11 15.373 13.873 9.309 84 HE3 LYS 11 HE1 LYS 11 15.460 12.304 10.109 85 HZ1 LYS 11 HZ1 LYS 11 17.784 12.147 9.414 86 HZ2 LYS 11 HZ2 LYS 11 17.518 13.507 10.378 87 HZ3 LYS 11 HZ3 LYS 11 17.688 13.678 8.706 88 H GLU 12 HN GLU 12 10.903 8.636 7.580 89 HA GLU 12 HA GLU 12 12.356 7.611 9.725 90 HB2 GLU 12 HB2 GLU 12 10.071 7.141 9.696 91 HB3 GLU 12 HB1 GLU 12 10.105 6.597 8.030 92 HG2 GLU 12 HG2 GLU 12 10.999 4.512 8.615 93 HG3 GLU 12 HG1 GLU 12 11.429 5.049 10.231 94 HA PRO 13 HA PRO 13 15.648 5.252 7.873 95 HB2 PRO 13 HB2 PRO 13 15.138 3.293 10.012 96 HB3 PRO 13 HB1 PRO 13 16.625 4.154 9.625 97 HG2 PRO 13 HG2 PRO 13 15.100 4.734 11.786 98 HG3 PRO 13 HG1 PRO 13 16.091 5.929 10.947 99 HD2 PRO 13 HD2 PRO 13 13.162 5.585 10.954 100 HD3 PRO 13 HD1 PRO 13 14.125 7.038 10.655 101 H TYR 14 HN TYR 14 15.408 3.909 6.217 102 HA TYR 14 HA TYR 14 12.787 2.983 5.775 103 HB2 TYR 14 HB2 TYR 14 14.123 3.953 3.973 104 HB3 TYR 14 HB1 TYR 14 15.217 2.575 4.044 105 HD1 TYR 14 HD1 TYR 14 14.119 0.265 3.766 106 HD2 TYR 14 HD2 TYR 14 12.327 3.877 2.558 107 HE1 TYR 14 HE1 TYR 14 12.675 -0.992 2.256 108 HE2 TYR 14 HE2 TYR 14 10.860 2.672 1.017 109 HH TYR 14 HH TYR 14 10.440 0.656 0.090 110 HA PRO 15 HA PRO 15 14.793 -1.464 5.623 111 HB2 PRO 15 HB2 PRO 15 16.914 -1.134 7.646 112 HB3 PRO 15 HB1 PRO 15 16.933 -2.047 6.142 113 HG2 PRO 15 HG2 PRO 15 18.268 0.254 6.419 114 HG3 PRO 15 HG1 PRO 15 17.554 -0.239 4.889 115 HD2 PRO 15 HD2 PRO 15 16.642 1.816 6.832 116 HD3 PRO 15 HD1 PRO 15 16.477 1.769 5.071 117 H ASP 16 HN ASP 16 14.490 0.736 8.147 118 HA ASP 16 HA ASP 16 13.676 -1.214 10.126 119 HB2 ASP 16 HB2 ASP 16 14.325 1.687 10.179 120 HB3 ASP 16 HB1 ASP 16 13.195 1.097 11.389 121 H PHE 17 HN PHE 17 12.311 1.473 8.276 122 HA PHE 17 HA PHE 17 9.706 1.415 9.243 123 HB2 PHE 17 HB2 PHE 17 9.553 3.075 7.682 124 HB3 PHE 17 HB1 PHE 17 11.091 2.566 6.998 125 HD1 PHE 17 HD1 PHE 17 7.516 1.440 6.938 126 HD2 PHE 17 HD2 PHE 17 11.118 2.072 4.790 127 HE1 PHE 17 HE1 PHE 17 6.401 0.754 4.849 128 HE2 PHE 17 HE2 PHE 17 9.997 1.390 2.724 129 HZ PHE 17 HZ PHE 17 7.631 0.760 2.754 130 H VAL 18 HN VAL 18 11.257 -0.466 6.713 131 HA VAL 18 HA VAL 18 8.894 -1.980 6.179 132 HB VAL 18 HB VAL 18 10.172 -1.755 4.266 133 HG11 VAL 18 HG11 VAL 18 12.582 -2.221 4.148 134 HG12 VAL 18 HG12 VAL 18 12.586 -2.549 5.894 135 HG13 VAL 18 HG13 VAL 18 12.205 -0.929 5.300 136 HG21 VAL 18 HG21 VAL 18 11.180 -4.039 3.865 137 HG22 VAL 18 HG22 VAL 18 9.486 -3.997 4.353 138 HG23 VAL 18 HG23 VAL 18 10.735 -4.415 5.532 139 H ALA 19 HN ALA 19 11.864 -2.527 8.048 140 HA ALA 19 HA ALA 19 11.543 -5.272 8.478 141 HB1 ALA 19 HB1 ALA 19 12.617 -3.264 10.466 142 HB2 ALA 19 HB2 ALA 19 13.545 -4.009 9.165 143 HB3 ALA 19 HB3 ALA 19 12.902 -5.005 10.472 144 H ARG 20 HN ARG 20 9.845 -2.569 10.007 145 HA ARG 20 HA ARG 20 8.557 -4.403 11.847 146 HB2 ARG 20 HB2 ARG 20 7.225 -2.451 12.577 147 HB3 ARG 20 HB1 ARG 20 8.953 -2.186 12.723 148 HG2 ARG 20 HG2 ARG 20 8.990 -0.631 11.015 149 HG3 ARG 20 HG1 ARG 20 7.488 -1.226 10.303 150 HD2 ARG 20 HD2 ARG 20 6.184 -0.280 12.035 151 HD3 ARG 20 HD1 ARG 20 7.598 0.044 13.020 152 HE ARG 20 HE ARG 20 8.093 1.555 10.871 153 HH11 ARG 20 HH11 ARG 20 5.207 1.192 12.824 154 HH12 ARG 20 HH12 ARG 20 4.675 2.821 12.569 155 HH21 ARG 20 HH21 ARG 20 7.416 3.707 10.553 156 HH22 ARG 20 HH22 ARG 20 5.928 4.253 11.273 157 H LEU 21 HN LEU 21 8.089 -2.845 8.815 158 HA LEU 21 HA LEU 21 5.431 -3.371 8.288 159 HB2 LEU 21 HB2 LEU 21 7.287 -2.187 6.897 160 HB3 LEU 21 HB1 LEU 21 7.603 -3.777 6.249 161 HG LEU 21 HG LEU 21 5.570 -3.846 5.098 162 HD11 LEU 21 HD11 LEU 21 4.029 -3.146 6.778 163 HD12 LEU 21 HD12 LEU 21 3.824 -2.083 5.383 164 HD13 LEU 21 HD13 LEU 21 4.716 -1.523 6.800 165 HD21 LEU 21 HD21 LEU 21 6.785 -1.125 5.045 166 HD22 LEU 21 HD22 LEU 21 5.494 -1.598 3.947 167 HD23 LEU 21 HD23 LEU 21 7.031 -2.465 3.926 168 H GLN 22 HN GLN 22 8.289 -5.386 7.822 169 HA GLN 22 HA GLN 22 6.937 -7.719 7.004 170 HB2 GLN 22 HB2 GLN 22 9.587 -7.778 8.379 171 HB3 GLN 22 HB1 GLN 22 8.987 -8.762 7.039 172 HG2 GLN 22 HG2 GLN 22 9.139 -6.756 5.623 173 HG3 GLN 22 HG1 GLN 22 9.848 -5.895 6.976 174 HE21 GLN 22 HE21 GLN 22 10.931 -6.349 4.459 175 HE22 GLN 22 HE22 GLN 22 12.390 -7.251 4.640 176 H ASP 23 HN ASP 23 8.345 -6.653 10.017 177 HA ASP 23 HA ASP 23 8.041 -8.863 11.602 178 HB2 ASP 23 HB2 ASP 23 8.938 -6.575 12.231 179 HB3 ASP 23 HB1 ASP 23 7.258 -6.118 12.499 180 H VAL 24 HN VAL 24 5.566 -6.358 11.097 181 HA VAL 24 HA VAL 24 3.724 -7.867 12.711 182 HB VAL 24 HB VAL 24 3.689 -5.442 12.897 183 HG11 VAL 24 HG11 VAL 24 4.448 -4.873 10.684 184 HG12 VAL 24 HG12 VAL 24 2.926 -4.049 11.023 185 HG13 VAL 24 HG13 VAL 24 2.947 -5.474 9.984 186 HG21 VAL 24 HG21 VAL 24 1.581 -6.503 13.350 187 HG22 VAL 24 HG22 VAL 24 1.196 -6.577 11.633 188 HG23 VAL 24 HG23 VAL 24 1.255 -5.015 12.454 189 H ALA 25 HN ALA 25 4.505 -7.482 9.379 190 HA ALA 25 HA ALA 25 2.055 -8.552 8.341 191 HB1 ALA 25 HB1 ALA 25 4.806 -8.471 7.085 192 HB2 ALA 25 HB2 ALA 25 3.557 -7.243 6.895 193 HB3 ALA 25 HB3 ALA 25 3.304 -8.863 6.249 194 H GLN 26 HN GLN 26 4.821 -9.648 9.896 195 HA GLN 26 HA GLN 26 4.563 -12.399 9.079 196 HB2 GLN 26 HB2 GLN 26 6.733 -12.167 9.529 197 HB3 GLN 26 HB1 GLN 26 6.438 -10.668 10.390 198 HG2 GLN 26 HG2 GLN 26 7.319 -11.878 12.057 199 HG3 GLN 26 HG1 GLN 26 5.630 -12.330 12.271 200 HE21 GLN 26 HE21 GLN 26 5.557 -13.972 9.909 201 HE22 GLN 26 HE22 GLN 26 6.424 -15.412 10.268 202 H LYS 27 HN LYS 27 3.875 -10.343 11.799 203 HA LYS 27 HA LYS 27 2.985 -12.315 13.609 204 HB2 LYS 27 HB2 LYS 27 2.101 -9.429 13.436 205 HB3 LYS 27 HB1 LYS 27 2.008 -10.474 14.856 206 HG2 LYS 27 HG2 LYS 27 4.517 -9.519 13.502 207 HG3 LYS 27 HG1 LYS 27 3.870 -8.945 15.038 208 HD2 LYS 27 HD2 LYS 27 4.444 -10.889 16.147 209 HD3 LYS 27 HD1 LYS 27 4.472 -11.847 14.667 210 HE2 LYS 27 HE2 LYS 27 6.524 -10.965 13.997 211 HE3 LYS 27 HE1 LYS 27 6.413 -9.621 15.128 212 HZ1 LYS 27 HZ1 LYS 27 6.764 -11.119 16.947 213 HZ2 LYS 27 HZ2 LYS 27 7.995 -11.366 15.816 214 HZ3 LYS 27 HZ3 LYS 27 6.712 -12.463 15.926 215 H SER 28 HN SER 28 1.310 -10.555 11.053 216 HA SER 28 HA SER 28 -1.235 -11.612 12.041 217 HB2 SER 28 HB2 SER 28 -0.654 -9.425 10.054 218 HB3 SER 28 HB1 SER 28 -2.260 -9.888 10.616 219 HG SER 28 HG SER 28 -0.943 -9.464 12.794 220 H ILE 29 HN ILE 29 1.131 -12.222 9.791 221 HA ILE 29 HA ILE 29 -0.793 -13.556 8.000 222 HB ILE 29 HB ILE 29 1.973 -12.529 7.412 223 HG12 ILE 29 HG12 ILE 29 -0.688 -11.751 6.221 224 HG13 ILE 29 HG11 ILE 29 0.196 -10.827 7.441 225 HG21 ILE 29 HG21 ILE 29 1.571 -13.230 5.088 226 HG22 ILE 29 HG22 ILE 29 0.140 -14.115 5.641 227 HG23 ILE 29 HG23 ILE 29 1.745 -14.571 6.220 228 HD11 ILE 29 HD11 ILE 29 0.486 -10.040 5.090 229 HD12 ILE 29 HD12 ILE 29 1.350 -11.555 4.770 230 HD13 ILE 29 HD13 ILE 29 1.976 -10.407 5.962 231 H ALA 30 HN ALA 30 -0.613 -15.717 7.683 232 HA ALA 30 HA ALA 30 1.390 -17.114 9.292 233 HB1 ALA 30 HB1 ALA 30 -1.101 -18.163 7.957 234 HB2 ALA 30 HB2 ALA 30 -0.951 -17.709 9.654 235 HB3 ALA 30 HB3 ALA 30 -0.034 -19.076 9.022 236 H ASP 31 HN ASP 31 1.109 -16.032 6.204 237 HA ASP 31 HA ASP 31 2.610 -18.318 5.110 238 HB2 ASP 31 HB2 ASP 31 0.281 -17.543 4.099 239 HB3 ASP 31 HB1 ASP 31 1.307 -16.357 3.308 240 H GLU 32 HN GLU 32 4.600 -17.965 4.427 241 HA GLU 32 HA GLU 32 5.940 -15.514 4.710 242 HB2 GLU 32 HB2 GLU 32 7.720 -16.575 3.347 243 HB3 GLU 32 HB1 GLU 32 7.154 -17.613 4.646 244 HG2 GLU 32 HG2 GLU 32 7.031 -19.177 3.075 245 HG3 GLU 32 HG1 GLU 32 5.545 -18.388 2.574 246 H LYS 33 HN LYS 33 4.138 -16.897 2.035 247 HA LYS 33 HA LYS 33 5.215 -15.288 -0.025 248 HB2 LYS 33 HB2 LYS 33 2.449 -16.495 0.167 249 HB3 LYS 33 HB1 LYS 33 3.204 -15.902 -1.292 250 HG2 LYS 33 HG2 LYS 33 4.389 -17.716 -1.584 251 HG3 LYS 33 HG1 LYS 33 4.767 -17.872 0.130 252 HD2 LYS 33 HD2 LYS 33 2.345 -18.588 0.405 253 HD3 LYS 33 HD1 LYS 33 2.331 -18.787 -1.354 254 HE2 LYS 33 HE2 LYS 33 2.854 -20.866 -0.222 255 HE3 LYS 33 HE1 LYS 33 4.212 -20.298 -1.192 256 HZ1 LYS 33 HZ1 LYS 33 5.331 -19.549 0.732 257 HZ2 LYS 33 HZ2 LYS 33 4.790 -21.118 1.088 258 HZ3 LYS 33 HZ3 LYS 33 3.963 -19.775 1.710 259 H ALA 34 HN ALA 34 2.149 -15.030 1.712 260 HA ALA 34 HA ALA 34 1.479 -12.490 0.746 261 HB1 ALA 34 HB1 ALA 34 0.623 -13.969 3.237 262 HB2 ALA 34 HB2 ALA 34 -0.220 -13.887 1.689 263 HB3 ALA 34 HB3 ALA 34 -0.097 -12.448 2.702 264 H ARG 35 HN ARG 35 3.636 -13.532 3.265 265 HA ARG 35 HA ARG 35 3.663 -11.073 4.747 266 HB2 ARG 35 HB2 ARG 35 4.455 -13.491 5.436 267 HB3 ARG 35 HB1 ARG 35 5.975 -12.979 4.722 268 HG2 ARG 35 HG2 ARG 35 4.703 -11.185 6.730 269 HG3 ARG 35 HG1 ARG 35 5.457 -12.674 7.295 270 HD2 ARG 35 HD2 ARG 35 6.758 -10.422 5.770 271 HD3 ARG 35 HD1 ARG 35 7.060 -10.923 7.444 272 HE ARG 35 HE ARG 35 7.739 -13.139 6.224 273 HH11 ARG 35 HH11 ARG 35 8.438 -9.866 5.207 274 HH12 ARG 35 HH12 ARG 35 9.901 -10.296 4.384 275 HH21 ARG 35 HH21 ARG 35 9.659 -13.711 5.144 276 HH22 ARG 35 HH22 ARG 35 10.600 -12.486 4.353 277 H LYS 36 HN LYS 36 5.979 -12.631 2.542 278 HA LYS 36 HA LYS 36 7.752 -10.498 2.239 279 HB2 LYS 36 HB2 LYS 36 6.947 -12.427 0.071 280 HB3 LYS 36 HB1 LYS 36 8.468 -11.550 0.208 281 HG2 LYS 36 HG2 LYS 36 9.327 -12.990 1.695 282 HG3 LYS 36 HG1 LYS 36 7.753 -13.319 2.451 283 HD2 LYS 36 HD2 LYS 36 8.491 -15.295 1.260 284 HD3 LYS 36 HD1 LYS 36 7.094 -14.565 0.437 285 HE2 LYS 36 HE2 LYS 36 8.863 -13.293 -0.962 286 HE3 LYS 36 HE1 LYS 36 9.995 -14.500 -0.344 287 HZ1 LYS 36 HZ1 LYS 36 7.530 -15.107 -1.880 288 HZ2 LYS 36 HZ2 LYS 36 8.629 -16.247 -1.289 289 HZ3 LYS 36 HZ3 LYS 36 9.106 -15.156 -2.487 290 H VAL 37 HN VAL 37 5.028 -11.461 0.170 291 HA VAL 37 HA VAL 37 5.455 -9.580 -1.797 292 HB VAL 37 HB VAL 37 3.164 -9.865 -2.549 293 HG11 VAL 37 HG11 VAL 37 4.536 -11.643 -3.214 294 HG12 VAL 37 HG12 VAL 37 3.101 -12.423 -2.537 295 HG13 VAL 37 HG13 VAL 37 4.587 -12.327 -1.587 296 HG21 VAL 37 HG21 VAL 37 2.707 -11.203 0.108 297 HG22 VAL 37 HG22 VAL 37 1.591 -11.290 -1.255 298 HG23 VAL 37 HG23 VAL 37 1.942 -9.734 -0.498 299 H ILE 38 HN ILE 38 3.706 -9.230 1.255 300 HA ILE 38 HA ILE 38 2.810 -6.620 0.407 301 HB ILE 38 HB ILE 38 1.631 -8.418 2.066 302 HG12 ILE 38 HG12 ILE 38 1.200 -5.451 2.267 303 HG13 ILE 38 HG11 ILE 38 0.775 -6.355 0.820 304 HG21 ILE 38 HG21 ILE 38 2.741 -6.248 3.844 305 HG22 ILE 38 HG22 ILE 38 3.279 -7.929 3.855 306 HG23 ILE 38 HG23 ILE 38 1.623 -7.527 4.319 307 HD11 ILE 38 HD11 ILE 38 -0.434 -6.369 3.525 308 HD12 ILE 38 HD12 ILE 38 -0.601 -7.786 2.486 309 HD13 ILE 38 HD13 ILE 38 -1.203 -6.217 1.953 310 H VAL 39 HN VAL 39 5.338 -7.915 2.493 311 HA VAL 39 HA VAL 39 5.942 -5.348 3.558 312 HB VAL 39 HB VAL 39 7.905 -6.208 4.464 313 HG11 VAL 39 HG11 VAL 39 5.901 -8.432 4.265 314 HG12 VAL 39 HG12 VAL 39 6.004 -7.179 5.502 315 HG13 VAL 39 HG13 VAL 39 7.257 -8.421 5.388 316 HG21 VAL 39 HG21 VAL 39 7.843 -8.478 2.486 317 HG22 VAL 39 HG22 VAL 39 9.003 -8.291 3.802 318 HG23 VAL 39 HG23 VAL 39 8.970 -7.121 2.483 319 H GLU 40 HN GLU 40 7.353 -7.233 0.903 320 HA GLU 40 HA GLU 40 9.032 -5.263 -0.103 321 HB2 GLU 40 HB2 GLU 40 7.724 -7.675 -1.312 322 HB3 GLU 40 HB1 GLU 40 8.907 -6.708 -2.168 323 HG2 GLU 40 HG2 GLU 40 10.595 -7.225 -0.630 324 HG3 GLU 40 HG1 GLU 40 9.465 -7.854 0.535 325 H LEU 41 HN LEU 41 5.606 -5.689 -0.463 326 HA LEU 41 HA LEU 41 5.468 -3.830 -2.689 327 HB2 LEU 41 HB2 LEU 41 3.744 -5.760 -1.622 328 HB3 LEU 41 HB1 LEU 41 2.949 -4.224 -1.335 329 HG LEU 41 HG LEU 41 2.116 -4.865 -3.394 330 HD11 LEU 41 HD11 LEU 41 2.891 -3.296 -4.944 331 HD12 LEU 41 HD12 LEU 41 4.513 -3.297 -4.265 332 HD13 LEU 41 HD13 LEU 41 3.177 -2.586 -3.360 333 HD21 LEU 41 HD21 LEU 41 3.551 -6.787 -3.748 334 HD22 LEU 41 HD22 LEU 41 4.890 -5.725 -4.182 335 HD23 LEU 41 HD23 LEU 41 3.456 -5.801 -5.207 336 H MET 42 HN MET 42 4.316 -3.801 0.696 337 HA MET 42 HA MET 42 3.428 -1.122 0.667 338 HB2 MET 42 HB2 MET 42 4.317 -2.826 2.992 339 HB3 MET 42 HB1 MET 42 3.459 -1.288 3.143 340 HG2 MET 42 HG2 MET 42 2.470 -3.855 1.928 341 HG3 MET 42 HG1 MET 42 1.909 -3.067 3.390 342 HE1 MET 42 HE1 MET 42 0.071 -4.141 1.015 343 HE2 MET 42 HE2 MET 42 -1.118 -2.841 0.922 344 HE3 MET 42 HE3 MET 42 -0.563 -3.422 2.497 345 H ALA 43 HN ALA 43 6.473 -2.608 0.997 346 HA ALA 43 HA ALA 43 8.143 -0.762 2.044 347 HB1 ALA 43 HB1 ALA 43 8.934 -2.834 1.176 348 HB2 ALA 43 HB2 ALA 43 9.780 -1.524 0.345 349 HB3 ALA 43 HB3 ALA 43 8.465 -2.385 -0.462 350 H TYR 44 HN TYR 44 6.335 -0.606 -0.948 351 HA TYR 44 HA TYR 44 7.529 2.016 -1.611 352 HB2 TYR 44 HB2 TYR 44 7.694 0.483 -3.470 353 HB3 TYR 44 HB1 TYR 44 6.021 0.002 -3.263 354 HD1 TYR 44 HD1 TYR 44 8.268 2.296 -4.890 355 HD2 TYR 44 HD2 TYR 44 4.194 1.654 -3.902 356 HE1 TYR 44 HE1 TYR 44 7.611 3.876 -6.647 357 HE2 TYR 44 HE2 TYR 44 3.515 3.241 -5.647 358 HH TYR 44 HH TYR 44 4.553 5.199 -6.868 359 H GLU 45 HN GLU 45 4.453 0.314 -2.007 360 HA GLU 45 HA GLU 45 2.798 2.401 -2.366 361 HB2 GLU 45 HB2 GLU 45 1.947 0.117 -0.664 362 HB3 GLU 45 HB1 GLU 45 1.020 0.977 -1.882 363 HG2 GLU 45 HG2 GLU 45 3.326 -0.848 -2.380 364 HG3 GLU 45 HG1 GLU 45 1.642 -1.280 -2.575 365 H ASN 46 HN ASN 46 4.121 1.305 0.699 366 HA ASN 46 HA ASN 46 2.350 3.126 2.135 367 HB2 ASN 46 HB2 ASN 46 3.730 0.582 2.796 368 HB3 ASN 46 HB1 ASN 46 3.549 1.765 4.085 369 HD21 ASN 46 HD21 ASN 46 2.101 0.419 5.221 370 HD22 ASN 46 HD22 ASN 46 0.478 0.205 4.683 371 H ALA 47 HN ALA 47 5.581 2.724 1.082 372 HA ALA 47 HA ALA 47 7.040 3.841 3.190 373 HB1 ALA 47 HB1 ALA 47 7.661 3.951 0.251 374 HB2 ALA 47 HB2 ALA 47 8.095 2.645 1.356 375 HB3 ALA 47 HB3 ALA 47 8.797 4.252 1.565 376 H ASN 48 HN ASN 48 8.445 5.818 2.685 377 HA ASN 48 HA ASN 48 6.899 8.135 2.866 378 HB2 ASN 48 HB2 ASN 48 9.766 7.459 2.560 379 HB3 ASN 48 HB1 ASN 48 9.304 9.080 2.034 380 HD21 ASN 48 HD21 ASN 48 10.900 8.110 4.355 381 HD22 ASN 48 HD22 ASN 48 10.130 8.813 5.738 382 HA PRO 49 HA PRO 49 5.562 8.870 -1.248 383 HB2 PRO 49 HB2 PRO 49 5.671 11.644 -1.182 384 HB3 PRO 49 HB1 PRO 49 4.323 10.665 -0.602 385 HG2 PRO 49 HG2 PRO 49 6.548 11.933 0.925 386 HG3 PRO 49 HG1 PRO 49 4.842 11.744 1.370 387 HD2 PRO 49 HD2 PRO 49 6.755 10.176 2.412 388 HD3 PRO 49 HD1 PRO 49 5.133 9.548 2.046 389 H GLU 50 HN GLU 50 8.513 10.202 -0.053 390 HA GLU 50 HA GLU 50 9.624 10.774 -2.649 391 HB2 GLU 50 HB2 GLU 50 11.492 11.595 -1.461 392 HB3 GLU 50 HB1 GLU 50 10.109 12.006 -0.456 393 HG2 GLU 50 HG2 GLU 50 11.184 9.415 0.170 394 HG3 GLU 50 HG1 GLU 50 12.346 10.711 0.387 395 H CYS 51 HN CYS 51 9.502 8.234 -0.308 396 HA CYS 51 HA CYS 51 11.980 7.098 -1.176 397 HB2 CYS 51 HB2 CYS 51 11.392 7.180 1.177 398 HB3 CYS 51 HB1 CYS 51 10.027 6.103 0.893 399 HG CYS 51 HG CYS 51 11.843 4.174 -0.307 400 H GLN 52 HN GLN 52 8.554 6.345 -1.313 401 HA GLN 52 HA GLN 52 8.938 3.898 -2.722 402 HB2 GLN 52 HB2 GLN 52 6.618 4.054 -3.317 403 HB3 GLN 52 HB1 GLN 52 6.782 4.551 -1.639 404 HG2 GLN 52 HG2 GLN 52 6.714 6.907 -2.392 405 HG3 GLN 52 HG1 GLN 52 6.400 6.337 -4.030 406 HE21 GLN 52 HE21 GLN 52 4.911 4.057 -2.944 407 HE22 GLN 52 HE22 GLN 52 3.380 4.659 -2.467 408 H SER 53 HN SER 53 8.874 7.217 -3.342 409 HA SER 53 HA SER 53 8.950 7.121 -6.158 410 HB2 SER 53 HB2 SER 53 9.528 9.151 -4.042 411 HB3 SER 53 HB1 SER 53 9.757 9.527 -5.758 412 HG SER 53 HG SER 53 7.506 9.556 -4.360 413 H ALA 54 HN ALA 54 11.317 6.765 -3.618 414 HA ALA 54 HA ALA 54 13.529 6.742 -5.460 415 HB1 ALA 54 HB1 ALA 54 13.930 7.192 -3.124 416 HB2 ALA 54 HB2 ALA 54 14.756 5.702 -3.580 417 HB3 ALA 54 HB3 ALA 54 13.240 5.633 -2.676 418 H ILE 55 HN ILE 55 11.054 4.608 -4.571 419 HA ILE 55 HA ILE 55 12.527 2.214 -5.209 420 HB ILE 55 HB ILE 55 9.833 2.719 -4.036 421 HG12 ILE 55 HG12 ILE 55 12.020 1.100 -2.840 422 HG13 ILE 55 HG11 ILE 55 12.183 2.860 -2.879 423 HG21 ILE 55 HG21 ILE 55 9.589 0.769 -5.442 424 HG22 ILE 55 HG22 ILE 55 9.621 0.289 -3.745 425 HG23 ILE 55 HG23 ILE 55 11.050 0.066 -4.751 426 HD11 ILE 55 HD11 ILE 55 11.228 1.937 -0.791 427 HD12 ILE 55 HD12 ILE 55 9.809 1.415 -1.722 428 HD13 ILE 55 HD13 ILE 55 10.213 3.138 -1.596 429 H LYS 56 HN LYS 56 9.891 4.095 -6.693 430 HA LYS 56 HA LYS 56 8.585 2.242 -8.147 431 HB2 LYS 56 HB2 LYS 56 9.115 4.334 -10.031 432 HB3 LYS 56 HB1 LYS 56 7.616 3.878 -9.253 433 HG2 LYS 56 HG2 LYS 56 7.751 6.003 -8.527 434 HG3 LYS 56 HG1 LYS 56 8.720 5.251 -7.257 435 HD2 LYS 56 HD2 LYS 56 10.656 6.040 -8.058 436 HD3 LYS 56 HD1 LYS 56 10.119 6.044 -9.737 437 HE2 LYS 56 HE2 LYS 56 9.696 8.133 -7.601 438 HE3 LYS 56 HE1 LYS 56 10.314 8.312 -9.240 439 HZ1 LYS 56 HZ1 LYS 56 7.490 7.702 -8.552 440 HZ2 LYS 56 HZ2 LYS 56 8.109 7.887 -10.116 441 HZ3 LYS 56 HZ3 LYS 56 8.086 9.202 -9.058 442 HA PRO 57 HA PRO 57 12.026 2.018 -11.669 443 HB2 PRO 57 HB2 PRO 57 14.545 2.023 -10.622 444 HB3 PRO 57 HB1 PRO 57 13.773 3.470 -11.291 445 HG2 PRO 57 HG2 PRO 57 13.850 2.535 -8.432 446 HG3 PRO 57 HG1 PRO 57 14.310 4.130 -9.078 447 HD2 PRO 57 HD2 PRO 57 11.932 3.810 -8.007 448 HD3 PRO 57 HD1 PRO 57 12.039 4.672 -9.552 449 H LEU 58 HN LEU 58 12.318 0.866 -8.367 450 HA LEU 58 HA LEU 58 13.303 -1.756 -9.235 451 HB2 LEU 58 HB2 LEU 58 12.723 -1.184 -6.395 452 HB3 LEU 58 HB1 LEU 58 14.042 -2.120 -7.087 453 HG LEU 58 HG LEU 58 13.853 0.901 -7.002 454 HD11 LEU 58 HD11 LEU 58 14.125 -0.010 -4.797 455 HD12 LEU 58 HD12 LEU 58 15.655 0.694 -5.328 456 HD13 LEU 58 HD13 LEU 58 15.432 -1.055 -5.350 457 HD21 LEU 58 HD21 LEU 58 16.108 -0.906 -7.875 458 HD22 LEU 58 HD22 LEU 58 16.203 0.847 -7.701 459 HD23 LEU 58 HD23 LEU 58 15.141 0.140 -8.917 460 H LYS 59 HN LYS 59 10.584 0.006 -8.335 461 HA LYS 59 HA LYS 59 8.975 -1.852 -7.050 462 HB2 LYS 59 HB2 LYS 59 8.310 0.463 -7.314 463 HB3 LYS 59 HB1 LYS 59 8.193 0.256 -9.053 464 HG2 LYS 59 HG2 LYS 59 6.010 -0.016 -8.611 465 HG3 LYS 59 HG1 LYS 59 6.519 -1.656 -8.241 466 HD2 LYS 59 HD2 LYS 59 6.243 0.556 -6.241 467 HD3 LYS 59 HD1 LYS 59 5.057 -0.725 -6.501 468 HE2 LYS 59 HE2 LYS 59 7.905 -1.060 -5.550 469 HE3 LYS 59 HE1 LYS 59 6.455 -1.221 -4.575 470 HZ1 LYS 59 HZ1 LYS 59 7.269 -3.377 -5.184 471 HZ2 LYS 59 HZ2 LYS 59 7.248 -2.975 -6.824 472 HZ3 LYS 59 HZ3 LYS 59 5.794 -3.103 -5.975 473 H GLY 60 HN GLY 60 8.691 -3.870 -7.655 474 HA2 GLY 60 HA3 GLY 60 7.527 -5.452 -9.011 475 HA3 GLY 60 HA2 GLY 60 7.780 -4.399 -10.394 476 H LYS 61 HN LYS 61 10.629 -3.978 -9.477 477 HA LYS 61 HA LYS 61 11.667 -6.427 -10.734 478 HB2 LYS 61 HB2 LYS 61 13.375 -4.022 -10.345 479 HB3 LYS 61 HB1 LYS 61 13.284 -5.118 -11.714 480 HG2 LYS 61 HG2 LYS 61 11.199 -3.061 -11.064 481 HG3 LYS 61 HG1 LYS 61 12.526 -2.802 -12.187 482 HD2 LYS 61 HD2 LYS 61 10.495 -5.011 -12.463 483 HD3 LYS 61 HD1 LYS 61 10.358 -3.441 -13.260 484 HE2 LYS 61 HE2 LYS 61 12.498 -3.825 -14.373 485 HE3 LYS 61 HE1 LYS 61 12.626 -5.395 -13.587 486 HZ1 LYS 61 HZ1 LYS 61 10.581 -6.062 -14.737 487 HZ2 LYS 61 HZ2 LYS 61 11.817 -5.664 -15.819 488 HZ3 LYS 61 HZ3 LYS 61 10.550 -4.578 -15.545 489 H VAL 62 HN VAL 62 12.336 -7.828 -9.210 490 HA VAL 62 HA VAL 62 14.265 -6.795 -7.246 491 HB VAL 62 HB VAL 62 12.294 -7.630 -6.076 492 HG11 VAL 62 HG11 VAL 62 11.630 -9.993 -6.179 493 HG12 VAL 62 HG12 VAL 62 12.783 -10.243 -7.493 494 HG13 VAL 62 HG13 VAL 62 11.406 -9.163 -7.721 495 HG21 VAL 62 HG21 VAL 62 13.361 -9.365 -4.661 496 HG22 VAL 62 HG22 VAL 62 14.381 -7.958 -4.951 497 HG23 VAL 62 HG23 VAL 62 14.676 -9.457 -5.833 498 HA PRO 63 HA PRO 63 17.339 -9.606 -9.118 499 HB2 PRO 63 HB2 PRO 63 17.913 -10.063 -6.233 500 HB3 PRO 63 HB1 PRO 63 19.031 -9.762 -7.548 501 HG2 PRO 63 HG2 PRO 63 18.436 -7.833 -5.829 502 HG3 PRO 63 HG1 PRO 63 18.619 -7.476 -7.554 503 HD2 PRO 63 HD2 PRO 63 16.150 -7.656 -5.911 504 HD3 PRO 63 HD1 PRO 63 16.498 -6.638 -7.321 505 H ALA 64 HN ALA 64 17.279 -11.756 -9.541 506 HA ALA 64 HA ALA 64 14.998 -13.207 -8.738 507 HB1 ALA 64 HB1 ALA 64 17.466 -14.237 -10.124 508 HB2 ALA 64 HB2 ALA 64 16.084 -13.488 -10.922 509 HB3 ALA 64 HB3 ALA 64 15.887 -15.022 -10.074 510 H GLY 65 HN GLY 65 14.811 -13.727 -6.637 511 HA2 GLY 65 HA3 GLY 65 15.155 -15.571 -5.125 512 HA3 GLY 65 HA2 GLY 65 16.851 -15.570 -5.580 513 H SER 66 HN SER 66 16.308 -12.421 -5.356 514 HA SER 66 HA SER 66 17.211 -12.364 -2.572 515 HB2 SER 66 HB2 SER 66 17.221 -10.124 -4.599 516 HB3 SER 66 HB1 SER 66 18.111 -10.193 -3.077 517 HG SER 66 HG SER 66 19.140 -12.133 -4.016 518 H ASP 67 HN ASP 67 16.529 -10.399 -1.319 519 HA ASP 67 HA ASP 67 13.649 -10.194 -1.214 520 HB2 ASP 67 HB2 ASP 67 15.768 -9.908 0.603 521 HB3 ASP 67 HB1 ASP 67 15.133 -8.284 0.404 522 H VAL 68 HN VAL 68 12.405 -8.423 -1.922 523 HA VAL 68 HA VAL 68 13.810 -6.558 -3.620 524 HB VAL 68 HB VAL 68 11.862 -5.919 -4.505 525 HG11 VAL 68 HG11 VAL 68 10.701 -8.180 -2.911 526 HG12 VAL 68 HG12 VAL 68 11.604 -8.343 -4.413 527 HG13 VAL 68 HG13 VAL 68 10.057 -7.497 -4.404 528 HG21 VAL 68 HG21 VAL 68 9.845 -5.325 -3.249 529 HG22 VAL 68 HG22 VAL 68 11.287 -4.484 -2.667 530 HG23 VAL 68 HG23 VAL 68 10.633 -5.851 -1.759 531 H ILE 69 HN ILE 69 12.690 -6.700 -0.398 532 HA ILE 69 HA ILE 69 12.539 -4.015 0.253 533 HB ILE 69 HB ILE 69 13.316 -6.402 1.898 534 HG12 ILE 69 HG12 ILE 69 11.038 -6.507 1.218 535 HG13 ILE 69 HG11 ILE 69 11.032 -5.975 2.882 536 HG21 ILE 69 HG21 ILE 69 14.369 -4.519 2.945 537 HG22 ILE 69 HG22 ILE 69 12.950 -4.954 3.901 538 HG23 ILE 69 HG23 ILE 69 12.897 -3.557 2.823 539 HD11 ILE 69 HD11 ILE 69 9.399 -4.756 1.607 540 HD12 ILE 69 HD12 ILE 69 10.651 -4.233 0.470 541 HD13 ILE 69 HD13 ILE 69 10.679 -3.657 2.139 542 H SER 70 HN SER 70 15.278 -6.201 0.384 543 HA SER 70 HA SER 70 17.261 -4.603 1.358 544 HB2 SER 70 HB2 SER 70 17.689 -6.907 0.823 545 HB3 SER 70 HB1 SER 70 17.369 -6.635 -0.886 546 HG SER 70 HG SER 70 19.580 -5.782 0.668 547 H GLU 71 HN GLU 71 15.827 -4.493 -1.833 548 HA GLU 71 HA GLU 71 17.734 -2.610 -2.894 549 HB2 GLU 71 HB2 GLU 71 15.143 -3.530 -4.110 550 HB3 GLU 71 HB1 GLU 71 16.569 -2.910 -4.940 551 HG2 GLU 71 HG2 GLU 71 16.987 -5.302 -3.300 552 HG3 GLU 71 HG1 GLU 71 15.961 -5.512 -4.713 553 H TYR 72 HN TYR 72 14.550 -2.701 -1.592 554 HA TYR 72 HA TYR 72 13.797 -0.114 -2.522 555 HB2 TYR 72 HB2 TYR 72 12.610 -2.108 -0.604 556 HB3 TYR 72 HB1 TYR 72 11.904 -0.514 -0.827 557 HD1 TYR 72 HD1 TYR 72 13.454 -2.022 -3.723 558 HD2 TYR 72 HD2 TYR 72 9.827 -1.670 -1.553 559 HE1 TYR 72 HE1 TYR 72 12.217 -2.857 -5.658 560 HE2 TYR 72 HE2 TYR 72 8.574 -2.522 -3.488 561 HH TYR 72 HH TYR 72 10.219 -3.832 -6.277 562 H VAL 73 HN VAL 73 15.107 -1.511 0.416 563 HA VAL 73 HA VAL 73 15.211 0.923 1.876 564 HB VAL 73 HB VAL 73 16.406 -0.114 3.522 565 HG11 VAL 73 HG11 VAL 73 15.682 -2.399 3.819 566 HG12 VAL 73 HG12 VAL 73 15.235 -2.482 2.115 567 HG13 VAL 73 HG13 VAL 73 14.379 -1.391 3.198 568 HG21 VAL 73 HG21 VAL 73 18.328 -0.630 1.898 569 HG22 VAL 73 HG22 VAL 73 17.602 -2.241 1.803 570 HG23 VAL 73 HG23 VAL 73 18.153 -1.605 3.362 571 H LYS 74 HN LYS 74 17.178 -0.693 -0.461 572 HA LYS 74 HA LYS 74 19.484 0.964 -0.312 573 HB2 LYS 74 HB2 LYS 74 19.633 -1.222 -1.224 574 HB3 LYS 74 HB1 LYS 74 18.331 -0.917 -2.354 575 HG2 LYS 74 HG2 LYS 74 20.256 0.983 -2.957 576 HG3 LYS 74 HG1 LYS 74 21.161 -0.495 -2.625 577 HD2 LYS 74 HD2 LYS 74 20.620 -0.439 -4.968 578 HD3 LYS 74 HD1 LYS 74 19.670 -1.706 -4.191 579 HE2 LYS 74 HE2 LYS 74 18.198 -0.552 -5.650 580 HE3 LYS 74 HE1 LYS 74 17.795 -0.043 -4.005 581 HZ1 LYS 74 HZ1 LYS 74 19.095 1.974 -4.364 582 HZ2 LYS 74 HZ2 LYS 74 17.861 1.841 -5.514 583 HZ3 LYS 74 HZ3 LYS 74 19.460 1.487 -5.943 584 H ALA 75 HN ALA 75 16.394 1.113 -1.839 585 HA ALA 75 HA ALA 75 16.893 3.229 -3.652 586 HB1 ALA 75 HB1 ALA 75 14.880 1.883 -3.777 587 HB2 ALA 75 HB2 ALA 75 14.452 3.580 -3.555 588 HB3 ALA 75 HB3 ALA 75 14.368 2.460 -2.192 589 H CYS 76 HN CYS 76 15.728 3.149 -0.314 590 HA CYS 76 HA CYS 76 15.974 6.043 -0.094 591 HB2 CYS 76 HB2 CYS 76 14.065 5.018 0.912 592 HB3 CYS 76 HB1 CYS 76 15.056 3.923 1.844 593 HG CYS 76 HG CYS 76 14.151 7.079 2.479 594 H ASP 77 HN ASP 77 18.166 3.670 -0.069 595 HA ASP 77 HA ASP 77 19.778 4.274 2.140 596 HB2 ASP 77 HB2 ASP 77 20.283 2.325 0.901 597 HB3 ASP 77 HB1 ASP 77 20.415 3.196 -0.616 598 H GLY 78 HN GLY 78 19.029 6.055 -0.688 599 HA2 GLY 78 HA3 GLY 78 21.142 8.009 -0.133 600 HA3 GLY 78 HA2 GLY 78 20.075 8.011 -1.531 601 H ILE 79 HN ILE 79 17.907 7.404 0.724 602 HA ILE 79 HA ILE 79 17.235 10.206 1.044 603 HB ILE 79 HB ILE 79 15.643 7.725 1.625 604 HG12 ILE 79 HG12 ILE 79 15.292 9.761 -0.586 605 HG13 ILE 79 HG11 ILE 79 16.095 8.202 -0.785 606 HG21 ILE 79 HG21 ILE 79 14.758 10.601 1.710 607 HG22 ILE 79 HG22 ILE 79 14.949 9.527 3.096 608 HG23 ILE 79 HG23 ILE 79 13.708 9.195 1.888 609 HD11 ILE 79 HD11 ILE 79 13.247 8.541 0.101 610 HD12 ILE 79 HD12 ILE 79 14.064 7.038 -0.336 611 HD13 ILE 79 HD13 ILE 79 13.750 8.263 -1.565 612 H GLY 80 HN GLY 80 16.928 11.201 3.014 613 HA2 GLY 80 HA3 GLY 80 16.550 10.521 5.490 614 HA3 GLY 80 HA2 GLY 80 18.169 9.869 5.294 615 H GLY 81 HN GLY 81 18.753 12.093 3.374 616 HA2 GLY 81 HA3 GLY 81 18.243 14.617 4.438 617 HA3 GLY 81 HA2 GLY 81 19.767 14.055 5.126 618 H ALA 82 HN ALA 82 19.680 16.292 3.511 619 HA ALA 82 HA ALA 82 20.665 17.277 1.724 620 HB1 ALA 82 HB1 ALA 82 22.289 14.745 1.628 621 HB2 ALA 82 HB2 ALA 82 22.624 16.144 2.646 622 HB3 ALA 82 HB3 ALA 82 22.715 16.289 0.891 623 H MET 83 HN MET 83 21.104 14.039 0.396 624 HA MET 83 HA MET 83 20.210 14.748 -2.166 625 HB2 MET 83 HB2 MET 83 20.411 12.015 -0.888 626 HB3 MET 83 HB1 MET 83 20.167 12.304 -2.603 627 HG2 MET 83 HG2 MET 83 22.322 13.497 -2.675 628 HG3 MET 83 HG1 MET 83 22.568 13.101 -0.976 629 HE1 MET 83 HE1 MET 83 22.390 9.978 -4.373 630 HE2 MET 83 HE2 MET 83 22.183 11.714 -4.602 631 HE3 MET 83 HE3 MET 83 20.946 10.784 -3.759 632 H HIS 84 HN HIS 84 18.539 13.220 0.546 633 HA HIS 84 HA HIS 84 16.125 12.527 -0.639 634 HB2 HIS 84 HB2 HIS 84 16.392 11.899 1.605 635 HB3 HIS 84 HB1 HIS 84 16.841 13.516 2.121 636 HD1 HIS 84 HD1 HIS 84 15.105 14.132 3.783 637 HD2 HIS 84 HD2 HIS 84 13.447 12.379 0.407 638 HE1 HIS 84 HE1 HIS 84 12.623 14.270 4.104 639 HE2 HIS 84 HE2 HIS 84 11.677 12.905 2.220 640 H LYS 85 HN LYS 85 17.291 15.745 0.216 641 HA LYS 85 HA LYS 85 14.682 16.932 -0.112 642 HB2 LYS 85 HB2 LYS 85 17.372 18.287 0.130 643 HB3 LYS 85 HB1 LYS 85 15.797 19.045 0.328 644 HG2 LYS 85 HG2 LYS 85 17.012 16.935 2.104 645 HG3 LYS 85 HG1 LYS 85 16.785 18.642 2.492 646 HD2 LYS 85 HD2 LYS 85 14.373 18.365 2.387 647 HD3 LYS 85 HD1 LYS 85 14.568 16.683 1.898 648 HE2 LYS 85 HE2 LYS 85 14.042 16.706 4.226 649 HE3 LYS 85 HE1 LYS 85 15.737 16.256 4.051 650 HZ1 LYS 85 HZ1 LYS 85 14.773 18.981 4.724 651 HZ2 LYS 85 HZ2 LYS 85 16.384 18.482 4.651 652 HZ3 LYS 85 HZ3 LYS 85 15.360 17.861 5.844 653 H ALA 86 HN ALA 86 17.595 16.522 -2.007 654 HA ALA 86 HA ALA 86 16.736 18.129 -4.214 655 HB1 ALA 86 HB1 ALA 86 18.608 17.079 -5.407 656 HB2 ALA 86 HB2 ALA 86 18.827 15.962 -4.056 657 HB3 ALA 86 HB3 ALA 86 19.097 17.691 -3.827 658 H MET 87 HN MET 87 16.741 14.726 -3.438 659 HA MET 87 HA MET 87 15.566 13.888 -5.907 660 HB2 MET 87 HB2 MET 87 15.934 12.401 -3.293 661 HB3 MET 87 HB1 MET 87 15.542 11.671 -4.852 662 HG2 MET 87 HG2 MET 87 17.653 12.277 -5.755 663 HG3 MET 87 HG1 MET 87 18.019 13.288 -4.369 664 HE1 MET 87 HE1 MET 87 16.510 9.618 -4.536 665 HE2 MET 87 HE2 MET 87 17.981 8.671 -4.313 666 HE3 MET 87 HE3 MET 87 17.775 9.651 -5.765 667 H LEU 88 HN LEU 88 14.380 15.182 -3.012 668 HA LEU 88 HA LEU 88 11.886 14.042 -2.726 669 HB2 LEU 88 HB2 LEU 88 13.150 16.005 -1.483 670 HB3 LEU 88 HB1 LEU 88 12.193 17.007 -2.551 671 HG LEU 88 HG LEU 88 10.440 16.855 -1.187 672 HD11 LEU 88 HD11 LEU 88 9.363 14.761 -0.610 673 HD12 LEU 88 HD12 LEU 88 10.786 13.860 -1.123 674 HD13 LEU 88 HD13 LEU 88 9.830 14.747 -2.309 675 HD21 LEU 88 HD21 LEU 88 12.308 15.168 0.450 676 HD22 LEU 88 HD22 LEU 88 10.796 15.859 1.047 677 HD23 LEU 88 HD23 LEU 88 12.110 16.919 0.534 678 H MET 89 HN MET 89 12.744 16.901 -4.679 679 HA MET 89 HA MET 89 10.143 17.127 -5.823 680 HB2 MET 89 HB2 MET 89 11.633 19.060 -5.544 681 HB3 MET 89 HB1 MET 89 12.777 18.351 -6.673 682 HG2 MET 89 HG2 MET 89 11.072 18.495 -8.445 683 HG3 MET 89 HG1 MET 89 9.988 19.286 -7.303 684 HE1 MET 89 HE1 MET 89 9.700 21.277 -9.042 685 HE2 MET 89 HE2 MET 89 10.827 20.508 -10.160 686 HE3 MET 89 HE3 MET 89 11.049 22.199 -9.710 687 H ALA 90 HN ALA 90 12.929 15.273 -6.556 688 HA ALA 90 HA ALA 90 12.346 15.068 -9.389 689 HB1 ALA 90 HB1 ALA 90 14.400 13.826 -9.522 690 HB2 ALA 90 HB2 ALA 90 14.436 13.615 -7.769 691 HB3 ALA 90 HB3 ALA 90 14.666 15.220 -8.471 692 H GLN 91 HN GLN 91 11.808 13.233 -6.507 693 HA GLN 91 HA GLN 91 11.016 10.931 -8.141 694 HB2 GLN 91 HB2 GLN 91 11.822 11.041 -5.239 695 HB3 GLN 91 HB1 GLN 91 11.416 9.587 -6.141 696 HG2 GLN 91 HG2 GLN 91 13.279 9.957 -7.620 697 HG3 GLN 91 HG1 GLN 91 13.684 11.424 -6.748 698 HE21 GLN 91 HE21 GLN 91 13.186 10.554 -4.179 699 HE22 GLN 91 HE22 GLN 91 14.338 9.358 -3.765 700 H LEU 92 HN LEU 92 10.079 12.715 -5.197 701 HA LEU 92 HA LEU 92 7.631 11.593 -4.630 702 HB2 LEU 92 HB2 LEU 92 9.026 13.635 -3.644 703 HB3 LEU 92 HB1 LEU 92 7.894 14.563 -4.595 704 HG LEU 92 HG LEU 92 7.442 12.980 -2.114 705 HD11 LEU 92 HD11 LEU 92 6.116 14.987 -1.576 706 HD12 LEU 92 HD12 LEU 92 6.539 15.648 -3.158 707 HD13 LEU 92 HD13 LEU 92 7.800 15.345 -1.965 708 HD21 LEU 92 HD21 LEU 92 5.294 13.573 -4.151 709 HD22 LEU 92 HD22 LEU 92 4.999 13.085 -2.483 710 HD23 LEU 92 HD23 LEU 92 5.807 11.980 -3.596 711 H GLU 93 HN GLU 93 8.667 13.633 -7.162 712 HA GLU 93 HA GLU 93 6.908 15.252 -8.130 713 HB2 GLU 93 HB2 GLU 93 7.495 14.588 -10.453 714 HB3 GLU 93 HB1 GLU 93 8.893 14.735 -9.384 715 HG2 GLU 93 HG2 GLU 93 9.259 12.456 -9.340 716 HG3 GLU 93 HG1 GLU 93 7.612 12.066 -9.831 717 H2 PRO 1 HT1 PRO 1 5.532 -3.805 -13.245 718 H3 PRO 1 HT2 PRO 1 5.874 -2.314 -13.820 719 HA PRO 1 HA PRO 1 6.538 -2.094 -11.768 720 HB2 PRO 1 HB2 PRO 1 4.368 -1.079 -10.562 721 HB3 PRO 1 HB1 PRO 1 5.126 -0.263 -11.930 722 HG2 PRO 1 HG2 PRO 1 2.578 -1.694 -11.813 723 HG3 PRO 1 HG1 PRO 1 3.170 -0.554 -13.034 724 HD2 PRO 1 HD2 PRO 1 3.184 -3.475 -13.064 725 HD3 PRO 1 HD1 PRO 1 3.514 -2.342 -14.391 726 H SER 2 HN SER 2 4.572 -2.175 -9.455 727 HA SER 2 HA SER 2 4.502 -4.915 -8.743 728 HB2 SER 2 HB2 SER 2 2.595 -2.737 -7.852 729 HB3 SER 2 HB1 SER 2 2.950 -4.239 -7.010 730 HG SER 2 HG SER 2 4.024 -2.114 -6.395 731 H PHE 3 HN PHE 3 2.183 -5.928 -8.360 732 HA PHE 3 HA PHE 3 0.592 -5.687 -10.730 733 HB2 PHE 3 HB2 PHE 3 -1.047 -6.780 -8.767 734 HB3 PHE 3 HB1 PHE 3 -0.075 -7.693 -9.920 735 HD1 PHE 3 HD1 PHE 3 -0.632 -6.787 -6.499 736 HD2 PHE 3 HD2 PHE 3 2.205 -8.476 -9.192 737 HE1 PHE 3 HE1 PHE 3 0.560 -7.822 -4.624 738 HE2 PHE 3 HE2 PHE 3 3.411 -9.490 -7.305 739 HZ PHE 3 HZ PHE 3 2.585 -9.162 -5.010 740 H ASN 4 HN ASN 4 0.415 -4.654 -7.401 741 HA ASN 4 HA ASN 4 -2.249 -3.625 -7.753 742 HB2 ASN 4 HB2 ASN 4 -2.155 -3.315 -5.336 743 HB3 ASN 4 HB1 ASN 4 -1.670 -4.944 -5.793 744 HD21 ASN 4 HD21 ASN 4 -0.445 -1.767 -4.879 745 HD22 ASN 4 HD22 ASN 4 1.058 -2.343 -4.231 746 H THR 5 HN THR 5 0.565 -2.171 -8.517 747 HA THR 5 HA THR 5 0.577 0.161 -6.901 748 HB THR 5 HB THR 5 1.689 1.103 -9.110 749 HG1 THR 5 HG1 THR 5 1.625 -0.388 -10.612 750 HG21 THR 5 HG21 THR 5 2.910 0.822 -7.085 751 HG22 THR 5 HG22 THR 5 3.830 0.060 -8.387 752 HG23 THR 5 HG23 THR 5 2.900 -0.931 -7.266 753 H VAL 6 HN VAL 6 -1.692 -0.860 -9.131 754 HA VAL 6 HA VAL 6 -2.462 1.698 -10.153 755 HB VAL 6 HB VAL 6 -4.191 0.597 -11.267 756 HG11 VAL 6 HG11 VAL 6 -2.022 -0.215 -12.030 757 HG12 VAL 6 HG12 VAL 6 -3.263 -1.457 -12.198 758 HG13 VAL 6 HG13 VAL 6 -2.107 -1.541 -10.866 759 HG21 VAL 6 HG21 VAL 6 -5.277 -1.422 -10.599 760 HG22 VAL 6 HG22 VAL 6 -5.178 -0.367 -9.178 761 HG23 VAL 6 HG23 VAL 6 -4.057 -1.721 -9.352 762 H ARG 7 HN ARG 7 -3.833 3.146 -9.162 763 HA ARG 7 HA ARG 7 -5.599 2.168 -7.121 764 HB2 ARG 7 HB2 ARG 7 -4.644 3.646 -5.358 765 HB3 ARG 7 HB1 ARG 7 -3.718 2.232 -5.819 766 HG2 ARG 7 HG2 ARG 7 -2.758 4.270 -7.433 767 HG3 ARG 7 HG1 ARG 7 -2.932 4.967 -5.821 768 HD2 ARG 7 HD2 ARG 7 -1.645 3.160 -4.863 769 HD3 ARG 7 HD1 ARG 7 -1.543 2.360 -6.428 770 HE ARG 7 HE ARG 7 -0.398 4.679 -7.010 771 HH11 ARG 7 HH11 ARG 7 0.055 2.596 -4.239 772 HH12 ARG 7 HH12 ARG 7 1.642 3.183 -3.901 773 HH21 ARG 7 HH21 ARG 7 1.695 5.454 -6.573 774 HH22 ARG 7 HH22 ARG 7 2.581 4.820 -5.224 775 H GLN 8 HN GLN 8 -6.991 3.649 -6.249 776 HA GLN 8 HA GLN 8 -8.437 5.282 -7.739 777 HB2 GLN 8 HB2 GLN 8 -8.110 4.784 -4.964 778 HB3 GLN 8 HB1 GLN 8 -8.345 6.517 -5.165 779 HG2 GLN 8 HG2 GLN 8 -10.382 6.092 -6.433 780 HG3 GLN 8 HG1 GLN 8 -10.144 4.358 -6.231 781 HE21 GLN 8 HE21 GLN 8 -12.381 5.936 -5.402 782 HE22 GLN 8 HE22 GLN 8 -12.490 5.757 -3.675 783 H GLY 9 HN GLY 9 -7.938 6.886 -9.014 784 HA2 GLY 9 HA3 GLY 9 -6.114 9.004 -8.138 785 HA3 GLY 9 HA2 GLY 9 -6.873 8.865 -9.720 786 H SER 10 HN SER 10 -7.544 11.091 -9.571 787 HA SER 10 HA SER 10 -8.867 12.334 -7.513 788 HB2 SER 10 HB2 SER 10 -9.474 12.696 -10.455 789 HB3 SER 10 HB1 SER 10 -9.745 13.876 -9.172 790 HG SER 10 HG SER 10 -7.387 13.673 -8.804 791 H LYS 11 HN LYS 11 -10.411 11.389 -6.380 792 HA LYS 11 HA LYS 11 -12.128 10.009 -5.811 793 HB2 LYS 11 HB2 LYS 11 -14.302 10.893 -6.397 794 HB3 LYS 11 HB1 LYS 11 -13.220 12.198 -5.976 795 HG2 LYS 11 HG2 LYS 11 -13.277 13.079 -8.035 796 HG3 LYS 11 HG1 LYS 11 -13.390 11.519 -8.843 797 HD2 LYS 11 HD2 LYS 11 -15.740 11.362 -8.166 798 HD3 LYS 11 HD1 LYS 11 -15.610 12.933 -7.380 799 HE2 LYS 11 HE2 LYS 11 -15.108 13.976 -9.527 800 HE3 LYS 11 HE1 LYS 11 -15.204 12.404 -10.320 801 HZ1 LYS 11 HZ1 LYS 11 -17.529 12.263 -9.650 802 HZ2 LYS 11 HZ2 LYS 11 -17.250 13.632 -10.595 803 HZ3 LYS 11 HZ3 LYS 11 -17.429 13.785 -8.923 804 H GLU 12 HN GLU 12 -10.684 8.719 -7.784 805 HA GLU 12 HA GLU 12 -12.137 7.700 -9.928 806 HB2 GLU 12 HB2 GLU 12 -9.856 7.211 -9.892 807 HB3 GLU 12 HB1 GLU 12 -9.897 6.670 -8.226 808 HG2 GLU 12 HG2 GLU 12 -10.806 4.590 -8.811 809 HG3 GLU 12 HG1 GLU 12 -11.226 5.127 -10.429 810 HA PRO 13 HA PRO 13 -15.446 5.360 -8.074 811 HB2 PRO 13 HB2 PRO 13 -14.946 3.400 -10.214 812 HB3 PRO 13 HB1 PRO 13 -16.428 4.269 -9.828 813 HG2 PRO 13 HG2 PRO 13 -14.897 4.839 -11.988 814 HG3 PRO 13 HG1 PRO 13 -15.883 6.041 -11.149 815 HD2 PRO 13 HD2 PRO 13 -12.954 5.679 -11.155 816 HD3 PRO 13 HD1 PRO 13 -13.908 7.137 -10.857 817 H TYR 14 HN TYR 14 -15.214 4.013 -6.422 818 HA TYR 14 HA TYR 14 -12.604 3.070 -5.972 819 HB2 TYR 14 HB2 TYR 14 -13.938 4.052 -4.176 820 HB3 TYR 14 HB1 TYR 14 -15.040 2.681 -4.249 821 HD1 TYR 14 HD1 TYR 14 -13.959 0.365 -3.962 822 HD2 TYR 14 HD2 TYR 14 -12.145 3.967 -2.757 823 HE1 TYR 14 HE1 TYR 14 -12.528 -0.899 -2.446 824 HE2 TYR 14 HE2 TYR 14 -10.691 2.755 -1.211 825 HH TYR 14 HH TYR 14 -10.282 0.739 -0.283 826 HA PRO 15 HA PRO 15 -14.641 -1.363 -5.820 827 HB2 PRO 15 HB2 PRO 15 -16.755 -1.017 -7.849 828 HB3 PRO 15 HB1 PRO 15 -16.786 -1.929 -6.344 829 HG2 PRO 15 HG2 PRO 15 -18.102 0.382 -6.626 830 HG3 PRO 15 HG1 PRO 15 -17.394 -0.115 -5.094 831 HD2 PRO 15 HD2 PRO 15 -16.464 1.927 -7.039 832 HD3 PRO 15 HD1 PRO 15 -16.304 1.886 -5.277 833 H ASP 16 HN ASP 16 -14.317 0.836 -8.344 834 HA ASP 16 HA ASP 16 -13.513 -1.118 -10.324 835 HB2 ASP 16 HB2 ASP 16 -14.157 1.783 -10.378 836 HB3 ASP 16 HB1 ASP 16 -13.018 1.196 -11.583 837 H PHE 17 HN PHE 17 -12.133 1.557 -8.468 838 HA PHE 17 HA PHE 17 -9.526 1.483 -9.436 839 HB2 PHE 17 HB2 PHE 17 -9.370 3.142 -7.875 840 HB3 PHE 17 HB1 PHE 17 -10.910 2.642 -7.194 841 HD1 PHE 17 HD1 PHE 17 -7.344 1.495 -7.125 842 HD2 PHE 17 HD2 PHE 17 -10.945 2.153 -4.985 843 HE1 PHE 17 HE1 PHE 17 -6.236 0.804 -5.033 844 HE2 PHE 17 HE2 PHE 17 -9.833 1.466 -2.916 845 HZ PHE 17 HZ PHE 17 -7.470 0.820 -2.939 846 H VAL 18 HN VAL 18 -11.098 -0.385 -6.911 847 HA VAL 18 HA VAL 18 -8.745 -1.915 -6.366 848 HB VAL 18 HB VAL 18 -10.025 -1.680 -4.454 849 HG11 VAL 18 HG11 VAL 18 -12.438 -2.127 -4.341 850 HG12 VAL 18 HG12 VAL 18 -12.440 -2.458 -6.086 851 HG13 VAL 18 HG13 VAL 18 -12.051 -0.842 -5.494 852 HG21 VAL 18 HG21 VAL 18 -11.047 -3.958 -4.052 853 HG22 VAL 18 HG22 VAL 18 -9.352 -3.928 -4.540 854 HG23 VAL 18 HG23 VAL 18 -10.605 -4.338 -5.719 855 H ALA 19 HN ALA 19 -11.717 -2.442 -8.236 856 HA ALA 19 HA ALA 19 -11.413 -5.191 -8.665 857 HB1 ALA 19 HB1 ALA 19 -12.468 -3.173 -10.656 858 HB2 ALA 19 HB2 ALA 19 -13.406 -3.911 -9.358 859 HB3 ALA 19 HB3 ALA 19 -12.768 -4.910 -10.663 860 H ARG 20 HN ARG 20 -9.694 -2.502 -10.195 861 HA ARG 20 HA ARG 20 -8.412 -4.346 -12.031 862 HB2 ARG 20 HB2 ARG 20 -7.065 -2.402 -12.760 863 HB3 ARG 20 HB1 ARG 20 -8.791 -2.127 -12.911 864 HG2 ARG 20 HG2 ARG 20 -8.825 -0.569 -11.206 865 HG3 ARG 20 HG1 ARG 20 -7.329 -1.173 -10.487 866 HD2 ARG 20 HD2 ARG 20 -6.013 -0.236 -12.218 867 HD3 ARG 20 HD1 ARG 20 -7.423 0.095 -13.206 868 HE ARG 20 HE ARG 20 -7.912 1.614 -11.059 869 HH11 ARG 20 HH11 ARG 20 -5.019 1.232 -13.002 870 HH12 ARG 20 HH12 ARG 20 -4.484 2.864 -12.751 871 HH21 ARG 20 HH21 ARG 20 -7.222 3.767 -10.751 872 HH22 ARG 20 HH22 ARG 20 -5.728 4.299 -11.473 873 H LEU 21 HN LEU 21 -7.942 -2.788 -8.998 874 HA LEU 21 HA LEU 21 -5.287 -3.329 -8.467 875 HB2 LEU 21 HB2 LEU 21 -7.136 -2.131 -7.078 876 HB3 LEU 21 HB1 LEU 21 -7.465 -3.719 -6.431 877 HG LEU 21 HG LEU 21 -5.435 -3.803 -5.276 878 HD11 LEU 21 HD11 LEU 21 -3.886 -3.112 -6.953 879 HD12 LEU 21 HD12 LEU 21 -3.678 -2.049 -5.559 880 HD13 LEU 21 HD13 LEU 21 -4.564 -1.487 -6.978 881 HD21 LEU 21 HD21 LEU 21 -6.634 -1.074 -5.226 882 HD22 LEU 21 HD22 LEU 21 -5.347 -1.555 -4.125 883 HD23 LEU 21 HD23 LEU 21 -6.890 -2.413 -4.108 884 H GLN 22 HN GLN 22 -8.160 -5.326 -8.003 885 HA GLN 22 HA GLN 22 -6.824 -7.665 -7.179 886 HB2 GLN 22 HB2 GLN 22 -9.470 -7.709 -8.561 887 HB3 GLN 22 HB1 GLN 22 -8.879 -8.697 -7.219 888 HG2 GLN 22 HG2 GLN 22 -9.023 -6.687 -5.804 889 HG3 GLN 22 HG1 GLN 22 -9.726 -5.826 -7.159 890 HE21 GLN 22 HE21 GLN 22 -10.821 -6.275 -4.642 891 HE22 GLN 22 HE22 GLN 22 -12.279 -7.177 -4.826 892 H ASP 23 HN ASP 23 -8.216 -6.591 -10.198 893 HA ASP 23 HA ASP 23 -7.921 -8.808 -11.777 894 HB2 ASP 23 HB2 ASP 23 -8.807 -6.522 -12.418 895 HB3 ASP 23 HB1 ASP 23 -7.124 -6.073 -12.685 896 H VAL 24 HN VAL 24 -5.433 -6.318 -11.271 897 HA VAL 24 HA VAL 24 -3.599 -7.839 -12.882 898 HB VAL 24 HB VAL 24 -3.548 -5.414 -13.066 899 HG11 VAL 24 HG11 VAL 24 -4.309 -4.837 -10.860 900 HG12 VAL 24 HG12 VAL 24 -2.781 -4.024 -11.195 901 HG13 VAL 24 HG13 VAL 24 -2.813 -5.447 -10.155 902 HG21 VAL 24 HG21 VAL 24 -1.448 -6.489 -13.519 903 HG22 VAL 24 HG22 VAL 24 -1.063 -6.564 -11.801 904 HG23 VAL 24 HG23 VAL 24 -1.112 -5.002 -12.625 905 H ALA 25 HN ALA 25 -4.385 -7.446 -9.552 906 HA ALA 25 HA ALA 25 -1.945 -8.532 -8.510 907 HB1 ALA 25 HB1 ALA 25 -4.697 -8.432 -7.257 908 HB2 ALA 25 HB2 ALA 25 -3.438 -7.212 -7.067 909 HB3 ALA 25 HB3 ALA 25 -3.198 -8.832 -6.419 910 H GLN 26 HN GLN 26 -4.715 -9.611 -10.068 911 HA GLN 26 HA GLN 26 -4.475 -12.363 -9.249 912 HB2 GLN 26 HB2 GLN 26 -6.644 -12.120 -9.703 913 HB3 GLN 26 HB1 GLN 26 -6.340 -10.623 -10.565 914 HG2 GLN 26 HG2 GLN 26 -7.219 -11.827 -12.237 915 HG3 GLN 26 HG1 GLN 26 -5.533 -12.290 -12.443 916 HE21 GLN 26 HE21 GLN 26 -5.490 -13.926 -10.076 917 HE22 GLN 26 HE22 GLN 26 -6.350 -15.368 -10.447 918 H LYS 27 HN LYS 27 -3.766 -10.309 -11.966 919 HA LYS 27 HA LYS 27 -2.893 -12.290 -13.773 920 HB2 LYS 27 HB2 LYS 27 -1.989 -9.411 -13.605 921 HB3 LYS 27 HB1 LYS 27 -1.900 -10.458 -15.023 922 HG2 LYS 27 HG2 LYS 27 -4.406 -9.482 -13.674 923 HG3 LYS 27 HG1 LYS 27 -3.752 -8.917 -15.211 924 HD2 LYS 27 HD2 LYS 27 -4.341 -10.856 -16.317 925 HD3 LYS 27 HD1 LYS 27 -4.373 -11.813 -14.839 926 HE2 LYS 27 HE2 LYS 27 -6.420 -10.916 -14.165 927 HE3 LYS 27 HE1 LYS 27 -6.304 -9.578 -15.304 928 HZ1 LYS 27 HZ1 LYS 27 -6.665 -11.095 -17.115 929 HZ2 LYS 27 HZ2 LYS 27 -7.900 -11.314 -15.981 930 HZ3 LYS 27 HZ3 LYS 27 -6.633 -12.427 -16.076 931 H SER 28 HN SER 28 -1.206 -10.545 -11.218 932 HA SER 28 HA SER 28 1.330 -11.618 -12.202 933 HB2 SER 28 HB2 SER 28 0.760 -9.427 -10.216 934 HB3 SER 28 HB1 SER 28 2.365 -9.902 -10.773 935 HG SER 28 HG SER 28 1.095 -9.481 -12.959 936 H ILE 29 HN ILE 29 -1.040 -12.204 -9.947 937 HA ILE 29 HA ILE 29 0.873 -13.552 -8.157 938 HB ILE 29 HB ILE 29 -1.889 -12.509 -7.578 939 HG12 ILE 29 HG12 ILE 29 0.776 -11.747 -6.384 940 HG13 ILE 29 HG11 ILE 29 -0.102 -10.818 -7.605 941 HG21 ILE 29 HG21 ILE 29 -1.497 -13.209 -5.252 942 HG22 ILE 29 HG22 ILE 29 -0.072 -14.105 -5.799 943 HG23 ILE 29 HG23 ILE 29 -1.678 -14.551 -6.381 944 HD11 ILE 29 HD11 ILE 29 -0.391 -10.026 -5.256 945 HD12 ILE 29 HD12 ILE 29 -1.262 -11.537 -4.932 946 HD13 ILE 29 HD13 ILE 29 -1.882 -10.387 -6.128 947 H ALA 30 HN ALA 30 0.675 -15.712 -7.826 948 HA ALA 30 HA ALA 30 -1.330 -17.096 -9.448 949 HB1 ALA 30 HB1 ALA 30 1.156 -18.156 -8.115 950 HB2 ALA 30 HB2 ALA 30 1.004 -17.703 -9.813 951 HB3 ALA 30 HB3 ALA 30 0.084 -19.067 -9.178 952 H ASP 31 HN ASP 31 -1.051 -16.017 -6.361 953 HA ASP 31 HA ASP 31 -2.572 -18.290 -5.271 954 HB2 ASP 31 HB2 ASP 31 -0.239 -17.527 -4.260 955 HB3 ASP 31 HB1 ASP 31 -1.263 -16.342 -3.466 956 H GLU 32 HN GLU 32 -4.556 -17.922 -4.594 957 HA GLU 32 HA GLU 32 -5.879 -15.466 -4.881 958 HB2 GLU 32 HB2 GLU 32 -7.665 -16.515 -3.514 959 HB3 GLU 32 HB1 GLU 32 -7.105 -17.555 -4.815 960 HG2 GLU 32 HG2 GLU 32 -6.981 -19.125 -3.253 961 HG3 GLU 32 HG1 GLU 32 -5.500 -18.337 -2.735 962 H LYS 33 HN LYS 33 -4.092 -16.856 -2.200 963 HA LYS 33 HA LYS 33 -5.163 -15.238 -0.144 964 HB2 LYS 33 HB2 LYS 33 -2.402 -16.462 -0.328 965 HB3 LYS 33 HB1 LYS 33 -3.161 -15.865 1.130 966 HG2 LYS 33 HG2 LYS 33 -4.354 -17.671 1.418 967 HG3 LYS 33 HG1 LYS 33 -4.730 -17.826 -0.297 968 HD2 LYS 33 HD2 LYS 33 -2.312 -18.558 -0.566 969 HD3 LYS 33 HD1 LYS 33 -2.305 -18.754 1.193 970 HE2 LYS 33 HE2 LYS 33 -2.837 -20.832 0.064 971 HE3 LYS 33 HE1 LYS 33 -4.197 -20.252 1.026 972 HZ1 LYS 33 HZ1 LYS 33 -5.300 -19.503 -0.904 973 HZ2 LYS 33 HZ2 LYS 33 -4.765 -21.073 -1.255 974 HZ3 LYS 33 HZ3 LYS 33 -3.930 -19.737 -1.877 975 H ALA 34 HN ALA 34 -2.092 -15.003 -1.879 976 HA ALA 34 HA ALA 34 -1.408 -12.468 -0.911 977 HB1 ALA 34 HB1 ALA 34 -0.553 -13.954 -3.399 978 HB2 ALA 34 HB2 ALA 34 0.285 -13.876 -1.848 979 HB3 ALA 34 HB3 ALA 34 0.173 -12.437 -2.862 980 H ARG 35 HN ARG 35 -3.568 -13.497 -3.433 981 HA ARG 35 HA ARG 35 -3.575 -11.038 -4.915 982 HB2 ARG 35 HB2 ARG 35 -4.382 -13.450 -5.607 983 HB3 ARG 35 HB1 ARG 35 -5.899 -12.927 -4.896 984 HG2 ARG 35 HG2 ARG 35 -4.614 -11.138 -6.896 985 HG3 ARG 35 HG1 ARG 35 -5.369 -12.623 -7.468 986 HD2 ARG 35 HD2 ARG 35 -6.669 -10.368 -5.944 987 HD3 ARG 35 HD1 ARG 35 -6.965 -10.865 -7.620 988 HE ARG 35 HE ARG 35 -7.657 -13.081 -6.411 989 HH11 ARG 35 HH11 ARG 35 -8.345 -9.807 -5.384 990 HH12 ARG 35 HH12 ARG 35 -9.809 -10.234 -4.558 991 HH21 ARG 35 HH21 ARG 35 -9.584 -13.649 -5.337 992 HH22 ARG 35 HH22 ARG 35 -10.515 -12.426 -4.529 993 H LYS 36 HN LYS 36 -5.903 -12.579 -2.713 994 HA LYS 36 HA LYS 36 -7.663 -10.435 -2.415 995 HB2 LYS 36 HB2 LYS 36 -6.877 -12.365 -0.242 996 HB3 LYS 36 HB1 LYS 36 -8.393 -11.483 -0.389 997 HG2 LYS 36 HG2 LYS 36 -9.251 -12.922 -1.876 998 HG3 LYS 36 HG1 LYS 36 -7.674 -13.258 -2.624 999 HD2 LYS 36 HD2 LYS 36 -8.429 -15.230 -1.435 1000 HD3 LYS 36 HD1 LYS 36 -7.030 -14.508 -0.608 1001 HE2 LYS 36 HE2 LYS 36 -8.804 -13.221 0.775 1002 HE3 LYS 36 HE1 LYS 36 -9.934 -14.428 0.159 1003 HZ1 LYS 36 HZ1 LYS 36 -7.480 -15.033 1.720 1004 HZ2 LYS 36 HZ2 LYS 36 -8.581 -16.171 1.133 1005 HZ3 LYS 36 HZ3 LYS 36 -9.061 -15.067 2.316 1006 H VAL 37 HN VAL 37 -4.947 -11.415 -0.344 1007 HA VAL 37 HA VAL 37 -5.365 -9.530 1.621 1008 HB VAL 37 HB VAL 37 -3.080 -9.832 2.380 1009 HG11 VAL 37 HG11 VAL 37 -4.465 -11.598 3.042 1010 HG12 VAL 37 HG12 VAL 37 -3.036 -12.391 2.368 1011 HG13 VAL 37 HG13 VAL 37 -4.520 -12.282 1.416 1012 HG21 VAL 37 HG21 VAL 37 -2.626 -11.172 -0.277 1013 HG22 VAL 37 HG22 VAL 37 -1.513 -11.267 1.089 1014 HG23 VAL 37 HG23 VAL 37 -1.851 -9.709 0.332 1015 H ILE 38 HN ILE 38 -3.609 -9.194 -1.424 1016 HA ILE 38 HA ILE 38 -2.702 -6.589 -0.578 1017 HB ILE 38 HB ILE 38 -1.532 -8.396 -2.232 1018 HG12 ILE 38 HG12 ILE 38 -1.080 -5.433 -2.435 1019 HG13 ILE 38 HG11 ILE 38 -0.662 -6.338 -0.987 1020 HG21 ILE 38 HG21 ILE 38 -2.622 -6.220 -4.016 1021 HG22 ILE 38 HG22 ILE 38 -3.174 -7.896 -4.026 1022 HG23 ILE 38 HG23 ILE 38 -1.513 -7.511 -4.486 1023 HD11 ILE 38 HD11 ILE 38 0.546 -6.363 -3.691 1024 HD12 ILE 38 HD12 ILE 38 0.704 -7.781 -2.650 1025 HD13 ILE 38 HD13 ILE 38 1.316 -6.215 -2.119 1026 H VAL 39 HN VAL 39 -5.234 -7.870 -2.668 1027 HA VAL 39 HA VAL 39 -5.818 -5.300 -3.737 1028 HB VAL 39 HB VAL 39 -7.787 -6.146 -4.644 1029 HG11 VAL 39 HG11 VAL 39 -5.799 -8.386 -4.440 1030 HG12 VAL 39 HG12 VAL 39 -5.887 -7.132 -5.676 1031 HG13 VAL 39 HG13 VAL 39 -7.151 -8.363 -5.567 1032 HG21 VAL 39 HG21 VAL 39 -7.744 -8.417 -2.664 1033 HG22 VAL 39 HG22 VAL 39 -8.900 -8.225 -3.982 1034 HG23 VAL 39 HG23 VAL 39 -8.863 -7.054 -2.664 1035 H GLU 40 HN GLU 40 -7.246 -7.171 -1.085 1036 HA GLU 40 HA GLU 40 -8.915 -5.193 -0.081 1037 HB2 GLU 40 HB2 GLU 40 -7.621 -7.609 1.132 1038 HB3 GLU 40 HB1 GLU 40 -8.798 -6.634 1.988 1039 HG2 GLU 40 HG2 GLU 40 -10.491 -7.147 0.452 1040 HG3 GLU 40 HG1 GLU 40 -9.365 -7.791 -0.710 1041 H LEU 41 HN LEU 41 -5.492 -5.637 0.284 1042 HA LEU 41 HA LEU 41 -5.347 -3.782 2.512 1043 HB2 LEU 41 HB2 LEU 41 -3.634 -5.721 1.449 1044 HB3 LEU 41 HB1 LEU 41 -2.829 -4.190 1.164 1045 HG LEU 41 HG LEU 41 -2.002 -4.838 3.225 1046 HD11 LEU 41 HD11 LEU 41 -2.768 -3.262 4.771 1047 HD12 LEU 41 HD12 LEU 41 -4.390 -3.255 4.092 1048 HD13 LEU 41 HD13 LEU 41 -3.051 -2.552 3.187 1049 HD21 LEU 41 HD21 LEU 41 -3.452 -6.750 3.574 1050 HD22 LEU 41 HD22 LEU 41 -4.784 -5.678 4.006 1051 HD23 LEU 41 HD23 LEU 41 -3.353 -5.765 5.033 1052 H MET 42 HN MET 42 -4.188 -3.762 -0.871 1053 HA MET 42 HA MET 42 -3.283 -1.089 -0.843 1054 HB2 MET 42 HB2 MET 42 -4.182 -2.786 -3.168 1055 HB3 MET 42 HB1 MET 42 -3.312 -1.255 -3.319 1056 HG2 MET 42 HG2 MET 42 -2.341 -3.827 -2.101 1057 HG3 MET 42 HG1 MET 42 -1.771 -3.044 -3.563 1058 HE1 MET 42 HE1 MET 42 0.053 -4.128 -1.184 1059 HE2 MET 42 HE2 MET 42 1.251 -2.838 -1.091 1060 HE3 MET 42 HE3 MET 42 0.695 -3.416 -2.666 1061 H ALA 43 HN ALA 43 -6.336 -2.553 -1.178 1062 HA ALA 43 HA ALA 43 -7.992 -0.699 -2.229 1063 HB1 ALA 43 HB1 ALA 43 -8.797 -2.764 -1.362 1064 HB2 ALA 43 HB2 ALA 43 -9.638 -1.449 -0.533 1065 HB3 ALA 43 HB3 ALA 43 -8.329 -2.317 0.277 1066 H TYR 44 HN TYR 44 -6.192 -0.552 0.767 1067 HA TYR 44 HA TYR 44 -7.370 2.078 1.427 1068 HB2 TYR 44 HB2 TYR 44 -7.548 0.546 3.287 1069 HB3 TYR 44 HB1 TYR 44 -5.879 0.055 3.082 1070 HD1 TYR 44 HD1 TYR 44 -8.114 2.364 4.702 1071 HD2 TYR 44 HD2 TYR 44 -4.043 1.696 3.723 1072 HE1 TYR 44 HE1 TYR 44 -7.450 3.945 6.457 1073 HE2 TYR 44 HE2 TYR 44 -3.357 3.281 5.467 1074 HH TYR 44 HH TYR 44 -4.372 5.243 6.677 1075 H GLU 45 HN GLU 45 -4.305 0.354 1.830 1076 HA GLU 45 HA GLU 45 -2.638 2.432 2.192 1077 HB2 GLU 45 HB2 GLU 45 -1.799 0.143 0.489 1078 HB3 GLU 45 HB1 GLU 45 -0.866 0.995 1.707 1079 HG2 GLU 45 HG2 GLU 45 -3.185 -0.812 2.205 1080 HG3 GLU 45 HG1 GLU 45 -1.504 -1.256 2.402 1081 H ASN 46 HN ASN 46 -3.956 1.338 -0.879 1082 HA ASN 46 HA ASN 46 -2.175 3.150 -2.312 1083 HB2 ASN 46 HB2 ASN 46 -3.573 0.617 -2.973 1084 HB3 ASN 46 HB1 ASN 46 -3.382 1.797 -4.262 1085 HD21 ASN 46 HD21 ASN 46 -1.941 0.440 -5.396 1086 HD22 ASN 46 HD22 ASN 46 -0.319 0.217 -4.855 1087 H ALA 47 HN ALA 47 -5.413 2.766 -1.266 1088 HA ALA 47 HA ALA 47 -6.858 3.900 -3.375 1089 HB1 ALA 47 HB1 ALA 47 -7.487 4.015 -0.439 1090 HB2 ALA 47 HB2 ALA 47 -7.926 2.709 -1.542 1091 HB3 ALA 47 HB3 ALA 47 -8.618 4.321 -1.756 1092 H ASN 48 HN ASN 48 -8.248 5.884 -2.879 1093 HA ASN 48 HA ASN 48 -6.689 8.191 -3.055 1094 HB2 ASN 48 HB2 ASN 48 -9.561 7.533 -2.756 1095 HB3 ASN 48 HB1 ASN 48 -9.091 9.150 -2.226 1096 HD21 ASN 48 HD21 ASN 48 -10.687 8.188 -4.556 1097 HD22 ASN 48 HD22 ASN 48 -9.909 8.891 -5.935 1098 HA PRO 49 HA PRO 49 -5.357 8.922 1.061 1099 HB2 PRO 49 HB2 PRO 49 -5.446 11.695 0.989 1100 HB3 PRO 49 HB1 PRO 49 -4.104 10.706 0.415 1101 HG2 PRO 49 HG2 PRO 49 -6.317 11.988 -1.119 1102 HG3 PRO 49 HG1 PRO 49 -4.612 11.786 -1.560 1103 HD2 PRO 49 HD2 PRO 49 -6.536 10.231 -2.604 1104 HD3 PRO 49 HD1 PRO 49 -4.918 9.592 -2.237 1105 H GLU 50 HN GLU 50 -8.300 10.268 -0.140 1106 HA GLU 50 HA GLU 50 -9.409 10.851 2.454 1107 HB2 GLU 50 HB2 GLU 50 -11.271 11.683 1.261 1108 HB3 GLU 50 HB1 GLU 50 -9.883 12.085 0.259 1109 HG2 GLU 50 HG2 GLU 50 -10.972 9.499 -0.366 1110 HG3 GLU 50 HG1 GLU 50 -12.125 10.803 -0.587 1111 H CYS 51 HN CYS 51 -9.301 8.309 0.115 1112 HA CYS 51 HA CYS 51 -11.787 7.185 0.980 1113 HB2 CYS 51 HB2 CYS 51 -11.195 7.266 -1.373 1114 HB3 CYS 51 HB1 CYS 51 -9.834 6.183 -1.086 1115 HG CYS 51 HG CYS 51 -11.661 4.262 0.109 1116 H GLN 52 HN GLN 52 -8.364 6.412 1.121 1117 HA GLN 52 HA GLN 52 -8.766 3.970 2.533 1118 HB2 GLN 52 HB2 GLN 52 -6.446 4.115 3.133 1119 HB3 GLN 52 HB1 GLN 52 -6.604 4.604 1.454 1120 HG2 GLN 52 HG2 GLN 52 -6.527 6.965 2.204 1121 HG3 GLN 52 HG1 GLN 52 -6.207 6.394 3.840 1122 HE21 GLN 52 HE21 GLN 52 -4.729 4.108 2.769 1123 HE22 GLN 52 HE22 GLN 52 -3.202 4.699 2.275 1124 H SER 53 HN SER 53 -8.684 7.289 3.149 1125 HA SER 53 HA SER 53 -8.765 7.198 5.965 1126 HB2 SER 53 HB2 SER 53 -9.334 9.226 3.844 1127 HB3 SER 53 HB1 SER 53 -9.556 9.606 5.561 1128 HG SER 53 HG SER 53 -7.310 9.620 4.160 1129 H ALA 54 HN ALA 54 -11.132 6.855 3.420 1130 HA ALA 54 HA ALA 54 -13.347 6.846 5.257 1131 HB1 ALA 54 HB1 ALA 54 -13.741 7.293 2.917 1132 HB2 ALA 54 HB2 ALA 54 -14.577 5.809 3.377 1133 HB3 ALA 54 HB3 ALA 54 -13.059 5.729 2.477 1134 H ILE 55 HN ILE 55 -10.884 4.694 4.371 1135 HA ILE 55 HA ILE 55 -12.371 2.312 5.013 1136 HB ILE 55 HB ILE 55 -9.672 2.799 3.843 1137 HG12 ILE 55 HG12 ILE 55 -11.867 1.190 2.644 1138 HG13 ILE 55 HG11 ILE 55 -12.020 2.952 2.681 1139 HG21 ILE 55 HG21 ILE 55 -9.444 0.849 5.252 1140 HG22 ILE 55 HG22 ILE 55 -9.478 0.365 3.556 1141 HG23 ILE 55 HG23 ILE 55 -10.909 0.155 4.562 1142 HD11 ILE 55 HD11 ILE 55 -11.066 2.021 0.596 1143 HD12 ILE 55 HD12 ILE 55 -9.653 1.492 1.532 1144 HD13 ILE 55 HD13 ILE 55 -10.046 3.218 1.403 1145 H LYS 56 HN LYS 56 -9.724 4.176 6.499 1146 HA LYS 56 HA LYS 56 -8.433 2.316 7.957 1147 HB2 LYS 56 HB2 LYS 56 -8.956 4.411 9.841 1148 HB3 LYS 56 HB1 LYS 56 -7.456 3.948 9.066 1149 HG2 LYS 56 HG2 LYS 56 -7.580 6.076 8.342 1150 HG3 LYS 56 HG1 LYS 56 -8.551 5.330 7.069 1151 HD2 LYS 56 HD2 LYS 56 -10.486 6.124 7.870 1152 HD3 LYS 56 HD1 LYS 56 -9.949 6.128 9.550 1153 HE2 LYS 56 HE2 LYS 56 -9.517 8.213 7.411 1154 HE3 LYS 56 HE1 LYS 56 -10.144 8.396 9.046 1155 HZ1 LYS 56 HZ1 LYS 56 -7.319 7.778 8.377 1156 HZ2 LYS 56 HZ2 LYS 56 -7.944 7.973 9.935 1157 HZ3 LYS 56 HZ3 LYS 56 -7.911 9.283 8.871 1158 HA PRO 57 HA PRO 57 -11.885 2.118 11.471 1159 HB2 PRO 57 HB2 PRO 57 -14.402 2.138 10.423 1160 HB3 PRO 57 HB1 PRO 57 -13.619 3.580 11.090 1161 HG2 PRO 57 HG2 PRO 57 -13.701 2.641 8.232 1162 HG3 PRO 57 HG1 PRO 57 -14.150 4.239 8.876 1163 HD2 PRO 57 HD2 PRO 57 -11.774 3.905 7.808 1164 HD3 PRO 57 HD1 PRO 57 -11.878 4.768 9.352 1165 H LEU 58 HN LEU 58 -12.180 0.964 8.172 1166 HA LEU 58 HA LEU 58 -13.182 -1.653 9.041 1167 HB2 LEU 58 HB2 LEU 58 -12.593 -1.085 6.203 1168 HB3 LEU 58 HB1 LEU 58 -13.921 -2.013 6.893 1169 HG LEU 58 HG LEU 58 -13.709 1.008 6.805 1170 HD11 LEU 58 HD11 LEU 58 -13.984 0.097 4.600 1171 HD12 LEU 58 HD12 LEU 58 -15.511 0.810 5.128 1172 HD13 LEU 58 HD13 LEU 58 -15.297 -0.941 5.153 1173 HD21 LEU 58 HD21 LEU 58 -15.976 -0.787 7.679 1174 HD22 LEU 58 HD22 LEU 58 -16.063 0.968 7.501 1175 HD23 LEU 58 HD23 LEU 58 -15.005 0.257 8.719 1176 H LYS 59 HN LYS 59 -10.449 0.091 8.140 1177 HA LYS 59 HA LYS 59 -8.850 -1.780 6.866 1178 HB2 LYS 59 HB2 LYS 59 -8.170 0.532 7.128 1179 HB3 LYS 59 HB1 LYS 59 -8.059 0.326 8.866 1180 HG2 LYS 59 HG2 LYS 59 -5.876 0.040 8.430 1181 HG3 LYS 59 HG1 LYS 59 -6.395 -1.598 8.059 1182 HD2 LYS 59 HD2 LYS 59 -6.100 0.611 6.059 1183 HD3 LYS 59 HD1 LYS 59 -4.923 -0.676 6.323 1184 HE2 LYS 59 HE2 LYS 59 -7.771 -0.994 5.368 1185 HE3 LYS 59 HE1 LYS 59 -6.320 -1.166 4.395 1186 HZ1 LYS 59 HZ1 LYS 59 -7.147 -3.318 5.009 1187 HZ2 LYS 59 HZ2 LYS 59 -7.130 -2.910 6.645 1188 HZ3 LYS 59 HZ3 LYS 59 -5.675 -3.048 5.801 1189 H GLY 60 HN GLY 60 -8.572 -3.801 7.471 1190 HA2 GLY 60 HA3 GLY 60 -7.425 -5.386 8.837 1191 HA3 GLY 60 HA2 GLY 60 -7.681 -4.329 10.217 1192 H LYS 61 HN LYS 61 -10.519 -3.891 9.289 1193 HA LYS 61 HA LYS 61 -11.580 -6.330 10.545 1194 HB2 LYS 61 HB2 LYS 61 -13.270 -3.915 10.149 1195 HB3 LYS 61 HB1 LYS 61 -13.189 -5.009 11.520 1196 HG2 LYS 61 HG2 LYS 61 -11.092 -2.966 10.874 1197 HG3 LYS 61 HG1 LYS 61 -12.418 -2.697 11.993 1198 HD2 LYS 61 HD2 LYS 61 -10.403 -4.917 12.269 1199 HD3 LYS 61 HD1 LYS 61 -10.259 -3.351 13.071 1200 HE2 LYS 61 HE2 LYS 61 -12.395 -3.726 14.187 1201 HE3 LYS 61 HE1 LYS 61 -12.539 -5.290 13.392 1202 HZ1 LYS 61 HZ1 LYS 61 -10.493 -5.981 14.531 1203 HZ2 LYS 61 HZ2 LYS 61 -11.722 -5.577 15.617 1204 HZ3 LYS 61 HZ3 LYS 61 -10.451 -4.499 15.346 1205 H VAL 62 HN VAL 62 -12.244 -7.728 9.016 1206 HA VAL 62 HA VAL 62 -14.168 -6.683 7.051 1207 HB VAL 62 HB VAL 62 -12.203 -7.535 5.884 1208 HG11 VAL 62 HG11 VAL 62 -11.558 -9.904 5.990 1209 HG12 VAL 62 HG12 VAL 62 -12.710 -10.143 7.306 1210 HG13 VAL 62 HG13 VAL 62 -11.326 -9.073 7.530 1211 HG21 VAL 62 HG21 VAL 62 -13.283 -9.262 4.468 1212 HG22 VAL 62 HG22 VAL 62 -14.294 -7.849 4.758 1213 HG23 VAL 62 HG23 VAL 62 -14.599 -9.346 5.641 1214 HA PRO 63 HA PRO 63 -17.268 -9.467 8.924 1215 HB2 PRO 63 HB2 PRO 63 -17.843 -9.926 6.037 1216 HB3 PRO 63 HB1 PRO 63 -18.959 -9.617 7.351 1217 HG2 PRO 63 HG2 PRO 63 -18.355 -7.694 5.631 1218 HG3 PRO 63 HG1 PRO 63 -18.534 -7.334 7.357 1219 HD2 PRO 63 HD2 PRO 63 -16.066 -7.535 5.712 1220 HD3 PRO 63 HD1 PRO 63 -16.406 -6.510 7.119 1221 H ALA 64 HN ALA 64 -17.240 -11.628 9.337 1222 HA ALA 64 HA ALA 64 -14.955 -13.087 8.548 1223 HB1 ALA 64 HB1 ALA 64 -17.427 -14.104 9.932 1224 HB2 ALA 64 HB2 ALA 64 -16.043 -13.359 10.730 1225 HB3 ALA 64 HB3 ALA 64 -15.852 -14.895 9.884 1226 H GLY 65 HN GLY 65 -14.768 -13.617 6.455 1227 HA2 GLY 65 HA3 GLY 65 -15.117 -15.454 4.941 1228 HA3 GLY 65 HA2 GLY 65 -16.817 -15.444 5.387 1229 H SER 66 HN SER 66 -16.247 -12.293 5.166 1230 HA SER 66 HA SER 66 -17.145 -12.235 2.380 1231 HB2 SER 66 HB2 SER 66 -17.146 -9.993 4.405 1232 HB3 SER 66 HB1 SER 66 -18.027 -10.054 2.879 1233 HG SER 66 HG SER 66 -19.069 -11.992 3.815 1234 H ASP 67 HN ASP 67 -16.452 -10.269 1.128 1235 HA ASP 67 HA ASP 67 -13.568 -10.090 1.017 1236 HB2 ASP 67 HB2 ASP 67 -15.688 -9.785 -0.796 1237 HB3 ASP 67 HB1 ASP 67 -15.035 -8.166 -0.600 1238 H VAL 68 HN VAL 68 -12.311 -8.328 1.730 1239 HA VAL 68 HA VAL 68 -13.709 -6.455 3.427 1240 HB VAL 68 HB VAL 68 -11.759 -5.825 4.315 1241 HG11 VAL 68 HG11 VAL 68 -10.609 -8.097 2.726 1242 HG12 VAL 68 HG12 VAL 68 -11.514 -8.251 4.229 1243 HG13 VAL 68 HG13 VAL 68 -9.962 -7.415 4.218 1244 HG21 VAL 68 HG21 VAL 68 -9.736 -5.245 3.061 1245 HG22 VAL 68 HG22 VAL 68 -11.172 -4.397 2.476 1246 HG23 VAL 68 HG23 VAL 68 -10.525 -5.768 1.570 1247 H ILE 69 HN ILE 69 -12.584 -6.604 0.207 1248 HA ILE 69 HA ILE 69 -12.413 -3.921 -0.444 1249 HB ILE 69 HB ILE 69 -13.201 -6.303 -2.088 1250 HG12 ILE 69 HG12 ILE 69 -10.926 -6.422 -1.401 1251 HG13 ILE 69 HG11 ILE 69 -10.913 -5.896 -3.068 1252 HG21 ILE 69 HG21 ILE 69 -14.240 -4.413 -3.139 1253 HG22 ILE 69 HG22 ILE 69 -12.822 -4.861 -4.093 1254 HG23 ILE 69 HG23 ILE 69 -12.759 -3.463 -3.015 1255 HD11 ILE 69 HD11 ILE 69 -9.274 -4.683 -1.792 1256 HD12 ILE 69 HD12 ILE 69 -10.526 -4.149 -0.659 1257 HD13 ILE 69 HD13 ILE 69 -10.548 -3.577 -2.329 1258 H SER 70 HN SER 70 -15.168 -6.088 -0.582 1259 HA SER 70 HA SER 70 -17.137 -4.475 -1.558 1260 HB2 SER 70 HB2 SER 70 -17.582 -6.780 -1.030 1261 HB3 SER 70 HB1 SER 70 -17.264 -6.511 0.681 1262 HG SER 70 HG SER 70 -19.465 -5.654 -0.873 1263 H GLU 71 HN GLU 71 -15.711 -4.375 1.635 1264 HA GLU 71 HA GLU 71 -17.606 -2.480 2.695 1265 HB2 GLU 71 HB2 GLU 71 -15.021 -3.414 3.911 1266 HB3 GLU 71 HB1 GLU 71 -16.441 -2.785 4.740 1267 HG2 GLU 71 HG2 GLU 71 -16.878 -5.177 3.105 1268 HG3 GLU 71 HG1 GLU 71 -15.848 -5.391 4.515 1269 H TYR 72 HN TYR 72 -14.424 -2.590 1.391 1270 HA TYR 72 HA TYR 72 -13.654 -0.010 2.325 1271 HB2 TYR 72 HB2 TYR 72 -12.477 -2.014 0.413 1272 HB3 TYR 72 HB1 TYR 72 -11.759 -0.426 0.634 1273 HD1 TYR 72 HD1 TYR 72 -13.327 -1.920 3.527 1274 HD2 TYR 72 HD2 TYR 72 -9.692 -1.590 1.367 1275 HE1 TYR 72 HE1 TYR 72 -12.099 -2.758 5.466 1276 HE2 TYR 72 HE2 TYR 72 -8.448 -2.445 3.306 1277 HH TYR 72 HH TYR 72 -10.099 -3.755 6.084 1278 H VAL 73 HN VAL 73 -14.969 -1.399 -0.614 1279 HA VAL 73 HA VAL 73 -15.049 1.033 -2.079 1280 HB VAL 73 HB VAL 73 -16.252 0.002 -3.726 1281 HG11 VAL 73 HG11 VAL 73 -15.541 -2.291 -4.016 1282 HG12 VAL 73 HG12 VAL 73 -15.100 -2.370 -2.311 1283 HG13 VAL 73 HG13 VAL 73 -14.235 -1.289 -3.395 1284 HG21 VAL 73 HG21 VAL 73 -18.180 -0.501 -2.101 1285 HG22 VAL 73 HG22 VAL 73 -17.465 -2.116 -2.005 1286 HG23 VAL 73 HG23 VAL 73 -18.012 -1.475 -3.565 1287 H LYS 74 HN LYS 74 -17.032 -0.568 0.255 1288 HA LYS 74 HA LYS 74 -19.327 1.105 0.102 1289 HB2 LYS 74 HB2 LYS 74 -19.500 -1.080 1.012 1290 HB3 LYS 74 HB1 LYS 74 -18.197 -0.788 2.147 1291 HG2 LYS 74 HG2 LYS 74 -20.109 1.131 2.745 1292 HG3 LYS 74 HG1 LYS 74 -21.026 -0.340 2.413 1293 HD2 LYS 74 HD2 LYS 74 -20.486 -0.288 4.758 1294 HD3 LYS 74 HD1 LYS 74 -19.543 -1.562 3.983 1295 HE2 LYS 74 HE2 LYS 74 -18.065 -0.417 5.444 1296 HE3 LYS 74 HE1 LYS 74 -17.654 0.087 3.800 1297 HZ1 LYS 74 HZ1 LYS 74 -18.937 2.114 4.158 1298 HZ2 LYS 74 HZ2 LYS 74 -17.707 1.971 5.311 1299 HZ3 LYS 74 HZ3 LYS 74 -19.307 1.632 5.736 1300 H ALA 75 HN ALA 75 -16.241 1.232 1.639 1301 HA ALA 75 HA ALA 75 -16.730 3.354 3.447 1302 HB1 ALA 75 HB1 ALA 75 -14.726 1.996 3.578 1303 HB2 ALA 75 HB2 ALA 75 -14.285 3.688 3.352 1304 HB3 ALA 75 HB3 ALA 75 -14.208 2.564 1.992 1305 H CYS 76 HN CYS 76 -15.560 3.262 0.110 1306 HA CYS 76 HA CYS 76 -15.783 6.158 -0.110 1307 HB2 CYS 76 HB2 CYS 76 -13.877 5.119 -1.111 1308 HB3 CYS 76 HB1 CYS 76 -14.875 4.032 -2.046 1309 HG CYS 76 HG CYS 76 -13.951 7.186 -2.674 1310 H ASP 77 HN ASP 77 -17.989 3.803 -0.136 1311 HA ASP 77 HA ASP 77 -19.597 4.408 -2.349 1312 HB2 ASP 77 HB2 ASP 77 -20.116 2.466 -1.106 1313 HB3 ASP 77 HB1 ASP 77 -20.236 3.341 0.410 1314 H GLY 78 HN GLY 78 -18.840 6.193 0.475 1315 HA2 GLY 78 HA3 GLY 78 -20.940 8.159 -0.083 1316 HA3 GLY 78 HA2 GLY 78 -19.874 8.157 1.314 1317 H ILE 79 HN ILE 79 -17.707 7.535 -0.931 1318 HA ILE 79 HA ILE 79 -17.016 10.331 -1.255 1319 HB ILE 79 HB ILE 79 -15.443 7.836 -1.832 1320 HG12 ILE 79 HG12 ILE 79 -15.079 9.874 0.375 1321 HG13 ILE 79 HG11 ILE 79 -15.895 8.322 0.576 1322 HG21 ILE 79 HG21 ILE 79 -14.537 10.705 -1.919 1323 HG22 ILE 79 HG22 ILE 79 -14.732 9.631 -3.303 1324 HG23 ILE 79 HG23 ILE 79 -13.495 9.293 -2.092 1325 HD11 ILE 79 HD11 ILE 79 -13.043 8.638 -0.304 1326 HD12 ILE 79 HD12 ILE 79 -13.870 7.141 0.134 1327 HD13 ILE 79 HD13 ILE 79 -13.551 8.367 1.360 1328 H GLY 80 HN GLY 80 -16.692 11.319 -3.229 1329 HA2 GLY 80 HA3 GLY 80 -16.324 10.641 -5.703 1330 HA3 GLY 80 HA2 GLY 80 -17.943 9.992 -5.510 1331 H GLY 81 HN GLY 81 -18.500 12.233 -3.581 1332 HA2 GLY 81 HA3 GLY 81 -17.993 14.748 -4.652 1333 HA3 GLY 81 HA2 GLY 81 -19.514 14.190 -5.344 1334 H ALA 82 HN ALA 82 -19.412 16.432 -3.721 1335 HA ALA 82 HA ALA 82 -20.405 17.420 -1.944 1336 HB1 ALA 82 HB1 ALA 82 -22.042 14.897 -1.851 1337 HB2 ALA 82 HB2 ALA 82 -22.367 16.297 -2.872 1338 HB3 ALA 82 HB3 ALA 82 -22.463 16.444 -1.117 1339 H MET 83 HN MET 83 -20.865 14.187 -0.616 1340 HA MET 83 HA MET 83 -19.968 14.891 1.945 1341 HB2 MET 83 HB2 MET 83 -20.186 12.158 0.672 1342 HB3 MET 83 HB1 MET 83 -19.944 12.449 2.388 1343 HG2 MET 83 HG2 MET 83 -22.091 13.656 2.452 1344 HG3 MET 83 HG1 MET 83 -22.334 13.259 0.753 1345 HE1 MET 83 HE1 MET 83 -22.193 10.136 4.153 1346 HE2 MET 83 HE2 MET 83 -21.973 11.871 4.385 1347 HE3 MET 83 HE3 MET 83 -20.741 10.930 3.546 1348 H HIS 84 HN HIS 84 -18.302 13.351 -0.764 1349 HA HIS 84 HA HIS 84 -15.897 12.642 0.427 1350 HB2 HIS 84 HB2 HIS 84 -16.163 12.017 -1.818 1351 HB3 HIS 84 HB1 HIS 84 -16.600 13.638 -2.333 1352 HD1 HIS 84 HD1 HIS 84 -14.863 14.248 -3.982 1353 HD2 HIS 84 HD2 HIS 84 -13.215 12.477 -0.614 1354 HE1 HIS 84 HE1 HIS 84 -12.380 14.367 -4.309 1355 HE2 HIS 84 HE2 HIS 84 -11.439 13.006 -2.419 1356 H LYS 85 HN LYS 85 -17.041 15.865 -0.433 1357 HA LYS 85 HA LYS 85 -14.424 17.035 -0.098 1358 HB2 LYS 85 HB2 LYS 85 -17.106 18.411 -0.347 1359 HB3 LYS 85 HB1 LYS 85 -15.524 19.157 -0.541 1360 HG2 LYS 85 HG2 LYS 85 -16.750 17.056 -2.319 1361 HG3 LYS 85 HG1 LYS 85 -16.507 18.761 -2.708 1362 HD2 LYS 85 HD2 LYS 85 -14.099 18.467 -2.594 1363 HD3 LYS 85 HD1 LYS 85 -14.307 16.785 -2.105 1364 HE2 LYS 85 HE2 LYS 85 -13.771 16.803 -4.430 1365 HE3 LYS 85 HE1 LYS 85 -15.470 16.370 -4.261 1366 HZ1 LYS 85 HZ1 LYS 85 -14.477 19.086 -4.931 1367 HZ2 LYS 85 HZ2 LYS 85 -16.095 18.601 -4.858 1368 HZ3 LYS 85 HZ3 LYS 85 -15.077 17.970 -6.050 1369 H ALA 86 HN ALA 86 -17.349 16.653 1.788 1370 HA ALA 86 HA ALA 86 -16.481 18.255 3.998 1371 HB1 ALA 86 HB1 ALA 86 -18.359 17.212 5.191 1372 HB2 ALA 86 HB2 ALA 86 -18.583 16.097 3.842 1373 HB3 ALA 86 HB3 ALA 86 -18.845 17.825 3.612 1374 H MET 87 HN MET 87 -16.510 14.847 3.229 1375 HA MET 87 HA MET 87 -15.339 14.006 5.697 1376 HB2 MET 87 HB2 MET 87 -15.709 12.518 3.083 1377 HB3 MET 87 HB1 MET 87 -15.328 11.787 4.643 1378 HG2 MET 87 HG2 MET 87 -17.437 12.406 5.541 1379 HG3 MET 87 HG1 MET 87 -17.794 13.418 4.152 1380 HE1 MET 87 HE1 MET 87 -16.303 9.739 4.317 1381 HE2 MET 87 HE2 MET 87 -17.779 8.800 4.096 1382 HE3 MET 87 HE3 MET 87 -17.565 9.777 5.547 1383 H LEU 88 HN LEU 88 -14.138 15.290 2.802 1384 HA LEU 88 HA LEU 88 -11.652 14.134 2.520 1385 HB2 LEU 88 HB2 LEU 88 -12.900 16.109 1.278 1386 HB3 LEU 88 HB1 LEU 88 -11.935 17.100 2.348 1387 HG LEU 88 HG LEU 88 -10.185 16.937 0.980 1388 HD11 LEU 88 HD11 LEU 88 -9.120 14.836 0.407 1389 HD12 LEU 88 HD12 LEU 88 -10.550 13.943 0.921 1390 HD13 LEU 88 HD13 LEU 88 -9.588 14.827 2.106 1391 HD21 LEU 88 HD21 LEU 88 -12.062 15.258 -0.654 1392 HD22 LEU 88 HD22 LEU 88 -10.545 15.938 -1.249 1393 HD23 LEU 88 HD23 LEU 88 -11.856 17.007 -0.741 1394 H MET 89 HN MET 89 -12.501 16.991 4.478 1395 HA MET 89 HA MET 89 -9.895 17.209 5.613 1396 HB2 MET 89 HB2 MET 89 -11.375 19.150 5.330 1397 HB3 MET 89 HB1 MET 89 -12.522 18.452 6.463 1398 HG2 MET 89 HG2 MET 89 -10.824 18.598 8.236 1399 HG3 MET 89 HG1 MET 89 -9.725 19.366 7.092 1400 HE1 MET 89 HE1 MET 89 -9.426 21.369 8.833 1401 HE2 MET 89 HE2 MET 89 -10.566 20.601 9.938 1402 HE3 MET 89 HE3 MET 89 -10.772 22.296 9.495 1403 H ALA 90 HN ALA 90 -12.698 15.381 6.359 1404 HA ALA 90 HA ALA 90 -12.112 15.169 9.191 1405 HB1 ALA 90 HB1 ALA 90 -14.175 13.938 9.319 1406 HB2 ALA 90 HB2 ALA 90 -14.211 13.732 7.565 1407 HB3 ALA 90 HB3 ALA 90 -14.431 15.337 8.272 1408 H GLN 91 HN GLN 91 -11.590 13.324 6.309 1409 HA GLN 91 HA GLN 91 -10.811 11.020 7.944 1410 HB2 GLN 91 HB2 GLN 91 -11.610 11.134 5.040 1411 HB3 GLN 91 HB1 GLN 91 -11.217 9.678 5.945 1412 HG2 GLN 91 HG2 GLN 91 -13.080 10.061 7.418 1413 HG3 GLN 91 HG1 GLN 91 -13.474 11.531 6.544 1414 HE21 GLN 91 HE21 GLN 91 -12.978 10.656 3.975 1415 HE22 GLN 91 HE22 GLN 91 -14.138 9.468 3.559 1416 H LEU 92 HN LEU 92 -9.858 12.803 5.005 1417 HA LEU 92 HA LEU 92 -7.419 11.657 4.438 1418 HB2 LEU 92 HB2 LEU 92 -8.797 13.710 3.449 1419 HB3 LEU 92 HB1 LEU 92 -7.658 14.630 4.401 1420 HG LEU 92 HG LEU 92 -7.217 13.041 1.922 1421 HD11 LEU 92 HD11 LEU 92 -5.879 15.037 1.384 1422 HD12 LEU 92 HD12 LEU 92 -6.302 15.703 2.964 1423 HD13 LEU 92 HD13 LEU 92 -7.561 15.404 1.768 1424 HD21 LEU 92 HD21 LEU 92 -5.066 13.624 3.958 1425 HD22 LEU 92 HD22 LEU 92 -4.774 13.129 2.292 1426 HD23 LEU 92 HD23 LEU 92 -5.589 12.033 3.407 1427 H GLU 93 HN GLU 93 -8.443 13.702 6.970 1428 HA GLU 93 HA GLU 93 -6.682 15.317 7.934 1429 HB2 GLU 93 HB2 GLU 93 -7.269 14.652 10.263 1430 HB3 GLU 93 HB1 GLU 93 -8.664 14.813 9.194 1431 HG2 GLU 93 HG2 GLU 93 -9.040 12.533 9.133 1432 HG3 GLU 93 HG1 GLU 93 -7.402 12.135 9.645 Start of MODEL 4 1 H2 PRO 1 HT1 PRO 1 -5.147 -3.979 13.340 2 H3 PRO 1 HT2 PRO 1 -5.503 -2.461 13.835 3 HA PRO 1 HA PRO 1 -6.300 -2.404 11.819 4 HB2 PRO 1 HB2 PRO 1 -4.250 -1.408 10.409 5 HB3 PRO 1 HB1 PRO 1 -4.937 -0.527 11.776 6 HG2 PRO 1 HG2 PRO 1 -2.363 -1.912 11.568 7 HG3 PRO 1 HG1 PRO 1 -2.894 -0.696 12.745 8 HD2 PRO 1 HD2 PRO 1 -2.831 -3.600 12.989 9 HD3 PRO 1 HD1 PRO 1 -3.110 -2.382 14.248 10 H SER 2 HN SER 2 -4.532 -2.587 9.385 11 HA SER 2 HA SER 2 -4.334 -5.390 8.923 12 HB2 SER 2 HB2 SER 2 -2.965 -3.056 7.567 13 HB3 SER 2 HB1 SER 2 -2.922 -4.712 6.989 14 HG SER 2 HG SER 2 -5.192 -4.646 6.782 15 H PHE 3 HN PHE 3 -1.963 -6.150 8.252 16 HA PHE 3 HA PHE 3 -0.312 -5.863 10.571 17 HB2 PHE 3 HB2 PHE 3 1.275 -6.933 8.582 18 HB3 PHE 3 HB1 PHE 3 0.321 -7.859 9.738 19 HD1 PHE 3 HD1 PHE 3 0.827 -6.906 6.318 20 HD2 PHE 3 HD2 PHE 3 -1.954 -8.671 9.024 21 HE1 PHE 3 HE1 PHE 3 -0.384 -7.913 4.441 22 HE2 PHE 3 HE2 PHE 3 -3.179 -9.659 7.136 23 HZ PHE 3 HZ PHE 3 -2.393 -9.278 4.834 24 H ASN 4 HN ASN 4 -0.166 -4.867 7.221 25 HA ASN 4 HA ASN 4 2.508 -3.861 7.544 26 HB2 ASN 4 HB2 ASN 4 2.367 -3.548 5.119 27 HB3 ASN 4 HB1 ASN 4 1.885 -5.175 5.594 28 HD21 ASN 4 HD21 ASN 4 0.673 -2.006 4.687 29 HD22 ASN 4 HD22 ASN 4 -0.862 -2.561 4.105 30 H THR 5 HN THR 5 -0.281 -2.416 8.335 31 HA THR 5 HA THR 5 -0.279 -0.055 6.749 32 HB THR 5 HB THR 5 -1.518 0.815 8.896 33 HG1 THR 5 HG1 THR 5 -1.363 -0.685 10.412 34 HG21 THR 5 HG21 THR 5 -2.642 0.459 6.845 35 HG22 THR 5 HG22 THR 5 -3.557 -0.399 8.091 36 HG23 THR 5 HG23 THR 5 -2.497 -1.290 7.001 37 H VAL 6 HN VAL 6 1.946 -1.127 9.017 38 HA VAL 6 HA VAL 6 2.704 1.414 10.095 39 HB VAL 6 HB VAL 6 4.440 0.309 11.178 40 HG11 VAL 6 HG11 VAL 6 2.368 -1.826 10.722 41 HG12 VAL 6 HG12 VAL 6 2.310 -0.555 11.943 42 HG13 VAL 6 HG13 VAL 6 3.548 -1.806 12.031 43 HG21 VAL 6 HG21 VAL 6 5.460 -0.574 9.079 44 HG22 VAL 6 HG22 VAL 6 4.355 -1.951 9.191 45 HG23 VAL 6 HG23 VAL 6 5.559 -1.677 10.460 46 H ARG 7 HN ARG 7 4.178 2.857 9.218 47 HA ARG 7 HA ARG 7 5.865 1.963 7.080 48 HB2 ARG 7 HB2 ARG 7 4.919 3.551 5.407 49 HB3 ARG 7 HB1 ARG 7 3.962 2.145 5.825 50 HG2 ARG 7 HG2 ARG 7 3.132 4.152 7.558 51 HG3 ARG 7 HG1 ARG 7 3.235 4.877 5.950 52 HD2 ARG 7 HD2 ARG 7 1.841 3.168 5.022 53 HD3 ARG 7 HD1 ARG 7 1.870 2.253 6.526 54 HE ARG 7 HE ARG 7 0.838 4.742 7.153 55 HH11 ARG 7 HH11 ARG 7 0.054 2.092 5.075 56 HH12 ARG 7 HH12 ARG 7 -1.661 2.349 5.128 57 HH21 ARG 7 HH21 ARG 7 -1.411 5.134 7.279 58 HH22 ARG 7 HH22 ARG 7 -2.500 4.096 6.421 59 H GLN 8 HN GLN 8 7.209 3.519 6.176 60 HA GLN 8 HA GLN 8 8.775 4.951 7.804 61 HB2 GLN 8 HB2 GLN 8 8.463 4.645 5.018 62 HB3 GLN 8 HB1 GLN 8 8.669 6.370 5.315 63 HG2 GLN 8 HG2 GLN 8 10.696 5.875 6.620 64 HG3 GLN 8 HG1 GLN 8 10.506 4.168 6.225 65 HE21 GLN 8 HE21 GLN 8 12.730 5.835 5.612 66 HE22 GLN 8 HE22 GLN 8 12.859 5.863 3.878 67 H GLY 9 HN GLY 9 8.333 6.480 9.201 68 HA2 GLY 9 HA3 GLY 9 6.446 8.612 8.589 69 HA3 GLY 9 HA2 GLY 9 7.330 8.396 10.095 70 H SER 10 HN SER 10 8.004 10.585 10.123 71 HA SER 10 HA SER 10 9.152 11.993 8.024 72 HB2 SER 10 HB2 SER 10 9.825 12.239 10.964 73 HB3 SER 10 HB1 SER 10 10.070 13.476 9.730 74 HG SER 10 HG SER 10 7.506 12.534 9.777 75 H LYS 11 HN LYS 11 10.676 11.129 6.797 76 HA LYS 11 HA LYS 11 12.292 9.660 6.150 77 HB2 LYS 11 HB2 LYS 11 14.481 10.562 6.377 78 HB3 LYS 11 HB1 LYS 11 13.361 11.890 6.188 79 HG2 LYS 11 HG2 LYS 11 14.248 11.060 8.921 80 HG3 LYS 11 HG1 LYS 11 15.279 12.074 7.913 81 HD2 LYS 11 HD2 LYS 11 13.580 13.766 7.784 82 HD3 LYS 11 HD1 LYS 11 12.419 12.725 8.611 83 HE2 LYS 11 HE2 LYS 11 14.972 13.825 9.783 84 HE3 LYS 11 HE1 LYS 11 13.342 14.400 10.129 85 HZ1 LYS 11 HZ1 LYS 11 14.032 12.946 11.873 86 HZ2 LYS 11 HZ2 LYS 11 14.462 11.730 10.784 87 HZ3 LYS 11 HZ3 LYS 11 12.836 12.148 10.984 88 H GLU 12 HN GLU 12 11.018 8.367 8.100 89 HA GLU 12 HA GLU 12 12.559 7.350 10.206 90 HB2 GLU 12 HB2 GLU 12 10.127 7.001 9.938 91 HB3 GLU 12 HB1 GLU 12 10.420 5.992 8.535 92 HG2 GLU 12 HG2 GLU 12 11.482 4.318 9.903 93 HG3 GLU 12 HG1 GLU 12 11.356 5.356 11.320 94 HA PRO 13 HA PRO 13 15.802 5.039 8.150 95 HB2 PRO 13 HB2 PRO 13 15.210 2.987 10.205 96 HB3 PRO 13 HB1 PRO 13 16.754 3.729 9.787 97 HG2 PRO 13 HG2 PRO 13 15.429 4.377 12.027 98 HG3 PRO 13 HG1 PRO 13 16.383 5.557 11.119 99 HD2 PRO 13 HD2 PRO 13 13.445 5.262 11.328 100 HD3 PRO 13 HD1 PRO 13 14.415 6.712 11.029 101 H TYR 14 HN TYR 14 15.497 3.823 6.380 102 HA TYR 14 HA TYR 14 12.860 2.924 5.948 103 HB2 TYR 14 HB2 TYR 14 14.099 4.004 4.155 104 HB3 TYR 14 HB1 TYR 14 15.250 2.673 4.125 105 HD1 TYR 14 HD1 TYR 14 14.156 0.316 3.824 106 HD2 TYR 14 HD2 TYR 14 12.334 3.940 2.652 107 HE1 TYR 14 HE1 TYR 14 12.744 -0.931 2.271 108 HE2 TYR 14 HE2 TYR 14 10.912 2.721 1.080 109 HH TYR 14 HH TYR 14 10.458 0.746 0.169 110 HA PRO 15 HA PRO 15 14.841 -1.517 5.463 111 HB2 PRO 15 HB2 PRO 15 17.036 -1.313 7.427 112 HB3 PRO 15 HB1 PRO 15 16.995 -2.140 5.873 113 HG2 PRO 15 HG2 PRO 15 18.349 0.141 6.238 114 HG3 PRO 15 HG1 PRO 15 17.584 -0.265 4.705 115 HD2 PRO 15 HD2 PRO 15 16.748 1.690 6.776 116 HD3 PRO 15 HD1 PRO 15 16.515 1.724 5.025 117 H ASP 16 HN ASP 16 14.658 0.508 8.146 118 HA ASP 16 HA ASP 16 13.899 -1.573 10.019 119 HB2 ASP 16 HB2 ASP 16 14.690 1.269 10.238 120 HB3 ASP 16 HB1 ASP 16 13.518 0.710 11.424 121 H PHE 17 HN PHE 17 12.501 1.210 8.362 122 HA PHE 17 HA PHE 17 9.933 1.131 9.463 123 HB2 PHE 17 HB2 PHE 17 9.706 2.879 8.015 124 HB3 PHE 17 HB1 PHE 17 11.240 2.439 7.282 125 HD1 PHE 17 HD1 PHE 17 7.667 1.292 7.153 126 HD2 PHE 17 HD2 PHE 17 11.266 2.075 5.044 127 HE1 PHE 17 HE1 PHE 17 6.555 0.722 5.025 128 HE2 PHE 17 HE2 PHE 17 10.148 1.511 2.940 129 HZ PHE 17 HZ PHE 17 7.788 0.858 2.933 130 H VAL 18 HN VAL 18 11.378 -0.595 6.768 131 HA VAL 18 HA VAL 18 8.980 -2.055 6.214 132 HB VAL 18 HB VAL 18 10.213 -1.733 4.279 133 HG11 VAL 18 HG11 VAL 18 12.652 -2.677 5.783 134 HG12 VAL 18 HG12 VAL 18 12.297 -1.016 5.301 135 HG13 VAL 18 HG13 VAL 18 12.604 -2.248 4.062 136 HG21 VAL 18 HG21 VAL 18 10.748 -4.473 5.379 137 HG22 VAL 18 HG22 VAL 18 11.166 -4.010 3.727 138 HG23 VAL 18 HG23 VAL 18 9.482 -3.964 4.253 139 H ALA 19 HN ALA 19 11.993 -2.718 7.963 140 HA ALA 19 HA ALA 19 11.651 -5.471 8.289 141 HB1 ALA 19 HB1 ALA 19 13.687 -4.263 8.976 142 HB2 ALA 19 HB2 ALA 19 13.063 -5.300 10.259 143 HB3 ALA 19 HB3 ALA 19 12.801 -3.558 10.327 144 H ARG 20 HN ARG 20 10.014 -2.814 9.956 145 HA ARG 20 HA ARG 20 8.737 -4.700 11.752 146 HB2 ARG 20 HB2 ARG 20 7.462 -2.773 12.608 147 HB3 ARG 20 HB1 ARG 20 9.194 -2.511 12.692 148 HG2 ARG 20 HG2 ARG 20 9.159 -0.871 11.084 149 HG3 ARG 20 HG1 ARG 20 7.675 -1.479 10.345 150 HD2 ARG 20 HD2 ARG 20 6.344 -0.640 12.111 151 HD3 ARG 20 HD1 ARG 20 7.748 -0.307 13.107 152 HE ARG 20 HE ARG 20 8.199 1.296 11.025 153 HH11 ARG 20 HH11 ARG 20 5.309 0.763 12.931 154 HH12 ARG 20 HH12 ARG 20 4.708 2.373 12.700 155 HH21 ARG 20 HH21 ARG 20 7.430 3.416 10.739 156 HH22 ARG 20 HH22 ARG 20 5.905 3.877 11.437 157 H LEU 21 HN LEU 21 8.232 -3.039 8.787 158 HA LEU 21 HA LEU 21 5.553 -3.513 8.292 159 HB2 LEU 21 HB2 LEU 21 7.377 -2.288 6.907 160 HB3 LEU 21 HB1 LEU 21 7.715 -3.859 6.226 161 HG LEU 21 HG LEU 21 5.678 -3.930 5.073 162 HD11 LEU 21 HD11 LEU 21 4.136 -3.248 6.767 163 HD12 LEU 21 HD12 LEU 21 3.921 -2.187 5.371 164 HD13 LEU 21 HD13 LEU 21 4.810 -1.621 6.788 165 HD21 LEU 21 HD21 LEU 21 7.184 -2.519 3.958 166 HD22 LEU 21 HD22 LEU 21 6.856 -1.186 5.061 167 HD23 LEU 21 HD23 LEU 21 5.622 -1.699 3.916 168 H GLN 22 HN GLN 22 8.386 -5.527 7.681 169 HA GLN 22 HA GLN 22 7.011 -7.840 6.870 170 HB2 GLN 22 HB2 GLN 22 9.681 -7.922 8.200 171 HB3 GLN 22 HB1 GLN 22 9.063 -8.891 6.859 172 HG2 GLN 22 HG2 GLN 22 9.173 -6.816 5.487 173 HG3 GLN 22 HG1 GLN 22 9.981 -6.044 6.838 174 HE21 GLN 22 HE21 GLN 22 10.967 -6.412 4.268 175 HE22 GLN 22 HE22 GLN 22 12.390 -7.384 4.361 176 H ASP 23 HN ASP 23 8.467 -6.818 9.876 177 HA ASP 23 HA ASP 23 8.162 -9.023 11.459 178 HB2 ASP 23 HB2 ASP 23 9.077 -6.778 12.125 179 HB3 ASP 23 HB1 ASP 23 7.405 -6.260 12.334 180 H VAL 24 HN VAL 24 5.686 -6.502 11.038 181 HA VAL 24 HA VAL 24 3.879 -8.029 12.663 182 HB VAL 24 HB VAL 24 3.836 -5.607 12.863 183 HG11 VAL 24 HG11 VAL 24 4.567 -5.028 10.642 184 HG12 VAL 24 HG12 VAL 24 3.056 -4.198 11.014 185 HG13 VAL 24 HG13 VAL 24 3.050 -5.615 9.963 186 HG21 VAL 24 HG21 VAL 24 1.327 -6.734 11.622 187 HG22 VAL 24 HG22 VAL 24 1.398 -5.176 12.450 188 HG23 VAL 24 HG23 VAL 24 1.734 -6.667 13.336 189 H ALA 25 HN ALA 25 4.592 -7.616 9.319 190 HA ALA 25 HA ALA 25 2.128 -8.692 8.322 191 HB1 ALA 25 HB1 ALA 25 3.587 -7.357 6.859 192 HB2 ALA 25 HB2 ALA 25 3.339 -8.973 6.201 193 HB3 ALA 25 HB3 ALA 25 4.852 -8.575 7.012 194 H GLN 26 HN GLN 26 4.932 -9.788 9.803 195 HA GLN 26 HA GLN 26 4.674 -12.528 8.949 196 HB2 GLN 26 HB2 GLN 26 6.854 -12.333 9.352 197 HB3 GLN 26 HB1 GLN 26 6.597 -10.808 10.182 198 HG2 GLN 26 HG2 GLN 26 7.514 -11.975 11.860 199 HG3 GLN 26 HG1 GLN 26 5.832 -12.419 12.127 200 HE21 GLN 26 HE21 GLN 26 5.761 -14.104 9.760 201 HE22 GLN 26 HE22 GLN 26 6.601 -15.547 10.165 202 H LYS 27 HN LYS 27 4.052 -10.515 11.721 203 HA LYS 27 HA LYS 27 3.262 -12.522 13.538 204 HB2 LYS 27 HB2 LYS 27 2.332 -9.647 13.421 205 HB3 LYS 27 HB1 LYS 27 2.300 -10.704 14.836 206 HG2 LYS 27 HG2 LYS 27 4.753 -9.707 13.406 207 HG3 LYS 27 HG1 LYS 27 4.144 -9.140 14.962 208 HD2 LYS 27 HD2 LYS 27 4.781 -11.077 16.054 209 HD3 LYS 27 HD1 LYS 27 4.786 -12.033 14.572 210 HE2 LYS 27 HE2 LYS 27 6.798 -11.109 13.841 211 HE3 LYS 27 HE1 LYS 27 6.695 -9.768 14.975 212 HZ1 LYS 27 HZ1 LYS 27 7.095 -11.310 16.786 213 HZ2 LYS 27 HZ2 LYS 27 8.340 -11.419 15.650 214 HZ3 LYS 27 HZ3 LYS 27 7.145 -12.611 15.707 215 H SER 28 HN SER 28 1.512 -10.816 11.015 216 HA SER 28 HA SER 28 -1.002 -11.893 12.066 217 HB2 SER 28 HB2 SER 28 -0.879 -9.445 11.833 218 HB3 SER 28 HB1 SER 28 -0.520 -9.640 10.119 219 HG SER 28 HG SER 28 -2.674 -10.982 10.368 220 H ILE 29 HN ILE 29 1.306 -12.403 9.726 221 HA ILE 29 HA ILE 29 -0.652 -13.740 7.973 222 HB ILE 29 HB ILE 29 2.077 -12.652 7.326 223 HG12 ILE 29 HG12 ILE 29 -0.628 -11.894 6.224 224 HG13 ILE 29 HG11 ILE 29 0.277 -10.977 7.435 225 HG21 ILE 29 HG21 ILE 29 0.226 -14.242 5.581 226 HG22 ILE 29 HG22 ILE 29 1.859 -14.670 6.105 227 HG23 ILE 29 HG23 ILE 29 1.615 -13.314 5.001 228 HD11 ILE 29 HD11 ILE 29 1.369 -11.644 4.722 229 HD12 ILE 29 HD12 ILE 29 2.009 -10.500 5.914 230 HD13 ILE 29 HD13 ILE 29 0.490 -10.152 5.084 231 H ALA 30 HN ALA 30 -0.547 -15.899 7.822 232 HA ALA 30 HA ALA 30 1.525 -17.294 9.296 233 HB1 ALA 30 HB1 ALA 30 -0.820 -17.952 9.553 234 HB2 ALA 30 HB2 ALA 30 0.169 -19.279 8.941 235 HB3 ALA 30 HB3 ALA 30 -0.882 -18.382 7.845 236 H ASP 31 HN ASP 31 1.264 -16.147 6.203 237 HA ASP 31 HA ASP 31 2.821 -18.384 5.088 238 HB2 ASP 31 HB2 ASP 31 0.473 -17.570 4.096 239 HB3 ASP 31 HB1 ASP 31 1.540 -16.443 3.270 240 H GLU 32 HN GLU 32 4.740 -17.986 4.159 241 HA GLU 32 HA GLU 32 6.056 -15.509 4.556 242 HB2 GLU 32 HB2 GLU 32 7.810 -16.496 3.089 243 HB3 GLU 32 HB1 GLU 32 7.331 -17.550 4.410 244 HG2 GLU 32 HG2 GLU 32 7.174 -19.118 2.854 245 HG3 GLU 32 HG1 GLU 32 5.651 -18.367 2.410 246 H LYS 33 HN LYS 33 4.225 -16.876 1.893 247 HA LYS 33 HA LYS 33 5.218 -15.219 -0.162 248 HB2 LYS 33 HB2 LYS 33 2.454 -16.425 0.072 249 HB3 LYS 33 HB1 LYS 33 3.206 -15.851 -1.397 250 HG2 LYS 33 HG2 LYS 33 4.356 -17.684 -1.686 251 HG3 LYS 33 HG1 LYS 33 4.770 -17.820 0.021 252 HD2 LYS 33 HD2 LYS 33 2.383 -18.549 0.387 253 HD3 LYS 33 HD1 LYS 33 2.264 -18.704 -1.372 254 HE2 LYS 33 HE2 LYS 33 2.828 -20.817 -0.332 255 HE3 LYS 33 HE1 LYS 33 4.137 -20.233 -1.358 256 HZ1 LYS 33 HZ1 LYS 33 5.368 -19.558 0.522 257 HZ2 LYS 33 HZ2 LYS 33 4.834 -21.133 0.852 258 HZ3 LYS 33 HZ3 LYS 33 4.055 -19.808 1.567 259 H ALA 34 HN ALA 34 2.143 -15.024 1.573 260 HA ALA 34 HA ALA 34 1.451 -12.471 0.699 261 HB1 ALA 34 HB1 ALA 34 -0.223 -13.882 1.643 262 HB2 ALA 34 HB2 ALA 34 -0.075 -12.481 2.706 263 HB3 ALA 34 HB3 ALA 34 0.657 -14.022 3.165 264 H ARG 35 HN ARG 35 3.680 -13.531 3.147 265 HA ARG 35 HA ARG 35 3.685 -11.115 4.694 266 HB2 ARG 35 HB2 ARG 35 4.558 -13.531 5.293 267 HB3 ARG 35 HB1 ARG 35 6.044 -12.958 4.554 268 HG2 ARG 35 HG2 ARG 35 4.772 -11.279 6.662 269 HG3 ARG 35 HG1 ARG 35 5.614 -12.749 7.143 270 HD2 ARG 35 HD2 ARG 35 6.771 -10.430 5.601 271 HD3 ARG 35 HD1 ARG 35 7.104 -10.864 7.286 272 HE ARG 35 HE ARG 35 7.927 -13.062 6.183 273 HH11 ARG 35 HH11 ARG 35 8.298 -9.850 4.834 274 HH12 ARG 35 HH12 ARG 35 9.781 -10.223 4.019 275 HH21 ARG 35 HH21 ARG 35 9.875 -13.554 5.102 276 HH22 ARG 35 HH22 ARG 35 10.679 -12.324 4.178 277 H LYS 36 HN LYS 36 5.992 -12.565 2.420 278 HA LYS 36 HA LYS 36 7.704 -10.386 2.116 279 HB2 LYS 36 HB2 LYS 36 6.926 -12.343 -0.032 280 HB3 LYS 36 HB1 LYS 36 8.425 -11.428 0.083 281 HG2 LYS 36 HG2 LYS 36 9.325 -12.818 1.597 282 HG3 LYS 36 HG1 LYS 36 7.758 -13.192 2.348 283 HD2 LYS 36 HD2 LYS 36 8.547 -15.156 1.195 284 HD3 LYS 36 HD1 LYS 36 7.162 -14.464 0.319 285 HE2 LYS 36 HE2 LYS 36 8.874 -13.205 -1.086 286 HE3 LYS 36 HE1 LYS 36 10.092 -14.247 -0.350 287 HZ1 LYS 36 HZ1 LYS 36 8.932 -16.181 -1.224 288 HZ2 LYS 36 HZ2 LYS 36 9.391 -15.134 -2.469 289 HZ3 LYS 36 HZ3 LYS 36 7.782 -15.182 -1.959 290 H VAL 37 HN VAL 37 4.991 -11.416 0.061 291 HA VAL 37 HA VAL 37 5.353 -9.521 -1.904 292 HB VAL 37 HB VAL 37 3.077 -9.867 -2.647 293 HG11 VAL 37 HG11 VAL 37 4.508 -12.305 -1.632 294 HG12 VAL 37 HG12 VAL 37 4.474 -11.644 -3.273 295 HG13 VAL 37 HG13 VAL 37 3.035 -12.418 -2.599 296 HG21 VAL 37 HG21 VAL 37 1.845 -9.707 -0.608 297 HG22 VAL 37 HG22 VAL 37 2.631 -11.143 0.041 298 HG23 VAL 37 HG23 VAL 37 1.520 -11.289 -1.321 299 H ILE 38 HN ILE 38 3.644 -9.192 1.172 300 HA ILE 38 HA ILE 38 2.730 -6.581 0.356 301 HB ILE 38 HB ILE 38 1.572 -8.374 2.017 302 HG12 ILE 38 HG12 ILE 38 1.184 -5.411 2.311 303 HG13 ILE 38 HG11 ILE 38 0.737 -6.256 0.834 304 HG21 ILE 38 HG21 ILE 38 2.772 -6.255 3.801 305 HG22 ILE 38 HG22 ILE 38 3.269 -7.950 3.774 306 HG23 ILE 38 HG23 ILE 38 1.635 -7.517 4.284 307 HD11 ILE 38 HD11 ILE 38 -0.663 -7.735 2.407 308 HD12 ILE 38 HD12 ILE 38 -1.223 -6.107 2.024 309 HD13 ILE 38 HD13 ILE 38 -0.435 -6.416 3.560 310 H VAL 39 HN VAL 39 5.284 -7.876 2.417 311 HA VAL 39 HA VAL 39 5.899 -5.315 3.482 312 HB VAL 39 HB VAL 39 7.878 -6.181 4.360 313 HG11 VAL 39 HG11 VAL 39 7.237 -8.444 5.222 314 HG12 VAL 39 HG12 VAL 39 5.833 -8.364 4.162 315 HG13 VAL 39 HG13 VAL 39 6.036 -7.168 5.443 316 HG21 VAL 39 HG21 VAL 39 7.785 -8.416 2.341 317 HG22 VAL 39 HG22 VAL 39 8.955 -8.271 3.653 318 HG23 VAL 39 HG23 VAL 39 8.924 -7.070 2.363 319 H GLU 40 HN GLU 40 7.256 -7.184 0.797 320 HA GLU 40 HA GLU 40 8.960 -5.245 -0.218 321 HB2 GLU 40 HB2 GLU 40 7.580 -7.617 -1.417 322 HB3 GLU 40 HB1 GLU 40 8.731 -6.649 -2.317 323 HG2 GLU 40 HG2 GLU 40 10.476 -7.174 -0.832 324 HG3 GLU 40 HG1 GLU 40 9.387 -7.855 0.340 325 H LEU 41 HN LEU 41 5.517 -5.586 -0.516 326 HA LEU 41 HA LEU 41 5.404 -3.676 -2.697 327 HB2 LEU 41 HB2 LEU 41 3.662 -5.615 -1.707 328 HB3 LEU 41 HB1 LEU 41 2.880 -4.082 -1.363 329 HG LEU 41 HG LEU 41 2.060 -4.678 -3.461 330 HD11 LEU 41 HD11 LEU 41 2.700 -2.939 -4.829 331 HD12 LEU 41 HD12 LEU 41 4.385 -3.021 -4.328 332 HD13 LEU 41 HD13 LEU 41 3.168 -2.372 -3.232 333 HD21 LEU 41 HD21 LEU 41 3.477 -5.444 -5.317 334 HD22 LEU 41 HD22 LEU 41 3.545 -6.527 -3.924 335 HD23 LEU 41 HD23 LEU 41 4.875 -5.412 -4.241 336 H MET 42 HN MET 42 4.303 -3.706 0.703 337 HA MET 42 HA MET 42 3.412 -1.030 0.741 338 HB2 MET 42 HB2 MET 42 4.331 -2.787 3.018 339 HB3 MET 42 HB1 MET 42 3.489 -1.243 3.218 340 HG2 MET 42 HG2 MET 42 2.472 -3.804 2.025 341 HG3 MET 42 HG1 MET 42 1.896 -2.953 3.447 342 HE1 MET 42 HE1 MET 42 0.090 -4.088 1.048 343 HE2 MET 42 HE2 MET 42 -1.089 -2.780 0.944 344 HE3 MET 42 HE3 MET 42 -0.533 -3.347 2.525 345 H ALA 43 HN ALA 43 6.465 -2.488 0.988 346 HA ALA 43 HA ALA 43 8.129 -0.682 2.119 347 HB1 ALA 43 HB1 ALA 43 8.437 -2.232 -0.433 348 HB2 ALA 43 HB2 ALA 43 8.933 -2.707 1.191 349 HB3 ALA 43 HB3 ALA 43 9.761 -1.381 0.367 350 H TYR 44 HN TYR 44 6.339 -0.404 -0.874 351 HA TYR 44 HA TYR 44 7.471 2.279 -1.394 352 HB2 TYR 44 HB2 TYR 44 7.672 0.797 -3.324 353 HB3 TYR 44 HB1 TYR 44 6.001 0.337 -3.146 354 HD1 TYR 44 HD1 TYR 44 8.232 2.456 -4.926 355 HD2 TYR 44 HD2 TYR 44 4.245 2.240 -3.510 356 HE1 TYR 44 HE1 TYR 44 7.558 4.090 -6.614 357 HE2 TYR 44 HE2 TYR 44 3.558 3.886 -5.187 358 HH TYR 44 HH TYR 44 4.704 5.754 -6.527 359 H GLU 45 HN GLU 45 4.415 0.524 -1.915 360 HA GLU 45 HA GLU 45 2.685 2.551 -2.128 361 HB2 GLU 45 HB2 GLU 45 2.029 0.099 -0.540 362 HB3 GLU 45 HB1 GLU 45 0.953 1.026 -1.572 363 HG2 GLU 45 HG2 GLU 45 3.309 -0.553 -2.540 364 HG3 GLU 45 HG1 GLU 45 1.663 -1.152 -2.518 365 H ASN 46 HN ASN 46 4.126 1.457 0.885 366 HA ASN 46 HA ASN 46 2.276 3.160 2.385 367 HB2 ASN 46 HB2 ASN 46 3.731 0.644 2.978 368 HB3 ASN 46 HB1 ASN 46 3.496 1.781 4.296 369 HD21 ASN 46 HD21 ASN 46 2.077 0.399 5.395 370 HD22 ASN 46 HD22 ASN 46 0.486 0.076 4.813 371 H ALA 47 HN ALA 47 5.509 2.913 1.322 372 HA ALA 47 HA ALA 47 6.901 3.976 3.522 373 HB1 ALA 47 HB1 ALA 47 7.571 3.999 0.605 374 HB2 ALA 47 HB2 ALA 47 7.983 2.739 1.772 375 HB3 ALA 47 HB3 ALA 47 8.689 4.352 1.918 376 H ASN 48 HN ASN 48 8.411 5.927 2.949 377 HA ASN 48 HA ASN 48 6.882 8.288 3.103 378 HB2 ASN 48 HB2 ASN 48 9.766 7.604 2.851 379 HB3 ASN 48 HB1 ASN 48 9.300 9.238 2.383 380 HD21 ASN 48 HD21 ASN 48 10.775 7.929 4.759 381 HD22 ASN 48 HD22 ASN 48 10.019 8.677 6.127 382 HA PRO 49 HA PRO 49 5.601 9.072 -0.987 383 HB2 PRO 49 HB2 PRO 49 5.964 11.840 -0.976 384 HB3 PRO 49 HB1 PRO 49 4.525 10.983 -0.423 385 HG2 PRO 49 HG2 PRO 49 6.800 12.094 1.145 386 HG3 PRO 49 HG1 PRO 49 5.080 12.007 1.562 387 HD2 PRO 49 HD2 PRO 49 6.881 10.334 2.643 388 HD3 PRO 49 HD1 PRO 49 5.231 9.800 2.253 389 H GLU 50 HN GLU 50 8.665 10.357 0.059 390 HA GLU 50 HA GLU 50 9.696 10.723 -2.601 391 HB2 GLU 50 HB2 GLU 50 10.726 12.258 -1.287 392 HB3 GLU 50 HB1 GLU 50 10.593 11.276 0.165 393 HG2 GLU 50 HG2 GLU 50 12.743 10.848 -0.069 394 HG3 GLU 50 HG1 GLU 50 12.305 9.876 -1.451 395 H CYS 51 HN CYS 51 9.599 8.326 -0.111 396 HA CYS 51 HA CYS 51 12.007 7.023 -0.830 397 HB2 CYS 51 HB2 CYS 51 11.620 6.561 1.305 398 HB3 CYS 51 HB1 CYS 51 9.891 6.819 1.188 399 HG CYS 51 HG CYS 51 11.364 4.042 -0.078 400 H GLN 52 HN GLN 52 8.569 6.465 -1.173 401 HA GLN 52 HA GLN 52 8.882 4.068 -2.671 402 HB2 GLN 52 HB2 GLN 52 6.544 4.328 -3.243 403 HB3 GLN 52 HB1 GLN 52 6.765 4.661 -1.533 404 HG2 GLN 52 HG2 GLN 52 6.768 7.089 -2.103 405 HG3 GLN 52 HG1 GLN 52 6.312 6.640 -3.747 406 HE21 GLN 52 HE21 GLN 52 4.826 4.347 -2.768 407 HE22 GLN 52 HE22 GLN 52 3.360 4.934 -2.114 408 H SER 53 HN SER 53 8.868 7.411 -3.195 409 HA SER 53 HA SER 53 8.911 7.384 -6.014 410 HB2 SER 53 HB2 SER 53 9.511 9.322 -3.853 411 HB3 SER 53 HB1 SER 53 10.014 9.712 -5.507 412 HG SER 53 HG SER 53 8.017 10.217 -5.883 413 H ALA 54 HN ALA 54 11.313 6.819 -3.554 414 HA ALA 54 HA ALA 54 13.468 6.791 -5.477 415 HB1 ALA 54 HB1 ALA 54 14.155 7.170 -3.281 416 HB2 ALA 54 HB2 ALA 54 14.608 5.493 -3.583 417 HB3 ALA 54 HB3 ALA 54 13.152 5.865 -2.650 418 H ILE 55 HN ILE 55 10.977 4.725 -4.499 419 HA ILE 55 HA ILE 55 12.348 2.317 -5.279 420 HB ILE 55 HB ILE 55 9.708 2.839 -3.981 421 HG12 ILE 55 HG12 ILE 55 11.929 1.183 -2.896 422 HG13 ILE 55 HG11 ILE 55 12.083 2.945 -2.884 423 HG21 ILE 55 HG21 ILE 55 9.392 0.912 -5.403 424 HG22 ILE 55 HG22 ILE 55 9.511 0.392 -3.721 425 HG23 ILE 55 HG23 ILE 55 10.887 0.197 -4.804 426 HD11 ILE 55 HD11 ILE 55 9.736 1.461 -1.718 427 HD12 ILE 55 HD12 ILE 55 10.153 3.176 -1.539 428 HD13 ILE 55 HD13 ILE 55 11.184 1.933 -0.805 429 H LYS 56 HN LYS 56 9.754 4.344 -6.615 430 HA LYS 56 HA LYS 56 8.268 2.575 -8.012 431 HB2 LYS 56 HB2 LYS 56 8.794 4.667 -9.904 432 HB3 LYS 56 HB1 LYS 56 7.323 4.290 -9.034 433 HG2 LYS 56 HG2 LYS 56 7.623 6.395 -8.285 434 HG3 LYS 56 HG1 LYS 56 8.654 5.579 -7.106 435 HD2 LYS 56 HD2 LYS 56 10.565 6.229 -8.109 436 HD3 LYS 56 HD1 LYS 56 9.837 6.392 -9.706 437 HE2 LYS 56 HE2 LYS 56 9.861 8.347 -7.406 438 HE3 LYS 56 HE1 LYS 56 10.250 8.603 -9.108 439 HZ1 LYS 56 HZ1 LYS 56 8.147 9.630 -8.520 440 HZ2 LYS 56 HZ2 LYS 56 7.513 8.135 -8.059 441 HZ3 LYS 56 HZ3 LYS 56 7.919 8.413 -9.674 442 HA PRO 57 HA PRO 57 11.514 2.237 -11.701 443 HB2 PRO 57 HB2 PRO 57 14.088 2.175 -10.821 444 HB3 PRO 57 HB1 PRO 57 13.309 3.649 -11.414 445 HG2 PRO 57 HG2 PRO 57 13.549 2.663 -8.582 446 HG3 PRO 57 HG1 PRO 57 14.009 4.259 -9.232 447 HD2 PRO 57 HD2 PRO 57 11.698 3.970 -8.012 448 HD3 PRO 57 HD1 PRO 57 11.735 4.874 -9.534 449 H LEU 58 HN LEU 58 11.963 1.060 -8.433 450 HA LEU 58 HA LEU 58 12.860 -1.577 -9.353 451 HB2 LEU 58 HB2 LEU 58 12.419 -1.007 -6.484 452 HB3 LEU 58 HB1 LEU 58 13.686 -1.962 -7.233 453 HG LEU 58 HG LEU 58 13.564 1.054 -7.101 454 HD11 LEU 58 HD11 LEU 58 15.116 -1.008 -5.550 455 HD12 LEU 58 HD12 LEU 58 13.953 0.161 -4.926 456 HD13 LEU 58 HD13 LEU 58 15.508 0.710 -5.556 457 HD21 LEU 58 HD21 LEU 58 15.862 0.969 -7.943 458 HD22 LEU 58 HD22 LEU 58 14.729 0.277 -9.102 459 HD23 LEU 58 HD23 LEU 58 15.739 -0.781 -8.116 460 H LYS 59 HN LYS 59 10.206 0.220 -8.355 461 HA LYS 59 HA LYS 59 8.658 -1.560 -6.914 462 HB2 LYS 59 HB2 LYS 59 7.953 0.723 -7.224 463 HB3 LYS 59 HB1 LYS 59 7.781 0.470 -8.952 464 HG2 LYS 59 HG2 LYS 59 5.614 0.187 -8.445 465 HG3 LYS 59 HG1 LYS 59 6.150 -1.432 -8.026 466 HD2 LYS 59 HD2 LYS 59 5.873 0.851 -6.111 467 HD3 LYS 59 HD1 LYS 59 4.719 -0.480 -6.281 468 HE2 LYS 59 HE2 LYS 59 7.610 -0.681 -5.413 469 HE3 LYS 59 HE1 LYS 59 6.196 -0.856 -4.388 470 HZ1 LYS 59 HZ1 LYS 59 7.043 -2.996 -4.914 471 HZ2 LYS 59 HZ2 LYS 59 7.021 -2.660 -6.568 472 HZ3 LYS 59 HZ3 LYS 59 5.566 -2.803 -5.724 473 H GLY 60 HN GLY 60 8.354 -3.602 -7.387 474 HA2 GLY 60 HA3 GLY 60 7.108 -5.279 -8.504 475 HA3 GLY 60 HA2 GLY 60 7.104 -4.276 -9.949 476 H LYS 61 HN LYS 61 10.064 -3.768 -9.424 477 HA LYS 61 HA LYS 61 10.967 -6.191 -10.826 478 HB2 LYS 61 HB2 LYS 61 12.687 -3.774 -10.647 479 HB3 LYS 61 HB1 LYS 61 12.401 -4.846 -12.010 480 HG2 LYS 61 HG2 LYS 61 10.452 -2.788 -11.026 481 HG3 LYS 61 HG1 LYS 61 11.583 -2.537 -12.346 482 HD2 LYS 61 HD2 LYS 61 9.518 -4.728 -12.302 483 HD3 LYS 61 HD1 LYS 61 9.254 -3.148 -13.045 484 HE2 LYS 61 HE2 LYS 61 11.189 -3.533 -14.499 485 HE3 LYS 61 HE1 LYS 61 11.398 -5.128 -13.785 486 HZ1 LYS 61 HZ1 LYS 61 8.966 -4.241 -15.237 487 HZ2 LYS 61 HZ2 LYS 61 9.266 -5.793 -14.639 488 HZ3 LYS 61 HZ3 LYS 61 10.198 -5.183 -15.912 489 H VAL 62 HN VAL 62 11.916 -7.592 -9.467 490 HA VAL 62 HA VAL 62 13.896 -6.497 -7.595 491 HB VAL 62 HB VAL 62 12.066 -7.489 -6.342 492 HG11 VAL 62 HG11 VAL 62 12.641 -10.028 -7.856 493 HG12 VAL 62 HG12 VAL 62 11.182 -9.043 -7.970 494 HG13 VAL 62 HG13 VAL 62 11.560 -9.890 -6.468 495 HG21 VAL 62 HG21 VAL 62 13.337 -9.145 -5.026 496 HG22 VAL 62 HG22 VAL 62 14.261 -7.687 -5.383 497 HG23 VAL 62 HG23 VAL 62 14.564 -9.167 -6.292 498 HA PRO 63 HA PRO 63 17.098 -8.820 -9.799 499 HB2 PRO 63 HB2 PRO 63 17.920 -9.176 -6.953 500 HB3 PRO 63 HB1 PRO 63 18.906 -8.780 -8.346 501 HG2 PRO 63 HG2 PRO 63 18.216 -6.879 -6.646 502 HG3 PRO 63 HG1 PRO 63 18.194 -6.561 -8.390 503 HD2 PRO 63 HD2 PRO 63 15.926 -7.013 -6.516 504 HD3 PRO 63 HD1 PRO 63 16.006 -6.000 -7.971 505 H ALA 64 HN ALA 64 17.332 -10.944 -10.250 506 HA ALA 64 HA ALA 64 15.347 -12.738 -9.412 507 HB1 ALA 64 HB1 ALA 64 17.943 -13.337 -10.821 508 HB2 ALA 64 HB2 ALA 64 16.434 -12.859 -11.598 509 HB3 ALA 64 HB3 ALA 64 16.536 -14.396 -10.741 510 H GLY 65 HN GLY 65 15.271 -13.252 -7.284 511 HA2 GLY 65 HA3 GLY 65 15.891 -15.047 -5.797 512 HA3 GLY 65 HA2 GLY 65 17.563 -14.807 -6.279 513 H SER 66 HN SER 66 16.759 -11.767 -6.043 514 HA SER 66 HA SER 66 17.665 -11.582 -3.288 515 HB2 SER 66 HB2 SER 66 17.164 -9.406 -5.335 516 HB3 SER 66 HB1 SER 66 17.932 -9.189 -3.761 517 HG SER 66 HG SER 66 19.245 -11.129 -4.935 518 H ASP 67 HN ASP 67 16.671 -9.986 -1.850 519 HA ASP 67 HA ASP 67 13.774 -10.143 -1.781 520 HB2 ASP 67 HB2 ASP 67 15.735 -9.994 0.134 521 HB3 ASP 67 HB1 ASP 67 15.196 -8.325 0.057 522 H VAL 68 HN VAL 68 12.361 -8.336 -2.211 523 HA VAL 68 HA VAL 68 13.645 -6.348 -3.859 524 HB VAL 68 HB VAL 68 11.661 -5.777 -4.688 525 HG11 VAL 68 HG11 VAL 68 11.484 -8.208 -4.641 526 HG12 VAL 68 HG12 VAL 68 9.912 -7.412 -4.585 527 HG13 VAL 68 HG13 VAL 68 10.605 -8.103 -3.118 528 HG21 VAL 68 HG21 VAL 68 11.079 -4.391 -2.817 529 HG22 VAL 68 HG22 VAL 68 10.498 -5.790 -1.915 530 HG23 VAL 68 HG23 VAL 68 9.653 -5.272 -3.374 531 H ILE 69 HN ILE 69 12.577 -6.657 -0.620 532 HA ILE 69 HA ILE 69 12.431 -3.985 0.121 533 HB ILE 69 HB ILE 69 13.191 -6.433 1.675 534 HG12 ILE 69 HG12 ILE 69 10.909 -6.479 1.050 535 HG13 ILE 69 HG11 ILE 69 10.938 -5.965 2.720 536 HG21 ILE 69 HG21 ILE 69 12.857 -3.616 2.710 537 HG22 ILE 69 HG22 ILE 69 14.305 -4.618 2.776 538 HG23 ILE 69 HG23 ILE 69 12.890 -5.053 3.734 539 HD11 ILE 69 HD11 ILE 69 9.310 -4.706 1.482 540 HD12 ILE 69 HD12 ILE 69 10.558 -4.191 0.335 541 HD13 ILE 69 HD13 ILE 69 10.617 -3.637 2.011 542 H SER 70 HN SER 70 15.141 -6.192 0.134 543 HA SER 70 HA SER 70 17.120 -4.617 1.182 544 HB2 SER 70 HB2 SER 70 17.504 -6.939 0.601 545 HB3 SER 70 HB1 SER 70 17.296 -6.593 -1.112 546 HG SER 70 HG SER 70 19.478 -6.676 -0.678 547 H GLU 71 HN GLU 71 15.720 -4.452 -2.023 548 HA GLU 71 HA GLU 71 17.666 -2.586 -3.037 549 HB2 GLU 71 HB2 GLU 71 15.101 -3.355 -4.371 550 HB3 GLU 71 HB1 GLU 71 16.664 -2.997 -5.101 551 HG2 GLU 71 HG2 GLU 71 16.384 -5.351 -3.313 552 HG3 GLU 71 HG1 GLU 71 15.796 -5.446 -4.958 553 H TYR 72 HN TYR 72 14.474 -2.665 -1.771 554 HA TYR 72 HA TYR 72 13.713 -0.063 -2.661 555 HB2 TYR 72 HB2 TYR 72 12.559 -2.077 -0.744 556 HB3 TYR 72 HB1 TYR 72 11.860 -0.471 -0.908 557 HD1 TYR 72 HD1 TYR 72 13.284 -1.923 -3.898 558 HD2 TYR 72 HD2 TYR 72 9.759 -1.602 -1.564 559 HE1 TYR 72 HE1 TYR 72 11.955 -2.708 -5.796 560 HE2 TYR 72 HE2 TYR 72 8.416 -2.405 -3.454 561 HH TYR 72 HH TYR 72 9.931 -3.653 -6.347 562 H VAL 73 HN VAL 73 14.975 -1.511 0.271 563 HA VAL 73 HA VAL 73 15.066 0.869 1.801 564 HB VAL 73 HB VAL 73 16.309 -0.189 3.420 565 HG11 VAL 73 HG11 VAL 73 15.578 -2.525 3.651 566 HG12 VAL 73 HG12 VAL 73 14.933 -2.437 2.013 567 HG13 VAL 73 HG13 VAL 73 14.285 -1.394 3.273 568 HG21 VAL 73 HG21 VAL 73 17.989 -1.773 3.214 569 HG22 VAL 73 HG22 VAL 73 18.196 -0.737 1.794 570 HG23 VAL 73 HG23 VAL 73 17.414 -2.311 1.630 571 H LYS 74 HN LYS 74 17.099 -0.695 -0.512 572 HA LYS 74 HA LYS 74 19.420 0.906 -0.224 573 HB2 LYS 74 HB2 LYS 74 18.721 -1.359 -1.582 574 HB3 LYS 74 HB1 LYS 74 18.764 -0.165 -2.869 575 HG2 LYS 74 HG2 LYS 74 20.962 -0.222 -2.957 576 HG3 LYS 74 HG1 LYS 74 21.093 0.096 -1.226 577 HD2 LYS 74 HD2 LYS 74 20.505 -2.618 -2.384 578 HD3 LYS 74 HD1 LYS 74 22.132 -2.057 -1.998 579 HE2 LYS 74 HE2 LYS 74 21.640 -1.908 0.303 580 HE3 LYS 74 HE1 LYS 74 19.906 -2.056 0.022 581 HZ1 LYS 74 HZ1 LYS 74 20.863 -4.115 0.870 582 HZ2 LYS 74 HZ2 LYS 74 21.921 -4.193 -0.443 583 HZ3 LYS 74 HZ3 LYS 74 20.256 -4.341 -0.692 584 H ALA 75 HN ALA 75 16.434 1.105 -1.995 585 HA ALA 75 HA ALA 75 17.074 3.192 -3.786 586 HB1 ALA 75 HB1 ALA 75 14.623 3.487 -3.904 587 HB2 ALA 75 HB2 ALA 75 14.449 2.405 -2.516 588 HB3 ALA 75 HB3 ALA 75 15.100 1.795 -4.036 589 H CYS 76 HN CYS 76 15.796 3.071 -0.546 590 HA CYS 76 HA CYS 76 15.757 5.971 -0.347 591 HB2 CYS 76 HB2 CYS 76 14.680 3.934 1.583 592 HB3 CYS 76 HB1 CYS 76 14.177 5.604 1.352 593 HG CYS 76 HG CYS 76 13.496 2.915 -0.597 594 H ASP 77 HN ASP 77 17.978 3.737 0.051 595 HA ASP 77 HA ASP 77 18.944 3.918 2.633 596 HB2 ASP 77 HB2 ASP 77 19.841 2.239 1.337 597 HB3 ASP 77 HB1 ASP 77 20.144 3.272 -0.047 598 H GLY 78 HN GLY 78 18.877 6.371 0.249 599 HA2 GLY 78 HA3 GLY 78 20.701 7.991 1.918 600 HA3 GLY 78 HA2 GLY 78 20.479 8.247 0.195 601 H ILE 79 HN ILE 79 17.602 7.491 1.875 602 HA ILE 79 HA ILE 79 16.680 10.210 1.430 603 HB ILE 79 HB ILE 79 15.234 7.626 1.894 604 HG12 ILE 79 HG12 ILE 79 15.304 9.575 -0.420 605 HG13 ILE 79 HG11 ILE 79 16.126 8.014 -0.355 606 HG21 ILE 79 HG21 ILE 79 13.931 9.294 3.054 607 HG22 ILE 79 HG22 ILE 79 13.117 8.868 1.548 608 HG23 ILE 79 HG23 ILE 79 14.020 10.377 1.665 609 HD11 ILE 79 HD11 ILE 79 14.049 8.025 -1.677 610 HD12 ILE 79 HD12 ILE 79 13.156 8.394 -0.204 611 HD13 ILE 79 HD13 ILE 79 14.029 6.869 -0.349 612 H GLY 80 HN GLY 80 17.682 8.241 3.992 613 HA2 GLY 80 HA3 GLY 80 15.972 9.114 6.045 614 HA3 GLY 80 HA2 GLY 80 17.582 8.476 6.262 615 H GLY 81 HN GLY 81 18.379 10.853 4.353 616 HA2 GLY 81 HA3 GLY 81 17.675 13.261 5.561 617 HA3 GLY 81 HA2 GLY 81 19.137 12.695 6.353 618 H ALA 82 HN ALA 82 18.715 15.055 4.762 619 HA ALA 82 HA ALA 82 20.012 16.350 3.444 620 HB1 ALA 82 HB1 ALA 82 21.856 15.171 4.522 621 HB2 ALA 82 HB2 ALA 82 22.233 15.646 2.867 622 HB3 ALA 82 HB3 ALA 82 21.823 13.969 3.236 623 H MET 83 HN MET 83 20.626 13.228 1.834 624 HA MET 83 HA MET 83 20.364 14.316 -0.754 625 HB2 MET 83 HB2 MET 83 20.024 11.428 0.081 626 HB3 MET 83 HB1 MET 83 20.374 12.006 -1.542 627 HG2 MET 83 HG2 MET 83 22.526 12.851 -0.795 628 HG3 MET 83 HG1 MET 83 22.171 12.323 0.846 629 HE1 MET 83 HE1 MET 83 22.913 11.199 -2.829 630 HE2 MET 83 HE2 MET 83 21.364 10.409 -2.532 631 HE3 MET 83 HE3 MET 83 22.830 9.442 -2.704 632 H HIS 84 HN HIS 84 18.104 12.865 1.439 633 HA HIS 84 HA HIS 84 15.836 12.535 -0.130 634 HB2 HIS 84 HB2 HIS 84 15.866 11.811 2.162 635 HB3 HIS 84 HB1 HIS 84 16.203 13.435 2.735 636 HD1 HIS 84 HD1 HIS 84 14.203 13.637 4.241 637 HD2 HIS 84 HD2 HIS 84 13.182 12.661 0.336 638 HE1 HIS 84 HE1 HIS 84 11.708 13.859 4.115 639 HE2 HIS 84 HE2 HIS 84 11.095 13.087 1.803 640 H LYS 85 HN LYS 85 17.293 15.473 1.135 641 HA LYS 85 HA LYS 85 14.956 17.063 0.523 642 HB2 LYS 85 HB2 LYS 85 17.711 17.913 1.429 643 HB3 LYS 85 HB1 LYS 85 16.273 18.927 1.395 644 HG2 LYS 85 HG2 LYS 85 16.552 16.423 3.056 645 HG3 LYS 85 HG1 LYS 85 16.838 18.063 3.650 646 HD2 LYS 85 HD2 LYS 85 14.557 18.665 3.290 647 HD3 LYS 85 HD1 LYS 85 14.240 17.163 2.417 648 HE2 LYS 85 HE2 LYS 85 14.659 15.884 4.450 649 HE3 LYS 85 HE1 LYS 85 14.999 17.376 5.324 650 HZ1 LYS 85 HZ1 LYS 85 12.743 16.602 5.730 651 HZ2 LYS 85 HZ2 LYS 85 12.388 16.690 4.077 652 HZ3 LYS 85 HZ3 LYS 85 12.732 18.099 4.942 653 H ALA 86 HN ALA 86 17.795 16.016 -1.035 654 HA ALA 86 HA ALA 86 17.750 18.052 -3.097 655 HB1 ALA 86 HB1 ALA 86 19.569 16.772 -4.099 656 HB2 ALA 86 HB2 ALA 86 19.320 15.480 -2.924 657 HB3 ALA 86 HB3 ALA 86 19.880 17.065 -2.389 658 H MET 87 HN MET 87 16.934 14.644 -2.727 659 HA MET 87 HA MET 87 16.090 14.369 -5.468 660 HB2 MET 87 HB2 MET 87 15.908 12.488 -3.114 661 HB3 MET 87 HB1 MET 87 15.474 12.066 -4.768 662 HG2 MET 87 HG2 MET 87 17.754 12.495 -5.487 663 HG3 MET 87 HG1 MET 87 18.190 12.948 -3.847 664 HE1 MET 87 HE1 MET 87 17.690 9.518 -1.954 665 HE2 MET 87 HE2 MET 87 16.415 10.705 -2.230 666 HE3 MET 87 HE3 MET 87 18.035 11.239 -1.781 667 H LEU 88 HN LEU 88 14.677 15.438 -2.609 668 HA LEU 88 HA LEU 88 12.103 14.517 -2.635 669 HB2 LEU 88 HB2 LEU 88 13.466 16.255 -1.153 670 HB3 LEU 88 HB1 LEU 88 12.524 17.397 -2.087 671 HG LEU 88 HG LEU 88 10.655 16.990 -0.903 672 HD11 LEU 88 HD11 LEU 88 9.871 14.764 -0.256 673 HD12 LEU 88 HD12 LEU 88 11.391 14.065 -0.807 674 HD13 LEU 88 HD13 LEU 88 10.293 14.812 -1.967 675 HD21 LEU 88 HD21 LEU 88 12.649 15.536 0.805 676 HD22 LEU 88 HD22 LEU 88 11.080 16.129 1.353 677 HD23 LEU 88 HD23 LEU 88 12.321 17.268 0.829 678 H MET 89 HN MET 89 13.542 17.008 -4.655 679 HA MET 89 HA MET 89 11.004 17.810 -5.786 680 HB2 MET 89 HB2 MET 89 12.872 19.415 -5.479 681 HB3 MET 89 HB1 MET 89 13.818 18.509 -6.651 682 HG2 MET 89 HG2 MET 89 12.877 20.457 -7.695 683 HG3 MET 89 HG1 MET 89 12.131 19.008 -8.367 684 HE1 MET 89 HE1 MET 89 10.960 21.982 -8.692 685 HE2 MET 89 HE2 MET 89 9.241 21.663 -8.463 686 HE3 MET 89 HE3 MET 89 10.226 20.550 -9.410 687 H ALA 90 HN ALA 90 13.393 15.433 -6.395 688 HA ALA 90 HA ALA 90 12.809 15.271 -9.254 689 HB1 ALA 90 HB1 ALA 90 15.152 15.176 -8.415 690 HB2 ALA 90 HB2 ALA 90 14.690 13.769 -9.370 691 HB3 ALA 90 HB3 ALA 90 14.760 13.654 -7.608 692 H GLN 91 HN GLN 91 12.668 13.206 -6.380 693 HA GLN 91 HA GLN 91 11.573 11.052 -8.002 694 HB2 GLN 91 HB2 GLN 91 12.354 11.155 -5.103 695 HB3 GLN 91 HB1 GLN 91 11.855 9.712 -5.974 696 HG2 GLN 91 HG2 GLN 91 13.772 9.876 -7.417 697 HG3 GLN 91 HG1 GLN 91 14.260 11.380 -6.633 698 HE21 GLN 91 HE21 GLN 91 13.518 10.621 -4.027 699 HE22 GLN 91 HE22 GLN 91 14.609 9.396 -3.516 700 H LEU 92 HN LEU 92 10.712 12.708 -4.953 701 HA LEU 92 HA LEU 92 8.183 11.764 -4.523 702 HB2 LEU 92 HB2 LEU 92 9.644 13.700 -3.414 703 HB3 LEU 92 HB1 LEU 92 8.589 14.716 -4.368 704 HG LEU 92 HG LEU 92 7.980 13.071 -1.963 705 HD11 LEU 92 HD11 LEU 92 8.355 15.438 -1.741 706 HD12 LEU 92 HD12 LEU 92 6.667 15.062 -1.399 707 HD13 LEU 92 HD13 LEU 92 7.117 15.776 -2.947 708 HD21 LEU 92 HD21 LEU 92 5.945 13.729 -4.090 709 HD22 LEU 92 HD22 LEU 92 5.552 13.237 -2.443 710 HD23 LEU 92 HD23 LEU 92 6.399 12.124 -3.518 711 H GLU 93 HN GLU 93 9.389 13.983 -6.857 712 HA GLU 93 HA GLU 93 8.160 15.650 -8.056 713 HB2 GLU 93 HB2 GLU 93 7.937 14.525 -10.293 714 HB3 GLU 93 HB1 GLU 93 9.506 14.363 -9.503 715 HG2 GLU 93 HG2 GLU 93 9.100 12.107 -8.954 716 HG3 GLU 93 HG1 GLU 93 7.385 12.233 -9.329 717 H2 PRO 1 HT1 PRO 1 5.294 -4.021 -13.521 718 H3 PRO 1 HT2 PRO 1 5.652 -2.503 -14.016 719 HA PRO 1 HA PRO 1 6.449 -2.453 -11.996 720 HB2 PRO 1 HB2 PRO 1 4.402 -1.439 -10.594 721 HB3 PRO 1 HB1 PRO 1 5.098 -0.563 -11.961 722 HG2 PRO 1 HG2 PRO 1 2.514 -1.931 -11.755 723 HG3 PRO 1 HG1 PRO 1 3.057 -0.723 -12.935 724 HD2 PRO 1 HD2 PRO 1 2.975 -3.630 -13.167 725 HD3 PRO 1 HD1 PRO 1 3.260 -2.417 -14.431 726 H SER 2 HN SER 2 4.679 -2.618 -9.563 727 HA SER 2 HA SER 2 4.456 -5.420 -9.103 728 HB2 SER 2 HB2 SER 2 3.118 -3.070 -7.748 729 HB3 SER 2 HB1 SER 2 3.039 -4.727 -7.173 730 HG SER 2 HG SER 2 5.312 -4.707 -6.979 731 H PHE 3 HN PHE 3 2.076 -6.160 -8.432 732 HA PHE 3 HA PHE 3 0.430 -5.865 -10.753 733 HB2 PHE 3 HB2 PHE 3 -1.163 -6.923 -8.762 734 HB3 PHE 3 HB1 PHE 3 -0.215 -7.856 -9.917 735 HD1 PHE 3 HD1 PHE 3 -0.717 -6.895 -6.499 736 HD2 PHE 3 HD2 PHE 3 2.052 -8.680 -9.203 737 HE1 PHE 3 HE1 PHE 3 0.487 -7.912 -4.621 738 HE2 PHE 3 HE2 PHE 3 3.272 -9.675 -7.314 739 HZ PHE 3 HZ PHE 3 2.488 -9.290 -5.013 740 H ASN 4 HN ASN 4 0.290 -4.867 -7.402 741 HA ASN 4 HA ASN 4 -2.377 -3.841 -7.723 742 HB2 ASN 4 HB2 ASN 4 -2.232 -3.532 -5.299 743 HB3 ASN 4 HB1 ASN 4 -1.759 -5.161 -5.776 744 HD21 ASN 4 HD21 ASN 4 -0.526 -1.999 -4.869 745 HD22 ASN 4 HD22 ASN 4 1.004 -2.565 -4.288 746 H THR 5 HN THR 5 0.423 -2.414 -8.518 747 HA THR 5 HA THR 5 0.442 -0.056 -6.928 748 HB THR 5 HB THR 5 1.684 0.808 -9.075 749 HG1 THR 5 HG1 THR 5 1.555 -0.673 -10.597 750 HG21 THR 5 HG21 THR 5 2.806 0.440 -7.027 751 HG22 THR 5 HG22 THR 5 3.713 -0.425 -8.272 752 HG23 THR 5 HG23 THR 5 2.646 -1.307 -7.183 753 H VAL 6 HN VAL 6 -1.792 -1.107 -9.203 754 HA VAL 6 HA VAL 6 -2.535 1.439 -10.278 755 HB VAL 6 HB VAL 6 -4.280 0.347 -11.359 756 HG11 VAL 6 HG11 VAL 6 -2.226 -1.805 -10.913 757 HG12 VAL 6 HG12 VAL 6 -2.158 -0.529 -12.129 758 HG13 VAL 6 HG13 VAL 6 -3.408 -1.769 -12.223 759 HG21 VAL 6 HG21 VAL 6 -5.303 -0.531 -9.260 760 HG22 VAL 6 HG22 VAL 6 -4.208 -1.915 -9.374 761 HG23 VAL 6 HG23 VAL 6 -5.412 -1.633 -10.641 762 H ARG 7 HN ARG 7 -3.992 2.895 -9.393 763 HA ARG 7 HA ARG 7 -5.689 2.007 -7.258 764 HB2 ARG 7 HB2 ARG 7 -4.732 3.590 -5.587 765 HB3 ARG 7 HB1 ARG 7 -3.784 2.180 -6.005 766 HG2 ARG 7 HG2 ARG 7 -2.944 4.183 -7.741 767 HG3 ARG 7 HG1 ARG 7 -3.040 4.908 -6.133 768 HD2 ARG 7 HD2 ARG 7 -1.658 3.188 -5.206 769 HD3 ARG 7 HD1 ARG 7 -1.692 2.276 -6.712 770 HE ARG 7 HE ARG 7 -0.645 4.762 -7.334 771 HH11 ARG 7 HH11 ARG 7 0.118 2.102 -5.256 772 HH12 ARG 7 HH12 ARG 7 1.835 2.347 -5.307 773 HH21 ARG 7 HH21 ARG 7 1.608 5.134 -7.458 774 HH22 ARG 7 HH22 ARG 7 2.687 4.091 -6.594 775 H GLN 8 HN GLN 8 -7.023 3.573 -6.356 776 HA GLN 8 HA GLN 8 -8.577 5.016 -7.985 777 HB2 GLN 8 HB2 GLN 8 -8.268 4.709 -5.201 778 HB3 GLN 8 HB1 GLN 8 -8.461 6.436 -5.498 779 HG2 GLN 8 HG2 GLN 8 -10.489 5.957 -6.804 780 HG3 GLN 8 HG1 GLN 8 -10.314 4.248 -6.412 781 HE21 GLN 8 HE21 GLN 8 -12.528 5.931 -5.796 782 HE22 GLN 8 HE22 GLN 8 -12.655 5.961 -4.062 783 H GLY 9 HN GLY 9 -8.111 6.536 -9.391 784 HA2 GLY 9 HA3 GLY 9 -6.220 8.661 -8.771 785 HA3 GLY 9 HA2 GLY 9 -7.102 8.449 -10.279 786 H SER 10 HN SER 10 -7.780 10.633 -10.319 787 HA SER 10 HA SER 10 -8.902 12.053 -8.208 788 HB2 SER 10 HB2 SER 10 -9.569 12.313 -11.148 789 HB3 SER 10 HB1 SER 10 -9.810 13.548 -9.913 790 HG SER 10 HG SER 10 -7.249 12.582 -9.966 791 H LYS 11 HN LYS 11 -10.424 11.188 -6.984 792 HA LYS 11 HA LYS 11 -12.060 9.747 -6.334 793 HB2 LYS 11 HB2 LYS 11 -14.241 10.672 -6.558 794 HB3 LYS 11 HB1 LYS 11 -13.108 11.989 -6.373 795 HG2 LYS 11 HG2 LYS 11 -14.004 11.163 -9.103 796 HG3 LYS 11 HG1 LYS 11 -15.027 12.183 -8.095 797 HD2 LYS 11 HD2 LYS 11 -13.319 13.865 -7.971 798 HD3 LYS 11 HD1 LYS 11 -12.164 12.816 -8.795 799 HE2 LYS 11 HE2 LYS 11 -14.710 13.925 -9.970 800 HE3 LYS 11 HE1 LYS 11 -13.078 14.491 -10.316 801 HZ1 LYS 11 HZ1 LYS 11 -13.771 13.037 -12.057 802 HZ2 LYS 11 HZ2 LYS 11 -14.208 11.826 -10.966 803 HZ3 LYS 11 HZ3 LYS 11 -12.581 12.235 -11.164 804 H GLU 12 HN GLU 12 -10.798 8.449 -8.288 805 HA GLU 12 HA GLU 12 -12.345 7.441 -10.390 806 HB2 GLU 12 HB2 GLU 12 -9.916 7.076 -10.124 807 HB3 GLU 12 HB1 GLU 12 -10.215 6.072 -8.717 808 HG2 GLU 12 HG2 GLU 12 -11.298 4.408 -10.079 809 HG3 GLU 12 HG1 GLU 12 -11.152 5.438 -11.501 810 HA PRO 13 HA PRO 13 -15.605 5.154 -8.337 811 HB2 PRO 13 HB2 PRO 13 -15.023 3.101 -10.394 812 HB3 PRO 13 HB1 PRO 13 -16.562 3.847 -9.975 813 HG2 PRO 13 HG2 PRO 13 -15.240 4.495 -12.214 814 HG3 PRO 13 HG1 PRO 13 -16.183 5.678 -11.302 815 HD2 PRO 13 HD2 PRO 13 -13.246 5.363 -11.513 816 HD3 PRO 13 HD1 PRO 13 -14.205 6.820 -11.213 817 H TYR 14 HN TYR 14 -15.306 3.941 -6.563 818 HA TYR 14 HA TYR 14 -12.679 3.018 -6.134 819 HB2 TYR 14 HB2 TYR 14 -13.909 4.108 -4.340 820 HB3 TYR 14 HB1 TYR 14 -15.069 2.787 -4.311 821 HD1 TYR 14 HD1 TYR 14 -13.994 0.422 -4.006 822 HD2 TYR 14 HD2 TYR 14 -12.144 4.034 -2.837 823 HE1 TYR 14 HE1 TYR 14 -12.591 -0.835 -2.452 824 HE2 TYR 14 HE2 TYR 14 -10.732 2.804 -1.264 825 HH TYR 14 HH TYR 14 -10.288 0.827 -0.354 826 HA PRO 15 HA PRO 15 -14.690 -1.408 -5.646 827 HB2 PRO 15 HB2 PRO 15 -16.884 -1.192 -7.606 828 HB3 PRO 15 HB1 PRO 15 -16.849 -2.016 -6.051 829 HG2 PRO 15 HG2 PRO 15 -18.187 0.273 -6.421 830 HG3 PRO 15 HG1 PRO 15 -17.425 -0.135 -4.887 831 HD2 PRO 15 HD2 PRO 15 -16.575 1.810 -6.964 832 HD3 PRO 15 HD1 PRO 15 -16.341 1.846 -5.212 833 H ASP 16 HN ASP 16 -14.492 0.614 -8.326 834 HA ASP 16 HA ASP 16 -13.755 -1.468 -10.204 835 HB2 ASP 16 HB2 ASP 16 -14.512 1.384 -10.412 836 HB3 ASP 16 HB1 ASP 16 -13.345 0.817 -11.600 837 H PHE 17 HN PHE 17 -12.330 1.298 -8.543 838 HA PHE 17 HA PHE 17 -9.764 1.203 -9.647 839 HB2 PHE 17 HB2 PHE 17 -9.522 2.950 -8.199 840 HB3 PHE 17 HB1 PHE 17 -11.060 2.523 -7.465 841 HD1 PHE 17 HD1 PHE 17 -7.495 1.348 -7.337 842 HD2 PHE 17 HD2 PHE 17 -11.089 2.159 -5.226 843 HE1 PHE 17 HE1 PHE 17 -6.387 0.771 -5.208 844 HE2 PHE 17 HE2 PHE 17 -9.975 1.585 -3.122 845 HZ PHE 17 HZ PHE 17 -7.621 0.915 -3.116 846 H VAL 18 HN VAL 18 -11.221 -0.509 -6.948 847 HA VAL 18 HA VAL 18 -8.833 -1.985 -6.395 848 HB VAL 18 HB VAL 18 -10.065 -1.655 -4.462 849 HG11 VAL 18 HG11 VAL 18 -12.510 -2.586 -5.963 850 HG12 VAL 18 HG12 VAL 18 -12.144 -0.925 -5.486 851 HG13 VAL 18 HG13 VAL 18 -12.458 -2.153 -4.244 852 HG21 VAL 18 HG21 VAL 18 -10.616 -4.391 -5.560 853 HG22 VAL 18 HG22 VAL 18 -11.034 -3.925 -3.908 854 HG23 VAL 18 HG23 VAL 18 -9.349 -3.891 -4.433 855 H ALA 19 HN ALA 19 -11.850 -2.625 -8.145 856 HA ALA 19 HA ALA 19 -11.528 -5.382 -8.468 857 HB1 ALA 19 HB1 ALA 19 -13.555 -4.163 -9.153 858 HB2 ALA 19 HB2 ALA 19 -12.940 -5.199 -10.439 859 HB3 ALA 19 HB3 ALA 19 -12.667 -3.458 -10.502 860 H ARG 20 HN ARG 20 -9.871 -2.739 -10.138 861 HA ARG 20 HA ARG 20 -8.610 -4.635 -11.935 862 HB2 ARG 20 HB2 ARG 20 -7.312 -2.720 -12.783 863 HB3 ARG 20 HB1 ARG 20 -9.040 -2.443 -12.877 864 HG2 ARG 20 HG2 ARG 20 -9.001 -0.805 -11.266 865 HG3 ARG 20 HG1 ARG 20 -7.519 -1.418 -10.529 866 HD2 ARG 20 HD2 ARG 20 -6.188 -0.589 -12.305 867 HD3 ARG 20 HD1 ARG 20 -7.597 -0.244 -13.291 868 HE ARG 20 HE ARG 20 -8.032 1.360 -11.207 869 HH11 ARG 20 HH11 ARG 20 -5.146 0.816 -13.121 870 HH12 ARG 20 HH12 ARG 20 -4.525 2.415 -12.872 871 HH21 ARG 20 HH21 ARG 20 -7.244 3.481 -10.915 872 HH22 ARG 20 HH22 ARG 20 -5.717 3.932 -11.615 873 H LEU 21 HN LEU 21 -8.092 -2.977 -8.969 874 HA LEU 21 HA LEU 21 -5.417 -3.470 -8.473 875 HB2 LEU 21 HB2 LEU 21 -7.232 -2.233 -7.088 876 HB3 LEU 21 HB1 LEU 21 -7.581 -3.803 -6.407 877 HG LEU 21 HG LEU 21 -5.544 -3.885 -5.253 878 HD11 LEU 21 HD11 LEU 21 -3.998 -3.214 -6.949 879 HD12 LEU 21 HD12 LEU 21 -3.776 -2.154 -5.554 880 HD13 LEU 21 HD13 LEU 21 -4.662 -1.583 -6.970 881 HD21 LEU 21 HD21 LEU 21 -7.041 -2.462 -4.141 882 HD22 LEU 21 HD22 LEU 21 -6.704 -1.132 -5.246 883 HD23 LEU 21 HD23 LEU 21 -5.473 -1.654 -4.099 884 H GLN 22 HN GLN 22 -8.263 -5.463 -7.867 885 HA GLN 22 HA GLN 22 -6.907 -7.787 -7.052 886 HB2 GLN 22 HB2 GLN 22 -9.578 -7.847 -8.383 887 HB3 GLN 22 HB1 GLN 22 -8.967 -8.820 -7.041 888 HG2 GLN 22 HG2 GLN 22 -9.058 -6.748 -5.667 889 HG3 GLN 22 HG1 GLN 22 -9.856 -5.963 -7.018 890 HE21 GLN 22 HE21 GLN 22 -10.849 -6.330 -4.446 891 HE22 GLN 22 HE22 GLN 22 -12.276 -7.296 -4.541 892 H ASP 23 HN ASP 23 -8.365 -6.763 -10.058 893 HA ASP 23 HA ASP 23 -8.066 -8.967 -11.643 894 HB2 ASP 23 HB2 ASP 23 -8.974 -6.724 -12.313 895 HB3 ASP 23 HB1 ASP 23 -7.300 -6.204 -12.506 896 H VAL 24 HN VAL 24 -5.575 -6.459 -11.213 897 HA VAL 24 HA VAL 24 -3.780 -7.997 -12.843 898 HB VAL 24 HB VAL 24 -3.717 -5.576 -13.046 899 HG11 VAL 24 HG11 VAL 24 -4.443 -4.991 -10.823 900 HG12 VAL 24 HG12 VAL 24 -2.927 -4.171 -11.196 901 HG13 VAL 24 HG13 VAL 24 -2.930 -5.588 -10.145 902 HG21 VAL 24 HG21 VAL 24 -1.218 -6.718 -11.803 903 HG22 VAL 24 HG22 VAL 24 -1.276 -5.161 -12.632 904 HG23 VAL 24 HG23 VAL 24 -1.621 -6.651 -13.518 905 H ALA 25 HN ALA 25 -4.487 -7.582 -9.498 906 HA ALA 25 HA ALA 25 -2.029 -8.675 -8.501 907 HB1 ALA 25 HB1 ALA 25 -3.478 -7.328 -7.041 908 HB2 ALA 25 HB2 ALA 25 -3.243 -8.945 -6.381 909 HB3 ALA 25 HB3 ALA 25 -4.753 -8.537 -7.192 910 H GLN 26 HN GLN 26 -4.839 -9.752 -9.985 911 HA GLN 26 HA GLN 26 -4.603 -12.494 -9.128 912 HB2 GLN 26 HB2 GLN 26 -6.783 -12.281 -9.531 913 HB3 GLN 26 HB1 GLN 26 -6.512 -10.757 -10.360 914 HG2 GLN 26 HG2 GLN 26 -7.440 -11.916 -12.038 915 HG3 GLN 26 HG1 GLN 26 -5.762 -12.376 -12.306 916 HE21 GLN 26 HE21 GLN 26 -5.698 -14.063 -9.943 917 HE22 GLN 26 HE22 GLN 26 -6.565 -15.494 -10.337 918 H LYS 27 HN LYS 27 -3.970 -10.487 -11.901 919 HA LYS 27 HA LYS 27 -3.190 -12.496 -13.719 920 HB2 LYS 27 HB2 LYS 27 -2.242 -9.627 -13.602 921 HB3 LYS 27 HB1 LYS 27 -2.218 -10.684 -15.016 922 HG2 LYS 27 HG2 LYS 27 -4.662 -9.670 -13.585 923 HG3 LYS 27 HG1 LYS 27 -4.052 -9.107 -15.141 924 HD2 LYS 27 HD2 LYS 27 -4.703 -11.042 -16.232 925 HD3 LYS 27 HD1 LYS 27 -4.712 -11.997 -14.749 926 HE2 LYS 27 HE2 LYS 27 -6.717 -11.057 -14.017 927 HE3 LYS 27 HE1 LYS 27 -6.607 -9.721 -15.156 928 HZ1 LYS 27 HZ1 LYS 27 -7.017 -11.271 -16.961 929 HZ2 LYS 27 HZ2 LYS 27 -8.265 -11.364 -15.823 930 HZ3 LYS 27 HZ3 LYS 27 -7.076 -12.565 -15.876 931 H SER 28 HN SER 28 -1.433 -10.802 -11.195 932 HA SER 28 HA SER 28 1.075 -11.892 -12.246 933 HB2 SER 28 HB2 SER 28 0.974 -9.447 -12.011 934 HB3 SER 28 HB1 SER 28 0.602 -9.640 -10.298 935 HG SER 28 HG SER 28 2.739 -11.002 -10.534 936 H ILE 29 HN ILE 29 -1.235 -12.397 -9.910 937 HA ILE 29 HA ILE 29 0.714 -13.742 -8.153 938 HB ILE 29 HB ILE 29 -2.006 -12.634 -7.507 939 HG12 ILE 29 HG12 ILE 29 0.703 -11.897 -6.402 940 HG13 ILE 29 HG11 ILE 29 -0.194 -10.973 -7.615 941 HG21 ILE 29 HG21 ILE 29 -0.169 -14.238 -5.759 942 HG22 ILE 29 HG22 ILE 29 -1.804 -14.654 -6.285 943 HG23 ILE 29 HG23 ILE 29 -1.551 -13.299 -5.181 944 HD11 ILE 29 HD11 ILE 29 -1.294 -11.631 -4.903 945 HD12 ILE 29 HD12 ILE 29 -1.922 -10.481 -6.096 946 HD13 ILE 29 HD13 ILE 29 -0.402 -10.145 -5.263 947 H ALA 30 HN ALA 30 0.588 -15.899 -7.983 948 HA ALA 30 HA ALA 30 -1.486 -17.276 -9.477 949 HB1 ALA 30 HB1 ALA 30 0.856 -17.954 -9.728 950 HB2 ALA 30 HB2 ALA 30 -0.143 -19.272 -9.117 951 HB3 ALA 30 HB3 ALA 30 0.911 -18.383 -8.018 952 H ASP 31 HN ASP 31 -1.222 -16.138 -6.380 953 HA ASP 31 HA ASP 31 -2.793 -18.365 -5.263 954 HB2 ASP 31 HB2 ASP 31 -0.439 -17.569 -4.271 955 HB3 ASP 31 HB1 ASP 31 -1.492 -16.426 -3.452 956 H GLU 32 HN GLU 32 -4.706 -17.953 -4.328 957 HA GLU 32 HA GLU 32 -6.010 -15.464 -4.734 958 HB2 GLU 32 HB2 GLU 32 -7.770 -16.434 -3.263 959 HB3 GLU 32 HB1 GLU 32 -7.303 -17.497 -4.583 960 HG2 GLU 32 HG2 GLU 32 -7.163 -19.061 -3.016 961 HG3 GLU 32 HG1 GLU 32 -5.628 -18.326 -2.587 962 H LYS 33 HN LYS 33 -4.183 -16.846 -2.078 963 HA LYS 33 HA LYS 33 -5.164 -15.184 -0.022 964 HB2 LYS 33 HB2 LYS 33 -2.408 -16.410 -0.255 965 HB3 LYS 33 HB1 LYS 33 -3.155 -15.826 1.213 966 HG2 LYS 33 HG2 LYS 33 -4.319 -17.648 1.510 967 HG3 LYS 33 HG1 LYS 33 -4.735 -17.786 -0.197 968 HD2 LYS 33 HD2 LYS 33 -2.353 -18.531 -0.560 969 HD3 LYS 33 HD1 LYS 33 -2.240 -18.690 1.199 970 HE2 LYS 33 HE2 LYS 33 -2.820 -20.797 0.155 971 HE3 LYS 33 HE1 LYS 33 -4.130 -20.203 1.174 972 HZ1 LYS 33 HZ1 LYS 33 -5.341 -19.509 -0.715 973 HZ2 LYS 33 HZ2 LYS 33 -4.820 -21.090 -1.045 974 HZ3 LYS 33 HZ3 LYS 33 -4.024 -19.773 -1.753 975 H ALA 34 HN ALA 34 -2.091 -15.007 -1.759 976 HA ALA 34 HA ALA 34 -1.381 -12.459 -0.878 977 HB1 ALA 34 HB1 ALA 34 0.284 -13.879 -1.821 978 HB2 ALA 34 HB2 ALA 34 0.145 -12.478 -2.885 979 HB3 ALA 34 HB3 ALA 34 -0.596 -14.015 -3.342 980 H ARG 35 HN ARG 35 -3.617 -13.502 -3.326 981 HA ARG 35 HA ARG 35 -3.605 -11.086 -4.874 982 HB2 ARG 35 HB2 ARG 35 -4.498 -13.498 -5.471 983 HB3 ARG 35 HB1 ARG 35 -5.980 -12.913 -4.733 984 HG2 ARG 35 HG2 ARG 35 -4.692 -11.245 -6.841 985 HG3 ARG 35 HG1 ARG 35 -5.548 -12.707 -7.322 986 HD2 ARG 35 HD2 ARG 35 -6.683 -10.377 -5.779 987 HD3 ARG 35 HD1 ARG 35 -7.019 -10.807 -7.465 988 HE ARG 35 HE ARG 35 -7.874 -12.992 -6.367 989 HH11 ARG 35 HH11 ARG 35 -8.205 -9.782 -5.010 990 HH12 ARG 35 HH12 ARG 35 -9.684 -10.145 -4.182 991 HH21 ARG 35 HH21 ARG 35 -9.823 -13.467 -5.281 992 HH22 ARG 35 HH22 ARG 35 -10.605 -12.237 -4.342 993 H LYS 36 HN LYS 36 -5.926 -12.519 -2.600 994 HA LYS 36 HA LYS 36 -7.617 -10.324 -2.296 995 HB2 LYS 36 HB2 LYS 36 -6.858 -12.286 -0.145 996 HB3 LYS 36 HB1 LYS 36 -8.351 -11.359 -0.263 997 HG2 LYS 36 HG2 LYS 36 -9.260 -12.742 -1.774 998 HG3 LYS 36 HG1 LYS 36 -7.696 -13.126 -2.527 999 HD2 LYS 36 HD2 LYS 36 -8.494 -15.086 -1.375 1000 HD3 LYS 36 HD1 LYS 36 -7.108 -14.401 -0.496 1001 HE2 LYS 36 HE2 LYS 36 -8.809 -13.137 0.907 1002 HE3 LYS 36 HE1 LYS 36 -10.037 -14.161 0.164 1003 HZ1 LYS 36 HZ1 LYS 36 -8.884 -16.110 1.029 1004 HZ2 LYS 36 HZ2 LYS 36 -9.365 -15.073 2.271 1005 HZ3 LYS 36 HZ3 LYS 36 -7.750 -15.117 1.788 1006 H VAL 37 HN VAL 37 -4.907 -11.373 -0.248 1007 HA VAL 37 HA VAL 37 -5.260 -9.479 1.722 1008 HB VAL 37 HB VAL 37 -2.988 -9.842 2.467 1009 HG11 VAL 37 HG11 VAL 37 -4.436 -12.270 1.454 1010 HG12 VAL 37 HG12 VAL 37 -4.399 -11.606 3.094 1011 HG13 VAL 37 HG13 VAL 37 -2.965 -12.391 2.424 1012 HG21 VAL 37 HG21 VAL 37 -1.751 -9.693 0.431 1013 HG22 VAL 37 HG22 VAL 37 -2.550 -11.122 -0.218 1014 HG23 VAL 37 HG23 VAL 37 -1.441 -11.277 1.145 1015 H ILE 38 HN ILE 38 -3.548 -9.163 -1.352 1016 HA ILE 38 HA ILE 38 -2.617 -6.557 -0.536 1017 HB ILE 38 HB ILE 38 -1.472 -8.359 -2.198 1018 HG12 ILE 38 HG12 ILE 38 -1.063 -5.400 -2.494 1019 HG13 ILE 38 HG11 ILE 38 -0.624 -6.246 -1.015 1020 HG21 ILE 38 HG21 ILE 38 -2.656 -6.233 -3.983 1021 HG22 ILE 38 HG22 ILE 38 -3.166 -7.923 -3.955 1022 HG23 ILE 38 HG23 ILE 38 -1.529 -7.503 -4.467 1023 HD11 ILE 38 HD11 ILE 38 0.767 -7.736 -2.586 1024 HD12 ILE 38 HD12 ILE 38 1.340 -6.114 -2.202 1025 HD13 ILE 38 HD13 ILE 38 0.553 -6.415 -3.739 1026 H VAL 39 HN VAL 39 -5.179 -7.834 -2.603 1027 HA VAL 39 HA VAL 39 -5.776 -5.269 -3.664 1028 HB VAL 39 HB VAL 39 -7.762 -6.121 -4.540 1029 HG11 VAL 39 HG11 VAL 39 -7.135 -8.386 -5.405 1030 HG12 VAL 39 HG12 VAL 39 -5.732 -8.318 -4.343 1031 HG13 VAL 39 HG13 VAL 39 -5.925 -7.120 -5.623 1032 HG21 VAL 39 HG21 VAL 39 -7.684 -8.357 -2.522 1033 HG22 VAL 39 HG22 VAL 39 -8.854 -8.204 -3.834 1034 HG23 VAL 39 HG23 VAL 39 -8.815 -7.004 -2.542 1035 H GLU 40 HN GLU 40 -7.147 -7.126 -0.981 1036 HA GLU 40 HA GLU 40 -8.838 -5.176 0.039 1037 HB2 GLU 40 HB2 GLU 40 -7.472 -7.558 1.237 1038 HB3 GLU 40 HB1 GLU 40 -8.618 -6.582 2.136 1039 HG2 GLU 40 HG2 GLU 40 -10.365 -7.096 0.652 1040 HG3 GLU 40 HG1 GLU 40 -9.280 -7.784 -0.522 1041 H LEU 41 HN LEU 41 -5.396 -5.543 0.336 1042 HA LEU 41 HA LEU 41 -5.270 -3.634 2.516 1043 HB2 LEU 41 HB2 LEU 41 -3.542 -5.584 1.525 1044 HB3 LEU 41 HB1 LEU 41 -2.749 -4.057 1.182 1045 HG LEU 41 HG LEU 41 -1.935 -4.658 3.280 1046 HD11 LEU 41 HD11 LEU 41 -2.561 -2.913 4.646 1047 HD12 LEU 41 HD12 LEU 41 -4.248 -2.985 4.146 1048 HD13 LEU 41 HD13 LEU 41 -3.028 -2.344 3.049 1049 HD21 LEU 41 HD21 LEU 41 -3.354 -5.416 5.136 1050 HD22 LEU 41 HD22 LEU 41 -3.433 -6.498 3.745 1051 HD23 LEU 41 HD23 LEU 41 -4.754 -5.372 4.062 1052 H MET 42 HN MET 42 -4.166 -3.670 -0.883 1053 HA MET 42 HA MET 42 -3.258 -0.999 -0.924 1054 HB2 MET 42 HB2 MET 42 -4.191 -2.751 -3.200 1055 HB3 MET 42 HB1 MET 42 -3.336 -1.214 -3.400 1056 HG2 MET 42 HG2 MET 42 -2.340 -3.784 -2.208 1057 HG3 MET 42 HG1 MET 42 -1.756 -2.934 -3.629 1058 HE1 MET 42 HE1 MET 42 0.042 -4.084 -1.232 1059 HE2 MET 42 HE2 MET 42 1.230 -2.784 -1.125 1060 HE3 MET 42 HE3 MET 42 0.671 -3.343 -2.706 1061 H ALA 43 HN ALA 43 -6.324 -2.437 -1.169 1062 HA ALA 43 HA ALA 43 -7.974 -0.618 -2.300 1063 HB1 ALA 43 HB1 ALA 43 -8.292 -2.167 0.250 1064 HB2 ALA 43 HB2 ALA 43 -8.790 -2.639 -1.374 1065 HB3 ALA 43 HB3 ALA 43 -9.609 -1.307 -0.551 1066 H TYR 44 HN TYR 44 -6.181 -0.353 0.694 1067 HA TYR 44 HA TYR 44 -7.295 2.337 1.212 1068 HB2 TYR 44 HB2 TYR 44 -7.506 0.858 3.143 1069 HB3 TYR 44 HB1 TYR 44 -5.838 0.386 2.964 1070 HD1 TYR 44 HD1 TYR 44 -8.052 2.522 4.744 1071 HD2 TYR 44 HD2 TYR 44 -4.067 2.274 3.327 1072 HE1 TYR 44 HE1 TYR 44 -7.362 4.151 6.432 1073 HE2 TYR 44 HE2 TYR 44 -3.365 3.913 5.003 1074 HH TYR 44 HH TYR 44 -4.513 5.799 6.336 1075 H GLU 45 HN GLU 45 -4.250 0.559 1.734 1076 HA GLU 45 HA GLU 45 -2.505 2.576 1.946 1077 HB2 GLU 45 HB2 GLU 45 -1.868 0.119 0.357 1078 HB3 GLU 45 HB1 GLU 45 -0.785 1.038 1.388 1079 HG2 GLU 45 HG2 GLU 45 -3.151 -0.526 2.356 1080 HG3 GLU 45 HG1 GLU 45 -1.510 -1.135 2.334 1081 H ASN 46 HN ASN 46 -3.952 1.487 -1.067 1082 HA ASN 46 HA ASN 46 -2.087 3.176 -2.566 1083 HB2 ASN 46 HB2 ASN 46 -3.565 0.672 -3.160 1084 HB3 ASN 46 HB1 ASN 46 -3.321 1.807 -4.478 1085 HD21 ASN 46 HD21 ASN 46 -1.912 0.417 -5.580 1086 HD22 ASN 46 HD22 ASN 46 -0.324 0.080 -4.997 1087 H ALA 47 HN ALA 47 -5.327 2.952 -1.508 1088 HA ALA 47 HA ALA 47 -6.709 4.029 -3.706 1089 HB1 ALA 47 HB1 ALA 47 -7.378 4.057 -0.790 1090 HB2 ALA 47 HB2 ALA 47 -7.801 2.801 -1.957 1091 HB3 ALA 47 HB3 ALA 47 -8.494 4.419 -2.104 1092 H ASN 48 HN ASN 48 -8.203 5.993 -3.133 1093 HA ASN 48 HA ASN 48 -6.656 8.342 -3.286 1094 HB2 ASN 48 HB2 ASN 48 -9.545 7.678 -3.036 1095 HB3 ASN 48 HB1 ASN 48 -9.070 9.310 -2.569 1096 HD21 ASN 48 HD21 ASN 48 -10.554 8.017 -4.944 1097 HD22 ASN 48 HD22 ASN 48 -9.787 8.754 -6.314 1098 HA PRO 49 HA PRO 49 -5.374 9.117 0.802 1099 HB2 PRO 49 HB2 PRO 49 -5.716 11.887 0.792 1100 HB3 PRO 49 HB1 PRO 49 -4.283 11.020 0.239 1101 HG2 PRO 49 HG2 PRO 49 -6.548 12.150 -1.329 1102 HG3 PRO 49 HG1 PRO 49 -4.828 12.051 -1.747 1103 HD2 PRO 49 HD2 PRO 49 -6.643 10.390 -2.828 1104 HD3 PRO 49 HD1 PRO 49 -4.997 9.844 -2.439 1105 H GLU 50 HN GLU 50 -8.430 10.432 -0.244 1106 HA GLU 50 HA GLU 50 -9.457 10.798 2.417 1107 HB2 GLU 50 HB2 GLU 50 -10.478 12.339 1.104 1108 HB3 GLU 50 HB1 GLU 50 -10.352 11.355 -0.347 1109 HG2 GLU 50 HG2 GLU 50 -12.505 10.946 -0.112 1110 HG3 GLU 50 HG1 GLU 50 -12.075 9.968 1.266 1111 H CYS 51 HN CYS 51 -9.376 8.399 -0.071 1112 HA CYS 51 HA CYS 51 -11.796 7.114 0.644 1113 HB2 CYS 51 HB2 CYS 51 -11.410 6.646 -1.490 1114 HB3 CYS 51 HB1 CYS 51 -9.680 6.894 -1.371 1115 HG CYS 51 HG CYS 51 -11.172 4.126 -0.105 1116 H GLN 52 HN GLN 52 -8.364 6.530 0.990 1117 HA GLN 52 HA GLN 52 -8.693 4.136 2.488 1118 HB2 GLN 52 HB2 GLN 52 -6.355 4.380 3.065 1119 HB3 GLN 52 HB1 GLN 52 -6.572 4.709 1.353 1120 HG2 GLN 52 HG2 GLN 52 -6.559 7.139 1.919 1121 HG3 GLN 52 HG1 GLN 52 -6.103 6.689 3.562 1122 HE21 GLN 52 HE21 GLN 52 -4.632 4.387 2.592 1123 HE22 GLN 52 HE22 GLN 52 -3.163 4.964 1.932 1124 H SER 53 HN SER 53 -8.654 7.481 3.013 1125 HA SER 53 HA SER 53 -8.700 7.452 5.831 1126 HB2 SER 53 HB2 SER 53 -9.281 9.396 3.670 1127 HB3 SER 53 HB1 SER 53 -9.783 9.789 5.323 1128 HG SER 53 HG SER 53 -7.783 10.290 5.690 1129 H ALA 54 HN ALA 54 -11.103 6.905 3.369 1130 HA ALA 54 HA ALA 54 -13.262 6.893 5.289 1131 HB1 ALA 54 HB1 ALA 54 -13.939 7.276 3.094 1132 HB2 ALA 54 HB2 ALA 54 -14.408 5.603 3.396 1133 HB3 ALA 54 HB3 ALA 54 -12.947 5.962 2.465 1134 H ILE 55 HN ILE 55 -10.783 4.809 4.314 1135 HA ILE 55 HA ILE 55 -12.171 2.413 5.095 1136 HB ILE 55 HB ILE 55 -9.527 2.916 3.799 1137 HG12 ILE 55 HG12 ILE 55 -11.761 1.277 2.712 1138 HG13 ILE 55 HG11 ILE 55 -11.900 3.041 2.701 1139 HG21 ILE 55 HG21 ILE 55 -9.223 0.987 5.220 1140 HG22 ILE 55 HG22 ILE 55 -9.349 0.465 3.539 1141 HG23 ILE 55 HG23 ILE 55 -10.724 0.281 4.625 1142 HD11 ILE 55 HD11 ILE 55 -9.563 1.539 1.537 1143 HD12 ILE 55 HD12 ILE 55 -9.969 3.257 1.356 1144 HD13 ILE 55 HD13 ILE 55 -11.008 2.020 0.623 1145 H LYS 56 HN LYS 56 -9.559 4.417 6.432 1146 HA LYS 56 HA LYS 56 -8.087 2.640 7.831 1147 HB2 LYS 56 HB2 LYS 56 -8.602 4.736 9.720 1148 HB3 LYS 56 HB1 LYS 56 -7.133 4.348 8.851 1149 HG2 LYS 56 HG2 LYS 56 -7.418 6.452 8.101 1150 HG3 LYS 56 HG1 LYS 56 -8.453 5.644 6.921 1151 HD2 LYS 56 HD2 LYS 56 -10.361 6.310 7.921 1152 HD3 LYS 56 HD1 LYS 56 -9.633 6.468 9.521 1153 HE2 LYS 56 HE2 LYS 56 -9.637 8.422 7.220 1154 HE3 LYS 56 HE1 LYS 56 -10.023 8.682 8.920 1155 HZ1 LYS 56 HZ1 LYS 56 -7.908 9.684 8.331 1156 HZ2 LYS 56 HZ2 LYS 56 -7.290 8.181 7.868 1157 HZ3 LYS 56 HZ3 LYS 56 -7.695 8.468 9.487 1158 HA PRO 57 HA PRO 57 -11.336 2.323 11.520 1159 HB2 PRO 57 HB2 PRO 57 -13.909 2.279 10.640 1160 HB3 PRO 57 HB1 PRO 57 -13.120 3.747 11.233 1161 HG2 PRO 57 HG2 PRO 57 -13.368 2.766 8.401 1162 HG3 PRO 57 HG1 PRO 57 -13.815 4.364 9.053 1163 HD2 PRO 57 HD2 PRO 57 -11.507 4.058 7.831 1164 HD3 PRO 57 HD1 PRO 57 -11.538 4.962 9.353 1165 H LEU 58 HN LEU 58 -11.797 1.153 8.251 1166 HA LEU 58 HA LEU 58 -12.714 -1.479 9.168 1167 HB2 LEU 58 HB2 LEU 58 -12.261 -0.909 6.302 1168 HB3 LEU 58 HB1 LEU 58 -13.537 -1.855 7.046 1169 HG LEU 58 HG LEU 58 -13.395 1.159 6.917 1170 HD11 LEU 58 HD11 LEU 58 -14.963 -0.893 5.368 1171 HD12 LEU 58 HD12 LEU 58 -13.790 0.266 4.742 1172 HD13 LEU 58 HD13 LEU 58 -15.339 0.828 5.373 1173 HD21 LEU 58 HD21 LEU 58 -15.693 1.093 7.756 1174 HD22 LEU 58 HD22 LEU 58 -14.566 0.389 8.915 1175 HD23 LEU 58 HD23 LEU 58 -15.584 -0.660 7.927 1176 H LYS 59 HN LYS 59 -10.045 0.300 8.166 1177 HA LYS 59 HA LYS 59 -8.509 -1.493 6.731 1178 HB2 LYS 59 HB2 LYS 59 -7.786 0.786 7.041 1179 HB3 LYS 59 HB1 LYS 59 -7.618 0.531 8.770 1180 HG2 LYS 59 HG2 LYS 59 -5.452 0.234 8.261 1181 HG3 LYS 59 HG1 LYS 59 -6.000 -1.383 7.846 1182 HD2 LYS 59 HD2 LYS 59 -5.708 0.894 5.926 1183 HD3 LYS 59 HD1 LYS 59 -4.563 -0.444 6.098 1184 HE2 LYS 59 HE2 LYS 59 -7.455 -0.626 5.230 1185 HE3 LYS 59 HE1 LYS 59 -6.043 -0.814 4.204 1186 HZ1 LYS 59 HZ1 LYS 59 -6.907 -2.951 4.736 1187 HZ2 LYS 59 HZ2 LYS 59 -6.881 -2.613 6.388 1188 HZ3 LYS 59 HZ3 LYS 59 -5.429 -2.767 5.545 1189 H GLY 60 HN GLY 60 -8.209 -3.540 7.203 1190 HA2 GLY 60 HA3 GLY 60 -6.981 -5.223 8.325 1191 HA3 GLY 60 HA2 GLY 60 -6.970 -4.217 9.767 1192 H LYS 61 HN LYS 61 -9.928 -3.691 9.237 1193 HA LYS 61 HA LYS 61 -10.847 -6.104 10.644 1194 HB2 LYS 61 HB2 LYS 61 -12.551 -3.675 10.462 1195 HB3 LYS 61 HB1 LYS 61 -12.276 -4.749 11.825 1196 HG2 LYS 61 HG2 LYS 61 -10.308 -2.709 10.846 1197 HG3 LYS 61 HG1 LYS 61 -11.439 -2.449 12.163 1198 HD2 LYS 61 HD2 LYS 61 -9.388 -4.656 12.126 1199 HD3 LYS 61 HD1 LYS 61 -9.116 -3.078 12.867 1200 HE2 LYS 61 HE2 LYS 61 -11.051 -3.446 14.324 1201 HE3 LYS 61 HE1 LYS 61 -11.281 -5.037 13.604 1202 HZ1 LYS 61 HZ1 LYS 61 -8.839 -4.180 15.059 1203 HZ2 LYS 61 HZ2 LYS 61 -9.154 -5.728 14.455 1204 HZ3 LYS 61 HZ3 LYS 61 -10.079 -5.115 15.728 1205 H VAL 62 HN VAL 62 -11.805 -7.503 9.286 1206 HA VAL 62 HA VAL 62 -13.784 -6.391 7.419 1207 HB VAL 62 HB VAL 62 -11.961 -7.394 6.161 1208 HG11 VAL 62 HG11 VAL 62 -12.553 -9.928 7.674 1209 HG12 VAL 62 HG12 VAL 62 -11.087 -8.955 7.785 1210 HG13 VAL 62 HG13 VAL 62 -11.476 -9.798 6.284 1211 HG21 VAL 62 HG21 VAL 62 -13.242 -9.041 4.844 1212 HG22 VAL 62 HG22 VAL 62 -14.157 -7.577 5.203 1213 HG23 VAL 62 HG23 VAL 62 -14.470 -9.057 6.110 1214 HA PRO 63 HA PRO 63 -17.002 -8.694 9.619 1215 HB2 PRO 63 HB2 PRO 63 -17.826 -9.044 6.772 1216 HB3 PRO 63 HB1 PRO 63 -18.810 -8.636 8.164 1217 HG2 PRO 63 HG2 PRO 63 -18.098 -6.745 6.461 1218 HG3 PRO 63 HG1 PRO 63 -18.081 -6.425 8.205 1219 HD2 PRO 63 HD2 PRO 63 -15.809 -6.888 6.341 1220 HD3 PRO 63 HD1 PRO 63 -15.889 -5.881 7.799 1221 H ALA 64 HN ALA 64 -17.255 -10.811 10.070 1222 HA ALA 64 HA ALA 64 -15.274 -12.616 9.236 1223 HB1 ALA 64 HB1 ALA 64 -17.870 -13.196 10.651 1224 HB2 ALA 64 HB2 ALA 64 -16.356 -12.732 11.424 1225 HB3 ALA 64 HB3 ALA 64 -16.473 -14.269 10.566 1226 H GLY 65 HN GLY 65 -15.208 -13.122 7.107 1227 HA2 GLY 65 HA3 GLY 65 -15.837 -14.918 5.621 1228 HA3 GLY 65 HA2 GLY 65 -17.506 -14.670 6.103 1229 H SER 66 HN SER 66 -16.685 -11.633 5.861 1230 HA SER 66 HA SER 66 -17.591 -11.450 3.106 1231 HB2 SER 66 HB2 SER 66 -17.084 -9.278 5.151 1232 HB3 SER 66 HB1 SER 66 -17.849 -9.058 3.576 1233 HG SER 66 HG SER 66 -19.164 -11.001 4.740 1234 H ASP 67 HN ASP 67 -16.583 -9.854 1.664 1235 HA ASP 67 HA ASP 67 -13.686 -10.042 1.609 1236 HB2 ASP 67 HB2 ASP 67 -15.635 -9.878 -0.320 1237 HB3 ASP 67 HB1 ASP 67 -15.077 -8.217 -0.246 1238 H VAL 68 HN VAL 68 -12.260 -8.245 2.031 1239 HA VAL 68 HA VAL 68 -13.529 -6.246 3.677 1240 HB VAL 68 HB VAL 68 -11.542 -5.687 4.506 1241 HG11 VAL 68 HG11 VAL 68 -11.380 -8.119 4.461 1242 HG12 VAL 68 HG12 VAL 68 -9.803 -7.336 4.401 1243 HG13 VAL 68 HG13 VAL 68 -10.504 -8.023 2.936 1244 HG21 VAL 68 HG21 VAL 68 -10.953 -4.307 2.631 1245 HG22 VAL 68 HG22 VAL 68 -10.376 -5.710 1.732 1246 HG23 VAL 68 HG23 VAL 68 -9.531 -5.193 3.192 1247 H ILE 69 HN ILE 69 -12.469 -6.564 0.437 1248 HA ILE 69 HA ILE 69 -12.303 -3.893 -0.303 1249 HB ILE 69 HB ILE 69 -13.079 -6.337 -1.858 1250 HG12 ILE 69 HG12 ILE 69 -10.797 -6.398 -1.231 1251 HG13 ILE 69 HG11 ILE 69 -10.819 -5.885 -2.902 1252 HG21 ILE 69 HG21 ILE 69 -12.725 -3.522 -2.894 1253 HG22 ILE 69 HG22 ILE 69 -14.180 -4.515 -2.959 1254 HG23 ILE 69 HG23 ILE 69 -12.767 -4.959 -3.918 1255 HD11 ILE 69 HD11 ILE 69 -9.185 -4.634 -1.665 1256 HD12 ILE 69 HD12 ILE 69 -10.428 -4.109 -0.519 1257 HD13 ILE 69 HD13 ILE 69 -10.486 -3.557 -2.195 1258 H SER 70 HN SER 70 -15.029 -6.081 -0.320 1259 HA SER 70 HA SER 70 -16.999 -4.492 -1.361 1260 HB2 SER 70 HB2 SER 70 -17.406 -6.808 -0.777 1261 HB3 SER 70 HB1 SER 70 -17.176 -6.467 0.934 1262 HG SER 70 HG SER 70 -19.369 -6.537 0.502 1263 H GLU 71 HN GLU 71 -15.590 -4.331 1.843 1264 HA GLU 71 HA GLU 71 -17.523 -2.450 2.859 1265 HB2 GLU 71 HB2 GLU 71 -14.962 -3.231 4.193 1266 HB3 GLU 71 HB1 GLU 71 -16.524 -2.864 4.922 1267 HG2 GLU 71 HG2 GLU 71 -16.248 -5.222 3.136 1268 HG3 GLU 71 HG1 GLU 71 -15.672 -5.317 4.786 1269 H TYR 72 HN TYR 72 -14.334 -2.554 1.590 1270 HA TYR 72 HA TYR 72 -13.550 0.041 2.479 1271 HB2 TYR 72 HB2 TYR 72 -12.413 -1.982 0.563 1272 HB3 TYR 72 HB1 TYR 72 -11.703 -0.383 0.725 1273 HD1 TYR 72 HD1 TYR 72 -13.139 -1.823 3.715 1274 HD2 TYR 72 HD2 TYR 72 -9.612 -1.526 1.379 1275 HE1 TYR 72 HE1 TYR 72 -11.813 -2.614 5.613 1276 HE2 TYR 72 HE2 TYR 72 -8.274 -2.334 3.274 1277 HH TYR 72 HH TYR 72 -9.789 -3.583 6.155 1278 H VAL 73 HN VAL 73 -14.825 -1.399 -0.451 1279 HA VAL 73 HA VAL 73 -14.898 0.982 -1.984 1280 HB VAL 73 HB VAL 73 -16.150 -0.069 -3.602 1281 HG11 VAL 73 HG11 VAL 73 -15.435 -2.409 -3.833 1282 HG12 VAL 73 HG12 VAL 73 -14.791 -2.326 -2.193 1283 HG13 VAL 73 HG13 VAL 73 -14.133 -1.288 -3.451 1284 HG21 VAL 73 HG21 VAL 73 -17.843 -1.639 -3.395 1285 HG22 VAL 73 HG22 VAL 73 -18.040 -0.603 -1.974 1286 HG23 VAL 73 HG23 VAL 73 -17.271 -2.183 -1.812 1287 H LYS 74 HN LYS 74 -16.945 -0.569 0.326 1288 HA LYS 74 HA LYS 74 -19.251 1.055 0.044 1289 HB2 LYS 74 HB2 LYS 74 -18.567 -1.216 1.403 1290 HB3 LYS 74 HB1 LYS 74 -18.604 -0.021 2.687 1291 HG2 LYS 74 HG2 LYS 74 -20.802 -0.065 2.773 1292 HG3 LYS 74 HG1 LYS 74 -20.928 0.255 1.042 1293 HD2 LYS 74 HD2 LYS 74 -20.355 -2.462 2.195 1294 HD3 LYS 74 HD1 LYS 74 -21.979 -1.894 1.814 1295 HE2 LYS 74 HE2 LYS 74 -21.494 -1.747 -0.486 1296 HE3 LYS 74 HE1 LYS 74 -19.758 -1.905 -0.211 1297 HZ1 LYS 74 HZ1 LYS 74 -20.726 -3.956 -1.053 1298 HZ2 LYS 74 HZ2 LYS 74 -21.792 -4.025 0.254 1299 HZ3 LYS 74 HZ3 LYS 74 -20.127 -4.188 0.511 1300 H ALA 75 HN ALA 75 -16.262 1.229 1.809 1301 HA ALA 75 HA ALA 75 -16.888 3.319 3.602 1302 HB1 ALA 75 HB1 ALA 75 -14.436 3.596 3.724 1303 HB2 ALA 75 HB2 ALA 75 -14.269 2.514 2.336 1304 HB3 ALA 75 HB3 ALA 75 -14.927 1.908 3.854 1305 H CYS 76 HN CYS 76 -15.618 3.189 0.361 1306 HA CYS 76 HA CYS 76 -15.553 6.090 0.166 1307 HB2 CYS 76 HB2 CYS 76 -14.493 4.044 -1.767 1308 HB3 CYS 76 HB1 CYS 76 -13.977 5.711 -1.538 1309 HG CYS 76 HG CYS 76 -13.313 3.019 0.413 1310 H ASP 77 HN ASP 77 -17.793 3.870 -0.233 1311 HA ASP 77 HA ASP 77 -18.758 4.053 -2.811 1312 HB2 ASP 77 HB2 ASP 77 -19.676 2.389 -1.510 1313 HB3 ASP 77 HB1 ASP 77 -19.976 3.430 -0.131 1314 H GLY 78 HN GLY 78 -18.691 6.508 -0.418 1315 HA2 GLY 78 HA3 GLY 78 -20.483 8.144 -2.105 1316 HA3 GLY 78 HA2 GLY 78 -20.262 8.403 -0.382 1317 H ILE 79 HN ILE 79 -17.387 7.620 -2.057 1318 HA ILE 79 HA ILE 79 -16.445 10.333 -1.618 1319 HB ILE 79 HB ILE 79 -15.018 7.740 -2.078 1320 HG12 ILE 79 HG12 ILE 79 -15.073 9.690 0.235 1321 HG13 ILE 79 HG11 ILE 79 -15.906 8.136 0.172 1322 HG21 ILE 79 HG21 ILE 79 -13.701 9.399 -3.239 1323 HG22 ILE 79 HG22 ILE 79 -12.891 8.966 -1.731 1324 HG23 ILE 79 HG23 ILE 79 -13.782 10.482 -1.848 1325 HD11 ILE 79 HD11 ILE 79 -13.827 8.134 1.492 1326 HD12 ILE 79 HD12 ILE 79 -12.934 8.494 0.018 1327 HD13 ILE 79 HD13 ILE 79 -13.817 6.975 0.165 1328 H GLY 80 HN GLY 80 -17.460 8.369 -4.178 1329 HA2 GLY 80 HA3 GLY 80 -15.745 9.230 -6.232 1330 HA3 GLY 80 HA2 GLY 80 -17.361 8.603 -6.448 1331 H GLY 81 HN GLY 81 -18.132 10.988 -4.538 1332 HA2 GLY 81 HA3 GLY 81 -17.414 13.390 -5.747 1333 HA3 GLY 81 HA2 GLY 81 -18.882 12.834 -6.540 1334 H ALA 82 HN ALA 82 -18.442 15.193 -4.946 1335 HA ALA 82 HA ALA 82 -19.735 16.498 -3.631 1336 HB1 ALA 82 HB1 ALA 82 -21.582 15.335 -4.713 1337 HB2 ALA 82 HB2 ALA 82 -21.960 15.802 -3.055 1338 HB3 ALA 82 HB3 ALA 82 -21.559 14.126 -3.431 1339 H MET 83 HN MET 83 -20.370 13.384 -2.019 1340 HA MET 83 HA MET 83 -20.103 14.465 0.571 1341 HB2 MET 83 HB2 MET 83 -19.779 11.576 -0.266 1342 HB3 MET 83 HB1 MET 83 -20.127 12.155 1.357 1343 HG2 MET 83 HG2 MET 83 -22.272 13.014 0.610 1344 HG3 MET 83 HG1 MET 83 -21.921 12.491 -1.034 1345 HE1 MET 83 HE1 MET 83 -22.667 11.365 2.636 1346 HE2 MET 83 HE2 MET 83 -21.128 10.557 2.336 1347 HE3 MET 83 HE3 MET 83 -22.603 9.607 2.510 1348 H HIS 84 HN HIS 84 -17.851 13.004 -1.626 1349 HA HIS 84 HA HIS 84 -15.585 12.656 -0.051 1350 HB2 HIS 84 HB2 HIS 84 -15.620 11.926 -2.342 1351 HB3 HIS 84 HB1 HIS 84 -15.943 13.551 -2.920 1352 HD1 HIS 84 HD1 HIS 84 -13.943 13.730 -4.423 1353 HD2 HIS 84 HD2 HIS 84 -12.928 12.762 -0.517 1354 HE1 HIS 84 HE1 HIS 84 -11.454 13.955 -4.300 1355 HE2 HIS 84 HE2 HIS 84 -10.842 13.146 -1.996 1356 H LYS 85 HN LYS 85 -17.022 15.601 -1.328 1357 HA LYS 85 HA LYS 85 -14.678 17.175 -0.710 1358 HB2 LYS 85 HB2 LYS 85 -17.425 18.051 -1.617 1359 HB3 LYS 85 HB1 LYS 85 -15.976 19.050 -1.583 1360 HG2 LYS 85 HG2 LYS 85 -16.277 16.550 -3.243 1361 HG3 LYS 85 HG1 LYS 85 -16.549 18.190 -3.840 1362 HD2 LYS 85 HD2 LYS 85 -14.263 18.774 -3.476 1363 HD3 LYS 85 HD1 LYS 85 -13.958 17.268 -2.607 1364 HE2 LYS 85 HE2 LYS 85 -14.387 15.996 -4.643 1365 HE3 LYS 85 HE1 LYS 85 -14.714 17.496 -5.515 1366 HZ1 LYS 85 HZ1 LYS 85 -12.459 16.711 -5.914 1367 HZ2 LYS 85 HZ2 LYS 85 -12.113 16.787 -4.263 1368 HZ3 LYS 85 HZ3 LYS 85 -12.443 18.201 -5.121 1369 H ALA 86 HN ALA 86 -17.517 16.142 0.851 1370 HA ALA 86 HA ALA 86 -17.459 18.182 2.907 1371 HB1 ALA 86 HB1 ALA 86 -19.283 16.916 3.915 1372 HB2 ALA 86 HB2 ALA 86 -19.045 15.620 2.740 1373 HB3 ALA 86 HB3 ALA 86 -19.595 17.209 2.204 1374 H MET 87 HN MET 87 -16.673 14.766 2.544 1375 HA MET 87 HA MET 87 -15.824 14.491 5.282 1376 HB2 MET 87 HB2 MET 87 -15.657 12.606 2.931 1377 HB3 MET 87 HB1 MET 87 -15.226 12.184 4.587 1378 HG2 MET 87 HG2 MET 87 -17.504 12.625 5.302 1379 HG3 MET 87 HG1 MET 87 -17.935 13.086 3.662 1380 HE1 MET 87 HE1 MET 87 -17.461 9.654 1.765 1381 HE2 MET 87 HE2 MET 87 -16.175 10.826 2.044 1382 HE3 MET 87 HE3 MET 87 -17.788 11.378 1.593 1383 H LEU 88 HN LEU 88 -14.405 15.545 2.422 1384 HA LEU 88 HA LEU 88 -11.837 14.606 2.447 1385 HB2 LEU 88 HB2 LEU 88 -13.186 16.362 0.966 1386 HB3 LEU 88 HB1 LEU 88 -12.235 17.493 1.905 1387 HG LEU 88 HG LEU 88 -10.370 17.076 0.719 1388 HD11 LEU 88 HD11 LEU 88 -9.599 14.844 0.074 1389 HD12 LEU 88 HD12 LEU 88 -11.125 14.154 0.620 1390 HD13 LEU 88 HD13 LEU 88 -10.024 14.894 1.784 1391 HD21 LEU 88 HD21 LEU 88 -12.370 15.631 -0.990 1392 HD22 LEU 88 HD22 LEU 88 -10.799 16.218 -1.540 1393 HD23 LEU 88 HD23 LEU 88 -12.036 17.361 -1.016 1394 H MET 89 HN MET 89 -13.254 17.121 4.466 1395 HA MET 89 HA MET 89 -10.708 17.889 5.601 1396 HB2 MET 89 HB2 MET 89 -12.558 19.512 5.296 1397 HB3 MET 89 HB1 MET 89 -13.515 18.615 6.464 1398 HG2 MET 89 HG2 MET 89 -12.563 20.554 7.510 1399 HG3 MET 89 HG1 MET 89 -11.828 19.101 8.184 1400 HE1 MET 89 HE1 MET 89 -10.640 22.070 8.509 1401 HE2 MET 89 HE2 MET 89 -8.921 21.741 8.287 1402 HE3 MET 89 HE3 MET 89 -9.916 20.633 9.233 1403 H ALA 90 HN ALA 90 -13.123 15.536 6.212 1404 HA ALA 90 HA ALA 90 -12.533 15.370 9.070 1405 HB1 ALA 90 HB1 ALA 90 -14.876 15.299 8.228 1406 HB2 ALA 90 HB2 ALA 90 -14.430 13.892 9.190 1407 HB3 ALA 90 HB3 ALA 90 -14.500 13.769 7.430 1408 H GLN 91 HN GLN 91 -12.411 13.306 6.195 1409 HA GLN 91 HA GLN 91 -11.332 11.144 7.816 1410 HB2 GLN 91 HB2 GLN 91 -12.111 11.249 4.918 1411 HB3 GLN 91 HB1 GLN 91 -11.622 9.805 5.792 1412 HG2 GLN 91 HG2 GLN 91 -13.536 9.987 7.236 1413 HG3 GLN 91 HG1 GLN 91 -14.015 11.490 6.448 1414 HE21 GLN 91 HE21 GLN 91 -13.280 10.724 3.844 1415 HE22 GLN 91 HE22 GLN 91 -14.382 9.507 3.338 1416 H LEU 92 HN LEU 92 -10.459 12.787 4.766 1417 HA LEU 92 HA LEU 92 -7.936 11.829 4.338 1418 HB2 LEU 92 HB2 LEU 92 -9.385 13.775 3.227 1419 HB3 LEU 92 HB1 LEU 92 -8.321 14.783 4.181 1420 HG LEU 92 HG LEU 92 -7.726 13.135 1.775 1421 HD11 LEU 92 HD11 LEU 92 -8.086 15.505 1.553 1422 HD12 LEU 92 HD12 LEU 92 -6.400 15.119 1.209 1423 HD13 LEU 92 HD13 LEU 92 -6.844 15.836 2.759 1424 HD21 LEU 92 HD21 LEU 92 -5.685 13.778 3.903 1425 HD22 LEU 92 HD22 LEU 92 -5.298 13.281 2.256 1426 HD23 LEU 92 HD23 LEU 92 -6.153 12.176 3.331 1427 H GLU 93 HN GLU 93 -9.127 14.061 6.670 1428 HA GLU 93 HA GLU 93 -7.886 15.717 7.870 1429 HB2 GLU 93 HB2 GLU 93 -7.671 14.590 10.107 1430 HB3 GLU 93 HB1 GLU 93 -9.240 14.437 9.315 1431 HG2 GLU 93 HG2 GLU 93 -8.845 12.183 8.761 1432 HG3 GLU 93 HG1 GLU 93 -7.131 12.299 9.144 Start of MODEL 5 1 H2 PRO 1 HT1 PRO 1 -5.174 -3.177 13.245 2 H3 PRO 1 HT2 PRO 1 -5.485 -1.662 13.773 3 HA PRO 1 HA PRO 1 -6.145 -1.490 11.720 4 HB2 PRO 1 HB2 PRO 1 -3.958 -0.570 10.473 5 HB3 PRO 1 HB1 PRO 1 -4.689 0.310 11.816 6 HG2 PRO 1 HG2 PRO 1 -2.179 -1.195 11.735 7 HG3 PRO 1 HG1 PRO 1 -2.730 0.005 12.916 8 HD2 PRO 1 HD2 PRO 1 -2.819 -2.909 13.060 9 HD3 PRO 1 HD1 PRO 1 -3.124 -1.717 14.343 10 H SER 2 HN SER 2 -4.245 -1.687 9.384 11 HA SER 2 HA SER 2 -4.197 -4.463 8.797 12 HB2 SER 2 HB2 SER 2 -2.341 -2.309 7.748 13 HB3 SER 2 HB1 SER 2 -2.658 -3.872 7.008 14 HG SER 2 HG SER 2 -3.812 -1.788 6.311 15 H PHE 3 HN PHE 3 -1.998 -5.603 8.517 16 HA PHE 3 HA PHE 3 -0.283 -5.259 10.756 17 HB2 PHE 3 HB2 PHE 3 1.257 -6.428 8.759 18 HB3 PHE 3 HB1 PHE 3 0.306 -7.299 9.962 19 HD1 PHE 3 HD1 PHE 3 0.775 -6.505 6.510 20 HD2 PHE 3 HD2 PHE 3 -2.051 -7.991 9.331 21 HE1 PHE 3 HE1 PHE 3 -0.529 -7.499 4.699 22 HE2 PHE 3 HE2 PHE 3 -3.369 -8.978 7.504 23 HZ PHE 3 HZ PHE 3 -2.608 -8.729 5.175 24 H ASN 4 HN ASN 4 -0.209 -4.349 7.384 25 HA ASN 4 HA ASN 4 2.460 -3.302 7.619 26 HB2 ASN 4 HB2 ASN 4 2.303 -3.082 5.197 27 HB3 ASN 4 HB1 ASN 4 1.826 -4.693 5.722 28 HD21 ASN 4 HD21 ASN 4 0.572 -1.541 4.742 29 HD22 ASN 4 HD22 ASN 4 -0.942 -2.140 4.145 30 H THR 5 HN THR 5 -0.351 -1.852 8.393 31 HA THR 5 HA THR 5 -0.402 0.450 6.733 32 HB THR 5 HB THR 5 -1.456 1.409 8.976 33 HG1 THR 5 HG1 THR 5 -1.268 -0.140 10.432 34 HG21 THR 5 HG21 THR 5 -2.736 1.193 6.994 35 HG22 THR 5 HG22 THR 5 -3.625 0.368 8.279 36 HG23 THR 5 HG23 THR 5 -2.707 -0.564 7.097 37 H VAL 6 HN VAL 6 1.894 -0.545 8.956 38 HA VAL 6 HA VAL 6 2.665 2.015 9.940 39 HB VAL 6 HB VAL 6 4.447 0.958 11.005 40 HG11 VAL 6 HG11 VAL 6 3.597 -1.125 11.965 41 HG12 VAL 6 HG12 VAL 6 2.366 -1.192 10.702 42 HG13 VAL 6 HG13 VAL 6 2.354 0.124 11.878 43 HG21 VAL 6 HG21 VAL 6 5.399 -0.014 8.903 44 HG22 VAL 6 HG22 VAL 6 4.318 -1.395 9.133 45 HG23 VAL 6 HG23 VAL 6 5.564 -1.036 10.338 46 H ARG 7 HN ARG 7 3.993 3.473 8.956 47 HA ARG 7 HA ARG 7 5.735 2.535 6.890 48 HB2 ARG 7 HB2 ARG 7 4.783 4.143 5.194 49 HB3 ARG 7 HB1 ARG 7 3.967 2.633 5.513 50 HG2 ARG 7 HG2 ARG 7 2.806 4.504 7.215 51 HG3 ARG 7 HG1 ARG 7 2.946 5.259 5.626 52 HD2 ARG 7 HD2 ARG 7 1.869 3.330 4.605 53 HD3 ARG 7 HD1 ARG 7 1.733 2.557 6.180 54 HE ARG 7 HE ARG 7 0.357 4.676 6.724 55 HH11 ARG 7 HH11 ARG 7 0.381 2.961 3.676 56 HH12 ARG 7 HH12 ARG 7 -1.155 3.571 3.175 57 HH21 ARG 7 HH21 ARG 7 -1.682 5.475 6.066 58 HH22 ARG 7 HH22 ARG 7 -2.326 5.007 4.527 59 H GLN 8 HN GLN 8 7.051 4.057 5.950 60 HA GLN 8 HA GLN 8 8.646 5.452 7.577 61 HB2 GLN 8 HB2 GLN 8 8.266 5.138 4.768 62 HB3 GLN 8 HB1 GLN 8 8.714 6.811 5.090 63 HG2 GLN 8 HG2 GLN 8 10.686 6.096 6.271 64 HG3 GLN 8 HG1 GLN 8 10.217 4.407 6.084 65 HE21 GLN 8 HE21 GLN 8 12.611 5.785 5.213 66 HE22 GLN 8 HE22 GLN 8 12.678 5.577 3.487 67 H GLY 9 HN GLY 9 8.270 7.031 8.922 68 HA2 GLY 9 HA3 GLY 9 6.498 9.235 8.272 69 HA3 GLY 9 HA2 GLY 9 7.444 9.042 9.743 70 H SER 10 HN SER 10 8.185 11.213 9.609 71 HA SER 10 HA SER 10 9.320 12.389 7.351 72 HB2 SER 10 HB2 SER 10 8.624 13.594 9.430 73 HB3 SER 10 HB1 SER 10 10.061 12.960 10.229 74 HG SER 10 HG SER 10 10.055 14.573 7.886 75 H LYS 11 HN LYS 11 10.779 11.294 6.236 76 HA LYS 11 HA LYS 11 12.597 10.128 5.604 77 HB2 LYS 11 HB2 LYS 11 14.670 11.079 6.086 78 HB3 LYS 11 HB1 LYS 11 13.559 12.424 6.117 79 HG2 LYS 11 HG2 LYS 11 13.538 11.849 8.684 80 HG3 LYS 11 HG1 LYS 11 15.104 11.153 8.314 81 HD2 LYS 11 HD2 LYS 11 15.608 13.339 8.944 82 HD3 LYS 11 HD1 LYS 11 15.593 13.411 7.181 83 HE2 LYS 11 HE2 LYS 11 14.407 15.313 8.075 84 HE3 LYS 11 HE1 LYS 11 13.271 14.232 7.269 85 HZ1 LYS 11 HZ1 LYS 11 12.362 14.984 9.352 86 HZ2 LYS 11 HZ2 LYS 11 13.719 14.436 10.197 87 HZ3 LYS 11 HZ3 LYS 11 12.681 13.326 9.457 88 H GLU 12 HN GLU 12 11.095 8.826 7.674 89 HA GLU 12 HA GLU 12 12.617 7.741 9.739 90 HB2 GLU 12 HB2 GLU 12 10.172 7.531 9.521 91 HB3 GLU 12 HB1 GLU 12 10.380 6.475 8.137 92 HG2 GLU 12 HG2 GLU 12 11.401 4.788 9.539 93 HG3 GLU 12 HG1 GLU 12 11.294 5.860 10.934 94 HA PRO 13 HA PRO 13 15.763 5.328 7.694 95 HB2 PRO 13 HB2 PRO 13 15.241 3.386 9.869 96 HB3 PRO 13 HB1 PRO 13 16.769 4.107 9.364 97 HG2 PRO 13 HG2 PRO 13 15.518 4.877 11.603 98 HG3 PRO 13 HG1 PRO 13 16.424 6.010 10.596 99 HD2 PRO 13 HD2 PRO 13 13.494 5.693 10.915 100 HD3 PRO 13 HD1 PRO 13 14.438 7.139 10.523 101 H TYR 14 HN TYR 14 15.447 4.020 6.011 102 HA TYR 14 HA TYR 14 12.819 3.066 5.668 103 HB2 TYR 14 HB2 TYR 14 14.044 4.068 3.820 104 HB3 TYR 14 HB1 TYR 14 15.180 2.726 3.835 105 HD1 TYR 14 HD1 TYR 14 14.203 0.398 3.548 106 HD2 TYR 14 HD2 TYR 14 12.118 3.925 2.496 107 HE1 TYR 14 HE1 TYR 14 12.776 -0.926 2.084 108 HE2 TYR 14 HE2 TYR 14 10.665 2.625 1.007 109 HH TYR 14 HH TYR 14 10.330 0.614 0.076 110 HA PRO 15 HA PRO 15 14.847 -1.376 5.400 111 HB2 PRO 15 HB2 PRO 15 17.025 -1.051 7.364 112 HB3 PRO 15 HB1 PRO 15 17.002 -1.962 5.856 113 HG2 PRO 15 HG2 PRO 15 18.337 0.341 6.102 114 HG3 PRO 15 HG1 PRO 15 17.582 -0.149 4.590 115 HD2 PRO 15 HD2 PRO 15 16.724 1.909 6.556 116 HD3 PRO 15 HD1 PRO 15 16.500 1.851 4.802 117 H ASP 16 HN ASP 16 14.616 0.792 7.944 118 HA ASP 16 HA ASP 16 13.853 -1.152 9.953 119 HB2 ASP 16 HB2 ASP 16 14.569 1.730 9.974 120 HB3 ASP 16 HB1 ASP 16 13.429 1.196 11.202 121 H PHE 17 HN PHE 17 12.468 1.568 8.162 122 HA PHE 17 HA PHE 17 9.886 1.551 9.194 123 HB2 PHE 17 HB2 PHE 17 9.796 3.253 7.682 124 HB3 PHE 17 HB1 PHE 17 11.233 2.650 6.868 125 HD1 PHE 17 HD1 PHE 17 11.090 1.592 4.782 126 HD2 PHE 17 HD2 PHE 17 7.555 2.307 7.024 127 HE1 PHE 17 HE1 PHE 17 9.736 0.929 2.846 128 HE2 PHE 17 HE2 PHE 17 6.188 1.660 5.084 129 HZ PHE 17 HZ PHE 17 7.278 0.970 2.992 130 H VAL 18 HN VAL 18 11.369 -0.338 6.647 131 HA VAL 18 HA VAL 18 8.962 -1.783 6.082 132 HB VAL 18 HB VAL 18 10.348 -1.369 4.204 133 HG11 VAL 18 HG11 VAL 18 12.540 -2.691 5.784 134 HG12 VAL 18 HG12 VAL 18 12.467 -0.995 5.289 135 HG13 VAL 18 HG13 VAL 18 12.642 -2.271 4.068 136 HG21 VAL 18 HG21 VAL 18 10.534 -4.197 5.145 137 HG22 VAL 18 HG22 VAL 18 11.046 -3.666 3.534 138 HG23 VAL 18 HG23 VAL 18 9.357 -3.490 4.025 139 H ALA 19 HN ALA 19 11.945 -2.389 7.871 140 HA ALA 19 HA ALA 19 11.632 -5.110 8.373 141 HB1 ALA 19 HB1 ALA 19 13.638 -3.846 9.021 142 HB2 ALA 19 HB2 ALA 19 12.994 -4.802 10.358 143 HB3 ALA 19 HB3 ALA 19 12.715 -3.061 10.303 144 H ARG 20 HN ARG 20 10.001 -2.377 9.936 145 HA ARG 20 HA ARG 20 8.720 -4.193 11.796 146 HB2 ARG 20 HB2 ARG 20 7.443 -2.230 12.568 147 HB3 ARG 20 HB1 ARG 20 9.176 -1.958 12.633 148 HG2 ARG 20 HG2 ARG 20 9.130 -0.418 10.919 149 HG3 ARG 20 HG1 ARG 20 7.613 -1.037 10.263 150 HD2 ARG 20 HD2 ARG 20 6.362 -0.095 12.053 151 HD3 ARG 20 HD1 ARG 20 7.822 0.296 12.946 152 HE ARG 20 HE ARG 20 8.182 1.749 10.754 153 HH11 ARG 20 HH11 ARG 20 5.357 1.369 12.795 154 HH12 ARG 20 HH12 ARG 20 4.738 2.951 12.439 155 HH21 ARG 20 HH21 ARG 20 7.395 3.833 10.321 156 HH22 ARG 20 HH22 ARG 20 5.879 4.341 11.018 157 H LEU 21 HN LEU 21 8.210 -2.632 8.773 158 HA LEU 21 HA LEU 21 5.532 -3.114 8.321 159 HB2 LEU 21 HB2 LEU 21 7.375 -1.958 6.877 160 HB3 LEU 21 HB1 LEU 21 7.623 -3.553 6.206 161 HG LEU 21 HG LEU 21 5.545 -3.558 5.131 162 HD11 LEU 21 HD11 LEU 21 3.838 -1.790 5.507 163 HD12 LEU 21 HD12 LEU 21 4.806 -1.214 6.869 164 HD13 LEU 21 HD13 LEU 21 4.106 -2.834 6.904 165 HD21 LEU 21 HD21 LEU 21 5.501 -1.412 3.910 166 HD22 LEU 21 HD22 LEU 21 7.107 -2.133 4.022 167 HD23 LEU 21 HD23 LEU 21 6.672 -0.777 5.064 168 H GLN 22 HN GLN 22 8.347 -5.177 7.847 169 HA GLN 22 HA GLN 22 6.912 -7.472 7.016 170 HB2 GLN 22 HB2 GLN 22 9.662 -7.433 8.230 171 HB3 GLN 22 HB1 GLN 22 8.957 -8.615 7.122 172 HG2 GLN 22 HG2 GLN 22 8.867 -6.754 5.460 173 HG3 GLN 22 HG1 GLN 22 9.835 -5.818 6.559 174 HE21 GLN 22 HE21 GLN 22 11.259 -5.731 4.781 175 HE22 GLN 22 HE22 GLN 22 12.386 -7.018 4.526 176 H ASP 23 HN ASP 23 8.366 -6.387 9.998 177 HA ASP 23 HA ASP 23 8.124 -8.635 11.562 178 HB2 ASP 23 HB2 ASP 23 9.072 -6.310 12.100 179 HB3 ASP 23 HB1 ASP 23 7.423 -5.918 12.584 180 H VAL 24 HN VAL 24 5.675 -6.106 11.088 181 HA VAL 24 HA VAL 24 3.851 -7.542 12.800 182 HB VAL 24 HB VAL 24 3.875 -5.109 12.940 183 HG11 VAL 24 HG11 VAL 24 3.105 -3.724 11.074 184 HG12 VAL 24 HG12 VAL 24 3.033 -5.162 10.054 185 HG13 VAL 24 HG13 VAL 24 4.581 -4.607 10.688 186 HG21 VAL 24 HG21 VAL 24 1.758 -6.094 13.484 187 HG22 VAL 24 HG22 VAL 24 1.323 -6.226 11.782 188 HG23 VAL 24 HG23 VAL 24 1.432 -4.634 12.539 189 H ALA 25 HN ALA 25 4.563 -7.209 9.449 190 HA ALA 25 HA ALA 25 2.094 -8.281 8.460 191 HB1 ALA 25 HB1 ALA 25 4.835 -8.254 7.179 192 HB2 ALA 25 HB2 ALA 25 3.593 -7.020 6.973 193 HB3 ALA 25 HB3 ALA 25 3.322 -8.653 6.365 194 H GLN 26 HN GLN 26 4.857 -9.373 10.016 195 HA GLN 26 HA GLN 26 4.517 -12.146 9.306 196 HB2 GLN 26 HB2 GLN 26 6.700 -11.959 9.710 197 HB3 GLN 26 HB1 GLN 26 6.462 -10.425 10.530 198 HG2 GLN 26 HG2 GLN 26 7.352 -11.640 12.204 199 HG3 GLN 26 HG1 GLN 26 5.644 -11.966 12.483 200 HE21 GLN 26 HE21 GLN 26 5.454 -13.686 10.146 201 HE22 GLN 26 HE22 GLN 26 6.200 -15.173 10.578 202 H LYS 27 HN LYS 27 3.968 -9.987 11.995 203 HA LYS 27 HA LYS 27 3.085 -11.883 13.883 204 HB2 LYS 27 HB2 LYS 27 2.307 -8.973 13.679 205 HB3 LYS 27 HB1 LYS 27 2.216 -9.982 15.121 206 HG2 LYS 27 HG2 LYS 27 4.721 -9.165 13.673 207 HG3 LYS 27 HG1 LYS 27 4.138 -8.513 15.204 208 HD2 LYS 27 HD2 LYS 27 4.665 -10.444 16.367 209 HD3 LYS 27 HD1 LYS 27 4.626 -11.449 14.917 210 HE2 LYS 27 HE2 LYS 27 6.696 -10.696 14.187 211 HE3 LYS 27 HE1 LYS 27 6.649 -9.273 15.222 212 HZ1 LYS 27 HZ1 LYS 27 6.983 -12.083 16.128 213 HZ2 LYS 27 HZ2 LYS 27 6.907 -10.737 17.147 214 HZ3 LYS 27 HZ3 LYS 27 8.197 -10.910 16.070 215 H SER 28 HN SER 28 1.341 -10.054 11.411 216 HA SER 28 HA SER 28 -1.189 -11.006 12.528 217 HB2 SER 28 HB2 SER 28 -0.628 -8.914 10.434 218 HB3 SER 28 HB1 SER 28 -2.214 -9.282 11.113 219 HG SER 28 HG SER 28 -0.341 -8.768 13.032 220 H ILE 29 HN ILE 29 1.047 -11.758 10.190 221 HA ILE 29 HA ILE 29 -0.998 -13.062 8.523 222 HB ILE 29 HB ILE 29 1.769 -12.149 7.779 223 HG12 ILE 29 HG12 ILE 29 -0.911 -11.253 6.727 224 HG13 ILE 29 HG11 ILE 29 0.091 -10.359 7.871 225 HG21 ILE 29 HG21 ILE 29 1.363 -14.195 6.643 226 HG22 ILE 29 HG22 ILE 29 1.219 -12.860 5.498 227 HG23 ILE 29 HG23 ILE 29 -0.235 -13.649 6.126 228 HD11 ILE 29 HD11 ILE 29 1.001 -11.179 5.134 229 HD12 ILE 29 HD12 ILE 29 1.818 -10.094 6.268 230 HD13 ILE 29 HD13 ILE 29 0.298 -9.602 5.516 231 H ALA 30 HN ALA 30 -1.045 -15.209 8.592 232 HA ALA 30 HA ALA 30 1.089 -16.650 9.931 233 HB1 ALA 30 HB1 ALA 30 -1.260 -17.176 10.428 234 HB2 ALA 30 HB2 ALA 30 -0.390 -18.574 9.800 235 HB3 ALA 30 HB3 ALA 30 -1.493 -17.679 8.754 236 H ASP 31 HN ASP 31 0.565 -15.584 6.860 237 HA ASP 31 HA ASP 31 1.789 -17.949 5.606 238 HB2 ASP 31 HB2 ASP 31 -0.494 -16.829 4.833 239 HB3 ASP 31 HB1 ASP 31 0.627 -15.764 3.981 240 H GLU 32 HN GLU 32 3.857 -17.783 5.088 241 HA GLU 32 HA GLU 32 5.375 -15.412 5.201 242 HB2 GLU 32 HB2 GLU 32 7.133 -16.730 4.101 243 HB3 GLU 32 HB1 GLU 32 6.368 -17.649 5.391 244 HG2 GLU 32 HG2 GLU 32 5.007 -18.832 3.723 245 HG3 GLU 32 HG1 GLU 32 5.817 -17.929 2.444 246 H LYS 33 HN LYS 33 3.362 -16.740 2.716 247 HA LYS 33 HA LYS 33 4.655 -15.449 0.506 248 HB2 LYS 33 HB2 LYS 33 1.901 -16.668 0.732 249 HB3 LYS 33 HB1 LYS 33 2.636 -16.119 -0.756 250 HG2 LYS 33 HG2 LYS 33 3.816 -17.952 -0.992 251 HG3 LYS 33 HG1 LYS 33 4.283 -17.989 0.705 252 HD2 LYS 33 HD2 LYS 33 2.067 -18.882 1.264 253 HD3 LYS 33 HD1 LYS 33 1.658 -18.902 -0.456 254 HE2 LYS 33 HE2 LYS 33 3.552 -20.419 -0.852 255 HE3 LYS 33 HE1 LYS 33 3.870 -20.436 0.879 256 HZ1 LYS 33 HZ1 LYS 33 1.391 -21.389 -0.434 257 HZ2 LYS 33 HZ2 LYS 33 1.674 -21.384 1.230 258 HZ3 LYS 33 HZ3 LYS 33 2.604 -22.367 0.218 259 H ALA 34 HN ALA 34 1.721 -14.840 2.391 260 HA ALA 34 HA ALA 34 1.207 -12.382 1.034 261 HB1 ALA 34 HB1 ALA 34 0.152 -13.473 3.652 262 HB2 ALA 34 HB2 ALA 34 -0.630 -13.558 2.072 263 HB3 ALA 34 HB3 ALA 34 -0.432 -12.001 2.875 264 H ARG 35 HN ARG 35 3.187 -13.401 3.654 265 HA ARG 35 HA ARG 35 3.496 -10.939 5.035 266 HB2 ARG 35 HB2 ARG 35 4.227 -13.419 5.614 267 HB3 ARG 35 HB1 ARG 35 5.723 -12.914 4.833 268 HG2 ARG 35 HG2 ARG 35 4.567 -11.179 6.982 269 HG3 ARG 35 HG1 ARG 35 5.372 -12.676 7.441 270 HD2 ARG 35 HD2 ARG 35 6.545 -10.377 5.889 271 HD3 ARG 35 HD1 ARG 35 6.933 -10.870 7.548 272 HE ARG 35 HE ARG 35 7.521 -13.089 6.167 273 HH11 ARG 35 HH11 ARG 35 8.362 -9.751 5.571 274 HH12 ARG 35 HH12 ARG 35 9.881 -10.130 4.827 275 HH21 ARG 35 HH21 ARG 35 9.507 -13.594 5.167 276 HH22 ARG 35 HH22 ARG 35 10.523 -12.313 4.588 277 H LYS 36 HN LYS 36 5.729 -12.608 2.805 278 HA LYS 36 HA LYS 36 7.512 -10.558 2.407 279 HB2 LYS 36 HB2 LYS 36 7.796 -11.618 0.115 280 HB3 LYS 36 HB1 LYS 36 8.091 -12.626 1.522 281 HG2 LYS 36 HG2 LYS 36 5.655 -13.183 1.266 282 HG3 LYS 36 HG1 LYS 36 5.848 -12.535 -0.370 283 HD2 LYS 36 HD2 LYS 36 7.533 -14.552 0.887 284 HD3 LYS 36 HD1 LYS 36 6.256 -14.965 -0.241 285 HE2 LYS 36 HE2 LYS 36 8.516 -13.095 -0.923 286 HE3 LYS 36 HE1 LYS 36 8.624 -14.837 -1.204 287 HZ1 LYS 36 HZ1 LYS 36 6.687 -12.935 -2.401 288 HZ2 LYS 36 HZ2 LYS 36 6.582 -14.613 -2.572 289 HZ3 LYS 36 HZ3 LYS 36 7.914 -13.783 -3.199 290 H VAL 37 HN VAL 37 4.837 -11.396 0.320 291 HA VAL 37 HA VAL 37 5.352 -9.464 -1.600 292 HB VAL 37 HB VAL 37 3.192 -9.890 -2.534 293 HG11 VAL 37 HG11 VAL 37 3.582 -12.573 -1.455 294 HG12 VAL 37 HG12 VAL 37 5.119 -11.795 -1.886 295 HG13 VAL 37 HG13 VAL 37 3.835 -11.975 -3.104 296 HG21 VAL 37 HG21 VAL 37 2.494 -11.143 0.126 297 HG22 VAL 37 HG22 VAL 37 1.497 -11.210 -1.327 298 HG23 VAL 37 HG23 VAL 37 1.814 -9.661 -0.545 299 H ILE 38 HN ILE 38 3.524 -9.112 1.392 300 HA ILE 38 HA ILE 38 2.619 -6.523 0.498 301 HB ILE 38 HB ILE 38 1.472 -8.259 2.241 302 HG12 ILE 38 HG12 ILE 38 1.069 -5.292 2.403 303 HG13 ILE 38 HG11 ILE 38 0.631 -6.194 0.962 304 HG21 ILE 38 HG21 ILE 38 2.659 -6.056 3.927 305 HG22 ILE 38 HG22 ILE 38 3.172 -7.745 3.973 306 HG23 ILE 38 HG23 ILE 38 1.535 -7.304 4.469 307 HD11 ILE 38 HD11 ILE 38 -0.712 -7.615 2.713 308 HD12 ILE 38 HD12 ILE 38 -1.342 -6.104 2.062 309 HD13 ILE 38 HD13 ILE 38 -0.589 -6.121 3.647 310 H VAL 39 HN VAL 39 5.170 -7.792 2.553 311 HA VAL 39 HA VAL 39 5.876 -5.210 3.526 312 HB VAL 39 HB VAL 39 7.768 -6.080 4.440 313 HG11 VAL 39 HG11 VAL 39 7.151 -8.294 5.394 314 HG12 VAL 39 HG12 VAL 39 5.812 -8.353 4.252 315 HG13 VAL 39 HG13 VAL 39 5.871 -7.082 5.475 316 HG21 VAL 39 HG21 VAL 39 7.767 -8.404 2.520 317 HG22 VAL 39 HG22 VAL 39 8.951 -8.109 3.797 318 HG23 VAL 39 HG23 VAL 39 8.829 -6.999 2.432 319 H GLU 40 HN GLU 40 7.101 -7.224 0.898 320 HA GLU 40 HA GLU 40 8.885 -5.453 -0.223 321 HB2 GLU 40 HB2 GLU 40 7.260 -7.695 -1.368 322 HB3 GLU 40 HB1 GLU 40 8.463 -6.835 -2.303 323 HG2 GLU 40 HG2 GLU 40 10.206 -7.586 -1.010 324 HG3 GLU 40 HG1 GLU 40 9.185 -7.992 0.346 325 H LEU 41 HN LEU 41 5.400 -5.600 -0.522 326 HA LEU 41 HA LEU 41 5.425 -3.686 -2.701 327 HB2 LEU 41 HB2 LEU 41 3.599 -5.573 -1.767 328 HB3 LEU 41 HB1 LEU 41 2.849 -4.021 -1.444 329 HG LEU 41 HG LEU 41 2.070 -4.566 -3.558 330 HD11 LEU 41 HD11 LEU 41 2.976 -2.967 -5.035 331 HD12 LEU 41 HD12 LEU 41 4.530 -2.982 -4.213 332 HD13 LEU 41 HD13 LEU 41 3.113 -2.310 -3.409 333 HD21 LEU 41 HD21 LEU 41 4.854 -5.447 -4.279 334 HD22 LEU 41 HD22 LEU 41 3.464 -5.435 -5.364 335 HD23 LEU 41 HD23 LEU 41 3.475 -6.496 -3.954 336 H MET 42 HN MET 42 4.238 -3.666 0.683 337 HA MET 42 HA MET 42 3.408 -0.969 0.671 338 HB2 MET 42 HB2 MET 42 4.303 -2.677 2.988 339 HB3 MET 42 HB1 MET 42 3.471 -1.127 3.143 340 HG2 MET 42 HG2 MET 42 2.427 -3.688 1.970 341 HG3 MET 42 HG1 MET 42 1.889 -2.864 3.422 342 HE1 MET 42 HE1 MET 42 -1.153 -2.625 0.995 343 HE2 MET 42 HE2 MET 42 -0.559 -3.234 2.544 344 HE3 MET 42 HE3 MET 42 0.024 -3.939 1.034 345 H ALA 43 HN ALA 43 6.447 -2.489 1.024 346 HA ALA 43 HA ALA 43 8.124 -0.634 2.065 347 HB1 ALA 43 HB1 ALA 43 8.906 -2.739 1.276 348 HB2 ALA 43 HB2 ALA 43 9.770 -1.480 0.386 349 HB3 ALA 43 HB3 ALA 43 8.440 -2.357 -0.378 350 H TYR 44 HN TYR 44 6.367 -0.496 -0.965 351 HA TYR 44 HA TYR 44 7.634 2.094 -1.607 352 HB2 TYR 44 HB2 TYR 44 7.772 0.560 -3.470 353 HB3 TYR 44 HB1 TYR 44 6.089 0.135 -3.274 354 HD1 TYR 44 HD1 TYR 44 8.409 2.332 -4.904 355 HD2 TYR 44 HD2 TYR 44 4.316 1.876 -3.897 356 HE1 TYR 44 HE1 TYR 44 7.822 3.946 -6.656 357 HE2 TYR 44 HE2 TYR 44 3.701 3.497 -5.635 358 HH TYR 44 HH TYR 44 4.744 5.355 -6.881 359 H GLU 45 HN GLU 45 4.502 0.494 -2.030 360 HA GLU 45 HA GLU 45 2.920 2.642 -2.383 361 HB2 GLU 45 HB2 GLU 45 2.005 0.367 -0.695 362 HB3 GLU 45 HB1 GLU 45 1.087 1.283 -1.876 363 HG2 GLU 45 HG2 GLU 45 3.327 -0.596 -2.463 364 HG3 GLU 45 HG1 GLU 45 1.626 -0.986 -2.613 365 H ASN 46 HN ASN 46 4.206 1.500 0.682 366 HA ASN 46 HA ASN 46 2.462 3.345 2.103 367 HB2 ASN 46 HB2 ASN 46 3.807 0.778 2.776 368 HB3 ASN 46 HB1 ASN 46 3.611 1.962 4.063 369 HD21 ASN 46 HD21 ASN 46 2.131 0.670 5.178 370 HD22 ASN 46 HD22 ASN 46 0.517 0.454 4.616 371 H ALA 47 HN ALA 47 5.709 2.903 1.068 372 HA ALA 47 HA ALA 47 7.119 4.023 3.220 373 HB1 ALA 47 HB1 ALA 47 8.236 2.743 1.498 374 HB2 ALA 47 HB2 ALA 47 8.949 4.354 1.630 375 HB3 ALA 47 HB3 ALA 47 7.849 3.982 0.303 376 H ASN 48 HN ASN 48 8.625 5.943 2.678 377 HA ASN 48 HA ASN 48 7.133 8.315 2.732 378 HB2 ASN 48 HB2 ASN 48 9.988 7.565 2.619 379 HB3 ASN 48 HB1 ASN 48 9.601 9.172 2.011 380 HD21 ASN 48 HD21 ASN 48 11.064 8.281 4.422 381 HD22 ASN 48 HD22 ASN 48 10.241 9.041 5.743 382 HA PRO 49 HA PRO 49 6.063 9.224 -1.430 383 HB2 PRO 49 HB2 PRO 49 7.030 11.953 -0.739 384 HB3 PRO 49 HB1 PRO 49 5.485 11.449 -1.429 385 HG2 PRO 49 HG2 PRO 49 5.693 12.156 1.142 386 HG3 PRO 49 HG1 PRO 49 4.608 10.854 0.621 387 HD2 PRO 49 HD2 PRO 49 7.215 10.689 2.047 388 HD3 PRO 49 HD1 PRO 49 5.808 9.606 2.114 389 H GLU 50 HN GLU 50 9.162 10.247 -0.183 390 HA GLU 50 HA GLU 50 10.389 10.545 -2.769 391 HB2 GLU 50 HB2 GLU 50 12.259 11.333 -1.589 392 HB3 GLU 50 HB1 GLU 50 10.884 11.872 -0.632 393 HG2 GLU 50 HG2 GLU 50 11.883 9.252 0.101 394 HG3 GLU 50 HG1 GLU 50 13.008 10.568 0.366 395 H CYS 51 HN CYS 51 10.064 8.163 -0.260 396 HA CYS 51 HA CYS 51 12.462 6.761 -0.979 397 HB2 CYS 51 HB2 CYS 51 10.319 6.274 1.100 398 HB3 CYS 51 HB1 CYS 51 11.673 5.175 0.829 399 HG CYS 51 HG CYS 51 11.858 8.421 1.905 400 H GLN 52 HN GLN 52 8.991 6.320 -1.259 401 HA GLN 52 HA GLN 52 9.217 3.838 -2.656 402 HB2 GLN 52 HB2 GLN 52 6.912 4.140 -3.256 403 HB3 GLN 52 HB1 GLN 52 7.104 4.606 -1.573 404 HG2 GLN 52 HG2 GLN 52 7.173 6.968 -2.288 405 HG3 GLN 52 HG1 GLN 52 6.853 6.446 -3.940 406 HE21 GLN 52 HE21 GLN 52 5.206 4.250 -2.974 407 HE22 GLN 52 HE22 GLN 52 3.705 4.926 -2.501 408 H SER 53 HN SER 53 9.339 7.174 -3.318 409 HA SER 53 HA SER 53 9.379 7.017 -6.137 410 HB2 SER 53 HB2 SER 53 10.023 9.053 -4.067 411 HB3 SER 53 HB1 SER 53 10.445 9.364 -5.760 412 HG SER 53 HG SER 53 8.034 9.474 -4.538 413 H ALA 54 HN ALA 54 11.742 6.530 -3.647 414 HA ALA 54 HA ALA 54 13.941 6.402 -5.494 415 HB1 ALA 54 HB1 ALA 54 14.412 6.797 -3.184 416 HB2 ALA 54 HB2 ALA 54 15.070 5.217 -3.610 417 HB3 ALA 54 HB3 ALA 54 13.552 5.334 -2.713 418 H ILE 55 HN ILE 55 11.361 4.424 -4.564 419 HA ILE 55 HA ILE 55 12.656 1.961 -5.283 420 HB ILE 55 HB ILE 55 10.003 2.621 -4.088 421 HG12 ILE 55 HG12 ILE 55 12.091 0.843 -2.936 422 HG13 ILE 55 HG11 ILE 55 12.344 2.595 -2.921 423 HG21 ILE 55 HG21 ILE 55 9.656 0.188 -3.835 424 HG22 ILE 55 HG22 ILE 55 11.046 -0.087 -4.885 425 HG23 ILE 55 HG23 ILE 55 9.610 0.720 -5.515 426 HD11 ILE 55 HD11 ILE 55 9.837 1.311 -1.867 427 HD12 ILE 55 HD12 ILE 55 10.457 2.953 -1.595 428 HD13 ILE 55 HD13 ILE 55 11.296 1.563 -0.885 429 H LYS 56 HN LYS 56 10.137 4.038 -6.719 430 HA LYS 56 HA LYS 56 8.706 2.284 -8.180 431 HB2 LYS 56 HB2 LYS 56 9.317 4.346 -10.061 432 HB3 LYS 56 HB1 LYS 56 7.812 3.996 -9.234 433 HG2 LYS 56 HG2 LYS 56 8.145 6.123 -8.537 434 HG3 LYS 56 HG1 LYS 56 9.050 5.280 -7.275 435 HD2 LYS 56 HD2 LYS 56 11.031 5.920 -8.064 436 HD3 LYS 56 HD1 LYS 56 10.516 5.915 -9.753 437 HE2 LYS 56 HE2 LYS 56 9.060 7.990 -8.861 438 HE3 LYS 56 HE1 LYS 56 10.414 8.090 -7.723 439 HZ1 LYS 56 HZ1 LYS 56 10.749 7.970 -10.672 440 HZ2 LYS 56 HZ2 LYS 56 11.934 8.301 -9.516 441 HZ3 LYS 56 HZ3 LYS 56 10.689 9.415 -9.798 442 HA PRO 57 HA PRO 57 12.079 1.858 -11.737 443 HB2 PRO 57 HB2 PRO 57 14.616 1.742 -10.761 444 HB3 PRO 57 HB1 PRO 57 13.895 3.233 -11.389 445 HG2 PRO 57 HG2 PRO 57 14.006 2.255 -8.546 446 HG3 PRO 57 HG1 PRO 57 14.530 3.834 -9.184 447 HD2 PRO 57 HD2 PRO 57 12.166 3.610 -8.050 448 HD3 PRO 57 HD1 PRO 57 12.279 4.506 -9.574 449 H LEU 58 HN LEU 58 12.359 0.699 -8.444 450 HA LEU 58 HA LEU 58 13.192 -1.977 -9.304 451 HB2 LEU 58 HB2 LEU 58 12.641 -1.335 -6.465 452 HB3 LEU 58 HB1 LEU 58 13.880 -2.387 -7.131 453 HG LEU 58 HG LEU 58 13.926 0.635 -7.055 454 HD11 LEU 58 HD11 LEU 58 14.224 -0.239 -4.872 455 HD12 LEU 58 HD12 LEU 58 15.828 0.189 -5.476 456 HD13 LEU 58 HD13 LEU 58 15.312 -1.497 -5.454 457 HD21 LEU 58 HD21 LEU 58 16.231 0.439 -7.842 458 HD22 LEU 58 HD22 LEU 58 15.096 -0.216 -9.022 459 HD23 LEU 58 HD23 LEU 58 16.036 -1.308 -8.002 460 H LYS 59 HN LYS 59 10.579 -0.066 -8.425 461 HA LYS 59 HA LYS 59 8.877 -1.831 -7.118 462 HB2 LYS 59 HB2 LYS 59 8.355 0.526 -7.354 463 HB3 LYS 59 HB1 LYS 59 8.195 0.338 -9.092 464 HG2 LYS 59 HG2 LYS 59 6.008 0.204 -8.604 465 HG3 LYS 59 HG1 LYS 59 6.424 -1.471 -8.271 466 HD2 LYS 59 HD2 LYS 59 6.319 0.715 -6.229 467 HD3 LYS 59 HD1 LYS 59 5.054 -0.488 -6.488 468 HE2 LYS 59 HE2 LYS 59 7.892 -1.005 -5.596 469 HE3 LYS 59 HE1 LYS 59 6.448 -1.111 -4.603 470 HZ1 LYS 59 HZ1 LYS 59 5.667 -2.932 -5.997 471 HZ2 LYS 59 HZ2 LYS 59 7.167 -3.294 -5.301 472 HZ3 LYS 59 HZ3 LYS 59 7.076 -2.843 -6.923 473 H GLY 60 HN GLY 60 8.439 -3.820 -7.731 474 HA2 GLY 60 HA3 GLY 60 7.182 -5.317 -9.100 475 HA3 GLY 60 HA2 GLY 60 7.501 -4.271 -10.476 476 H LYS 61 HN LYS 61 10.350 -4.025 -9.535 477 HA LYS 61 HA LYS 61 11.268 -6.509 -10.816 478 HB2 LYS 61 HB2 LYS 61 13.117 -4.221 -10.422 479 HB3 LYS 61 HB1 LYS 61 12.920 -5.273 -11.814 480 HG2 LYS 61 HG2 LYS 61 10.984 -3.106 -11.075 481 HG3 LYS 61 HG1 LYS 61 12.316 -2.887 -12.197 482 HD2 LYS 61 HD2 LYS 61 10.151 -4.956 -12.531 483 HD3 LYS 61 HD1 LYS 61 10.114 -3.358 -13.281 484 HE2 LYS 61 HE2 LYS 61 12.228 -3.849 -14.406 485 HE3 LYS 61 HE1 LYS 61 12.239 -5.452 -13.678 486 HZ1 LYS 61 HZ1 LYS 61 10.226 -4.408 -15.591 487 HZ2 LYS 61 HZ2 LYS 61 10.146 -5.922 -14.843 488 HZ3 LYS 61 HZ3 LYS 61 11.406 -5.575 -15.914 489 H VAL 62 HN VAL 62 11.918 -7.965 -9.305 490 HA VAL 62 HA VAL 62 13.876 -6.968 -7.356 491 HB VAL 62 HB VAL 62 11.970 -7.858 -6.152 492 HG11 VAL 62 HG11 VAL 62 11.281 -10.201 -6.318 493 HG12 VAL 62 HG12 VAL 62 12.394 -10.425 -7.670 494 HG13 VAL 62 HG13 VAL 62 11.021 -9.328 -7.830 495 HG21 VAL 62 HG21 VAL 62 14.114 -8.230 -5.139 496 HG22 VAL 62 HG22 VAL 62 14.345 -9.708 -6.073 497 HG23 VAL 62 HG23 VAL 62 13.088 -9.634 -4.838 498 HA PRO 63 HA PRO 63 16.951 -9.394 -9.584 499 HB2 PRO 63 HB2 PRO 63 17.954 -9.672 -6.793 500 HB3 PRO 63 HB1 PRO 63 18.840 -9.260 -8.257 501 HG2 PRO 63 HG2 PRO 63 18.220 -7.366 -6.520 502 HG3 PRO 63 HG1 PRO 63 18.067 -7.059 -8.260 503 HD2 PRO 63 HD2 PRO 63 15.942 -7.602 -6.237 504 HD3 PRO 63 HD1 PRO 63 15.907 -6.533 -7.652 505 H ALA 64 HN ALA 64 17.053 -11.507 -10.020 506 HA ALA 64 HA ALA 64 15.227 -13.293 -8.848 507 HB1 ALA 64 HB1 ALA 64 15.966 -13.485 -11.170 508 HB2 ALA 64 HB2 ALA 64 16.235 -14.986 -10.284 509 HB3 ALA 64 HB3 ALA 64 17.587 -13.906 -10.620 510 H GLY 65 HN GLY 65 15.404 -14.008 -6.840 511 HA2 GLY 65 HA3 GLY 65 16.410 -15.644 -5.396 512 HA3 GLY 65 HA2 GLY 65 17.982 -15.155 -6.007 513 H SER 66 HN SER 66 16.884 -12.251 -5.743 514 HA SER 66 HA SER 66 17.808 -11.958 -2.992 515 HB2 SER 66 HB2 SER 66 18.465 -10.476 -5.084 516 HB3 SER 66 HB1 SER 66 16.965 -9.647 -4.668 517 HG SER 66 HG SER 66 18.417 -8.582 -3.495 518 H ASP 67 HN ASP 67 16.696 -9.870 -2.057 519 HA ASP 67 HA ASP 67 13.814 -10.416 -1.805 520 HB2 ASP 67 HB2 ASP 67 15.685 -10.370 0.085 521 HB3 ASP 67 HB1 ASP 67 15.360 -8.647 0.023 522 H VAL 68 HN VAL 68 12.354 -8.583 -2.083 523 HA VAL 68 HA VAL 68 13.556 -6.576 -3.762 524 HB VAL 68 HB VAL 68 11.546 -6.097 -4.564 525 HG11 VAL 68 HG11 VAL 68 10.578 -8.373 -2.865 526 HG12 VAL 68 HG12 VAL 68 11.369 -8.512 -4.433 527 HG13 VAL 68 HG13 VAL 68 9.795 -7.730 -4.309 528 HG21 VAL 68 HG21 VAL 68 9.556 -5.609 -3.160 529 HG22 VAL 68 HG22 VAL 68 10.976 -4.619 -2.802 530 HG23 VAL 68 HG23 VAL 68 10.539 -5.956 -1.735 531 H ILE 69 HN ILE 69 12.539 -6.919 -0.484 532 HA ILE 69 HA ILE 69 12.397 -4.217 0.213 533 HB ILE 69 HB ILE 69 13.088 -6.641 1.837 534 HG12 ILE 69 HG12 ILE 69 10.818 -6.735 1.271 535 HG13 ILE 69 HG11 ILE 69 10.809 -5.964 2.850 536 HG21 ILE 69 HG21 ILE 69 12.716 -5.144 3.845 537 HG22 ILE 69 HG22 ILE 69 12.833 -3.768 2.746 538 HG23 ILE 69 HG23 ILE 69 14.206 -4.854 2.947 539 HD11 ILE 69 HD11 ILE 69 10.647 -3.772 1.733 540 HD12 ILE 69 HD12 ILE 69 9.272 -4.840 1.433 541 HD13 ILE 69 HD13 ILE 69 10.514 -4.619 0.191 542 H SER 70 HN SER 70 15.042 -6.479 0.345 543 HA SER 70 HA SER 70 17.010 -4.905 1.427 544 HB2 SER 70 HB2 SER 70 17.274 -7.303 0.919 545 HB3 SER 70 HB1 SER 70 17.332 -6.934 -0.802 546 HG SER 70 HG SER 70 19.150 -5.859 1.095 547 H GLU 71 HN GLU 71 15.736 -4.855 -1.840 548 HA GLU 71 HA GLU 71 17.766 -3.054 -2.829 549 HB2 GLU 71 HB2 GLU 71 15.251 -3.729 -4.289 550 HB3 GLU 71 HB1 GLU 71 16.881 -3.518 -4.919 551 HG2 GLU 71 HG2 GLU 71 16.334 -5.791 -3.095 552 HG3 GLU 71 HG1 GLU 71 15.772 -5.888 -4.749 553 H TYR 72 HN TYR 72 14.508 -3.020 -1.691 554 HA TYR 72 HA TYR 72 13.841 -0.428 -2.677 555 HB2 TYR 72 HB2 TYR 72 12.577 -2.350 -0.736 556 HB3 TYR 72 HB1 TYR 72 11.939 -0.726 -0.948 557 HD1 TYR 72 HD1 TYR 72 13.375 -2.280 -3.875 558 HD2 TYR 72 HD2 TYR 72 9.808 -1.812 -1.624 559 HE1 TYR 72 HE1 TYR 72 12.065 -3.050 -5.791 560 HE2 TYR 72 HE2 TYR 72 8.484 -2.597 -3.541 561 HH TYR 72 HH TYR 72 9.998 -3.973 -6.350 562 H VAL 73 HN VAL 73 15.012 -1.808 0.313 563 HA VAL 73 HA VAL 73 15.046 0.617 1.765 564 HB VAL 73 HB VAL 73 16.209 -0.380 3.471 565 HG11 VAL 73 HG11 VAL 73 14.147 -1.474 3.319 566 HG12 VAL 73 HG12 VAL 73 15.359 -2.672 3.766 567 HG13 VAL 73 HG13 VAL 73 14.758 -2.599 2.110 568 HG21 VAL 73 HG21 VAL 73 18.142 -1.056 2.020 569 HG22 VAL 73 HG22 VAL 73 17.300 -2.588 1.772 570 HG23 VAL 73 HG23 VAL 73 17.790 -2.094 3.401 571 H LYS 74 HN LYS 74 17.163 -1.091 -0.383 572 HA LYS 74 HA LYS 74 19.504 0.472 -0.088 573 HB2 LYS 74 HB2 LYS 74 18.729 -1.789 -1.502 574 HB3 LYS 74 HB1 LYS 74 19.023 -0.587 -2.749 575 HG2 LYS 74 HG2 LYS 74 21.107 -1.454 -2.620 576 HG3 LYS 74 HG1 LYS 74 21.253 -0.220 -1.370 577 HD2 LYS 74 HD2 LYS 74 20.471 -3.081 -0.840 578 HD3 LYS 74 HD1 LYS 74 22.125 -2.474 -0.720 579 HE2 LYS 74 HE2 LYS 74 21.360 -0.851 0.984 580 HE3 LYS 74 HE1 LYS 74 19.747 -1.558 0.891 581 HZ1 LYS 74 HZ1 LYS 74 22.210 -3.000 1.707 582 HZ2 LYS 74 HZ2 LYS 74 20.657 -3.664 1.637 583 HZ3 LYS 74 HZ3 LYS 74 21.007 -2.445 2.755 584 H ALA 75 HN ALA 75 16.575 0.708 -1.944 585 HA ALA 75 HA ALA 75 17.335 2.730 -3.763 586 HB1 ALA 75 HB1 ALA 75 15.319 1.420 -4.055 587 HB2 ALA 75 HB2 ALA 75 14.897 3.127 -3.946 588 HB3 ALA 75 HB3 ALA 75 14.649 2.064 -2.558 589 H CYS 76 HN CYS 76 15.889 2.776 -0.582 590 HA CYS 76 HA CYS 76 16.036 5.667 -0.440 591 HB2 CYS 76 HB2 CYS 76 14.916 3.780 1.609 592 HB3 CYS 76 HB1 CYS 76 14.459 5.443 1.270 593 HG CYS 76 HG CYS 76 13.694 2.666 -0.535 594 H ASP 77 HN ASP 77 18.169 3.352 -0.005 595 HA ASP 77 HA ASP 77 19.186 3.703 2.581 596 HB2 ASP 77 HB2 ASP 77 19.894 1.805 1.387 597 HB3 ASP 77 HB1 ASP 77 20.397 2.734 -0.015 598 H GLY 78 HN GLY 78 19.583 5.539 -0.362 599 HA2 GLY 78 HA3 GLY 78 21.494 7.337 0.921 600 HA3 GLY 78 HA2 GLY 78 20.931 7.428 -0.742 601 H ILE 79 HN ILE 79 18.322 6.953 1.282 602 HA ILE 79 HA ILE 79 17.657 9.784 1.156 603 HB ILE 79 HB ILE 79 15.891 7.394 1.510 604 HG12 ILE 79 HG12 ILE 79 16.050 9.426 -0.726 605 HG13 ILE 79 HG11 ILE 79 16.717 7.793 -0.793 606 HG21 ILE 79 HG21 ILE 79 13.997 8.914 1.490 607 HG22 ILE 79 HG22 ILE 79 15.093 10.292 1.405 608 HG23 ILE 79 HG23 ILE 79 15.071 9.271 2.842 609 HD11 ILE 79 HD11 ILE 79 14.512 8.150 -1.933 610 HD12 ILE 79 HD12 ILE 79 13.806 8.366 -0.333 611 HD13 ILE 79 HD13 ILE 79 14.559 6.831 -0.766 612 H GLY 80 HN GLY 80 17.627 10.938 2.879 613 HA2 GLY 80 HA3 GLY 80 16.172 10.361 5.156 614 HA3 GLY 80 HA2 GLY 80 17.860 10.041 5.532 615 H GLY 81 HN GLY 81 19.203 11.831 4.169 616 HA2 GLY 81 HA3 GLY 81 18.043 14.478 4.604 617 HA3 GLY 81 HA2 GLY 81 19.492 14.086 5.523 618 H ALA 82 HN ALA 82 19.243 16.175 3.607 619 HA ALA 82 HA ALA 82 20.426 17.146 1.943 620 HB1 ALA 82 HB1 ALA 82 22.277 14.801 2.259 621 HB2 ALA 82 HB2 ALA 82 22.328 16.289 3.202 622 HB3 ALA 82 HB3 ALA 82 22.652 16.333 1.470 623 H MET 83 HN MET 83 21.191 13.803 1.017 624 HA MET 83 HA MET 83 20.594 14.197 -1.702 625 HB2 MET 83 HB2 MET 83 20.650 11.613 -0.130 626 HB3 MET 83 HB1 MET 83 20.670 11.735 -1.885 627 HG2 MET 83 HG2 MET 83 22.798 12.959 -1.749 628 HG3 MET 83 HG1 MET 83 22.782 12.751 -0.000 629 HE1 MET 83 HE1 MET 83 25.223 11.678 -0.150 630 HE2 MET 83 HE2 MET 83 25.203 11.866 -1.903 631 HE3 MET 83 HE3 MET 83 25.622 10.309 -1.188 632 H HIS 84 HN HIS 84 18.702 12.925 0.967 633 HA HIS 84 HA HIS 84 16.344 12.201 -0.325 634 HB2 HIS 84 HB2 HIS 84 16.505 11.721 1.986 635 HB3 HIS 84 HB1 HIS 84 16.989 13.353 2.395 636 HD1 HIS 84 HD1 HIS 84 15.232 13.630 4.200 637 HD2 HIS 84 HD2 HIS 84 13.622 12.673 0.484 638 HE1 HIS 84 HE1 HIS 84 12.754 13.984 4.421 639 HE2 HIS 84 HE2 HIS 84 11.789 13.202 2.235 640 H LYS 85 HN LYS 85 17.625 15.399 0.384 641 HA LYS 85 HA LYS 85 15.126 16.716 -0.253 642 HB2 LYS 85 HB2 LYS 85 17.858 17.901 0.262 643 HB3 LYS 85 HB1 LYS 85 16.335 18.782 0.208 644 HG2 LYS 85 HG2 LYS 85 17.036 16.640 2.209 645 HG3 LYS 85 HG1 LYS 85 17.099 18.378 2.503 646 HD2 LYS 85 HD2 LYS 85 14.719 18.567 2.173 647 HD3 LYS 85 HD1 LYS 85 14.614 16.872 1.700 648 HE2 LYS 85 HE2 LYS 85 15.164 16.133 3.889 649 HE3 LYS 85 HE1 LYS 85 15.605 17.767 4.392 650 HZ1 LYS 85 HZ1 LYS 85 13.426 17.152 5.232 651 HZ2 LYS 85 HZ2 LYS 85 12.863 16.881 3.658 652 HZ3 LYS 85 HZ3 LYS 85 13.298 18.440 4.143 653 H ALA 86 HN ALA 86 18.282 16.199 -1.745 654 HA ALA 86 HA ALA 86 17.862 17.694 -4.099 655 HB1 ALA 86 HB1 ALA 86 20.032 16.636 -3.307 656 HB2 ALA 86 HB2 ALA 86 19.675 16.483 -5.027 657 HB3 ALA 86 HB3 ALA 86 19.408 15.110 -3.950 658 H MET 87 HN MET 87 17.405 14.294 -3.370 659 HA MET 87 HA MET 87 16.294 13.637 -5.911 660 HB2 MET 87 HB2 MET 87 16.245 12.028 -3.350 661 HB3 MET 87 HB1 MET 87 16.055 11.413 -4.995 662 HG2 MET 87 HG2 MET 87 18.414 12.538 -5.321 663 HG3 MET 87 HG1 MET 87 18.495 12.335 -3.578 664 HE1 MET 87 HE1 MET 87 18.551 10.068 -2.315 665 HE2 MET 87 HE2 MET 87 18.257 8.505 -3.075 666 HE3 MET 87 HE3 MET 87 16.959 9.693 -2.975 667 H LEU 88 HN LEU 88 15.042 15.024 -3.120 668 HA LEU 88 HA LEU 88 12.433 14.076 -3.006 669 HB2 LEU 88 HB2 LEU 88 13.821 15.915 -1.654 670 HB3 LEU 88 HB1 LEU 88 12.878 16.984 -2.671 671 HG LEU 88 HG LEU 88 11.062 16.734 -1.383 672 HD11 LEU 88 HD11 LEU 88 10.127 14.575 -0.724 673 HD12 LEU 88 HD12 LEU 88 11.594 13.763 -1.265 674 HD13 LEU 88 HD13 LEU 88 10.549 14.570 -2.434 675 HD21 LEU 88 HD21 LEU 88 12.991 15.170 0.306 676 HD22 LEU 88 HD22 LEU 88 11.464 15.847 0.875 677 HD23 LEU 88 HD23 LEU 88 12.755 16.917 0.329 678 H MET 89 HN MET 89 13.863 16.577 -5.070 679 HA MET 89 HA MET 89 11.324 17.241 -6.271 680 HB2 MET 89 HB2 MET 89 13.104 18.923 -5.941 681 HB3 MET 89 HB1 MET 89 14.128 18.044 -7.066 682 HG2 MET 89 HG2 MET 89 12.522 18.465 -8.857 683 HG3 MET 89 HG1 MET 89 11.498 19.349 -7.728 684 HE1 MET 89 HE1 MET 89 13.752 22.428 -6.832 685 HE2 MET 89 HE2 MET 89 13.694 20.892 -5.969 686 HE3 MET 89 HE3 MET 89 12.204 21.626 -6.562 687 H ALA 90 HN ALA 90 13.772 14.937 -6.789 688 HA ALA 90 HA ALA 90 13.234 14.661 -9.643 689 HB1 ALA 90 HB1 ALA 90 15.113 13.136 -9.654 690 HB2 ALA 90 HB2 ALA 90 15.158 13.127 -7.889 691 HB3 ALA 90 HB3 ALA 90 15.560 14.601 -8.778 692 H GLN 91 HN GLN 91 12.987 12.771 -6.678 693 HA GLN 91 HA GLN 91 11.899 10.541 -8.192 694 HB2 GLN 91 HB2 GLN 91 12.631 10.768 -5.280 695 HB3 GLN 91 HB1 GLN 91 12.155 9.292 -6.107 696 HG2 GLN 91 HG2 GLN 91 14.087 9.410 -7.523 697 HG3 GLN 91 HG1 GLN 91 14.549 10.938 -6.785 698 HE21 GLN 91 HE21 GLN 91 13.805 10.209 -4.147 699 HE22 GLN 91 HE22 GLN 91 14.925 9.038 -3.607 700 H LEU 92 HN LEU 92 10.978 12.427 -5.285 701 HA LEU 92 HA LEU 92 8.417 11.495 -4.901 702 HB2 LEU 92 HB2 LEU 92 9.867 13.439 -3.786 703 HB3 LEU 92 HB1 LEU 92 8.859 14.442 -4.799 704 HG LEU 92 HG LEU 92 8.139 12.841 -2.393 705 HD11 LEU 92 HD11 LEU 92 8.583 15.194 -2.162 706 HD12 LEU 92 HD12 LEU 92 6.873 14.875 -1.876 707 HD13 LEU 92 HD13 LEU 92 7.397 15.571 -3.410 708 HD21 LEU 92 HD21 LEU 92 5.745 13.035 -2.942 709 HD22 LEU 92 HD22 LEU 92 6.595 11.949 -4.041 710 HD23 LEU 92 HD23 LEU 92 6.174 13.581 -4.563 711 H GLU 93 HN GLU 93 9.783 13.659 -7.199 712 HA GLU 93 HA GLU 93 8.807 15.244 -8.625 713 HB2 GLU 93 HB2 GLU 93 8.388 13.908 -10.741 714 HB3 GLU 93 HB1 GLU 93 9.955 13.703 -9.953 715 HG2 GLU 93 HG2 GLU 93 9.300 11.601 -9.052 716 HG3 GLU 93 HG1 GLU 93 7.635 11.822 -9.564 717 H2 PRO 1 HT1 PRO 1 5.348 -3.209 -13.390 718 H3 PRO 1 HT2 PRO 1 5.667 -1.695 -13.918 719 HA PRO 1 HA PRO 1 6.325 -1.529 -11.856 720 HB2 PRO 1 HB2 PRO 1 4.139 -0.592 -10.618 721 HB3 PRO 1 HB1 PRO 1 4.879 0.281 -11.961 722 HG2 PRO 1 HG2 PRO 1 2.358 -1.209 -11.886 723 HG3 PRO 1 HG1 PRO 1 2.920 -0.013 -13.064 724 HD2 PRO 1 HD2 PRO 1 2.993 -2.928 -13.209 725 HD3 PRO 1 HD1 PRO 1 3.307 -1.737 -14.489 726 H SER 2 HN SER 2 4.420 -1.716 -9.526 727 HA SER 2 HA SER 2 4.338 -4.487 -8.940 728 HB2 SER 2 HB2 SER 2 2.484 -2.325 -7.908 729 HB3 SER 2 HB1 SER 2 2.804 -3.882 -7.156 730 HG SER 2 HG SER 2 3.946 -1.813 -6.447 731 H PHE 3 HN PHE 3 2.133 -5.606 -8.661 732 HA PHE 3 HA PHE 3 0.428 -5.258 -10.911 733 HB2 PHE 3 HB2 PHE 3 -1.123 -6.414 -8.915 734 HB3 PHE 3 HB1 PHE 3 -0.176 -7.294 -10.115 735 HD1 PHE 3 HD1 PHE 3 -0.648 -6.494 -6.668 736 HD2 PHE 3 HD2 PHE 3 2.177 -8.000 -9.477 737 HE1 PHE 3 HE1 PHE 3 0.642 -7.495 -4.852 738 HE2 PHE 3 HE2 PHE 3 3.483 -8.994 -7.645 739 HZ PHE 3 HZ PHE 3 2.716 -8.739 -5.319 740 H ASN 4 HN ASN 4 0.352 -4.347 -7.539 741 HA ASN 4 HA ASN 4 -2.309 -3.281 -7.783 742 HB2 ASN 4 HB2 ASN 4 -2.159 -3.059 -5.360 743 HB3 ASN 4 HB1 ASN 4 -1.691 -4.675 -5.881 744 HD21 ASN 4 HD21 ASN 4 -0.420 -1.530 -4.902 745 HD22 ASN 4 HD22 ASN 4 1.089 -2.140 -4.300 746 H THR 5 HN THR 5 0.521 -1.854 -8.542 747 HA THR 5 HA THR 5 0.575 0.449 -6.888 748 HB THR 5 HB THR 5 1.633 1.406 -9.129 749 HG1 THR 5 HG1 THR 5 1.474 -0.126 -10.596 750 HG21 THR 5 HG21 THR 5 2.913 1.182 -7.148 751 HG22 THR 5 HG22 THR 5 3.797 0.355 -8.433 752 HG23 THR 5 HG23 THR 5 2.875 -0.575 -7.253 753 H VAL 6 HN VAL 6 -1.722 -0.533 -9.123 754 HA VAL 6 HA VAL 6 -2.468 2.033 -10.107 755 HB VAL 6 HB VAL 6 -4.258 0.992 -11.174 756 HG11 VAL 6 HG11 VAL 6 -3.417 -1.095 -12.136 757 HG12 VAL 6 HG12 VAL 6 -2.192 -1.172 -10.868 758 HG13 VAL 6 HG13 VAL 6 -2.168 0.146 -12.042 759 HG21 VAL 6 HG21 VAL 6 -5.220 0.025 -9.077 760 HG22 VAL 6 HG22 VAL 6 -4.147 -1.363 -9.302 761 HG23 VAL 6 HG23 VAL 6 -5.387 -0.998 -10.511 762 H ARG 7 HN ARG 7 -3.796 3.505 -9.130 763 HA ARG 7 HA ARG 7 -5.548 2.576 -7.067 764 HB2 ARG 7 HB2 ARG 7 -4.590 4.176 -5.365 765 HB3 ARG 7 HB1 ARG 7 -3.782 2.661 -5.685 766 HG2 ARG 7 HG2 ARG 7 -2.606 4.525 -7.381 767 HG3 ARG 7 HG1 ARG 7 -2.749 5.283 -5.793 768 HD2 ARG 7 HD2 ARG 7 -1.683 3.352 -4.766 769 HD3 ARG 7 HD1 ARG 7 -1.547 2.574 -6.339 770 HE ARG 7 HE ARG 7 -0.168 4.694 -6.884 771 HH11 ARG 7 HH11 ARG 7 -0.197 2.972 -3.838 772 HH12 ARG 7 HH12 ARG 7 1.345 3.570 -3.343 773 HH21 ARG 7 HH21 ARG 7 1.881 5.476 -6.233 774 HH22 ARG 7 HH22 ARG 7 2.521 5.009 -4.693 775 H GLN 8 HN GLN 8 -6.862 4.100 -6.135 776 HA GLN 8 HA GLN 8 -8.433 5.515 -7.761 777 HB2 GLN 8 HB2 GLN 8 -8.067 5.202 -4.950 778 HB3 GLN 8 HB1 GLN 8 -8.503 6.877 -5.279 779 HG2 GLN 8 HG2 GLN 8 -10.475 6.173 -6.463 780 HG3 GLN 8 HG1 GLN 8 -10.019 4.482 -6.273 781 HE21 GLN 8 HE21 GLN 8 -12.407 5.872 -5.410 782 HE22 GLN 8 HE22 GLN 8 -12.480 5.668 -3.682 783 H GLY 9 HN GLY 9 -8.045 7.088 -9.103 784 HA2 GLY 9 HA3 GLY 9 -6.261 9.284 -8.457 785 HA3 GLY 9 HA2 GLY 9 -7.207 9.092 -9.929 786 H SER 10 HN SER 10 -7.927 11.268 -9.797 787 HA SER 10 HA SER 10 -9.061 12.464 -7.547 788 HB2 SER 10 HB2 SER 10 -8.342 13.642 -9.636 789 HB3 SER 10 HB1 SER 10 -9.786 13.021 -10.435 790 HG SER 10 HG SER 10 -9.851 14.583 -8.063 791 H LYS 11 HN LYS 11 -10.533 11.368 -6.433 792 HA LYS 11 HA LYS 11 -12.360 10.214 -5.805 793 HB2 LYS 11 HB2 LYS 11 -14.426 11.178 -6.291 794 HB3 LYS 11 HB1 LYS 11 -13.307 12.517 -6.318 795 HG2 LYS 11 HG2 LYS 11 -13.284 11.946 -8.885 796 HG3 LYS 11 HG1 LYS 11 -14.855 11.257 -8.519 797 HD2 LYS 11 HD2 LYS 11 -15.348 13.445 -9.145 798 HD3 LYS 11 HD1 LYS 11 -15.332 13.515 -7.382 799 HE2 LYS 11 HE2 LYS 11 -14.139 15.411 -8.276 800 HE3 LYS 11 HE1 LYS 11 -13.008 14.330 -7.465 801 HZ1 LYS 11 HZ1 LYS 11 -12.089 15.068 -9.543 802 HZ2 LYS 11 HZ2 LYS 11 -13.450 14.537 -10.393 803 HZ3 LYS 11 HZ3 LYS 11 -12.425 13.415 -9.651 804 H GLU 12 HN GLU 12 -10.863 8.902 -7.868 805 HA GLU 12 HA GLU 12 -12.387 7.830 -9.937 806 HB2 GLU 12 HB2 GLU 12 -9.945 7.600 -9.714 807 HB3 GLU 12 HB1 GLU 12 -10.163 6.547 -8.330 808 HG2 GLU 12 HG2 GLU 12 -11.195 4.867 -9.732 809 HG3 GLU 12 HG1 GLU 12 -11.079 5.939 -11.126 810 HA PRO 13 HA PRO 13 -15.558 5.437 -7.905 811 HB2 PRO 13 HB2 PRO 13 -15.035 3.490 -10.077 812 HB3 PRO 13 HB1 PRO 13 -16.560 4.222 -9.579 813 HG2 PRO 13 HG2 PRO 13 -15.294 4.981 -11.814 814 HG3 PRO 13 HG1 PRO 13 -16.200 6.120 -10.811 815 HD2 PRO 13 HD2 PRO 13 -13.271 5.787 -11.115 816 HD3 PRO 13 HD1 PRO 13 -14.208 7.239 -10.730 817 H TYR 14 HN TYR 14 -15.256 4.127 -6.219 818 HA TYR 14 HA TYR 14 -12.634 3.157 -5.866 819 HB2 TYR 14 HB2 TYR 14 -13.856 4.167 -4.021 820 HB3 TYR 14 HB1 TYR 14 -15.002 2.833 -4.040 821 HD1 TYR 14 HD1 TYR 14 -14.041 0.497 -3.750 822 HD2 TYR 14 HD2 TYR 14 -11.939 4.013 -2.694 823 HE1 TYR 14 HE1 TYR 14 -12.625 -0.835 -2.280 824 HE2 TYR 14 HE2 TYR 14 -10.496 2.705 -1.199 825 HH TYR 14 HH TYR 14 -10.175 0.690 -0.268 826 HA PRO 15 HA PRO 15 -14.687 -1.274 -5.605 827 HB2 PRO 15 HB2 PRO 15 -16.858 -0.935 -7.573 828 HB3 PRO 15 HB1 PRO 15 -16.843 -1.846 -6.066 829 HG2 PRO 15 HG2 PRO 15 -18.162 0.466 -6.316 830 HG3 PRO 15 HG1 PRO 15 -17.415 -0.029 -4.801 831 HD2 PRO 15 HD2 PRO 15 -16.540 2.023 -6.763 832 HD3 PRO 15 HD1 PRO 15 -16.321 1.963 -5.008 833 H ASP 16 HN ASP 16 -14.440 0.895 -8.147 834 HA ASP 16 HA ASP 16 -13.679 -1.055 -10.151 835 HB2 ASP 16 HB2 ASP 16 -14.385 1.827 -10.181 836 HB3 ASP 16 HB1 ASP 16 -13.232 1.292 -11.397 837 H PHE 17 HN PHE 17 -12.284 1.651 -8.350 838 HA PHE 17 HA PHE 17 -9.699 1.621 -9.381 839 HB2 PHE 17 HB2 PHE 17 -9.602 3.323 -7.871 840 HB3 PHE 17 HB1 PHE 17 -11.046 2.730 -7.061 841 HD1 PHE 17 HD1 PHE 17 -10.916 1.671 -4.974 842 HD2 PHE 17 HD2 PHE 17 -7.369 2.363 -7.204 843 HE1 PHE 17 HE1 PHE 17 -9.572 0.999 -3.033 844 HE2 PHE 17 HE2 PHE 17 -6.012 1.707 -5.260 845 HZ PHE 17 HZ PHE 17 -7.114 1.023 -3.171 846 H VAL 18 HN VAL 18 -11.199 -0.256 -6.835 847 HA VAL 18 HA VAL 18 -8.804 -1.719 -6.267 848 HB VAL 18 HB VAL 18 -10.192 -1.293 -4.393 849 HG11 VAL 18 HG11 VAL 18 -12.388 -2.603 -5.978 850 HG12 VAL 18 HG12 VAL 18 -12.307 -0.907 -5.485 851 HG13 VAL 18 HG13 VAL 18 -12.493 -2.182 -4.263 852 HG21 VAL 18 HG21 VAL 18 -10.396 -4.120 -5.333 853 HG22 VAL 18 HG22 VAL 18 -10.910 -3.585 -3.723 854 HG23 VAL 18 HG23 VAL 18 -9.217 -3.421 -4.210 855 H ALA 19 HN ALA 19 -11.790 -2.306 -8.058 856 HA ALA 19 HA ALA 19 -11.493 -5.028 -8.561 857 HB1 ALA 19 HB1 ALA 19 -13.484 -3.746 -9.223 858 HB2 ALA 19 HB2 ALA 19 -12.840 -4.708 -10.554 859 HB3 ALA 19 HB3 ALA 19 -12.547 -2.970 -10.500 860 H ARG 20 HN ARG 20 -9.836 -2.305 -10.122 861 HA ARG 20 HA ARG 20 -8.563 -4.133 -11.976 862 HB2 ARG 20 HB2 ARG 20 -7.269 -2.180 -12.749 863 HB3 ARG 20 HB1 ARG 20 -9.000 -1.895 -12.818 864 HG2 ARG 20 HG2 ARG 20 -8.948 -0.353 -11.107 865 HG3 ARG 20 HG1 ARG 20 -7.438 -0.983 -10.444 866 HD2 ARG 20 HD2 ARG 20 -6.171 -0.048 -12.227 867 HD3 ARG 20 HD1 ARG 20 -7.622 0.349 -13.130 868 HE ARG 20 HE ARG 20 -7.988 1.814 -10.945 869 HH11 ARG 20 HH11 ARG 20 -5.153 1.416 -12.970 870 HH12 ARG 20 HH12 ARG 20 -4.518 2.991 -12.611 871 HH21 ARG 20 HH21 ARG 20 -7.190 3.892 -10.508 872 HH22 ARG 20 HH22 ARG 20 -5.667 4.392 -11.195 873 H LEU 21 HN LEU 21 -8.053 -2.577 -8.953 874 HA LEU 21 HA LEU 21 -5.378 -3.072 -8.492 875 HB2 LEU 21 HB2 LEU 21 -7.217 -1.902 -7.058 876 HB3 LEU 21 HB1 LEU 21 -7.481 -3.495 -6.385 877 HG LEU 21 HG LEU 21 -5.407 -3.515 -5.305 878 HD11 LEU 21 HD11 LEU 21 -3.684 -1.763 -5.673 879 HD12 LEU 21 HD12 LEU 21 -4.644 -1.176 -7.037 880 HD13 LEU 21 HD13 LEU 21 -3.955 -2.801 -7.072 881 HD21 LEU 21 HD21 LEU 21 -5.349 -1.368 -4.085 882 HD22 LEU 21 HD22 LEU 21 -6.959 -2.079 -4.198 883 HD23 LEU 21 HD23 LEU 21 -6.514 -0.728 -5.242 884 H GLN 22 HN GLN 22 -8.210 -5.117 -8.031 885 HA GLN 22 HA GLN 22 -6.790 -7.418 -7.192 886 HB2 GLN 22 HB2 GLN 22 -9.538 -7.367 -8.410 887 HB3 GLN 22 HB1 GLN 22 -8.840 -8.551 -7.301 888 HG2 GLN 22 HG2 GLN 22 -8.744 -6.691 -5.640 889 HG3 GLN 22 HG1 GLN 22 -9.702 -5.747 -6.741 890 HE21 GLN 22 HE21 GLN 22 -11.132 -5.654 -4.963 891 HE22 GLN 22 HE22 GLN 22 -12.267 -6.934 -4.713 892 H ASP 23 HN ASP 23 -8.242 -6.337 -10.180 893 HA ASP 23 HA ASP 23 -8.001 -8.581 -11.744 894 HB2 ASP 23 HB2 ASP 23 -8.939 -6.256 -12.280 895 HB3 ASP 23 HB1 ASP 23 -7.285 -5.862 -12.745 896 H VAL 24 HN VAL 24 -5.537 -6.069 -11.255 897 HA VAL 24 HA VAL 24 -3.717 -7.515 -12.963 898 HB VAL 24 HB VAL 24 -3.722 -5.082 -13.106 899 HG11 VAL 24 HG11 VAL 24 -2.943 -3.702 -11.237 900 HG12 VAL 24 HG12 VAL 24 -2.884 -5.139 -10.217 901 HG13 VAL 24 HG13 VAL 24 -4.428 -4.573 -10.855 902 HG21 VAL 24 HG21 VAL 24 -1.614 -6.085 -13.644 903 HG22 VAL 24 HG22 VAL 24 -1.183 -6.224 -11.943 904 HG23 VAL 24 HG23 VAL 24 -1.275 -4.631 -12.698 905 H ALA 25 HN ALA 25 -4.433 -7.173 -9.612 906 HA ALA 25 HA ALA 25 -1.972 -8.262 -8.619 907 HB1 ALA 25 HB1 ALA 25 -4.717 -8.220 -7.347 908 HB2 ALA 25 HB2 ALA 25 -3.469 -6.992 -7.137 909 HB3 ALA 25 HB3 ALA 25 -3.210 -8.626 -6.528 910 H GLN 26 HN GLN 26 -4.743 -9.337 -10.180 911 HA GLN 26 HA GLN 26 -4.418 -12.111 -9.475 912 HB2 GLN 26 HB2 GLN 26 -6.598 -11.913 -9.881 913 HB3 GLN 26 HB1 GLN 26 -6.353 -10.381 -10.700 914 HG2 GLN 26 HG2 GLN 26 -7.241 -11.593 -12.376 915 HG3 GLN 26 HG1 GLN 26 -5.535 -11.925 -12.650 916 HE21 GLN 26 HE21 GLN 26 -5.363 -13.641 -10.301 917 HE22 GLN 26 HE22 GLN 26 -6.111 -15.124 -10.735 918 H LYS 27 HN LYS 27 -3.843 -9.951 -12.159 919 HA LYS 27 HA LYS 27 -2.972 -11.860 -14.044 920 HB2 LYS 27 HB2 LYS 27 -2.173 -8.953 -13.846 921 HB3 LYS 27 HB1 LYS 27 -2.087 -9.967 -15.287 922 HG2 LYS 27 HG2 LYS 27 -4.587 -9.129 -13.844 923 HG3 LYS 27 HG1 LYS 27 -3.997 -8.485 -15.376 924 HD2 LYS 27 HD2 LYS 27 -4.534 -10.418 -16.532 925 HD3 LYS 27 HD1 LYS 27 -4.506 -11.417 -15.079 926 HE2 LYS 27 HE2 LYS 27 -6.572 -10.648 -14.357 927 HE3 LYS 27 HE1 LYS 27 -6.512 -9.228 -15.395 928 HZ1 LYS 27 HZ1 LYS 27 -6.862 -12.037 -16.294 929 HZ2 LYS 27 HZ2 LYS 27 -6.772 -10.693 -17.316 930 HZ3 LYS 27 HZ3 LYS 27 -8.068 -10.853 -16.242 931 H SER 28 HN SER 28 -1.224 -10.039 -11.569 932 HA SER 28 HA SER 28 1.301 -11.012 -12.673 933 HB2 SER 28 HB2 SER 28 0.750 -8.909 -10.588 934 HB3 SER 28 HB1 SER 28 2.337 -9.296 -11.255 935 HG SER 28 HG SER 28 0.469 -8.771 -13.179 936 H ILE 29 HN ILE 29 -0.946 -11.751 -10.346 937 HA ILE 29 HA ILE 29 1.090 -13.061 -8.670 938 HB ILE 29 HB ILE 29 -1.675 -12.132 -7.936 939 HG12 ILE 29 HG12 ILE 29 1.009 -11.257 -6.873 940 HG13 ILE 29 HG11 ILE 29 0.018 -10.353 -8.022 941 HG21 ILE 29 HG21 ILE 29 -1.289 -14.179 -6.796 942 HG22 ILE 29 HG22 ILE 29 -1.133 -12.845 -5.652 943 HG23 ILE 29 HG23 ILE 29 0.314 -13.648 -6.280 944 HD11 ILE 29 HD11 ILE 29 -0.910 -11.165 -5.286 945 HD12 ILE 29 HD12 ILE 29 -1.716 -10.076 -6.426 946 HD13 ILE 29 HD13 ILE 29 -0.195 -9.594 -5.670 947 H ALA 30 HN ALA 30 1.124 -15.214 -8.734 948 HA ALA 30 HA ALA 30 -1.014 -16.637 -10.081 949 HB1 ALA 30 HB1 ALA 30 1.332 -17.175 -10.573 950 HB2 ALA 30 HB2 ALA 30 0.450 -18.568 -9.953 951 HB3 ALA 30 HB3 ALA 30 1.554 -17.686 -8.900 952 H ASP 31 HN ASP 31 -0.516 -15.572 -7.016 953 HA ASP 31 HA ASP 31 -1.746 -17.933 -5.764 954 HB2 ASP 31 HB2 ASP 31 0.540 -16.820 -4.995 955 HB3 ASP 31 HB1 ASP 31 -0.573 -15.750 -4.144 956 H GLU 32 HN GLU 32 -3.810 -17.752 -5.245 957 HA GLU 32 HA GLU 32 -5.310 -15.369 -5.366 958 HB2 GLU 32 HB2 GLU 32 -7.081 -16.674 -4.266 959 HB3 GLU 32 HB1 GLU 32 -6.323 -17.597 -5.559 960 HG2 GLU 32 HG2 GLU 32 -4.969 -18.793 -3.891 961 HG3 GLU 32 HG1 GLU 32 -5.775 -17.886 -2.613 962 H LYS 33 HN LYS 33 -3.314 -16.714 -2.875 963 HA LYS 33 HA LYS 33 -4.606 -15.412 -0.671 964 HB2 LYS 33 HB2 LYS 33 -1.858 -16.648 -0.884 965 HB3 LYS 33 HB1 LYS 33 -2.595 -16.091 0.601 966 HG2 LYS 33 HG2 LYS 33 -3.786 -17.919 0.838 967 HG3 LYS 33 HG1 LYS 33 -4.252 -17.952 -0.860 968 HD2 LYS 33 HD2 LYS 33 -2.040 -18.860 -1.417 969 HD3 LYS 33 HD1 LYS 33 -1.635 -18.885 0.305 970 HE2 LYS 33 HE2 LYS 33 -3.547 -20.383 0.692 971 HE3 LYS 33 HE1 LYS 33 -3.856 -20.398 -1.040 972 HZ1 LYS 33 HZ1 LYS 33 -1.387 -21.371 0.280 973 HZ2 LYS 33 HZ2 LYS 33 -1.672 -21.374 -1.384 974 HZ3 LYS 33 HZ3 LYS 33 -2.610 -22.344 -0.365 975 H ALA 34 HN ALA 34 -1.662 -14.822 -2.548 976 HA ALA 34 HA ALA 34 -1.138 -12.368 -1.190 977 HB1 ALA 34 HB1 ALA 34 -0.083 -13.462 -3.805 978 HB2 ALA 34 HB2 ALA 34 0.695 -13.556 -2.225 979 HB3 ALA 34 HB3 ALA 34 0.510 -11.995 -3.026 980 H ARG 35 HN ARG 35 -3.116 -13.375 -3.817 981 HA ARG 35 HA ARG 35 -3.404 -10.911 -5.199 982 HB2 ARG 35 HB2 ARG 35 -4.149 -13.386 -5.778 983 HB3 ARG 35 HB1 ARG 35 -5.644 -12.872 -5.002 984 HG2 ARG 35 HG2 ARG 35 -4.470 -11.147 -7.148 985 HG3 ARG 35 HG1 ARG 35 -5.286 -12.640 -7.609 986 HD2 ARG 35 HD2 ARG 35 -6.445 -10.329 -6.061 987 HD3 ARG 35 HD1 ARG 35 -6.832 -10.818 -7.721 988 HE ARG 35 HE ARG 35 -7.444 -13.031 -6.348 989 HH11 ARG 35 HH11 ARG 35 -8.256 -9.688 -5.754 990 HH12 ARG 35 HH12 ARG 35 -9.782 -10.050 -5.017 991 HH21 ARG 35 HH21 ARG 35 -9.446 -13.517 -5.353 992 HH22 ARG 35 HH22 ARG 35 -10.449 -12.225 -4.776 993 H LYS 36 HN LYS 36 -5.654 -12.563 -2.972 994 HA LYS 36 HA LYS 36 -7.424 -10.503 -2.579 995 HB2 LYS 36 HB2 LYS 36 -7.722 -11.560 -0.290 996 HB3 LYS 36 HB1 LYS 36 -8.018 -12.567 -1.699 997 HG2 LYS 36 HG2 LYS 36 -5.589 -13.140 -1.435 998 HG3 LYS 36 HG1 LYS 36 -5.779 -12.486 0.199 999 HD2 LYS 36 HD2 LYS 36 -7.474 -14.497 -1.056 1000 HD3 LYS 36 HD1 LYS 36 -6.203 -14.913 0.076 1001 HE2 LYS 36 HE2 LYS 36 -8.452 -13.029 0.748 1002 HE3 LYS 36 HE1 LYS 36 -8.574 -14.769 1.030 1003 HZ1 LYS 36 HZ1 LYS 36 -6.637 -12.874 2.240 1004 HZ2 LYS 36 HZ2 LYS 36 -6.529 -14.552 2.405 1005 HZ3 LYS 36 HZ3 LYS 36 -7.863 -13.729 3.030 1006 H VAL 37 HN VAL 37 -4.759 -11.355 -0.490 1007 HA VAL 37 HA VAL 37 -5.269 -9.421 1.429 1008 HB VAL 37 HB VAL 37 -3.116 -9.862 2.370 1009 HG11 VAL 37 HG11 VAL 37 -3.518 -12.543 1.293 1010 HG12 VAL 37 HG12 VAL 37 -5.051 -11.757 1.718 1011 HG13 VAL 37 HG13 VAL 37 -3.772 -11.942 2.941 1012 HG21 VAL 37 HG21 VAL 37 -2.415 -11.118 -0.288 1013 HG22 VAL 37 HG22 VAL 37 -1.425 -11.195 1.169 1014 HG23 VAL 37 HG23 VAL 37 -1.726 -9.643 0.388 1015 H ILE 38 HN ILE 38 -3.432 -9.080 -1.558 1016 HA ILE 38 HA ILE 38 -2.510 -6.498 -0.659 1017 HB ILE 38 HB ILE 38 -1.368 -8.242 -2.400 1018 HG12 ILE 38 HG12 ILE 38 -0.947 -5.278 -2.564 1019 HG13 ILE 38 HG11 ILE 38 -0.521 -6.179 -1.119 1020 HG21 ILE 38 HG21 ILE 38 -2.541 -6.032 -4.088 1021 HG22 ILE 38 HG22 ILE 38 -3.060 -7.719 -4.137 1022 HG23 ILE 38 HG23 ILE 38 -1.421 -7.283 -4.628 1023 HD11 ILE 38 HD11 ILE 38 0.818 -7.613 -2.861 1024 HD12 ILE 38 HD12 ILE 38 1.457 -6.105 -2.213 1025 HD13 ILE 38 HD13 ILE 38 0.708 -6.120 -3.801 1026 H VAL 39 HN VAL 39 -5.066 -7.751 -2.723 1027 HA VAL 39 HA VAL 39 -5.750 -5.164 -3.697 1028 HB VAL 39 HB VAL 39 -7.645 -6.022 -4.618 1029 HG11 VAL 39 HG11 VAL 39 -7.040 -8.242 -5.567 1030 HG12 VAL 39 HG12 VAL 39 -5.703 -8.305 -4.423 1031 HG13 VAL 39 HG13 VAL 39 -5.753 -7.036 -5.646 1032 HG21 VAL 39 HG21 VAL 39 -7.665 -8.343 -2.696 1033 HG22 VAL 39 HG22 VAL 39 -8.842 -8.044 -3.978 1034 HG23 VAL 39 HG23 VAL 39 -8.720 -6.933 -2.614 1035 H GLU 40 HN GLU 40 -6.999 -7.167 -1.070 1036 HA GLU 40 HA GLU 40 -8.771 -5.381 0.050 1037 HB2 GLU 40 HB2 GLU 40 -7.164 -7.636 1.194 1038 HB3 GLU 40 HB1 GLU 40 -8.365 -6.769 2.127 1039 HG2 GLU 40 HG2 GLU 40 -10.106 -7.503 0.823 1040 HG3 GLU 40 HG1 GLU 40 -9.080 -7.912 -0.528 1041 H LEU 41 HN LEU 41 -5.289 -5.555 0.350 1042 HA LEU 41 HA LEU 41 -5.305 -3.640 2.529 1043 HB2 LEU 41 HB2 LEU 41 -3.489 -5.540 1.600 1044 HB3 LEU 41 HB1 LEU 41 -2.728 -3.993 1.282 1045 HG LEU 41 HG LEU 41 -1.959 -4.544 3.400 1046 HD11 LEU 41 HD11 LEU 41 -2.862 -2.937 4.874 1047 HD12 LEU 41 HD12 LEU 41 -4.412 -2.941 4.042 1048 HD13 LEU 41 HD13 LEU 41 -2.985 -2.281 3.246 1049 HD21 LEU 41 HD21 LEU 41 -4.756 -5.402 4.112 1050 HD22 LEU 41 HD22 LEU 41 -3.368 -5.404 5.202 1051 HD23 LEU 41 HD23 LEU 41 -3.385 -6.463 3.790 1052 H MET 42 HN MET 42 -4.111 -3.629 -0.852 1053 HA MET 42 HA MET 42 -3.263 -0.938 -0.837 1054 HB2 MET 42 HB2 MET 42 -4.161 -2.640 -3.156 1055 HB3 MET 42 HB1 MET 42 -3.320 -1.093 -3.310 1056 HG2 MET 42 HG2 MET 42 -2.294 -3.663 -2.133 1057 HG3 MET 42 HG1 MET 42 -1.747 -2.841 -3.584 1058 HE1 MET 42 HE1 MET 42 1.287 -2.629 -1.142 1059 HE2 MET 42 HE2 MET 42 0.698 -3.227 -2.697 1060 HE3 MET 42 HE3 MET 42 0.098 -3.933 -1.195 1061 H ALA 43 HN ALA 43 -6.311 -2.438 -1.196 1062 HA ALA 43 HA ALA 43 -7.974 -0.573 -2.246 1063 HB1 ALA 43 HB1 ALA 43 -8.773 -2.673 -1.459 1064 HB2 ALA 43 HB2 ALA 43 -9.628 -1.409 -0.571 1065 HB3 ALA 43 HB3 ALA 43 -8.307 -2.294 0.197 1066 H TYR 44 HN TYR 44 -6.222 -0.442 0.784 1067 HA TYR 44 HA TYR 44 -7.476 2.154 1.425 1068 HB2 TYR 44 HB2 TYR 44 -7.629 0.621 3.288 1069 HB3 TYR 44 HB1 TYR 44 -5.949 0.186 3.097 1070 HD1 TYR 44 HD1 TYR 44 -8.258 2.399 4.721 1071 HD2 TYR 44 HD2 TYR 44 -4.165 1.914 3.727 1072 HE1 TYR 44 HE1 TYR 44 -7.666 4.011 6.472 1073 HE2 TYR 44 HE2 TYR 44 -3.546 3.534 5.466 1074 HH TYR 44 HH TYR 44 -4.557 5.383 6.719 1075 H GLU 45 HN GLU 45 -4.354 0.533 1.863 1076 HA GLU 45 HA GLU 45 -2.761 2.670 2.217 1077 HB2 GLU 45 HB2 GLU 45 -1.853 0.389 0.533 1078 HB3 GLU 45 HB1 GLU 45 -0.934 1.300 1.719 1079 HG2 GLU 45 HG2 GLU 45 -3.187 -0.565 2.297 1080 HG3 GLU 45 HG1 GLU 45 -1.489 -0.965 2.454 1081 H ASN 46 HN ASN 46 -4.044 1.536 -0.853 1082 HA ASN 46 HA ASN 46 -2.281 3.374 -2.266 1083 HB2 ASN 46 HB2 ASN 46 -3.646 0.815 -2.941 1084 HB3 ASN 46 HB1 ASN 46 -3.438 1.996 -4.231 1085 HD21 ASN 46 HD21 ASN 46 -1.961 0.689 -5.340 1086 HD22 ASN 46 HD22 ASN 46 -0.352 0.468 -4.774 1087 H ALA 47 HN ALA 47 -5.537 2.948 -1.246 1088 HA ALA 47 HA ALA 47 -6.935 4.079 -3.399 1089 HB1 ALA 47 HB1 ALA 47 -8.062 2.804 -1.679 1090 HB2 ALA 47 HB2 ALA 47 -8.766 4.419 -1.813 1091 HB3 ALA 47 HB3 ALA 47 -7.672 4.042 -0.484 1092 H ASN 48 HN ASN 48 -8.430 6.007 -2.863 1093 HA ASN 48 HA ASN 48 -6.921 8.369 -2.915 1094 HB2 ASN 48 HB2 ASN 48 -9.780 7.639 -2.805 1095 HB3 ASN 48 HB1 ASN 48 -9.383 9.244 -2.199 1096 HD21 ASN 48 HD21 ASN 48 -10.849 8.361 -4.614 1097 HD22 ASN 48 HD22 ASN 48 -10.016 9.115 -5.932 1098 HA PRO 49 HA PRO 49 -5.857 9.272 1.252 1099 HB2 PRO 49 HB2 PRO 49 -6.805 12.006 0.557 1100 HB3 PRO 49 HB1 PRO 49 -5.266 11.494 1.253 1101 HG2 PRO 49 HG2 PRO 49 -5.460 12.201 -1.318 1102 HG3 PRO 49 HG1 PRO 49 -4.385 10.892 -0.794 1103 HD2 PRO 49 HD2 PRO 49 -6.989 10.745 -2.228 1104 HD3 PRO 49 HD1 PRO 49 -5.589 9.654 -2.293 1105 H GLU 50 HN GLU 50 -8.945 10.319 -0.005 1106 HA GLU 50 HA GLU 50 -10.179 10.623 2.577 1107 HB2 GLU 50 HB2 GLU 50 -12.038 11.423 1.390 1108 HB3 GLU 50 HB1 GLU 50 -10.658 11.951 0.436 1109 HG2 GLU 50 HG2 GLU 50 -11.673 9.338 -0.296 1110 HG3 GLU 50 HG1 GLU 50 -12.786 10.663 -0.569 1111 H CYS 51 HN CYS 51 -9.859 8.239 0.070 1112 HA CYS 51 HA CYS 51 -12.269 6.854 0.782 1113 HB2 CYS 51 HB2 CYS 51 -10.122 6.352 -1.291 1114 HB3 CYS 51 HB1 CYS 51 -11.486 5.262 -1.023 1115 HG CYS 51 HG CYS 51 -11.643 8.510 -2.102 1116 H GLN 52 HN GLN 52 -8.801 6.389 1.071 1117 HA GLN 52 HA GLN 52 -9.050 3.908 2.468 1118 HB2 GLN 52 HB2 GLN 52 -6.747 4.193 3.075 1119 HB3 GLN 52 HB1 GLN 52 -6.930 4.662 1.392 1120 HG2 GLN 52 HG2 GLN 52 -6.981 7.023 2.105 1121 HG3 GLN 52 HG1 GLN 52 -6.675 6.500 3.760 1122 HE21 GLN 52 HE21 GLN 52 -5.043 4.288 2.803 1123 HE22 GLN 52 HE22 GLN 52 -3.533 4.950 2.337 1124 H SER 53 HN SER 53 -9.153 7.243 3.128 1125 HA SER 53 HA SER 53 -9.204 7.086 5.948 1126 HB2 SER 53 HB2 SER 53 -9.823 9.129 3.879 1127 HB3 SER 53 HB1 SER 53 -10.246 9.442 5.573 1128 HG SER 53 HG SER 53 -7.840 9.555 4.361 1129 H ALA 54 HN ALA 54 -11.561 6.618 3.448 1130 HA ALA 54 HA ALA 54 -13.765 6.506 5.288 1131 HB1 ALA 54 HB1 ALA 54 -14.226 6.900 2.978 1132 HB2 ALA 54 HB2 ALA 54 -14.896 5.326 3.405 1133 HB3 ALA 54 HB3 ALA 54 -13.373 5.430 2.512 1134 H ILE 55 HN ILE 55 -11.198 4.507 4.369 1135 HA ILE 55 HA ILE 55 -12.512 2.052 5.086 1136 HB ILE 55 HB ILE 55 -9.851 2.696 3.900 1137 HG12 ILE 55 HG12 ILE 55 -11.945 0.932 2.740 1138 HG13 ILE 55 HG11 ILE 55 -12.186 2.686 2.725 1139 HG21 ILE 55 HG21 ILE 55 -9.517 0.262 3.647 1140 HG22 ILE 55 HG22 ILE 55 -10.910 -0.006 4.694 1141 HG23 ILE 55 HG23 ILE 55 -9.470 0.793 5.327 1142 HD11 ILE 55 HD11 ILE 55 -9.684 1.384 1.678 1143 HD12 ILE 55 HD12 ILE 55 -10.294 3.031 1.404 1144 HD13 ILE 55 HD13 ILE 55 -11.139 1.646 0.691 1145 H LYS 56 HN LYS 56 -9.981 4.113 6.526 1146 HA LYS 56 HA LYS 56 -8.566 2.356 7.995 1147 HB2 LYS 56 HB2 LYS 56 -9.172 4.421 9.873 1148 HB3 LYS 56 HB1 LYS 56 -7.667 4.061 9.050 1149 HG2 LYS 56 HG2 LYS 56 -7.983 6.188 8.350 1150 HG3 LYS 56 HG1 LYS 56 -8.892 5.353 7.087 1151 HD2 LYS 56 HD2 LYS 56 -10.868 6.007 7.872 1152 HD3 LYS 56 HD1 LYS 56 -10.358 5.997 9.562 1153 HE2 LYS 56 HE2 LYS 56 -8.885 8.063 8.669 1154 HE3 LYS 56 HE1 LYS 56 -10.239 8.173 7.532 1155 HZ1 LYS 56 HZ1 LYS 56 -10.575 8.056 10.482 1156 HZ2 LYS 56 HZ2 LYS 56 -11.757 8.404 9.329 1157 HZ3 LYS 56 HZ3 LYS 56 -10.499 9.501 9.613 1158 HA PRO 57 HA PRO 57 -11.950 1.948 11.540 1159 HB2 PRO 57 HB2 PRO 57 -14.484 1.848 10.556 1160 HB3 PRO 57 HB1 PRO 57 -13.756 3.333 11.188 1161 HG2 PRO 57 HG2 PRO 57 -13.864 2.358 8.345 1162 HG3 PRO 57 HG1 PRO 57 -14.380 3.940 8.981 1163 HD2 PRO 57 HD2 PRO 57 -12.014 3.703 7.855 1164 HD3 PRO 57 HD1 PRO 57 -12.127 4.598 9.380 1165 H LEU 58 HN LEU 58 -12.236 0.790 8.246 1166 HA LEU 58 HA LEU 58 -13.086 -1.879 9.107 1167 HB2 LEU 58 HB2 LEU 58 -12.525 -1.245 6.270 1168 HB3 LEU 58 HB1 LEU 58 -13.774 -2.285 6.934 1169 HG LEU 58 HG LEU 58 -13.795 0.736 6.854 1170 HD11 LEU 58 HD11 LEU 58 -14.088 -0.138 4.673 1171 HD12 LEU 58 HD12 LEU 58 -15.692 0.302 5.269 1172 HD13 LEU 58 HD13 LEU 58 -15.188 -1.388 5.252 1173 HD21 LEU 58 HD21 LEU 58 -16.107 0.554 7.630 1174 HD22 LEU 58 HD22 LEU 58 -14.981 -0.104 8.817 1175 HD23 LEU 58 HD23 LEU 58 -15.921 -1.193 7.794 1176 H LYS 59 HN LYS 59 -10.459 0.017 8.238 1177 HA LYS 59 HA LYS 59 -8.763 -1.763 6.935 1178 HB2 LYS 59 HB2 LYS 59 -8.223 0.592 7.169 1179 HB3 LYS 59 HB1 LYS 59 -8.071 0.406 8.908 1180 HG2 LYS 59 HG2 LYS 59 -5.881 0.251 8.428 1181 HG3 LYS 59 HG1 LYS 59 -6.309 -1.420 8.090 1182 HD2 LYS 59 HD2 LYS 59 -6.183 0.770 6.054 1183 HD3 LYS 59 HD1 LYS 59 -4.927 -0.442 6.316 1184 HE2 LYS 59 HE2 LYS 59 -7.765 -0.938 5.413 1185 HE3 LYS 59 HE1 LYS 59 -6.318 -1.050 4.424 1186 HZ1 LYS 59 HZ1 LYS 59 -5.551 -2.873 5.815 1187 HZ2 LYS 59 HZ2 LYS 59 -7.053 -3.228 5.112 1188 HZ3 LYS 59 HZ3 LYS 59 -6.963 -2.779 6.739 1189 H GLY 60 HN GLY 60 -8.353 -3.751 7.553 1190 HA2 GLY 60 HA3 GLY 60 -7.092 -5.257 8.917 1191 HA3 GLY 60 HA2 GLY 60 -7.410 -4.213 10.295 1192 H LYS 61 HN LYS 61 -10.256 -3.949 9.352 1193 HA LYS 61 HA LYS 61 -11.198 -6.425 10.628 1194 HB2 LYS 61 HB2 LYS 61 -13.027 -4.126 10.228 1195 HB3 LYS 61 HB1 LYS 61 -12.840 -5.175 11.620 1196 HG2 LYS 61 HG2 LYS 61 -10.889 -3.021 10.884 1197 HG3 LYS 61 HG1 LYS 61 -12.225 -2.791 12.002 1198 HD2 LYS 61 HD2 LYS 61 -10.072 -4.871 12.346 1199 HD3 LYS 61 HD1 LYS 61 -10.031 -3.271 13.093 1200 HE2 LYS 61 HE2 LYS 61 -12.142 -3.745 14.218 1201 HE3 LYS 61 HE1 LYS 61 -12.177 -5.344 13.485 1202 HZ1 LYS 61 HZ1 LYS 61 -10.154 -4.338 15.406 1203 HZ2 LYS 61 HZ2 LYS 61 -10.089 -5.843 14.640 1204 HZ3 LYS 61 HZ3 LYS 61 -11.346 -5.498 15.713 1205 H VAL 62 HN VAL 62 -11.851 -7.869 9.121 1206 HA VAL 62 HA VAL 62 -13.794 -6.866 7.160 1207 HB VAL 62 HB VAL 62 -11.889 -7.767 5.963 1208 HG11 VAL 62 HG11 VAL 62 -11.213 -10.114 6.133 1209 HG12 VAL 62 HG12 VAL 62 -12.334 -10.332 7.481 1210 HG13 VAL 62 HG13 VAL 62 -10.956 -9.243 7.648 1211 HG21 VAL 62 HG21 VAL 62 -14.032 -8.126 4.943 1212 HG22 VAL 62 HG22 VAL 62 -14.275 -9.602 5.877 1213 HG23 VAL 62 HG23 VAL 62 -13.014 -9.536 4.646 1214 HA PRO 63 HA PRO 63 -16.887 -9.269 9.379 1215 HB2 PRO 63 HB2 PRO 63 -17.888 -9.541 6.588 1216 HB3 PRO 63 HB1 PRO 63 -18.772 -9.122 8.050 1217 HG2 PRO 63 HG2 PRO 63 -18.135 -7.233 6.312 1218 HG3 PRO 63 HG1 PRO 63 -17.984 -6.926 8.052 1219 HD2 PRO 63 HD2 PRO 63 -15.859 -7.486 6.033 1220 HD3 PRO 63 HD1 PRO 63 -15.819 -6.416 7.449 1221 H ALA 64 HN ALA 64 -16.991 -11.376 9.824 1222 HA ALA 64 HA ALA 64 -15.190 -13.183 8.653 1223 HB1 ALA 64 HB1 ALA 64 -15.945 -13.373 10.970 1224 HB2 ALA 64 HB2 ALA 64 -16.222 -14.870 10.079 1225 HB3 ALA 64 HB3 ALA 64 -17.567 -13.780 10.411 1226 H GLY 65 HN GLY 65 -15.362 -13.877 6.635 1227 HA2 GLY 65 HA3 GLY 65 -16.373 -15.523 5.193 1228 HA3 GLY 65 HA2 GLY 65 -17.944 -15.020 5.797 1229 H SER 66 HN SER 66 -16.836 -12.128 5.537 1230 HA SER 66 HA SER 66 -17.751 -11.827 2.781 1231 HB2 SER 66 HB2 SER 66 -18.396 -10.344 4.881 1232 HB3 SER 66 HB1 SER 66 -16.897 -9.518 4.455 1233 HG SER 66 HG SER 66 -18.338 -8.452 3.279 1234 H ASP 67 HN ASP 67 -16.621 -9.743 1.851 1235 HA ASP 67 HA ASP 67 -13.740 -10.316 1.617 1236 HB2 ASP 67 HB2 ASP 67 -15.604 -10.255 -0.285 1237 HB3 ASP 67 HB1 ASP 67 -15.249 -8.538 -0.232 1238 H VAL 68 HN VAL 68 -12.266 -8.493 1.903 1239 HA VAL 68 HA VAL 68 -13.462 -6.474 3.568 1240 HB VAL 68 HB VAL 68 -11.450 -6.011 4.377 1241 HG11 VAL 68 HG11 VAL 68 -10.491 -8.291 2.679 1242 HG12 VAL 68 HG12 VAL 68 -11.289 -8.429 4.243 1243 HG13 VAL 68 HG13 VAL 68 -9.709 -7.656 4.125 1244 HG21 VAL 68 HG21 VAL 68 -9.454 -5.531 2.979 1245 HG22 VAL 68 HG22 VAL 68 -10.868 -4.536 2.616 1246 HG23 VAL 68 HG23 VAL 68 -10.436 -5.876 1.551 1247 H ILE 69 HN ILE 69 -12.434 -6.825 0.295 1248 HA ILE 69 HA ILE 69 -12.275 -4.124 -0.407 1249 HB ILE 69 HB ILE 69 -12.974 -6.548 -2.027 1250 HG12 ILE 69 HG12 ILE 69 -10.708 -6.655 -1.457 1251 HG13 ILE 69 HG11 ILE 69 -10.690 -5.883 -3.037 1252 HG21 ILE 69 HG21 ILE 69 -12.589 -5.054 -4.036 1253 HG22 ILE 69 HG22 ILE 69 -12.702 -3.676 -2.939 1254 HG23 ILE 69 HG23 ILE 69 -14.080 -4.756 -3.143 1255 HD11 ILE 69 HD11 ILE 69 -10.519 -3.693 -1.920 1256 HD12 ILE 69 HD12 ILE 69 -9.150 -4.767 -1.615 1257 HD13 ILE 69 HD13 ILE 69 -10.395 -4.538 -0.378 1258 H SER 70 HN SER 70 -14.939 -6.370 -0.541 1259 HA SER 70 HA SER 70 -16.898 -4.786 -1.633 1260 HB2 SER 70 HB2 SER 70 -17.179 -7.182 -1.121 1261 HB3 SER 70 HB1 SER 70 -17.228 -6.813 0.601 1262 HG SER 70 HG SER 70 -19.055 -5.734 -1.292 1263 H GLU 71 HN GLU 71 -15.624 -4.742 1.635 1264 HA GLU 71 HA GLU 71 -17.644 -2.929 2.619 1265 HB2 GLU 71 HB2 GLU 71 -15.136 -3.615 4.087 1266 HB3 GLU 71 HB1 GLU 71 -16.766 -3.395 4.714 1267 HG2 GLU 71 HG2 GLU 71 -16.229 -5.673 2.891 1268 HG3 GLU 71 HG1 GLU 71 -15.667 -5.771 4.545 1269 H TYR 72 HN TYR 72 -14.384 -2.911 1.493 1270 HA TYR 72 HA TYR 72 -13.702 -0.326 2.480 1271 HB2 TYR 72 HB2 TYR 72 -12.445 -2.258 0.543 1272 HB3 TYR 72 HB1 TYR 72 -11.797 -0.638 0.755 1273 HD1 TYR 72 HD1 TYR 72 -13.249 -2.178 3.681 1274 HD2 TYR 72 HD2 TYR 72 -9.674 -1.739 1.436 1275 HE1 TYR 72 HE1 TYR 72 -11.948 -2.962 5.598 1276 HE2 TYR 72 HE2 TYR 72 -8.360 -2.537 3.353 1277 HH TYR 72 HH TYR 72 -9.902 -3.890 6.172 1278 H VAL 73 HN VAL 73 -14.869 -1.698 -0.515 1279 HA VAL 73 HA VAL 73 -14.885 0.725 -1.968 1280 HB VAL 73 HB VAL 73 -16.049 -0.265 -3.676 1281 HG11 VAL 73 HG11 VAL 73 -13.995 -1.373 -3.517 1282 HG12 VAL 73 HG12 VAL 73 -15.213 -2.562 -3.968 1283 HG13 VAL 73 HG13 VAL 73 -14.617 -2.494 -2.310 1284 HG21 VAL 73 HG21 VAL 73 -17.992 -0.927 -2.228 1285 HG22 VAL 73 HG22 VAL 73 -17.162 -2.467 -1.982 1286 HG23 VAL 73 HG23 VAL 73 -17.641 -1.965 -3.611 1287 H LYS 74 HN LYS 74 -17.027 -0.970 0.169 1288 HA LYS 74 HA LYS 74 -19.354 0.614 -0.129 1289 HB2 LYS 74 HB2 LYS 74 -18.595 -1.654 1.287 1290 HB3 LYS 74 HB1 LYS 74 -18.884 -0.448 2.533 1291 HG2 LYS 74 HG2 LYS 74 -20.973 -1.305 2.401 1292 HG3 LYS 74 HG1 LYS 74 -21.108 -0.068 1.150 1293 HD2 LYS 74 HD2 LYS 74 -20.345 -2.935 0.623 1294 HD3 LYS 74 HD1 LYS 74 -21.994 -2.315 0.498 1295 HE2 LYS 74 HE2 LYS 74 -21.208 -0.695 -1.201 1296 HE3 LYS 74 HE1 LYS 74 -19.605 -1.421 -1.108 1297 HZ1 LYS 74 HZ1 LYS 74 -22.084 -2.834 -1.923 1298 HZ2 LYS 74 HZ2 LYS 74 -20.536 -3.508 -1.867 1299 HZ3 LYS 74 HZ3 LYS 74 -20.884 -2.281 -2.974 1300 H ALA 75 HN ALA 75 -16.427 0.828 1.735 1301 HA ALA 75 HA ALA 75 -17.178 2.853 3.555 1302 HB1 ALA 75 HB1 ALA 75 -15.170 1.531 3.850 1303 HB2 ALA 75 HB2 ALA 75 -14.737 3.236 3.742 1304 HB3 ALA 75 HB3 ALA 75 -14.494 2.170 2.354 1305 H CYS 76 HN CYS 76 -15.718 2.889 0.378 1306 HA CYS 76 HA CYS 76 -15.851 5.781 0.234 1307 HB2 CYS 76 HB2 CYS 76 -14.737 3.886 -1.811 1308 HB3 CYS 76 HB1 CYS 76 -14.269 5.545 -1.471 1309 HG CYS 76 HG CYS 76 -13.528 2.763 0.336 1310 H ASP 77 HN ASP 77 -17.998 3.476 -0.204 1311 HA ASP 77 HA ASP 77 -19.001 3.834 -2.795 1312 HB2 ASP 77 HB2 ASP 77 -19.727 1.941 -1.603 1313 HB3 ASP 77 HB1 ASP 77 -20.242 2.875 -0.208 1314 H GLY 78 HN GLY 78 -19.399 5.672 0.146 1315 HA2 GLY 78 HA3 GLY 78 -21.289 7.484 -1.143 1316 HA3 GLY 78 HA2 GLY 78 -20.732 7.576 0.521 1317 H ILE 79 HN ILE 79 -18.123 7.079 -1.502 1318 HA ILE 79 HA ILE 79 -17.439 9.906 -1.376 1319 HB ILE 79 HB ILE 79 -15.687 7.506 -1.718 1320 HG12 ILE 79 HG12 ILE 79 -15.842 9.539 0.517 1321 HG13 ILE 79 HG11 ILE 79 -16.518 7.910 0.582 1322 HG21 ILE 79 HG21 ILE 79 -13.784 9.014 -1.695 1323 HG22 ILE 79 HG22 ILE 79 -14.871 10.398 -1.611 1324 HG23 ILE 79 HG23 ILE 79 -14.853 9.378 -3.050 1325 HD11 ILE 79 HD11 ILE 79 -14.316 8.255 1.729 1326 HD12 ILE 79 HD12 ILE 79 -13.603 8.467 0.133 1327 HD13 ILE 79 HD13 ILE 79 -14.366 6.936 0.562 1328 H GLY 80 HN GLY 80 -17.410 11.055 -3.094 1329 HA2 GLY 80 HA3 GLY 80 -15.939 10.473 -5.361 1330 HA3 GLY 80 HA2 GLY 80 -17.625 10.166 -5.749 1331 H GLY 81 HN GLY 81 -18.951 11.974 -4.371 1332 HA2 GLY 81 HA3 GLY 81 -17.775 14.610 -4.821 1333 HA3 GLY 81 HA2 GLY 81 -19.223 14.223 -5.746 1334 H ALA 82 HN ALA 82 -18.963 16.314 -3.824 1335 HA ALA 82 HA ALA 82 -20.157 17.288 -2.167 1336 HB1 ALA 82 HB1 ALA 82 -22.018 14.953 -2.495 1337 HB2 ALA 82 HB2 ALA 82 -22.056 16.440 -3.441 1338 HB3 ALA 82 HB3 ALA 82 -22.388 16.487 -1.709 1339 H MET 83 HN MET 83 -20.944 13.944 -1.246 1340 HA MET 83 HA MET 83 -20.358 14.344 1.477 1341 HB2 MET 83 HB2 MET 83 -20.423 11.758 -0.093 1342 HB3 MET 83 HB1 MET 83 -20.443 11.881 1.662 1343 HG2 MET 83 HG2 MET 83 -22.565 13.116 1.523 1344 HG3 MET 83 HG1 MET 83 -22.550 12.902 -0.224 1345 HE1 MET 83 HE1 MET 83 -24.988 11.841 -0.091 1346 HE2 MET 83 HE2 MET 83 -24.983 12.042 1.659 1347 HE3 MET 83 HE3 MET 83 -25.406 10.484 0.952 1348 H HIS 84 HN HIS 84 -18.469 13.046 -1.185 1349 HA HIS 84 HA HIS 84 -16.116 12.317 0.112 1350 HB2 HIS 84 HB2 HIS 84 -16.274 11.834 -2.199 1351 HB3 HIS 84 HB1 HIS 84 -16.745 13.470 -2.610 1352 HD1 HIS 84 HD1 HIS 84 -14.985 13.733 -4.411 1353 HD2 HIS 84 HD2 HIS 84 -13.385 12.771 -0.689 1354 HE1 HIS 84 HE1 HIS 84 -12.505 14.074 -4.627 1355 HE2 HIS 84 HE2 HIS 84 -11.545 13.294 -2.438 1356 H LYS 85 HN LYS 85 -17.370 15.523 -0.610 1357 HA LYS 85 HA LYS 85 -14.866 16.821 0.039 1358 HB2 LYS 85 HB2 LYS 85 -17.588 18.024 -0.483 1359 HB3 LYS 85 HB1 LYS 85 -16.060 18.895 -0.423 1360 HG2 LYS 85 HG2 LYS 85 -16.768 16.760 -2.425 1361 HG3 LYS 85 HG1 LYS 85 -16.819 18.498 -2.717 1362 HD2 LYS 85 HD2 LYS 85 -14.443 18.674 -2.384 1363 HD3 LYS 85 HD1 LYS 85 -14.345 16.979 -1.907 1364 HE2 LYS 85 HE2 LYS 85 -14.892 16.238 -4.096 1365 HE3 LYS 85 HE1 LYS 85 -15.327 17.873 -4.603 1366 HZ1 LYS 85 HZ1 LYS 85 -13.148 17.247 -5.434 1367 HZ2 LYS 85 HZ2 LYS 85 -12.590 16.983 -3.859 1368 HZ3 LYS 85 HZ3 LYS 85 -13.021 18.540 -4.354 1369 H ALA 86 HN ALA 86 -18.032 16.327 1.524 1370 HA ALA 86 HA ALA 86 -17.604 17.824 3.877 1371 HB1 ALA 86 HB1 ALA 86 -19.783 16.785 3.087 1372 HB2 ALA 86 HB2 ALA 86 -19.431 16.631 4.808 1373 HB3 ALA 86 HB3 ALA 86 -19.174 15.253 3.732 1374 H MET 87 HN MET 87 -17.160 14.422 3.147 1375 HA MET 87 HA MET 87 -16.072 13.756 5.698 1376 HB2 MET 87 HB2 MET 87 -16.023 12.143 3.138 1377 HB3 MET 87 HB1 MET 87 -15.846 11.529 4.784 1378 HG2 MET 87 HG2 MET 87 -18.199 12.671 5.095 1379 HG3 MET 87 HG1 MET 87 -18.272 12.466 3.352 1380 HE1 MET 87 HE1 MET 87 -18.342 10.196 2.095 1381 HE2 MET 87 HE2 MET 87 -18.061 8.632 2.859 1382 HE3 MET 87 HE3 MET 87 -16.755 9.813 2.760 1383 H LEU 88 HN LEU 88 -14.801 15.130 2.908 1384 HA LEU 88 HA LEU 88 -12.197 14.167 2.806 1385 HB2 LEU 88 HB2 LEU 88 -13.571 16.016 1.448 1386 HB3 LEU 88 HB1 LEU 88 -12.621 17.077 2.464 1387 HG LEU 88 HG LEU 88 -10.805 16.814 1.182 1388 HD11 LEU 88 HD11 LEU 88 -9.881 14.650 0.528 1389 HD12 LEU 88 HD12 LEU 88 -11.354 13.846 1.065 1390 HD13 LEU 88 HD13 LEU 88 -10.310 14.650 2.237 1391 HD21 LEU 88 HD21 LEU 88 -12.738 15.260 -0.513 1392 HD22 LEU 88 HD22 LEU 88 -11.206 15.930 -1.078 1393 HD23 LEU 88 HD23 LEU 88 -12.494 17.006 -0.535 1394 H MET 89 HN MET 89 -13.617 16.681 4.860 1395 HA MET 89 HA MET 89 -11.080 17.330 6.069 1396 HB2 MET 89 HB2 MET 89 -12.851 19.020 5.735 1397 HB3 MET 89 HB1 MET 89 -13.883 18.147 6.857 1398 HG2 MET 89 HG2 MET 89 -12.281 18.557 8.652 1399 HG3 MET 89 HG1 MET 89 -11.249 19.439 7.525 1400 HE1 MET 89 HE1 MET 89 -13.481 22.527 6.623 1401 HE2 MET 89 HE2 MET 89 -13.427 20.991 5.761 1402 HE3 MET 89 HE3 MET 89 -11.937 21.717 6.362 1403 H ALA 90 HN ALA 90 -13.541 15.038 6.586 1404 HA ALA 90 HA ALA 90 -13.014 14.764 9.443 1405 HB1 ALA 90 HB1 ALA 90 -14.904 13.251 9.453 1406 HB2 ALA 90 HB2 ALA 90 -14.945 13.243 7.686 1407 HB3 ALA 90 HB3 ALA 90 -15.339 14.720 8.575 1408 H GLN 91 HN GLN 91 -12.772 12.872 6.476 1409 HA GLN 91 HA GLN 91 -11.705 10.633 7.992 1410 HB2 GLN 91 HB2 GLN 91 -12.430 10.864 5.077 1411 HB3 GLN 91 HB1 GLN 91 -11.962 9.385 5.905 1412 HG2 GLN 91 HG2 GLN 91 -13.895 9.514 7.320 1413 HG3 GLN 91 HG1 GLN 91 -14.348 11.044 6.580 1414 HE21 GLN 91 HE21 GLN 91 -13.604 10.310 3.943 1415 HE22 GLN 91 HE22 GLN 91 -14.732 9.146 3.403 1416 H LEU 92 HN LEU 92 -10.760 12.512 5.089 1417 HA LEU 92 HA LEU 92 -8.206 11.560 4.714 1418 HB2 LEU 92 HB2 LEU 92 -9.640 13.514 3.593 1419 HB3 LEU 92 HB1 LEU 92 -8.624 14.510 4.609 1420 HG LEU 92 HG LEU 92 -7.913 12.901 2.206 1421 HD11 LEU 92 HD11 LEU 92 -8.342 15.255 1.968 1422 HD12 LEU 92 HD12 LEU 92 -6.632 14.927 1.690 1423 HD13 LEU 92 HD13 LEU 92 -7.161 15.627 3.219 1424 HD21 LEU 92 HD21 LEU 92 -5.518 13.082 2.761 1425 HD22 LEU 92 HD22 LEU 92 -6.378 12.003 3.860 1426 HD23 LEU 92 HD23 LEU 92 -5.949 13.633 4.380 1427 H GLU 93 HN GLU 93 -9.564 13.741 7.002 1428 HA GLU 93 HA GLU 93 -8.581 15.310 8.435 1429 HB2 GLU 93 HB2 GLU 93 -8.195 13.969 10.550 1430 HB3 GLU 93 HB1 GLU 93 -9.753 13.772 9.749 1431 HG2 GLU 93 HG2 GLU 93 -9.108 11.662 8.863 1432 HG3 GLU 93 HG1 GLU 93 -7.443 11.879 9.377 Start of MODEL 6 1 H2 PRO 1 HT1 PRO 1 -4.937 -3.731 13.429 2 H3 PRO 1 HT2 PRO 1 -5.241 -2.223 13.980 3 HA PRO 1 HA PRO 1 -6.069 -2.079 11.980 4 HB2 PRO 1 HB2 PRO 1 -4.019 -1.083 10.576 5 HB3 PRO 1 HB1 PRO 1 -4.660 -0.236 11.983 6 HG2 PRO 1 HG2 PRO 1 -2.130 -1.679 11.684 7 HG3 PRO 1 HG1 PRO 1 -2.606 -0.492 12.910 8 HD2 PRO 1 HD2 PRO 1 -2.617 -3.404 13.050 9 HD3 PRO 1 HD1 PRO 1 -2.842 -2.224 14.357 10 H SER 2 HN SER 2 -4.269 -2.221 9.537 11 HA SER 2 HA SER 2 -4.303 -4.973 8.868 12 HB2 SER 2 HB2 SER 2 -2.461 -2.825 7.780 13 HB3 SER 2 HB1 SER 2 -2.905 -4.332 6.990 14 HG SER 2 HG SER 2 -4.057 -2.048 6.709 15 H PHE 3 HN PHE 3 -2.022 -6.035 8.305 16 HA PHE 3 HA PHE 3 -0.304 -5.838 10.585 17 HB2 PHE 3 HB2 PHE 3 1.244 -6.955 8.599 18 HB3 PHE 3 HB1 PHE 3 0.241 -7.861 9.727 19 HD1 PHE 3 HD1 PHE 3 0.849 -6.901 6.331 20 HD2 PHE 3 HD2 PHE 3 -2.058 -8.570 8.961 21 HE1 PHE 3 HE1 PHE 3 -0.350 -7.866 4.424 22 HE2 PHE 3 HE2 PHE 3 -3.273 -9.508 7.042 23 HZ PHE 3 HZ PHE 3 -2.414 -9.158 4.763 24 H ASN 4 HN ASN 4 -0.191 -4.819 7.235 25 HA ASN 4 HA ASN 4 2.481 -3.788 7.548 26 HB2 ASN 4 HB2 ASN 4 2.341 -3.453 5.132 27 HB3 ASN 4 HB1 ASN 4 1.857 -5.087 5.580 28 HD21 ASN 4 HD21 ASN 4 0.624 -1.892 4.744 29 HD22 ASN 4 HD22 ASN 4 -0.894 -2.452 4.124 30 H THR 5 HN THR 5 -0.345 -2.393 8.345 31 HA THR 5 HA THR 5 -0.412 -0.015 6.806 32 HB THR 5 HB THR 5 -1.465 0.764 9.153 33 HG1 THR 5 HG1 THR 5 -1.148 -1.052 10.336 34 HG21 THR 5 HG21 THR 5 -2.716 -0.959 7.040 35 HG22 THR 5 HG22 THR 5 -2.692 0.804 7.117 36 HG23 THR 5 HG23 THR 5 -3.630 -0.121 8.292 37 H VAL 6 HN VAL 6 1.897 -1.069 9.010 38 HA VAL 6 HA VAL 6 2.589 1.460 10.123 39 HB VAL 6 HB VAL 6 4.417 0.409 11.127 40 HG11 VAL 6 HG11 VAL 6 2.368 -0.501 12.004 41 HG12 VAL 6 HG12 VAL 6 3.617 -1.746 11.994 42 HG13 VAL 6 HG13 VAL 6 2.358 -1.751 10.759 43 HG21 VAL 6 HG21 VAL 6 4.311 -1.865 9.158 44 HG22 VAL 6 HG22 VAL 6 5.563 -1.539 10.366 45 HG23 VAL 6 HG23 VAL 6 5.364 -0.458 8.979 46 H ARG 7 HN ARG 7 3.912 3.003 9.229 47 HA ARG 7 HA ARG 7 5.660 2.188 7.117 48 HB2 ARG 7 HB2 ARG 7 4.689 3.824 5.476 49 HB3 ARG 7 HB1 ARG 7 3.872 2.308 5.764 50 HG2 ARG 7 HG2 ARG 7 2.713 4.119 7.521 51 HG3 ARG 7 HG1 ARG 7 2.862 4.940 5.962 52 HD2 ARG 7 HD2 ARG 7 1.789 3.054 4.858 53 HD3 ARG 7 HD1 ARG 7 1.652 2.213 6.395 54 HE ARG 7 HE ARG 7 0.158 4.066 7.097 55 HH11 ARG 7 HH11 ARG 7 0.643 3.428 3.693 56 HH12 ARG 7 HH12 ARG 7 -0.829 4.189 3.206 57 HH21 ARG 7 HH21 ARG 7 -1.779 5.104 6.457 58 HH22 ARG 7 HH22 ARG 7 -2.203 5.157 4.778 59 H GLN 8 HN GLN 8 6.939 3.764 6.225 60 HA GLN 8 HA GLN 8 8.508 5.164 7.874 61 HB2 GLN 8 HB2 GLN 8 8.144 4.875 5.078 62 HB3 GLN 8 HB1 GLN 8 8.442 6.581 5.392 63 HG2 GLN 8 HG2 GLN 8 10.480 6.024 6.580 64 HG3 GLN 8 HG1 GLN 8 10.173 4.307 6.328 65 HE21 GLN 8 HE21 GLN 8 12.427 5.922 5.502 66 HE22 GLN 8 HE22 GLN 8 12.493 5.799 3.768 67 H GLY 9 HN GLY 9 8.096 6.704 9.262 68 HA2 GLY 9 HA3 GLY 9 6.159 8.799 8.674 69 HA3 GLY 9 HA2 GLY 9 7.035 8.568 10.178 70 H SER 10 HN SER 10 7.915 10.559 10.462 71 HA SER 10 HA SER 10 8.917 12.228 8.460 72 HB2 SER 10 HB2 SER 10 10.201 13.268 10.442 73 HB3 SER 10 HB1 SER 10 8.439 13.229 10.538 74 HG SER 10 HG SER 10 9.786 11.016 11.548 75 H LYS 11 HN LYS 11 10.289 11.305 7.038 76 HA LYS 11 HA LYS 11 12.000 10.093 6.158 77 HB2 LYS 11 HB2 LYS 11 14.153 11.055 6.534 78 HB3 LYS 11 HB1 LYS 11 12.982 12.349 6.539 79 HG2 LYS 11 HG2 LYS 11 13.093 12.512 8.903 80 HG3 LYS 11 HG1 LYS 11 14.093 11.073 9.026 81 HD2 LYS 11 HD2 LYS 11 15.814 12.298 7.661 82 HD3 LYS 11 HD1 LYS 11 14.832 13.749 7.867 83 HE2 LYS 11 HE2 LYS 11 15.055 13.605 10.268 84 HE3 LYS 11 HE1 LYS 11 15.939 12.088 10.119 85 HZ1 LYS 11 HZ1 LYS 11 17.465 13.885 10.471 86 HZ2 LYS 11 HZ2 LYS 11 16.842 14.748 9.161 87 HZ3 LYS 11 HZ3 LYS 11 17.671 13.297 8.898 88 H GLU 12 HN GLU 12 10.781 8.590 8.131 89 HA GLU 12 HA GLU 12 12.397 7.509 10.121 90 HB2 GLU 12 HB2 GLU 12 9.986 7.154 9.947 91 HB3 GLU 12 HB1 GLU 12 10.201 6.235 8.473 92 HG2 GLU 12 HG2 GLU 12 11.362 4.489 9.718 93 HG3 GLU 12 HG1 GLU 12 11.177 5.432 11.200 94 HA PRO 13 HA PRO 13 15.593 5.302 7.928 95 HB2 PRO 13 HB2 PRO 13 15.259 3.188 9.952 96 HB3 PRO 13 HB1 PRO 13 16.700 4.110 9.536 97 HG2 PRO 13 HG2 PRO 13 15.308 4.506 11.822 98 HG3 PRO 13 HG1 PRO 13 16.208 5.785 11.000 99 HD2 PRO 13 HD2 PRO 13 13.293 5.341 11.168 100 HD3 PRO 13 HD1 PRO 13 14.194 6.846 10.927 101 H TYR 14 HN TYR 14 15.291 4.063 6.186 102 HA TYR 14 HA TYR 14 12.679 3.068 5.836 103 HB2 TYR 14 HB2 TYR 14 13.842 4.185 4.021 104 HB3 TYR 14 HB1 TYR 14 15.031 2.889 3.967 105 HD1 TYR 14 HD1 TYR 14 14.142 0.544 3.585 106 HD2 TYR 14 HD2 TYR 14 11.925 4.028 2.688 107 HE1 TYR 14 HE1 TYR 14 12.769 -0.771 2.069 108 HE2 TYR 14 HE2 TYR 14 10.515 2.737 1.146 109 HH TYR 14 HH TYR 14 10.238 0.747 0.149 110 HA PRO 15 HA PRO 15 14.792 -1.313 5.351 111 HB2 PRO 15 HB2 PRO 15 17.001 -1.062 7.277 112 HB3 PRO 15 HB1 PRO 15 16.972 -1.855 5.707 113 HG2 PRO 15 HG2 PRO 15 18.254 0.469 6.133 114 HG3 PRO 15 HG1 PRO 15 17.530 0.051 4.583 115 HD2 PRO 15 HD2 PRO 15 16.600 1.967 6.649 116 HD3 PRO 15 HD1 PRO 15 16.373 1.989 4.894 117 H ASP 16 HN ASP 16 14.542 0.734 7.989 118 HA ASP 16 HA ASP 16 13.882 -1.324 9.920 119 HB2 ASP 16 HB2 ASP 16 14.361 1.622 10.068 120 HB3 ASP 16 HB1 ASP 16 13.446 0.848 11.353 121 H PHE 17 HN PHE 17 12.384 1.383 8.232 122 HA PHE 17 HA PHE 17 9.816 1.234 9.295 123 HB2 PHE 17 HB2 PHE 17 9.649 2.989 7.866 124 HB3 PHE 17 HB1 PHE 17 11.106 2.480 7.022 125 HD1 PHE 17 HD1 PHE 17 10.992 1.534 4.879 126 HD2 PHE 17 HD2 PHE 17 7.452 1.988 7.175 127 HE1 PHE 17 HE1 PHE 17 9.649 0.921 2.919 128 HE2 PHE 17 HE2 PHE 17 6.093 1.389 5.213 129 HZ PHE 17 HZ PHE 17 7.193 0.854 3.081 130 H VAL 18 HN VAL 18 11.319 -0.486 6.626 131 HA VAL 18 HA VAL 18 8.966 -1.996 6.052 132 HB VAL 18 HB VAL 18 10.299 -1.617 4.165 133 HG11 VAL 18 HG11 VAL 18 12.621 -2.728 5.733 134 HG12 VAL 18 HG12 VAL 18 12.380 -1.035 5.290 135 HG13 VAL 18 HG13 VAL 18 12.663 -2.247 4.030 136 HG21 VAL 18 HG21 VAL 18 11.138 -3.908 3.574 137 HG22 VAL 18 HG22 VAL 18 9.454 -3.813 4.097 138 HG23 VAL 18 HG23 VAL 18 10.697 -4.395 5.216 139 H ALA 19 HN ALA 19 11.965 -2.574 7.839 140 HA ALA 19 HA ALA 19 11.715 -5.310 8.259 141 HB1 ALA 19 HB1 ALA 19 13.673 -3.972 8.963 142 HB2 ALA 19 HB2 ALA 19 13.076 -5.029 10.241 143 HB3 ALA 19 HB3 ALA 19 12.715 -3.303 10.283 144 H ARG 20 HN ARG 20 10.027 -2.664 9.923 145 HA ARG 20 HA ARG 20 8.800 -4.554 11.732 146 HB2 ARG 20 HB2 ARG 20 7.452 -2.640 12.533 147 HB3 ARG 20 HB1 ARG 20 9.177 -2.341 12.631 148 HG2 ARG 20 HG2 ARG 20 9.131 -0.750 10.963 149 HG3 ARG 20 HG1 ARG 20 7.634 -1.379 10.264 150 HD2 ARG 20 HD2 ARG 20 6.336 -0.508 12.038 151 HD3 ARG 20 HD1 ARG 20 7.759 -0.158 13.002 152 HE ARG 20 HE ARG 20 8.176 1.424 10.901 153 HH11 ARG 20 HH11 ARG 20 5.307 0.875 12.821 154 HH12 ARG 20 HH12 ARG 20 4.688 2.478 12.591 155 HH21 ARG 20 HH21 ARG 20 7.389 3.555 10.627 156 HH22 ARG 20 HH22 ARG 20 5.865 3.996 11.341 157 H LEU 21 HN LEU 21 8.218 -2.941 8.755 158 HA LEU 21 HA LEU 21 5.549 -3.462 8.290 159 HB2 LEU 21 HB2 LEU 21 7.392 -2.251 6.888 160 HB3 LEU 21 HB1 LEU 21 7.659 -3.825 6.180 161 HG LEU 21 HG LEU 21 5.605 -3.820 5.077 162 HD11 LEU 21 HD11 LEU 21 3.857 -2.096 5.493 163 HD12 LEU 21 HD12 LEU 21 4.796 -1.565 6.893 164 HD13 LEU 21 HD13 LEU 21 4.124 -3.195 6.848 165 HD21 LEU 21 HD21 LEU 21 7.153 -2.321 4.040 166 HD22 LEU 21 HD22 LEU 21 6.667 -1.015 5.121 167 HD23 LEU 21 HD23 LEU 21 5.530 -1.636 3.926 168 H GLN 22 HN GLN 22 8.398 -5.449 7.822 169 HA GLN 22 HA GLN 22 7.078 -7.753 6.869 170 HB2 GLN 22 HB2 GLN 22 9.720 -7.641 8.280 171 HB3 GLN 22 HB1 GLN 22 9.140 -8.840 7.101 172 HG2 GLN 22 HG2 GLN 22 8.995 -6.752 5.572 173 HG3 GLN 22 HG1 GLN 22 10.133 -6.076 6.698 174 HE21 GLN 22 HE21 GLN 22 11.438 -5.971 4.785 175 HE22 GLN 22 HE22 GLN 22 12.420 -7.336 4.384 176 H ASP 23 HN ASP 23 8.581 -6.919 9.917 177 HA ASP 23 HA ASP 23 8.149 -9.197 11.371 178 HB2 ASP 23 HB2 ASP 23 7.996 -6.325 12.077 179 HB3 ASP 23 HB1 ASP 23 7.721 -7.544 13.308 180 H VAL 24 HN VAL 24 5.849 -6.530 10.906 181 HA VAL 24 HA VAL 24 4.015 -7.860 12.640 182 HB VAL 24 HB VAL 24 4.086 -5.420 12.695 183 HG11 VAL 24 HG11 VAL 24 3.251 -4.107 10.807 184 HG12 VAL 24 HG12 VAL 24 3.099 -5.587 9.859 185 HG13 VAL 24 HG13 VAL 24 4.689 -5.032 10.379 186 HG21 VAL 24 HG21 VAL 24 1.634 -4.960 12.387 187 HG22 VAL 24 HG22 VAL 24 1.996 -6.394 13.354 188 HG23 VAL 24 HG23 VAL 24 1.495 -6.572 11.674 189 H ALA 25 HN ALA 25 4.631 -7.590 9.261 190 HA ALA 25 HA ALA 25 2.122 -8.557 8.312 191 HB1 ALA 25 HB1 ALA 25 4.866 -8.748 7.048 192 HB2 ALA 25 HB2 ALA 25 3.715 -7.435 6.805 193 HB3 ALA 25 HB3 ALA 25 3.335 -9.057 6.230 194 H GLN 26 HN GLN 26 4.971 -9.807 9.658 195 HA GLN 26 HA GLN 26 4.581 -12.531 8.918 196 HB2 GLN 26 HB2 GLN 26 6.755 -12.423 9.373 197 HB3 GLN 26 HB1 GLN 26 6.537 -10.857 10.135 198 HG2 GLN 26 HG2 GLN 26 7.377 -11.976 11.888 199 HG3 GLN 26 HG1 GLN 26 5.678 -12.372 12.125 200 HE21 GLN 26 HE21 GLN 26 5.632 -14.160 9.820 201 HE22 GLN 26 HE22 GLN 26 6.436 -15.594 10.317 202 H LYS 27 HN LYS 27 3.916 -10.495 11.657 203 HA LYS 27 HA LYS 27 3.049 -12.460 13.481 204 HB2 LYS 27 HB2 LYS 27 2.202 -9.563 13.285 205 HB3 LYS 27 HB1 LYS 27 2.093 -10.589 14.719 206 HG2 LYS 27 HG2 LYS 27 4.608 -9.667 13.355 207 HG3 LYS 27 HG1 LYS 27 3.979 -9.097 14.899 208 HD2 LYS 27 HD2 LYS 27 4.567 -11.037 16.000 209 HD3 LYS 27 HD1 LYS 27 4.548 -12.004 14.524 210 HE2 LYS 27 HE2 LYS 27 6.578 -11.068 13.770 211 HE3 LYS 27 HE1 LYS 27 6.531 -9.813 14.998 212 HZ1 LYS 27 HZ1 LYS 27 8.122 -11.531 15.569 213 HZ2 LYS 27 HZ2 LYS 27 6.919 -12.719 15.486 214 HZ3 LYS 27 HZ3 LYS 27 6.854 -11.531 16.686 215 H SER 28 HN SER 28 1.418 -10.734 10.901 216 HA SER 28 HA SER 28 -1.159 -11.724 11.886 217 HB2 SER 28 HB2 SER 28 -0.595 -9.534 9.905 218 HB3 SER 28 HB1 SER 28 -2.160 -9.917 10.623 219 HG SER 28 HG SER 28 0.131 -8.793 11.843 220 H ILE 29 HN ILE 29 1.198 -12.327 9.663 221 HA ILE 29 HA ILE 29 -0.703 -13.678 7.859 222 HB ILE 29 HB ILE 29 2.055 -12.611 7.275 223 HG12 ILE 29 HG12 ILE 29 -0.609 -11.846 6.081 224 HG13 ILE 29 HG11 ILE 29 0.274 -10.920 7.299 225 HG21 ILE 29 HG21 ILE 29 1.825 -14.661 6.092 226 HG22 ILE 29 HG22 ILE 29 1.675 -13.316 4.959 227 HG23 ILE 29 HG23 ILE 29 0.232 -14.190 5.492 228 HD11 ILE 29 HD11 ILE 29 1.428 -11.640 4.632 229 HD12 ILE 29 HD12 ILE 29 2.045 -10.484 5.823 230 HD13 ILE 29 HD13 ILE 29 0.553 -10.134 4.947 231 H ALA 30 HN ALA 30 -0.656 -15.837 7.969 232 HA ALA 30 HA ALA 30 1.479 -17.191 9.382 233 HB1 ALA 30 HB1 ALA 30 -0.966 -18.313 8.017 234 HB2 ALA 30 HB2 ALA 30 -0.855 -17.858 9.718 235 HB3 ALA 30 HB3 ALA 30 0.118 -19.192 9.097 236 H ASP 31 HN ASP 31 1.107 -16.088 6.326 237 HA ASP 31 HA ASP 31 2.485 -18.336 5.038 238 HB2 ASP 31 HB2 ASP 31 0.351 -17.524 4.051 239 HB3 ASP 31 HB1 ASP 31 1.135 -15.972 3.784 240 H GLU 32 HN GLU 32 4.443 -18.101 4.140 241 HA GLU 32 HA GLU 32 6.004 -15.756 4.717 242 HB2 GLU 32 HB2 GLU 32 7.793 -16.972 3.555 243 HB3 GLU 32 HB1 GLU 32 6.990 -18.003 4.732 244 HG2 GLU 32 HG2 GLU 32 5.601 -18.906 2.817 245 HG3 GLU 32 HG1 GLU 32 6.703 -18.040 1.746 246 H LYS 33 HN LYS 33 4.200 -16.951 1.955 247 HA LYS 33 HA LYS 33 5.568 -15.353 0.006 248 HB2 LYS 33 HB2 LYS 33 2.770 -16.440 -0.265 249 HB3 LYS 33 HB1 LYS 33 3.925 -16.106 -1.536 250 HG2 LYS 33 HG2 LYS 33 4.799 -18.104 -1.415 251 HG3 LYS 33 HG1 LYS 33 4.922 -18.037 0.342 252 HD2 LYS 33 HD2 LYS 33 2.499 -18.518 0.458 253 HD3 LYS 33 HD1 LYS 33 2.501 -18.746 -1.293 254 HE2 LYS 33 HE2 LYS 33 2.650 -20.869 -0.232 255 HE3 LYS 33 HE1 LYS 33 4.201 -20.503 -0.990 256 HZ1 LYS 33 HZ1 LYS 33 5.125 -19.960 1.106 257 HZ2 LYS 33 HZ2 LYS 33 4.351 -21.451 1.290 258 HZ3 LYS 33 HZ3 LYS 33 3.621 -20.038 1.878 259 H ALA 34 HN ALA 34 2.333 -15.208 1.447 260 HA ALA 34 HA ALA 34 1.668 -12.639 0.612 261 HB1 ALA 34 HB1 ALA 34 0.026 -12.646 2.421 262 HB2 ALA 34 HB2 ALA 34 0.830 -14.035 3.150 263 HB3 ALA 34 HB3 ALA 34 0.055 -14.194 1.575 264 H ARG 35 HN ARG 35 3.815 -13.686 3.151 265 HA ARG 35 HA ARG 35 3.846 -11.253 4.655 266 HB2 ARG 35 HB2 ARG 35 4.767 -13.689 5.220 267 HB3 ARG 35 HB1 ARG 35 6.244 -13.028 4.538 268 HG2 ARG 35 HG2 ARG 35 4.822 -11.473 6.652 269 HG3 ARG 35 HG1 ARG 35 5.748 -12.897 7.117 270 HD2 ARG 35 HD2 ARG 35 6.771 -10.462 5.664 271 HD3 ARG 35 HD1 ARG 35 7.103 -10.923 7.339 272 HE ARG 35 HE ARG 35 7.917 -12.758 5.205 273 HH11 ARG 35 HH11 ARG 35 8.798 -10.527 7.751 274 HH12 ARG 35 HH12 ARG 35 10.488 -10.904 7.673 275 HH21 ARG 35 HH21 ARG 35 10.142 -13.271 5.115 276 HH22 ARG 35 HH22 ARG 35 11.253 -12.456 6.167 277 H LYS 36 HN LYS 36 6.081 -12.702 2.297 278 HA LYS 36 HA LYS 36 7.788 -10.507 1.976 279 HB2 LYS 36 HB2 LYS 36 6.897 -12.390 -0.197 280 HB3 LYS 36 HB1 LYS 36 8.355 -11.408 -0.190 281 HG2 LYS 36 HG2 LYS 36 9.468 -12.824 1.123 282 HG3 LYS 36 HG1 LYS 36 8.020 -13.287 2.047 283 HD2 LYS 36 HD2 LYS 36 8.744 -15.154 0.692 284 HD3 LYS 36 HD1 LYS 36 7.207 -14.500 0.081 285 HE2 LYS 36 HE2 LYS 36 8.705 -13.075 -1.481 286 HE3 LYS 36 HE1 LYS 36 9.982 -14.213 -1.056 287 HZ1 LYS 36 HZ1 LYS 36 8.627 -16.020 -1.900 288 HZ2 LYS 36 HZ2 LYS 36 8.869 -14.856 -3.098 289 HZ3 LYS 36 HZ3 LYS 36 7.386 -14.944 -2.299 290 H VAL 37 HN VAL 37 5.000 -11.474 0.008 291 HA VAL 37 HA VAL 37 5.345 -9.553 -1.934 292 HB VAL 37 HB VAL 37 3.059 -9.906 -2.655 293 HG11 VAL 37 HG11 VAL 37 4.422 -12.414 -1.658 294 HG12 VAL 37 HG12 VAL 37 4.616 -11.639 -3.235 295 HG13 VAL 37 HG13 VAL 37 3.080 -12.396 -2.809 296 HG21 VAL 37 HG21 VAL 37 1.570 -11.417 -1.314 297 HG22 VAL 37 HG22 VAL 37 1.826 -9.811 -0.634 298 HG23 VAL 37 HG23 VAL 37 2.685 -11.196 0.035 299 H ILE 38 HN ILE 38 3.674 -9.254 1.168 300 HA ILE 38 HA ILE 38 2.797 -6.616 0.388 301 HB ILE 38 HB ILE 38 1.610 -8.416 2.039 302 HG12 ILE 38 HG12 ILE 38 1.227 -5.445 2.278 303 HG13 ILE 38 HG11 ILE 38 0.782 -6.321 0.820 304 HG21 ILE 38 HG21 ILE 38 1.636 -7.542 4.298 305 HG22 ILE 38 HG22 ILE 38 2.780 -6.286 3.828 306 HG23 ILE 38 HG23 ILE 38 3.279 -7.979 3.821 307 HD11 ILE 38 HD11 ILE 38 -0.628 -7.749 2.443 308 HD12 ILE 38 HD12 ILE 38 -1.183 -6.139 1.984 309 HD13 ILE 38 HD13 ILE 38 -0.409 -6.381 3.539 310 H VAL 39 HN VAL 39 5.341 -7.977 2.432 311 HA VAL 39 HA VAL 39 6.062 -5.436 3.486 312 HB VAL 39 HB VAL 39 8.027 -6.329 4.278 313 HG11 VAL 39 HG11 VAL 39 6.053 -8.593 4.144 314 HG12 VAL 39 HG12 VAL 39 6.121 -7.311 5.354 315 HG13 VAL 39 HG13 VAL 39 7.418 -8.509 5.255 316 HG21 VAL 39 HG21 VAL 39 7.874 -8.533 2.235 317 HG22 VAL 39 HG22 VAL 39 9.044 -8.462 3.554 318 HG23 VAL 39 HG23 VAL 39 9.053 -7.223 2.300 319 H GLU 40 HN GLU 40 7.310 -7.292 0.752 320 HA GLU 40 HA GLU 40 9.038 -5.377 -0.262 321 HB2 GLU 40 HB2 GLU 40 7.573 -7.528 -1.776 322 HB3 GLU 40 HB1 GLU 40 9.073 -6.775 -2.239 323 HG2 GLU 40 HG2 GLU 40 9.271 -7.867 0.392 324 HG3 GLU 40 HG1 GLU 40 8.718 -9.068 -0.746 325 H LEU 41 HN LEU 41 5.578 -5.705 -0.592 326 HA LEU 41 HA LEU 41 5.472 -3.756 -2.731 327 HB2 LEU 41 HB2 LEU 41 3.728 -5.704 -1.799 328 HB3 LEU 41 HB1 LEU 41 2.950 -4.187 -1.389 329 HG LEU 41 HG LEU 41 2.097 -4.678 -3.490 330 HD11 LEU 41 HD11 LEU 41 2.888 -2.991 -4.941 331 HD12 LEU 41 HD12 LEU 41 4.481 -2.994 -4.196 332 HD13 LEU 41 HD13 LEU 41 3.088 -2.394 -3.299 333 HD21 LEU 41 HD21 LEU 41 3.419 -5.467 -5.372 334 HD22 LEU 41 HD22 LEU 41 3.570 -6.551 -3.989 335 HD23 LEU 41 HD23 LEU 41 4.874 -5.428 -4.377 336 H MET 42 HN MET 42 4.341 -3.807 0.669 337 HA MET 42 HA MET 42 3.406 -1.140 0.681 338 HB2 MET 42 HB2 MET 42 4.315 -2.864 2.982 339 HB3 MET 42 HB1 MET 42 3.445 -1.336 3.160 340 HG2 MET 42 HG2 MET 42 2.475 -3.891 1.905 341 HG3 MET 42 HG1 MET 42 1.903 -3.124 3.377 342 HE1 MET 42 HE1 MET 42 0.008 -4.153 1.052 343 HE2 MET 42 HE2 MET 42 -1.154 -2.828 0.994 344 HE3 MET 42 HE3 MET 42 -0.560 -3.416 2.552 345 H ALA 43 HN ALA 43 6.483 -2.559 1.007 346 HA ALA 43 HA ALA 43 8.084 -0.677 2.121 347 HB1 ALA 43 HB1 ALA 43 9.772 -1.410 0.430 348 HB2 ALA 43 HB2 ALA 43 8.482 -2.317 -0.369 349 HB3 ALA 43 HB3 ALA 43 8.954 -2.724 1.280 350 H TYR 44 HN TYR 44 6.344 -0.520 -0.912 351 HA TYR 44 HA TYR 44 7.477 2.149 -1.476 352 HB2 TYR 44 HB2 TYR 44 7.637 0.647 -3.370 353 HB3 TYR 44 HB1 TYR 44 5.969 0.182 -3.164 354 HD1 TYR 44 HD1 TYR 44 8.224 2.496 -4.766 355 HD2 TYR 44 HD2 TYR 44 4.153 1.847 -3.761 356 HE1 TYR 44 HE1 TYR 44 7.564 4.115 -6.478 357 HE2 TYR 44 HE2 TYR 44 3.473 3.478 -5.465 358 HH TYR 44 HH TYR 44 4.512 5.457 -6.647 359 H GLU 45 HN GLU 45 4.392 0.442 -1.924 360 HA GLU 45 HA GLU 45 2.710 2.531 -2.121 361 HB2 GLU 45 HB2 GLU 45 2.060 0.015 -0.627 362 HB3 GLU 45 HB1 GLU 45 0.944 1.025 -1.530 363 HG2 GLU 45 HG2 GLU 45 3.226 -0.516 -2.728 364 HG3 GLU 45 HG1 GLU 45 1.565 -1.077 -2.680 365 H ASN 46 HN ASN 46 4.148 1.382 0.877 366 HA ASN 46 HA ASN 46 2.333 3.113 2.370 367 HB2 ASN 46 HB2 ASN 46 3.767 0.572 2.996 368 HB3 ASN 46 HB1 ASN 46 3.478 1.714 4.300 369 HD21 ASN 46 HD21 ASN 46 1.984 0.407 5.382 370 HD22 ASN 46 HD22 ASN 46 0.423 0.085 4.748 371 H ALA 47 HN ALA 47 5.582 2.758 1.315 372 HA ALA 47 HA ALA 47 7.004 3.861 3.460 373 HB1 ALA 47 HB1 ALA 47 8.770 4.344 1.839 374 HB2 ALA 47 HB2 ALA 47 7.649 3.989 0.525 375 HB3 ALA 47 HB3 ALA 47 8.122 2.713 1.649 376 H ASN 48 HN ASN 48 8.396 5.879 3.032 377 HA ASN 48 HA ASN 48 6.783 8.169 3.155 378 HB2 ASN 48 HB2 ASN 48 9.687 7.606 3.018 379 HB3 ASN 48 HB1 ASN 48 9.195 9.200 2.451 380 HD21 ASN 48 HD21 ASN 48 10.647 8.158 4.916 381 HD22 ASN 48 HD22 ASN 48 9.798 8.901 6.229 382 HA PRO 49 HA PRO 49 5.525 8.945 -0.960 383 HB2 PRO 49 HB2 PRO 49 6.280 11.704 -0.914 384 HB3 PRO 49 HB1 PRO 49 4.673 11.019 -0.688 385 HG2 PRO 49 HG2 PRO 49 6.618 11.955 1.317 386 HG3 PRO 49 HG1 PRO 49 4.859 11.805 1.438 387 HD2 PRO 49 HD2 PRO 49 6.556 10.130 2.719 388 HD3 PRO 49 HD1 PRO 49 4.970 9.600 2.113 389 H GLU 50 HN GLU 50 8.517 10.572 -0.046 390 HA GLU 50 HA GLU 50 9.731 10.605 -2.571 391 HB2 GLU 50 HB2 GLU 50 10.553 12.208 -1.152 392 HB3 GLU 50 HB1 GLU 50 10.542 11.139 0.243 393 HG2 GLU 50 HG2 GLU 50 12.709 10.948 -0.059 394 HG3 GLU 50 HG1 GLU 50 12.328 9.978 -1.459 395 H CYS 51 HN CYS 51 9.683 8.296 0.076 396 HA CYS 51 HA CYS 51 12.074 6.987 -0.747 397 HB2 CYS 51 HB2 CYS 51 9.962 6.345 1.324 398 HB3 CYS 51 HB1 CYS 51 11.366 5.323 1.007 399 HG CYS 51 HG CYS 51 13.213 7.382 1.624 400 H GLN 52 HN GLN 52 8.626 6.511 -1.096 401 HA GLN 52 HA GLN 52 8.938 4.031 -2.503 402 HB2 GLN 52 HB2 GLN 52 6.619 4.202 -3.046 403 HB3 GLN 52 HB1 GLN 52 6.803 4.713 -1.375 404 HG2 GLN 52 HG2 GLN 52 6.759 7.066 -2.164 405 HG3 GLN 52 HG1 GLN 52 6.403 6.470 -3.782 406 HE21 GLN 52 HE21 GLN 52 4.898 4.238 -2.676 407 HE22 GLN 52 HE22 GLN 52 3.382 4.866 -2.182 408 H SER 53 HN SER 53 8.859 7.380 -3.134 409 HA SER 53 HA SER 53 8.916 7.277 -5.953 410 HB2 SER 53 HB2 SER 53 9.591 9.307 -3.875 411 HB3 SER 53 HB1 SER 53 9.899 9.641 -5.584 412 HG SER 53 HG SER 53 7.482 9.327 -4.207 413 H ALA 54 HN ALA 54 11.285 6.829 -3.466 414 HA ALA 54 HA ALA 54 13.502 6.777 -5.285 415 HB1 ALA 54 HB1 ALA 54 14.706 5.731 -3.463 416 HB2 ALA 54 HB2 ALA 54 13.186 5.442 -2.610 417 HB3 ALA 54 HB3 ALA 54 13.754 7.088 -2.863 418 H ILE 55 HN ILE 55 11.000 4.666 -4.388 419 HA ILE 55 HA ILE 55 12.400 2.283 -5.205 420 HB ILE 55 HB ILE 55 9.755 2.786 -3.924 421 HG12 ILE 55 HG12 ILE 55 11.919 1.059 -2.861 422 HG13 ILE 55 HG11 ILE 55 12.145 2.815 -2.839 423 HG21 ILE 55 HG21 ILE 55 10.892 0.154 -4.827 424 HG22 ILE 55 HG22 ILE 55 9.399 0.908 -5.386 425 HG23 ILE 55 HG23 ILE 55 9.530 0.333 -3.724 426 HD11 ILE 55 HD11 ILE 55 11.179 1.787 -0.776 427 HD12 ILE 55 HD12 ILE 55 9.701 1.462 -1.718 428 HD13 ILE 55 HD13 ILE 55 10.262 3.127 -1.477 429 H LYS 56 HN LYS 56 9.776 4.282 -6.534 430 HA LYS 56 HA LYS 56 8.335 2.526 -7.973 431 HB2 LYS 56 HB2 LYS 56 8.865 4.601 -9.865 432 HB3 LYS 56 HB1 LYS 56 7.395 4.244 -8.981 433 HG2 LYS 56 HG2 LYS 56 7.727 6.364 -8.287 434 HG3 LYS 56 HG1 LYS 56 8.713 5.544 -7.074 435 HD2 LYS 56 HD2 LYS 56 10.657 6.164 -8.016 436 HD3 LYS 56 HD1 LYS 56 9.997 6.260 -9.647 437 HE2 LYS 56 HE2 LYS 56 9.924 8.317 -7.436 438 HE3 LYS 56 HE1 LYS 56 10.434 8.486 -9.117 439 HZ1 LYS 56 HZ1 LYS 56 8.152 8.308 -9.836 440 HZ2 LYS 56 HZ2 LYS 56 8.309 9.564 -8.717 441 HZ3 LYS 56 HZ3 LYS 56 7.626 8.093 -8.243 442 HA PRO 57 HA PRO 57 11.596 2.205 -11.639 443 HB2 PRO 57 HB2 PRO 57 14.169 2.135 -10.766 444 HB3 PRO 57 HB1 PRO 57 13.390 3.618 -11.340 445 HG2 PRO 57 HG2 PRO 57 13.639 2.600 -8.521 446 HG3 PRO 57 HG1 PRO 57 14.098 4.201 -9.154 447 HD2 PRO 57 HD2 PRO 57 11.786 3.896 -7.929 448 HD3 PRO 57 HD1 PRO 57 11.820 4.825 -9.434 449 H LEU 58 HN LEU 58 12.098 1.012 -8.373 450 HA LEU 58 HA LEU 58 12.980 -1.609 -9.319 451 HB2 LEU 58 HB2 LEU 58 12.496 -1.045 -6.447 452 HB3 LEU 58 HB1 LEU 58 13.745 -2.039 -7.184 453 HG LEU 58 HG LEU 58 13.691 0.979 -7.062 454 HD11 LEU 58 HD11 LEU 58 15.222 -1.110 -5.536 455 HD12 LEU 58 HD12 LEU 58 14.076 0.068 -4.898 456 HD13 LEU 58 HD13 LEU 58 15.634 0.604 -5.535 457 HD21 LEU 58 HD21 LEU 58 15.974 0.865 -7.927 458 HD22 LEU 58 HD22 LEU 58 14.823 0.180 -9.075 459 HD23 LEU 58 HD23 LEU 58 15.832 -0.886 -8.093 460 H LYS 59 HN LYS 59 10.309 0.164 -8.301 461 HA LYS 59 HA LYS 59 8.705 -1.738 -7.057 462 HB2 LYS 59 HB2 LYS 59 8.067 0.609 -7.207 463 HB3 LYS 59 HB1 LYS 59 7.883 0.462 -8.946 464 HG2 LYS 59 HG2 LYS 59 5.720 0.170 -8.447 465 HG3 LYS 59 HG1 LYS 59 6.236 -1.475 -8.113 466 HD2 LYS 59 HD2 LYS 59 5.988 0.718 -6.090 467 HD3 LYS 59 HD1 LYS 59 4.834 -0.605 -6.305 468 HE2 LYS 59 HE2 LYS 59 7.738 -0.841 -5.481 469 HE3 LYS 59 HE1 LYS 59 6.342 -1.048 -4.435 470 HZ1 LYS 59 HZ1 LYS 59 5.697 -2.984 -5.721 471 HZ2 LYS 59 HZ2 LYS 59 7.269 -3.170 -5.120 472 HZ3 LYS 59 HZ3 LYS 59 7.024 -2.777 -6.742 473 H GLY 60 HN GLY 60 8.360 -3.724 -7.760 474 HA2 GLY 60 HA3 GLY 60 7.184 -5.200 -9.247 475 HA3 GLY 60 HA2 GLY 60 7.556 -4.100 -10.562 476 H LYS 61 HN LYS 61 10.345 -3.757 -9.677 477 HA LYS 61 HA LYS 61 11.299 -6.288 -10.809 478 HB2 LYS 61 HB2 LYS 61 12.898 -3.757 -10.615 479 HB3 LYS 61 HB1 LYS 61 13.055 -5.084 -11.765 480 HG2 LYS 61 HG2 LYS 61 10.756 -3.192 -11.611 481 HG3 LYS 61 HG1 LYS 61 12.071 -3.103 -12.778 482 HD2 LYS 61 HD2 LYS 61 11.390 -5.053 -13.871 483 HD3 LYS 61 HD1 LYS 61 10.461 -5.607 -12.469 484 HE2 LYS 61 HE2 LYS 61 8.764 -4.096 -12.839 485 HE3 LYS 61 HE1 LYS 61 9.729 -3.123 -13.948 486 HZ1 LYS 61 HZ1 LYS 61 8.095 -4.433 -15.142 487 HZ2 LYS 61 HZ2 LYS 61 8.703 -5.861 -14.475 488 HZ3 LYS 61 HZ3 LYS 61 9.655 -4.955 -15.539 489 H VAL 62 HN VAL 62 11.925 -7.592 -9.379 490 HA VAL 62 HA VAL 62 13.905 -6.654 -7.413 491 HB VAL 62 HB VAL 62 12.012 -7.543 -6.210 492 HG11 VAL 62 HG11 VAL 62 11.248 -9.864 -6.460 493 HG12 VAL 62 HG12 VAL 62 12.334 -10.058 -7.839 494 HG13 VAL 62 HG13 VAL 62 10.993 -8.916 -7.928 495 HG21 VAL 62 HG21 VAL 62 13.082 -9.373 -4.957 496 HG22 VAL 62 HG22 VAL 62 14.180 -8.027 -5.263 497 HG23 VAL 62 HG23 VAL 62 14.302 -9.501 -6.224 498 HA PRO 63 HA PRO 63 16.956 -8.990 -9.748 499 HB2 PRO 63 HB2 PRO 63 18.039 -9.286 -6.989 500 HB3 PRO 63 HB1 PRO 63 18.874 -8.826 -8.468 501 HG2 PRO 63 HG2 PRO 63 18.246 -6.984 -6.673 502 HG3 PRO 63 HG1 PRO 63 18.061 -6.647 -8.402 503 HD2 PRO 63 HD2 PRO 63 15.978 -7.257 -6.359 504 HD3 PRO 63 HD1 PRO 63 15.899 -6.178 -7.766 505 H ALA 64 HN ALA 64 17.140 -11.096 -10.208 506 HA ALA 64 HA ALA 64 15.422 -12.977 -9.007 507 HB1 ALA 64 HB1 ALA 64 17.762 -13.462 -10.847 508 HB2 ALA 64 HB2 ALA 64 16.109 -13.113 -11.353 509 HB3 ALA 64 HB3 ALA 64 16.470 -14.606 -10.487 510 H GLY 65 HN GLY 65 15.695 -13.687 -7.006 511 HA2 GLY 65 HA3 GLY 65 16.838 -15.260 -5.584 512 HA3 GLY 65 HA2 GLY 65 18.360 -14.683 -6.245 513 H SER 66 HN SER 66 17.014 -11.866 -5.958 514 HA SER 66 HA SER 66 18.005 -11.489 -3.233 515 HB2 SER 66 HB2 SER 66 18.647 -10.002 -5.270 516 HB3 SER 66 HB1 SER 66 17.057 -9.281 -5.029 517 HG SER 66 HG SER 66 18.322 -8.042 -3.800 518 H ASP 67 HN ASP 67 16.802 -9.487 -2.280 519 HA ASP 67 HA ASP 67 13.943 -10.136 -2.010 520 HB2 ASP 67 HB2 ASP 67 16.086 -8.999 -0.270 521 HB3 ASP 67 HB1 ASP 67 14.411 -8.583 0.085 522 H VAL 68 HN VAL 68 12.424 -8.343 -2.271 523 HA VAL 68 HA VAL 68 13.525 -6.311 -3.934 524 HB VAL 68 HB VAL 68 11.518 -5.720 -4.631 525 HG11 VAL 68 HG11 VAL 68 9.816 -7.324 -4.580 526 HG12 VAL 68 HG12 VAL 68 10.356 -7.981 -3.026 527 HG13 VAL 68 HG13 VAL 68 11.338 -8.213 -4.485 528 HG21 VAL 68 HG21 VAL 68 9.623 -5.208 -3.171 529 HG22 VAL 68 HG22 VAL 68 11.105 -4.358 -2.727 530 HG23 VAL 68 HG23 VAL 68 10.578 -5.757 -1.783 531 H ILE 69 HN ILE 69 12.553 -6.628 -0.652 532 HA ILE 69 HA ILE 69 12.470 -3.985 0.138 533 HB ILE 69 HB ILE 69 13.304 -6.442 1.650 534 HG12 ILE 69 HG12 ILE 69 11.019 -6.626 1.178 535 HG13 ILE 69 HG11 ILE 69 11.039 -5.892 2.777 536 HG21 ILE 69 HG21 ILE 69 14.381 -4.642 2.788 537 HG22 ILE 69 HG22 ILE 69 12.938 -5.044 3.723 538 HG23 ILE 69 HG23 ILE 69 12.948 -3.622 2.678 539 HD11 ILE 69 HD11 ILE 69 10.711 -3.694 1.749 540 HD12 ILE 69 HD12 ILE 69 9.396 -4.828 1.410 541 HD13 ILE 69 HD13 ILE 69 10.613 -4.477 0.171 542 H SER 70 HN SER 70 15.168 -6.195 0.171 543 HA SER 70 HA SER 70 17.188 -4.685 1.182 544 HB2 SER 70 HB2 SER 70 17.338 -7.059 0.426 545 HB3 SER 70 HB1 SER 70 17.397 -6.493 -1.240 546 HG SER 70 HG SER 70 19.475 -6.932 -0.264 547 H GLU 71 HN GLU 71 15.774 -4.485 -2.019 548 HA GLU 71 HA GLU 71 17.736 -2.611 -3.009 549 HB2 GLU 71 HB2 GLU 71 15.203 -3.299 -4.426 550 HB3 GLU 71 HB1 GLU 71 16.816 -3.048 -5.087 551 HG2 GLU 71 HG2 GLU 71 16.334 -5.375 -3.308 552 HG3 GLU 71 HG1 GLU 71 15.756 -5.437 -4.957 553 H TYR 72 HN TYR 72 14.512 -2.682 -1.791 554 HA TYR 72 HA TYR 72 13.750 -0.093 -2.708 555 HB2 TYR 72 HB2 TYR 72 12.591 -2.071 -0.757 556 HB3 TYR 72 HB1 TYR 72 11.902 -0.466 -0.954 557 HD1 TYR 72 HD1 TYR 72 13.324 -1.961 -3.913 558 HD2 TYR 72 HD2 TYR 72 9.790 -1.619 -1.586 559 HE1 TYR 72 HE1 TYR 72 12.002 -2.765 -5.805 560 HE2 TYR 72 HE2 TYR 72 8.454 -2.438 -3.480 561 HH TYR 72 HH TYR 72 9.941 -3.782 -6.306 562 H VAL 73 HN VAL 73 14.974 -1.485 0.262 563 HA VAL 73 HA VAL 73 15.017 0.929 1.739 564 HB VAL 73 HB VAL 73 16.190 -0.103 3.414 565 HG11 VAL 73 HG11 VAL 73 14.791 -2.312 1.977 566 HG12 VAL 73 HG12 VAL 73 14.169 -1.272 3.256 567 HG13 VAL 73 HG13 VAL 73 15.422 -2.453 3.615 568 HG21 VAL 73 HG21 VAL 73 17.335 -2.237 1.655 569 HG22 VAL 73 HG22 VAL 73 17.833 -1.755 3.287 570 HG23 VAL 73 HG23 VAL 73 18.131 -0.686 1.915 571 H LYS 74 HN LYS 74 17.141 -0.709 -0.466 572 HA LYS 74 HA LYS 74 19.426 0.940 -0.200 573 HB2 LYS 74 HB2 LYS 74 18.648 -1.310 -1.671 574 HB3 LYS 74 HB1 LYS 74 18.980 -0.063 -2.867 575 HG2 LYS 74 HG2 LYS 74 21.058 -0.947 -2.720 576 HG3 LYS 74 HG1 LYS 74 21.179 0.238 -1.421 577 HD2 LYS 74 HD2 LYS 74 20.376 -2.638 -1.013 578 HD3 LYS 74 HD1 LYS 74 22.029 -2.045 -0.845 579 HE2 LYS 74 HE2 LYS 74 19.680 -1.005 0.725 580 HE3 LYS 74 HE1 LYS 74 20.781 -2.252 1.304 581 HZ1 LYS 74 HZ1 LYS 74 22.592 -0.697 1.207 582 HZ2 LYS 74 HZ2 LYS 74 21.343 -0.019 2.121 583 HZ3 LYS 74 HZ3 LYS 74 21.605 0.494 0.532 584 H ALA 75 HN ALA 75 16.444 1.102 -1.981 585 HA ALA 75 HA ALA 75 17.098 3.199 -3.764 586 HB1 ALA 75 HB1 ALA 75 14.454 2.373 -2.565 587 HB2 ALA 75 HB2 ALA 75 15.141 1.822 -4.092 588 HB3 ALA 75 HB3 ALA 75 14.640 3.503 -3.909 589 H CYS 76 HN CYS 76 15.615 3.132 -0.577 590 HA CYS 76 HA CYS 76 15.658 6.024 -0.387 591 HB2 CYS 76 HB2 CYS 76 14.720 4.046 1.675 592 HB3 CYS 76 HB1 CYS 76 14.169 5.691 1.393 593 HG CYS 76 HG CYS 76 13.433 2.901 -0.396 594 H ASP 77 HN ASP 77 17.921 3.815 -0.060 595 HA ASP 77 HA ASP 77 19.025 4.160 2.481 596 HB2 ASP 77 HB2 ASP 77 19.799 2.356 1.190 597 HB3 ASP 77 HB1 ASP 77 20.196 3.365 -0.193 598 H GLY 78 HN GLY 78 19.116 6.189 -0.348 599 HA2 GLY 78 HA3 GLY 78 21.067 7.980 0.889 600 HA3 GLY 78 HA2 GLY 78 20.376 8.149 -0.718 601 H ILE 79 HN ILE 79 17.826 7.482 1.182 602 HA ILE 79 HA ILE 79 17.083 10.288 1.322 603 HB ILE 79 HB ILE 79 15.411 7.800 1.559 604 HG12 ILE 79 HG12 ILE 79 15.474 9.894 -0.620 605 HG13 ILE 79 HG11 ILE 79 16.290 8.333 -0.718 606 HG21 ILE 79 HG21 ILE 79 14.435 9.546 2.916 607 HG22 ILE 79 HG22 ILE 79 13.464 9.306 1.460 608 HG23 ILE 79 HG23 ILE 79 14.554 10.687 1.576 609 HD11 ILE 79 HD11 ILE 79 14.252 7.174 -0.783 610 HD12 ILE 79 HD12 ILE 79 14.055 8.559 -1.863 611 HD13 ILE 79 HD13 ILE 79 13.346 8.589 -0.251 612 H GLY 80 HN GLY 80 16.988 11.341 3.189 613 HA2 GLY 80 HA3 GLY 80 15.755 10.568 5.482 614 HA3 GLY 80 HA2 GLY 80 17.394 9.986 5.682 615 H GLY 81 HN GLY 81 16.696 12.895 3.887 616 HA2 GLY 81 HA3 GLY 81 16.418 14.878 5.612 617 HA3 GLY 81 HA2 GLY 81 18.099 14.463 5.891 618 H ALA 82 HN ALA 82 19.603 15.302 4.590 619 HA ALA 82 HA ALA 82 19.012 17.584 3.130 620 HB1 ALA 82 HB1 ALA 82 21.482 15.884 2.902 621 HB2 ALA 82 HB2 ALA 82 21.185 17.095 4.148 622 HB3 ALA 82 HB3 ALA 82 21.329 17.584 2.460 623 H MET 83 HN MET 83 19.976 14.396 1.831 624 HA MET 83 HA MET 83 19.668 15.206 -0.872 625 HB2 MET 83 HB2 MET 83 19.636 12.400 0.257 626 HB3 MET 83 HB1 MET 83 19.862 12.831 -1.431 627 HG2 MET 83 HG2 MET 83 21.922 14.039 -0.804 628 HG3 MET 83 HG1 MET 83 21.709 13.473 0.850 629 HE1 MET 83 HE1 MET 83 24.373 13.008 -0.854 630 HE2 MET 83 HE2 MET 83 24.737 11.339 -0.419 631 HE3 MET 83 HE3 MET 83 24.160 12.464 0.810 632 H HIS 84 HN HIS 84 17.541 13.824 1.509 633 HA HIS 84 HA HIS 84 15.366 13.138 -0.139 634 HB2 HIS 84 HB2 HIS 84 15.297 12.379 2.114 635 HB3 HIS 84 HB1 HIS 84 15.577 13.992 2.751 636 HD1 HIS 84 HD1 HIS 84 13.549 14.453 4.085 637 HD2 HIS 84 HD2 HIS 84 12.615 12.911 0.351 638 HE1 HIS 84 HE1 HIS 84 11.051 14.584 3.914 639 HE2 HIS 84 HE2 HIS 84 10.493 13.511 1.702 640 H LYS 85 HN LYS 85 16.415 16.236 1.190 641 HA LYS 85 HA LYS 85 13.986 17.564 0.381 642 HB2 LYS 85 HB2 LYS 85 16.605 18.800 1.246 643 HB3 LYS 85 HB1 LYS 85 15.035 19.593 1.184 644 HG2 LYS 85 HG2 LYS 85 15.804 17.317 3.000 645 HG3 LYS 85 HG1 LYS 85 15.621 19.010 3.466 646 HD2 LYS 85 HD2 LYS 85 13.257 18.919 2.946 647 HD3 LYS 85 HD1 LYS 85 13.426 17.266 2.349 648 HE2 LYS 85 HE2 LYS 85 12.544 17.121 4.556 649 HE3 LYS 85 HE1 LYS 85 14.233 16.622 4.630 650 HZ1 LYS 85 HZ1 LYS 85 14.821 18.794 5.474 651 HZ2 LYS 85 HZ2 LYS 85 13.630 18.101 6.453 652 HZ3 LYS 85 HZ3 LYS 85 13.216 19.317 5.354 653 H ALA 86 HN ALA 86 16.943 16.711 -1.066 654 HA ALA 86 HA ALA 86 16.787 18.669 -3.193 655 HB1 ALA 86 HB1 ALA 86 18.736 17.555 -4.104 656 HB2 ALA 86 HB2 ALA 86 18.547 16.232 -2.954 657 HB3 ALA 86 HB3 ALA 86 18.969 17.848 -2.381 658 H MET 87 HN MET 87 16.400 15.194 -2.795 659 HA MET 87 HA MET 87 15.618 14.772 -5.525 660 HB2 MET 87 HB2 MET 87 15.587 12.930 -3.124 661 HB3 MET 87 HB1 MET 87 15.322 12.428 -4.795 662 HG2 MET 87 HG2 MET 87 17.746 13.918 -4.647 663 HG3 MET 87 HG1 MET 87 17.760 12.674 -3.404 664 HE1 MET 87 HE1 MET 87 19.942 11.177 -6.323 665 HE2 MET 87 HE2 MET 87 19.913 11.626 -4.618 666 HE3 MET 87 HE3 MET 87 19.820 12.875 -5.860 667 H LEU 88 HN LEU 88 14.031 15.727 -2.718 668 HA LEU 88 HA LEU 88 11.557 14.619 -2.739 669 HB2 LEU 88 HB2 LEU 88 12.687 16.562 -1.377 670 HB3 LEU 88 HB1 LEU 88 11.795 17.577 -2.487 671 HG LEU 88 HG LEU 88 9.831 17.204 -1.435 672 HD11 LEU 88 HD11 LEU 88 9.674 14.876 -2.200 673 HD12 LEU 88 HD12 LEU 88 9.112 15.045 -0.538 674 HD13 LEU 88 HD13 LEU 88 10.707 14.369 -0.865 675 HD21 LEU 88 HD21 LEU 88 10.136 16.660 0.949 676 HD22 LEU 88 HD22 LEU 88 11.325 17.821 0.352 677 HD23 LEU 88 HD23 LEU 88 11.778 16.130 0.577 678 H MET 89 HN MET 89 12.713 17.240 -4.844 679 HA MET 89 HA MET 89 10.144 17.478 -6.152 680 HB2 MET 89 HB2 MET 89 11.618 19.442 -5.751 681 HB3 MET 89 HB1 MET 89 12.786 18.761 -6.874 682 HG2 MET 89 HG2 MET 89 11.119 18.897 -8.669 683 HG3 MET 89 HG1 MET 89 9.975 19.617 -7.538 684 HE1 MET 89 HE1 MET 89 10.334 21.976 -6.380 685 HE2 MET 89 HE2 MET 89 11.718 23.025 -6.687 686 HE3 MET 89 HE3 MET 89 11.937 21.510 -5.814 687 H ALA 90 HN ALA 90 12.853 15.489 -6.481 688 HA ALA 90 HA ALA 90 12.599 15.231 -9.387 689 HB1 ALA 90 HB1 ALA 90 14.662 13.960 -9.274 690 HB2 ALA 90 HB2 ALA 90 14.592 13.951 -7.509 691 HB3 ALA 90 HB3 ALA 90 14.848 15.469 -8.380 692 H GLN 91 HN GLN 91 12.252 13.341 -6.443 693 HA GLN 91 HA GLN 91 11.409 11.033 -8.035 694 HB2 GLN 91 HB2 GLN 91 12.115 11.264 -5.117 695 HB3 GLN 91 HB1 GLN 91 11.728 9.772 -5.962 696 HG2 GLN 91 HG2 GLN 91 13.675 10.019 -7.355 697 HG3 GLN 91 HG1 GLN 91 14.053 11.562 -6.596 698 HE21 GLN 91 HE21 GLN 91 13.330 10.856 -3.990 699 HE22 GLN 91 HE22 GLN 91 14.475 9.707 -3.419 700 H LEU 92 HN LEU 92 10.438 12.771 -5.076 701 HA LEU 92 HA LEU 92 7.920 11.614 -4.795 702 HB2 LEU 92 HB2 LEU 92 9.225 12.978 -3.129 703 HB3 LEU 92 HB1 LEU 92 8.644 14.401 -3.965 704 HG LEU 92 HG LEU 92 7.440 13.203 -1.825 705 HD11 LEU 92 HD11 LEU 92 7.107 15.493 -2.556 706 HD12 LEU 92 HD12 LEU 92 5.557 14.693 -2.296 707 HD13 LEU 92 HD13 LEU 92 6.164 14.926 -3.934 708 HD21 LEU 92 HD21 LEU 92 5.295 12.319 -2.652 709 HD22 LEU 92 HD22 LEU 92 6.669 11.301 -3.085 710 HD23 LEU 92 HD23 LEU 92 5.940 12.360 -4.293 711 H GLU 93 HN GLU 93 9.054 13.540 -7.236 712 HA GLU 93 HA GLU 93 7.315 15.434 -7.980 713 HB2 GLU 93 HB2 GLU 93 7.771 14.768 -10.356 714 HB3 GLU 93 HB1 GLU 93 9.209 14.949 -9.354 715 HG2 GLU 93 HG2 GLU 93 9.571 12.644 -9.254 716 HG3 GLU 93 HG1 GLU 93 7.937 12.267 -9.796 717 H2 PRO 1 HT1 PRO 1 5.121 -3.784 -13.542 718 H3 PRO 1 HT2 PRO 1 5.439 -2.281 -14.097 719 HA PRO 1 HA PRO 1 6.263 -2.138 -12.093 720 HB2 PRO 1 HB2 PRO 1 4.214 -1.119 -10.699 721 HB3 PRO 1 HB1 PRO 1 4.869 -0.280 -12.106 722 HG2 PRO 1 HG2 PRO 1 2.326 -1.702 -11.811 723 HG3 PRO 1 HG1 PRO 1 2.815 -0.523 -13.039 724 HD2 PRO 1 HD2 PRO 1 2.802 -3.435 -13.173 725 HD3 PRO 1 HD1 PRO 1 3.042 -2.260 -14.481 726 H SER 2 HN SER 2 4.453 -2.259 -9.651 727 HA SER 2 HA SER 2 4.455 -5.010 -8.980 728 HB2 SER 2 HB2 SER 2 2.620 -2.850 -7.913 729 HB3 SER 2 HB1 SER 2 3.051 -4.356 -7.114 730 HG SER 2 HG SER 2 4.211 -2.079 -6.835 731 H PHE 3 HN PHE 3 2.169 -6.055 -8.430 732 HA PHE 3 HA PHE 3 0.464 -5.846 -10.719 733 HB2 PHE 3 HB2 PHE 3 -1.103 -6.951 -8.738 734 HB3 PHE 3 HB1 PHE 3 -0.102 -7.864 -9.862 735 HD1 PHE 3 HD1 PHE 3 -0.719 -6.901 -6.470 736 HD2 PHE 3 HD2 PHE 3 2.191 -8.589 -9.085 737 HE1 PHE 3 HE1 PHE 3 0.463 -7.874 -4.557 738 HE2 PHE 3 HE2 PHE 3 3.388 -9.537 -7.160 739 HZ PHE 3 HZ PHE 3 2.521 -9.178 -4.885 740 H ASN 4 HN ASN 4 0.339 -4.825 -7.368 741 HA ASN 4 HA ASN 4 -2.324 -3.778 -7.699 742 HB2 ASN 4 HB2 ASN 4 -2.195 -3.437 -5.281 743 HB3 ASN 4 HB1 ASN 4 -1.723 -5.077 -5.725 744 HD21 ASN 4 HD21 ASN 4 -0.467 -1.892 -4.883 745 HD22 ASN 4 HD22 ASN 4 1.043 -2.465 -4.257 746 H THR 5 HN THR 5 0.518 -2.403 -8.473 747 HA THR 5 HA THR 5 0.587 -0.022 -6.945 748 HB THR 5 HB THR 5 1.656 0.748 -9.285 749 HG1 THR 5 HG1 THR 5 1.353 -1.050 -10.482 750 HG21 THR 5 HG21 THR 5 2.882 -0.984 -7.167 751 HG22 THR 5 HG22 THR 5 2.873 0.778 -7.244 752 HG23 THR 5 HG23 THR 5 3.809 -0.154 -8.414 753 H VAL 6 HN VAL 6 -1.721 -1.060 -9.149 754 HA VAL 6 HA VAL 6 -2.388 1.472 -10.272 755 HB VAL 6 HB VAL 6 -4.221 0.432 -11.282 756 HG11 VAL 6 HG11 VAL 6 -2.177 -0.490 -12.150 757 HG12 VAL 6 HG12 VAL 6 -3.432 -1.729 -12.142 758 HG13 VAL 6 HG13 VAL 6 -2.178 -1.738 -10.902 759 HG21 VAL 6 HG21 VAL 6 -4.135 -1.840 -9.311 760 HG22 VAL 6 HG22 VAL 6 -5.380 -1.509 -10.526 761 HG23 VAL 6 HG23 VAL 6 -5.182 -0.427 -9.141 762 H ARG 7 HN ARG 7 -3.689 3.028 -9.371 763 HA ARG 7 HA ARG 7 -5.465 2.222 -7.278 764 HB2 ARG 7 HB2 ARG 7 -4.492 3.853 -5.634 765 HB3 ARG 7 HB1 ARG 7 -3.684 2.331 -5.918 766 HG2 ARG 7 HG2 ARG 7 -2.505 4.134 -7.669 767 HG3 ARG 7 HG1 ARG 7 -2.655 4.955 -6.111 768 HD2 ARG 7 HD2 ARG 7 -1.601 3.062 -5.002 769 HD3 ARG 7 HD1 ARG 7 -1.460 2.220 -6.540 770 HE ARG 7 HE ARG 7 0.042 4.072 -7.231 771 HH11 ARG 7 HH11 ARG 7 -0.459 3.429 -3.831 772 HH12 ARG 7 HH12 ARG 7 1.018 4.176 -3.338 773 HH21 ARG 7 HH21 ARG 7 1.981 5.087 -6.586 774 HH22 ARG 7 HH22 ARG 7 2.404 5.135 -4.906 775 H GLN 8 HN GLN 8 -6.730 3.813 -6.391 776 HA GLN 8 HA GLN 8 -8.285 5.216 -8.052 777 HB2 GLN 8 HB2 GLN 8 -7.937 4.926 -5.254 778 HB3 GLN 8 HB1 GLN 8 -8.223 6.634 -5.569 779 HG2 GLN 8 HG2 GLN 8 -10.257 6.093 -6.767 780 HG3 GLN 8 HG1 GLN 8 -9.963 4.373 -6.515 781 HE21 GLN 8 HE21 GLN 8 -12.206 6.008 -5.698 782 HE22 GLN 8 HE22 GLN 8 -12.287 5.887 -3.965 783 H GLY 9 HN GLY 9 -7.854 6.751 -9.446 784 HA2 GLY 9 HA3 GLY 9 -5.911 8.835 -8.848 785 HA3 GLY 9 HA2 GLY 9 -6.783 8.613 -10.357 786 H SER 10 HN SER 10 -7.657 10.601 -10.646 787 HA SER 10 HA SER 10 -8.650 12.284 -8.643 788 HB2 SER 10 HB2 SER 10 -9.917 13.337 -10.627 789 HB3 SER 10 HB1 SER 10 -8.155 13.285 -10.716 790 HG SER 10 HG SER 10 -9.460 11.063 -11.731 791 H LYS 11 HN LYS 11 -10.026 11.373 -7.231 792 HA LYS 11 HA LYS 11 -11.746 10.173 -6.351 793 HB2 LYS 11 HB2 LYS 11 -13.895 11.145 -6.740 794 HB3 LYS 11 HB1 LYS 11 -12.716 12.432 -6.739 795 HG2 LYS 11 HG2 LYS 11 -12.816 12.595 -9.105 796 HG3 LYS 11 HG1 LYS 11 -13.824 11.163 -9.230 797 HD2 LYS 11 HD2 LYS 11 -15.543 12.398 -7.875 798 HD3 LYS 11 HD1 LYS 11 -14.550 13.844 -8.071 799 HE2 LYS 11 HE2 LYS 11 -14.764 13.702 -10.478 800 HE3 LYS 11 HE1 LYS 11 -15.665 12.193 -10.332 801 HZ1 LYS 11 HZ1 LYS 11 -17.172 14.007 -10.683 802 HZ2 LYS 11 HZ2 LYS 11 -16.536 14.863 -9.377 803 HZ3 LYS 11 HZ3 LYS 11 -17.382 13.425 -9.111 804 H GLU 12 HN GLU 12 -10.530 8.654 -8.319 805 HA GLU 12 HA GLU 12 -12.146 7.585 -10.316 806 HB2 GLU 12 HB2 GLU 12 -9.740 7.215 -10.134 807 HB3 GLU 12 HB1 GLU 12 -9.964 6.299 -8.658 808 HG2 GLU 12 HG2 GLU 12 -11.136 4.560 -9.911 809 HG3 GLU 12 HG1 GLU 12 -10.928 5.497 -11.392 810 HA PRO 13 HA PRO 13 -15.370 5.401 -8.138 811 HB2 PRO 13 HB2 PRO 13 -15.046 3.286 -10.160 812 HB3 PRO 13 HB1 PRO 13 -16.481 4.220 -9.749 813 HG2 PRO 13 HG2 PRO 13 -15.075 4.603 -12.031 814 HG3 PRO 13 HG1 PRO 13 -15.970 5.889 -11.215 815 HD2 PRO 13 HD2 PRO 13 -13.055 5.423 -11.366 816 HD3 PRO 13 HD1 PRO 13 -13.945 6.935 -11.132 817 H TYR 14 HN TYR 14 -15.081 4.158 -6.398 818 HA TYR 14 HA TYR 14 -12.480 3.148 -6.034 819 HB2 TYR 14 HB2 TYR 14 -13.643 4.274 -4.224 820 HB3 TYR 14 HB1 TYR 14 -14.843 2.989 -4.176 821 HD1 TYR 14 HD1 TYR 14 -13.972 0.634 -3.789 822 HD2 TYR 14 HD2 TYR 14 -11.734 4.104 -2.882 823 HE1 TYR 14 HE1 TYR 14 -12.616 -0.688 -2.267 824 HE2 TYR 14 HE2 TYR 14 -10.341 2.804 -1.334 825 HH TYR 14 HH TYR 14 -10.084 0.814 -0.335 826 HA PRO 15 HA PRO 15 -14.628 -1.216 -5.554 827 HB2 PRO 15 HB2 PRO 15 -16.824 -0.947 -7.494 828 HB3 PRO 15 HB1 PRO 15 -16.809 -1.744 -5.924 829 HG2 PRO 15 HG2 PRO 15 -18.071 0.589 -6.352 830 HG3 PRO 15 HG1 PRO 15 -17.356 0.164 -4.800 831 HD2 PRO 15 HD2 PRO 15 -16.405 2.075 -6.860 832 HD3 PRO 15 HD1 PRO 15 -16.185 2.096 -5.106 833 H ASP 16 HN ASP 16 -14.350 0.824 -8.194 834 HA ASP 16 HA ASP 16 -13.695 -1.238 -10.120 835 HB2 ASP 16 HB2 ASP 16 -14.160 1.711 -10.268 836 HB3 ASP 16 HB1 ASP 16 -13.224 0.941 -11.542 837 H PHE 17 HN PHE 17 -12.188 1.466 -8.431 838 HA PHE 17 HA PHE 17 -9.616 1.296 -9.480 839 HB2 PHE 17 HB2 PHE 17 -9.441 3.049 -8.051 840 HB3 PHE 17 HB1 PHE 17 -10.906 2.552 -7.214 841 HD1 PHE 17 HD1 PHE 17 -10.810 1.604 -5.070 842 HD2 PHE 17 HD2 PHE 17 -7.255 2.032 -7.347 843 HE1 PHE 17 HE1 PHE 17 -9.481 0.983 -3.102 844 HE2 PHE 17 HE2 PHE 17 -5.910 1.426 -5.379 845 HZ PHE 17 HZ PHE 17 -7.024 0.900 -3.251 846 H VAL 18 HN VAL 18 -11.142 -0.412 -6.817 847 HA VAL 18 HA VAL 18 -8.802 -1.937 -6.231 848 HB VAL 18 HB VAL 18 -10.140 -1.551 -4.350 849 HG11 VAL 18 HG11 VAL 18 -12.462 -2.644 -5.928 850 HG12 VAL 18 HG12 VAL 18 -12.210 -0.954 -5.484 851 HG13 VAL 18 HG13 VAL 18 -12.509 -2.164 -4.226 852 HG21 VAL 18 HG21 VAL 18 -10.999 -3.834 -3.761 853 HG22 VAL 18 HG22 VAL 18 -9.312 -3.755 -4.277 854 HG23 VAL 18 HG23 VAL 18 -10.556 -4.327 -5.400 855 H ALA 19 HN ALA 19 -11.795 -2.492 -8.032 856 HA ALA 19 HA ALA 19 -11.564 -5.232 -8.446 857 HB1 ALA 19 HB1 ALA 19 -13.514 -3.884 -9.157 858 HB2 ALA 19 HB2 ALA 19 -12.917 -4.948 -10.430 859 HB3 ALA 19 HB3 ALA 19 -12.547 -3.224 -10.477 860 H ARG 20 HN ARG 20 -9.854 -2.598 -10.108 861 HA ARG 20 HA ARG 20 -8.632 -4.499 -11.908 862 HB2 ARG 20 HB2 ARG 20 -7.267 -2.595 -12.702 863 HB3 ARG 20 HB1 ARG 20 -8.989 -2.283 -12.807 864 HG2 ARG 20 HG2 ARG 20 -8.938 -0.694 -11.139 865 HG3 ARG 20 HG1 ARG 20 -7.449 -1.332 -10.434 866 HD2 ARG 20 HD2 ARG 20 -6.136 -0.475 -12.203 867 HD3 ARG 20 HD1 ARG 20 -7.551 -0.114 -13.173 868 HE ARG 20 HE ARG 20 -7.960 1.477 -11.074 869 HH11 ARG 20 HH11 ARG 20 -5.089 0.903 -12.991 870 HH12 ARG 20 HH12 ARG 20 -4.454 2.499 -12.756 871 HH21 ARG 20 HH21 ARG 20 -7.157 3.596 -10.798 872 HH22 ARG 20 HH22 ARG 20 -5.633 4.033 -11.513 873 H LEU 21 HN LEU 21 -8.051 -2.892 -8.926 874 HA LEU 21 HA LEU 21 -5.387 -3.428 -8.453 875 HB2 LEU 21 HB2 LEU 21 -7.227 -2.207 -7.059 876 HB3 LEU 21 HB1 LEU 21 -7.509 -3.778 -6.352 877 HG LEU 21 HG LEU 21 -5.460 -3.788 -5.238 878 HD11 LEU 21 HD11 LEU 21 -3.698 -2.076 -5.648 879 HD12 LEU 21 HD12 LEU 21 -4.627 -1.539 -7.053 880 HD13 LEU 21 HD13 LEU 21 -3.967 -3.173 -7.003 881 HD21 LEU 21 HD21 LEU 21 -7.000 -2.276 -4.209 882 HD22 LEU 21 HD22 LEU 21 -6.498 -0.974 -5.288 883 HD23 LEU 21 HD23 LEU 21 -5.372 -1.604 -4.089 884 H GLN 22 HN GLN 22 -8.248 -5.395 -7.995 885 HA GLN 22 HA GLN 22 -6.952 -7.711 -7.038 886 HB2 GLN 22 HB2 GLN 22 -9.586 -7.582 -8.461 887 HB3 GLN 22 HB1 GLN 22 -9.021 -8.783 -7.277 888 HG2 GLN 22 HG2 GLN 22 -8.870 -6.695 -5.749 889 HG3 GLN 22 HG1 GLN 22 -9.997 -6.011 -6.882 890 HE21 GLN 22 HE21 GLN 22 -11.309 -5.897 -4.974 891 HE22 GLN 22 HE22 GLN 22 -12.301 -7.256 -4.575 892 H ASP 23 HN ASP 23 -8.435 -6.866 -10.092 893 HA ASP 23 HA ASP 23 -8.013 -9.145 -11.544 894 HB2 ASP 23 HB2 ASP 23 -7.832 -6.275 -12.251 895 HB3 ASP 23 HB1 ASP 23 -7.560 -7.497 -13.480 896 H VAL 24 HN VAL 24 -5.693 -6.498 -11.067 897 HA VAL 24 HA VAL 24 -3.861 -7.841 -12.796 898 HB VAL 24 HB VAL 24 -3.914 -5.400 -12.850 899 HG11 VAL 24 HG11 VAL 24 -3.079 -4.093 -10.959 900 HG12 VAL 24 HG12 VAL 24 -2.943 -5.573 -10.009 901 HG13 VAL 24 HG13 VAL 24 -4.528 -5.007 -10.537 902 HG21 VAL 24 HG21 VAL 24 -1.462 -4.958 -12.531 903 HG22 VAL 24 HG22 VAL 24 -1.828 -6.391 -13.498 904 HG23 VAL 24 HG23 VAL 24 -1.336 -6.569 -11.815 905 H ALA 25 HN ALA 25 -4.491 -7.565 -9.418 906 HA ALA 25 HA ALA 25 -1.995 -8.549 -8.456 907 HB1 ALA 25 HB1 ALA 25 -4.745 -8.721 -7.206 908 HB2 ALA 25 HB2 ALA 25 -3.586 -7.416 -6.956 909 HB3 ALA 25 HB3 ALA 25 -3.221 -9.040 -6.380 910 H GLN 26 HN GLN 26 -4.847 -9.782 -9.816 911 HA GLN 26 HA GLN 26 -4.482 -12.508 -9.068 912 HB2 GLN 26 HB2 GLN 26 -6.652 -12.384 -9.540 913 HB3 GLN 26 HB1 GLN 26 -6.417 -10.820 -10.303 914 HG2 GLN 26 HG2 GLN 26 -7.257 -11.936 -12.058 915 HG3 GLN 26 HG1 GLN 26 -5.560 -12.344 -12.286 916 HE21 GLN 26 HE21 GLN 26 -5.533 -14.126 -9.982 917 HE22 GLN 26 HE22 GLN 26 -6.347 -15.557 -10.476 918 H LYS 27 HN LYS 27 -3.788 -10.482 -11.809 919 HA LYS 27 HA LYS 27 -2.920 -12.450 -13.626 920 HB2 LYS 27 HB2 LYS 27 -2.055 -9.558 -13.429 921 HB3 LYS 27 HB1 LYS 27 -1.951 -10.586 -14.861 922 HG2 LYS 27 HG2 LYS 27 -4.463 -9.645 -13.507 923 HG3 LYS 27 HG1 LYS 27 -3.822 -9.078 -15.048 924 HD2 LYS 27 HD2 LYS 27 -4.421 -11.012 -16.153 925 HD3 LYS 27 HD1 LYS 27 -4.416 -11.981 -14.676 926 HE2 LYS 27 HE2 LYS 27 -6.441 -11.028 -13.933 927 HE3 LYS 27 HE1 LYS 27 -6.379 -9.772 -15.159 928 HZ1 LYS 27 HZ1 LYS 27 -7.981 -11.474 -15.738 929 HZ2 LYS 27 HZ2 LYS 27 -6.792 -12.673 -15.650 930 HZ3 LYS 27 HZ3 LYS 27 -6.708 -11.487 -16.851 931 H SER 28 HN SER 28 -1.289 -10.728 -11.042 932 HA SER 28 HA SER 28 1.283 -11.742 -12.017 933 HB2 SER 28 HB2 SER 28 0.727 -9.542 -10.042 934 HB3 SER 28 HB1 SER 28 2.295 -9.942 -10.748 935 HG SER 28 HG SER 28 0.024 -8.792 -11.980 936 H ILE 29 HN ILE 29 -1.088 -12.322 -9.803 937 HA ILE 29 HA ILE 29 0.796 -13.686 -7.989 938 HB ILE 29 HB ILE 29 -1.959 -12.601 -7.418 939 HG12 ILE 29 HG12 ILE 29 0.705 -11.854 -6.214 940 HG13 ILE 29 HG11 ILE 29 -0.166 -10.923 -7.434 941 HG21 ILE 29 HG21 ILE 29 -1.746 -14.652 -6.234 942 HG22 ILE 29 HG22 ILE 29 -1.591 -13.308 -5.100 943 HG23 ILE 29 HG23 ILE 29 -0.151 -14.193 -5.627 944 HD11 ILE 29 HD11 ILE 29 -1.340 -11.634 -4.774 945 HD12 ILE 29 HD12 ILE 29 -1.940 -10.470 -5.966 946 HD13 ILE 29 HD13 ILE 29 -0.450 -10.136 -5.082 947 H ALA 30 HN ALA 30 0.731 -15.844 -8.096 948 HA ALA 30 HA ALA 30 -1.406 -17.185 -9.516 949 HB1 ALA 30 HB1 ALA 30 1.022 -18.322 -8.142 950 HB2 ALA 30 HB2 ALA 30 0.924 -17.867 -9.842 951 HB3 ALA 30 HB3 ALA 30 -0.063 -19.192 -9.224 952 H ASP 31 HN ASP 31 -1.037 -16.083 -6.462 953 HA ASP 31 HA ASP 31 -2.435 -18.321 -5.179 954 HB2 ASP 31 HB2 ASP 31 -0.299 -17.521 -4.187 955 HB3 ASP 31 HB1 ASP 31 -1.075 -15.965 -3.922 956 H GLU 32 HN GLU 32 -4.396 -18.071 -4.288 957 HA GLU 32 HA GLU 32 -5.942 -15.719 -4.877 958 HB2 GLU 32 HB2 GLU 32 -7.744 -16.928 -3.723 959 HB3 GLU 32 HB1 GLU 32 -6.940 -17.959 -4.900 960 HG2 GLU 32 HG2 GLU 32 -5.562 -18.867 -2.973 961 HG3 GLU 32 HG1 GLU 32 -6.676 -18.005 -1.911 962 H LYS 33 HN LYS 33 -4.158 -16.924 -2.108 963 HA LYS 33 HA LYS 33 -5.522 -15.319 -0.160 964 HB2 LYS 33 HB2 LYS 33 -2.731 -16.422 0.112 965 HB3 LYS 33 HB1 LYS 33 -3.881 -16.078 1.382 966 HG2 LYS 33 HG2 LYS 33 -4.771 -18.070 1.263 967 HG3 LYS 33 HG1 LYS 33 -4.889 -18.004 -0.494 968 HD2 LYS 33 HD2 LYS 33 -2.469 -18.502 -0.602 969 HD3 LYS 33 HD1 LYS 33 -2.477 -18.727 1.150 970 HE2 LYS 33 HE2 LYS 33 -2.640 -20.849 0.094 971 HE3 LYS 33 HE1 LYS 33 -4.189 -20.471 0.847 972 HZ1 LYS 33 HZ1 LYS 33 -5.110 -19.937 -1.249 973 HZ2 LYS 33 HZ2 LYS 33 -4.326 -21.424 -1.438 974 HZ3 LYS 33 HZ3 LYS 33 -3.606 -20.006 -2.021 975 H ALA 34 HN ALA 34 -2.282 -15.194 -1.592 976 HA ALA 34 HA ALA 34 -1.604 -12.630 -0.753 977 HB1 ALA 34 HB1 ALA 34 0.048 -12.649 -2.555 978 HB2 ALA 34 HB2 ALA 34 -0.761 -14.035 -3.284 979 HB3 ALA 34 HB3 ALA 34 0.006 -14.194 -1.705 980 H ARG 35 HN ARG 35 -3.748 -13.664 -3.297 981 HA ARG 35 HA ARG 35 -3.751 -11.230 -4.804 982 HB2 ARG 35 HB2 ARG 35 -4.686 -13.659 -5.374 983 HB3 ARG 35 HB1 ARG 35 -6.162 -12.991 -4.699 984 HG2 ARG 35 HG2 ARG 35 -4.720 -11.443 -6.807 985 HG3 ARG 35 HG1 ARG 35 -5.654 -12.860 -7.275 986 HD2 ARG 35 HD2 ARG 35 -6.670 -10.420 -5.827 987 HD3 ARG 35 HD1 ARG 35 -6.996 -10.877 -7.503 988 HE ARG 35 HE ARG 35 -7.833 -12.709 -5.370 989 HH11 ARG 35 HH11 ARG 35 -8.682 -10.477 -7.929 990 HH12 ARG 35 HH12 ARG 35 -10.374 -10.843 -7.861 991 HH21 ARG 35 HH21 ARG 35 -10.059 -13.206 -5.291 992 HH22 ARG 35 HH22 ARG 35 -11.158 -12.388 -6.355 993 H LYS 36 HN LYS 36 -6.009 -12.664 -2.457 994 HA LYS 36 HA LYS 36 -7.702 -10.458 -2.145 995 HB2 LYS 36 HB2 LYS 36 -6.836 -12.345 0.033 996 HB3 LYS 36 HB1 LYS 36 -8.287 -11.353 0.016 997 HG2 LYS 36 HG2 LYS 36 -9.404 -12.766 -1.303 998 HG3 LYS 36 HG1 LYS 36 -7.950 -13.238 -2.215 999 HD2 LYS 36 HD2 LYS 36 -8.693 -15.098 -0.860 1000 HD3 LYS 36 HD1 LYS 36 -7.156 -14.452 -0.244 1001 HE2 LYS 36 HE2 LYS 36 -8.646 -13.015 1.312 1002 HE3 LYS 36 HE1 LYS 36 -9.934 -14.135 0.879 1003 HZ1 LYS 36 HZ1 LYS 36 -8.615 -15.961 1.732 1004 HZ2 LYS 36 HZ2 LYS 36 -8.845 -14.790 2.932 1005 HZ3 LYS 36 HZ3 LYS 36 -7.359 -14.904 2.135 1006 H VAL 37 HN VAL 37 -4.929 -11.443 -0.164 1007 HA VAL 37 HA VAL 37 -5.269 -9.518 1.775 1008 HB VAL 37 HB VAL 37 -2.989 -9.885 2.507 1009 HG11 VAL 37 HG11 VAL 37 -4.364 -12.385 1.505 1010 HG12 VAL 37 HG12 VAL 37 -4.564 -11.605 3.080 1011 HG13 VAL 37 HG13 VAL 37 -3.032 -12.374 2.664 1012 HG21 VAL 37 HG21 VAL 37 -1.505 -11.408 1.173 1013 HG22 VAL 37 HG22 VAL 37 -1.747 -9.801 0.489 1014 HG23 VAL 37 HG23 VAL 37 -2.612 -11.181 -0.181 1015 H ILE 38 HN ILE 38 -3.582 -9.230 -1.320 1016 HA ILE 38 HA ILE 38 -2.691 -6.598 -0.534 1017 HB ILE 38 HB ILE 38 -1.508 -8.405 -2.180 1018 HG12 ILE 38 HG12 ILE 38 -1.108 -5.439 -2.420 1019 HG13 ILE 38 HG11 ILE 38 -0.671 -6.316 -0.961 1020 HG21 ILE 38 HG21 ILE 38 -1.517 -7.531 -4.439 1021 HG22 ILE 38 HG22 ILE 38 -2.655 -6.269 -3.974 1022 HG23 ILE 38 HG23 ILE 38 -3.165 -7.959 -3.971 1023 HD11 ILE 38 HD11 ILE 38 0.736 -7.754 -2.577 1024 HD12 ILE 38 HD12 ILE 38 1.298 -6.148 -2.117 1025 HD13 ILE 38 HD13 ILE 38 0.528 -6.386 -3.675 1026 H VAL 39 HN VAL 39 -5.233 -7.942 -2.594 1027 HA VAL 39 HA VAL 39 -5.935 -5.399 -3.649 1028 HB VAL 39 HB VAL 39 -7.902 -6.279 -4.451 1029 HG11 VAL 39 HG11 VAL 39 -5.944 -8.555 -4.310 1030 HG12 VAL 39 HG12 VAL 39 -6.000 -7.274 -5.520 1031 HG13 VAL 39 HG13 VAL 39 -7.304 -8.463 -5.426 1032 HG21 VAL 39 HG21 VAL 39 -7.773 -8.482 -2.406 1033 HG22 VAL 39 HG22 VAL 39 -8.936 -8.406 -3.732 1034 HG23 VAL 39 HG23 VAL 39 -8.944 -7.165 -2.480 1035 H GLU 40 HN GLU 40 -7.203 -7.245 -0.918 1036 HA GLU 40 HA GLU 40 -8.926 -5.318 0.086 1037 HB2 GLU 40 HB2 GLU 40 -7.482 -7.480 1.607 1038 HB3 GLU 40 HB1 GLU 40 -8.980 -6.715 2.064 1039 HG2 GLU 40 HG2 GLU 40 -9.172 -7.807 -0.568 1040 HG3 GLU 40 HG1 GLU 40 -8.639 -9.011 0.576 1041 H LEU 41 HN LEU 41 -5.469 -5.669 0.432 1042 HA LEU 41 HA LEU 41 -5.358 -3.716 2.570 1043 HB2 LEU 41 HB2 LEU 41 -3.626 -5.679 1.647 1044 HB3 LEU 41 HB1 LEU 41 -2.834 -4.169 1.239 1045 HG LEU 41 HG LEU 41 -1.996 -4.666 3.345 1046 HD11 LEU 41 HD11 LEU 41 -2.783 -2.974 4.795 1047 HD12 LEU 41 HD12 LEU 41 -4.370 -2.963 4.037 1048 HD13 LEU 41 HD13 LEU 41 -2.967 -2.374 3.151 1049 HD21 LEU 41 HD21 LEU 41 -3.336 -5.446 5.221 1050 HD22 LEU 41 HD22 LEU 41 -3.484 -6.528 3.838 1051 HD23 LEU 41 HD23 LEU 41 -4.784 -5.397 4.216 1052 H MET 42 HN MET 42 -4.216 -3.781 -0.825 1053 HA MET 42 HA MET 42 -3.264 -1.121 -0.836 1054 HB2 MET 42 HB2 MET 42 -4.171 -2.839 -3.140 1055 HB3 MET 42 HB1 MET 42 -3.292 -1.315 -3.313 1056 HG2 MET 42 HG2 MET 42 -2.343 -3.877 -2.054 1057 HG3 MET 42 HG1 MET 42 -1.760 -3.115 -3.523 1058 HE1 MET 42 HE1 MET 42 0.116 -4.154 -1.185 1059 HE2 MET 42 HE2 MET 42 1.287 -2.835 -1.123 1060 HE3 MET 42 HE3 MET 42 0.698 -3.423 -2.684 1061 H ALA 43 HN ALA 43 -6.347 -2.519 -1.176 1062 HA ALA 43 HA ALA 43 -7.931 -0.626 -2.295 1063 HB1 ALA 43 HB1 ALA 43 -9.631 -1.347 -0.612 1064 HB2 ALA 43 HB2 ALA 43 -8.351 -2.264 0.192 1065 HB3 ALA 43 HB3 ALA 43 -8.820 -2.666 -1.459 1066 H TYR 44 HN TYR 44 -6.201 -0.479 0.744 1067 HA TYR 44 HA TYR 44 -7.318 2.196 1.301 1068 HB2 TYR 44 HB2 TYR 44 -7.498 0.696 3.197 1069 HB3 TYR 44 HB1 TYR 44 -5.832 0.222 3.000 1070 HD1 TYR 44 HD1 TYR 44 -8.081 2.550 4.587 1071 HD2 TYR 44 HD2 TYR 44 -4.010 1.874 3.602 1072 HE1 TYR 44 HE1 TYR 44 -7.419 4.169 6.299 1073 HE2 TYR 44 HE2 TYR 44 -3.329 3.506 5.305 1074 HH TYR 44 HH TYR 44 -4.362 5.501 6.467 1075 H GLU 45 HN GLU 45 -4.246 0.472 1.770 1076 HA GLU 45 HA GLU 45 -2.553 2.550 1.971 1077 HB2 GLU 45 HB2 GLU 45 -1.913 0.028 0.480 1078 HB3 GLU 45 HB1 GLU 45 -0.793 1.032 1.389 1079 HG2 GLU 45 HG2 GLU 45 -3.091 -0.493 2.578 1080 HG3 GLU 45 HG1 GLU 45 -1.433 -1.068 2.536 1081 H ASN 46 HN ASN 46 -3.986 1.407 -1.033 1082 HA ASN 46 HA ASN 46 -2.154 3.125 -2.520 1083 HB2 ASN 46 HB2 ASN 46 -3.603 0.593 -3.147 1084 HB3 ASN 46 HB1 ASN 46 -3.302 1.732 -4.451 1085 HD21 ASN 46 HD21 ASN 46 -1.817 0.414 -5.527 1086 HD22 ASN 46 HD22 ASN 46 -0.258 0.085 -4.891 1087 H ALA 47 HN ALA 47 -5.410 2.795 -1.478 1088 HA ALA 47 HA ALA 47 -6.811 3.906 -3.632 1089 HB1 ALA 47 HB1 ALA 47 -8.585 4.399 -2.020 1090 HB2 ALA 47 HB2 ALA 47 -7.473 4.036 -0.700 1091 HB3 ALA 47 HB3 ALA 47 -7.948 2.764 -1.827 1092 H ASN 48 HN ASN 48 -8.192 5.932 -3.211 1093 HA ASN 48 HA ASN 48 -6.564 8.210 -3.328 1094 HB2 ASN 48 HB2 ASN 48 -9.473 7.668 -3.209 1095 HB3 ASN 48 HB1 ASN 48 -8.974 9.257 -2.635 1096 HD21 ASN 48 HD21 ASN 48 -10.418 8.225 -5.108 1097 HD22 ASN 48 HD22 ASN 48 -9.558 8.962 -6.418 1098 HA PRO 49 HA PRO 49 -5.320 8.983 0.793 1099 HB2 PRO 49 HB2 PRO 49 -6.057 11.747 0.741 1100 HB3 PRO 49 HB1 PRO 49 -4.453 11.051 0.523 1101 HG2 PRO 49 HG2 PRO 49 -6.384 11.997 -1.493 1102 HG3 PRO 49 HG1 PRO 49 -4.624 11.837 -1.605 1103 HD2 PRO 49 HD2 PRO 49 -6.324 10.170 -2.893 1104 HD3 PRO 49 HD1 PRO 49 -4.745 9.631 -2.276 1105 H GLU 50 HN GLU 50 -8.299 10.625 -0.137 1106 HA GLU 50 HA GLU 50 -9.522 10.670 2.383 1107 HB2 GLU 50 HB2 GLU 50 -10.327 12.279 0.963 1108 HB3 GLU 50 HB1 GLU 50 -10.317 11.213 -0.433 1109 HG2 GLU 50 HG2 GLU 50 -12.487 11.032 -0.142 1110 HG3 GLU 50 HG1 GLU 50 -12.115 10.059 1.260 1111 H CYS 51 HN CYS 51 -9.477 8.359 -0.261 1112 HA CYS 51 HA CYS 51 -11.882 7.067 0.551 1113 HB2 CYS 51 HB2 CYS 51 -9.763 6.405 -1.506 1114 HB3 CYS 51 HB1 CYS 51 -11.185 5.404 -1.203 1115 HG CYS 51 HG CYS 51 -13.005 7.453 -1.863 1116 H GLN 52 HN GLN 52 -8.439 6.566 0.914 1117 HA GLN 52 HA GLN 52 -8.774 4.090 2.325 1118 HB2 GLN 52 HB2 GLN 52 -6.456 4.247 2.877 1119 HB3 GLN 52 HB1 GLN 52 -6.630 4.755 1.203 1120 HG2 GLN 52 HG2 GLN 52 -6.575 7.110 1.988 1121 HG3 GLN 52 HG1 GLN 52 -6.226 6.513 3.609 1122 HE21 GLN 52 HE21 GLN 52 -4.734 4.272 2.519 1123 HE22 GLN 52 HE22 GLN 52 -3.214 4.885 2.027 1124 H SER 53 HN SER 53 -8.672 7.440 2.952 1125 HA SER 53 HA SER 53 -8.746 7.339 5.770 1126 HB2 SER 53 HB2 SER 53 -9.400 9.373 3.688 1127 HB3 SER 53 HB1 SER 53 -9.713 9.709 5.397 1128 HG SER 53 HG SER 53 -7.288 9.368 4.031 1129 H ALA 54 HN ALA 54 -11.106 6.905 3.271 1130 HA ALA 54 HA ALA 54 -13.332 6.865 5.078 1131 HB1 ALA 54 HB1 ALA 54 -14.534 5.823 3.252 1132 HB2 ALA 54 HB2 ALA 54 -13.009 5.529 2.409 1133 HB3 ALA 54 HB3 ALA 54 -13.572 7.177 2.658 1134 H ILE 55 HN ILE 55 -10.839 4.740 4.197 1135 HA ILE 55 HA ILE 55 -12.257 2.368 5.009 1136 HB ILE 55 HB ILE 55 -9.605 2.851 3.738 1137 HG12 ILE 55 HG12 ILE 55 -11.778 1.140 2.664 1138 HG13 ILE 55 HG11 ILE 55 -11.989 2.897 2.642 1139 HG21 ILE 55 HG21 ILE 55 -10.765 0.226 4.637 1140 HG22 ILE 55 HG22 ILE 55 -9.271 0.972 5.204 1141 HG23 ILE 55 HG23 ILE 55 -9.396 0.397 3.541 1142 HD11 ILE 55 HD11 ILE 55 -11.021 1.862 0.584 1143 HD12 ILE 55 HD12 ILE 55 -9.551 1.525 1.535 1144 HD13 ILE 55 HD13 ILE 55 -10.098 3.196 1.291 1145 H LYS 56 HN LYS 56 -9.625 4.350 6.349 1146 HA LYS 56 HA LYS 56 -8.203 2.584 7.796 1147 HB2 LYS 56 HB2 LYS 56 -8.729 4.664 9.684 1148 HB3 LYS 56 HB1 LYS 56 -7.258 4.295 8.807 1149 HG2 LYS 56 HG2 LYS 56 -7.572 6.417 8.110 1150 HG3 LYS 56 HG1 LYS 56 -8.558 5.601 6.893 1151 HD2 LYS 56 HD2 LYS 56 -10.502 6.237 7.824 1152 HD3 LYS 56 HD1 LYS 56 -9.851 6.331 9.461 1153 HE2 LYS 56 HE2 LYS 56 -9.745 8.383 7.243 1154 HE3 LYS 56 HE1 LYS 56 -10.266 8.558 8.919 1155 HZ1 LYS 56 HZ1 LYS 56 -7.990 8.359 9.657 1156 HZ2 LYS 56 HZ2 LYS 56 -8.133 9.620 8.540 1157 HZ3 LYS 56 HZ3 LYS 56 -7.454 8.147 8.067 1158 HA PRO 57 HA PRO 57 -11.482 2.293 11.450 1159 HB2 PRO 57 HB2 PRO 57 -14.054 2.226 10.562 1160 HB3 PRO 57 HB1 PRO 57 -13.275 3.707 11.140 1161 HG2 PRO 57 HG2 PRO 57 -13.515 2.692 8.319 1162 HG3 PRO 57 HG1 PRO 57 -13.965 4.296 8.951 1163 HD2 PRO 57 HD2 PRO 57 -11.651 3.974 7.734 1164 HD3 PRO 57 HD1 PRO 57 -11.685 4.909 9.237 1165 H LEU 58 HN LEU 58 -11.994 1.095 8.181 1166 HA LEU 58 HA LEU 58 -12.885 -1.521 9.123 1167 HB2 LEU 58 HB2 LEU 58 -12.382 -0.959 6.254 1168 HB3 LEU 58 HB1 LEU 58 -13.642 -1.945 6.984 1169 HG LEU 58 HG LEU 58 -13.569 1.075 6.860 1170 HD11 LEU 58 HD11 LEU 58 -15.104 -1.008 5.329 1171 HD12 LEU 58 HD12 LEU 58 -13.949 0.164 4.695 1172 HD13 LEU 58 HD13 LEU 58 -15.507 0.708 5.325 1173 HD21 LEU 58 HD21 LEU 58 -15.857 0.975 7.716 1174 HD22 LEU 58 HD22 LEU 58 -14.717 0.283 8.870 1175 HD23 LEU 58 HD23 LEU 58 -15.726 -0.777 7.884 1176 H LYS 59 HN LYS 59 -10.199 0.238 8.113 1177 HA LYS 59 HA LYS 59 -8.600 -1.677 6.881 1178 HB2 LYS 59 HB2 LYS 59 -7.942 0.666 7.030 1179 HB3 LYS 59 HB1 LYS 59 -7.768 0.519 8.771 1180 HG2 LYS 59 HG2 LYS 59 -5.603 0.208 8.286 1181 HG3 LYS 59 HG1 LYS 59 -6.132 -1.433 7.949 1182 HD2 LYS 59 HD2 LYS 59 -5.852 0.759 5.928 1183 HD3 LYS 59 HD1 LYS 59 -4.710 -0.573 6.149 1184 HE2 LYS 59 HE2 LYS 59 -7.612 -0.788 5.314 1185 HE3 LYS 59 HE1 LYS 59 -6.215 -1.001 4.271 1186 HZ1 LYS 59 HZ1 LYS 59 -5.582 -2.942 5.557 1187 HZ2 LYS 59 HZ2 LYS 59 -7.154 -3.117 4.947 1188 HZ3 LYS 59 HZ3 LYS 59 -6.915 -2.728 6.572 1189 H GLY 60 HN GLY 60 -8.287 -3.661 7.591 1190 HA2 GLY 60 HA3 GLY 60 -7.115 -5.147 9.078 1191 HA3 GLY 60 HA2 GLY 60 -7.486 -4.046 10.393 1192 H LYS 61 HN LYS 61 -10.268 -3.686 9.496 1193 HA LYS 61 HA LYS 61 -11.244 -6.210 10.620 1194 HB2 LYS 61 HB2 LYS 61 -12.827 -3.668 10.420 1195 HB3 LYS 61 HB1 LYS 61 -12.996 -4.995 11.569 1196 HG2 LYS 61 HG2 LYS 61 -10.683 -3.119 11.423 1197 HG3 LYS 61 HG1 LYS 61 -12.002 -3.020 12.585 1198 HD2 LYS 61 HD2 LYS 61 -11.339 -4.973 13.683 1199 HD3 LYS 61 HD1 LYS 61 -10.409 -5.534 12.284 1200 HE2 LYS 61 HE2 LYS 61 -8.702 -4.036 12.661 1201 HE3 LYS 61 HE1 LYS 61 -9.663 -3.056 13.766 1202 HZ1 LYS 61 HZ1 LYS 61 -8.054 -4.381 14.973 1203 HZ2 LYS 61 HZ2 LYS 61 -8.656 -5.804 14.288 1204 HZ3 LYS 61 HZ3 LYS 61 -9.615 -4.903 15.347 1205 H VAL 62 HN VAL 62 -11.872 -7.508 9.189 1206 HA VAL 62 HA VAL 62 -13.834 -6.559 7.211 1207 HB VAL 62 HB VAL 62 -11.941 -7.464 6.020 1208 HG11 VAL 62 HG11 VAL 62 -11.199 -9.791 6.278 1209 HG12 VAL 62 HG12 VAL 62 -12.291 -9.975 7.652 1210 HG13 VAL 62 HG13 VAL 62 -10.941 -8.843 7.743 1211 HG21 VAL 62 HG21 VAL 62 -13.019 -9.284 4.761 1212 HG22 VAL 62 HG22 VAL 62 -14.111 -7.933 5.064 1213 HG23 VAL 62 HG23 VAL 62 -14.246 -9.408 6.024 1214 HA PRO 63 HA PRO 63 -16.912 -8.874 9.534 1215 HB2 PRO 63 HB2 PRO 63 -17.986 -9.161 6.771 1216 HB3 PRO 63 HB1 PRO 63 -18.824 -8.700 8.247 1217 HG2 PRO 63 HG2 PRO 63 -18.181 -6.856 6.461 1218 HG3 PRO 63 HG1 PRO 63 -17.995 -6.524 8.193 1219 HD2 PRO 63 HD2 PRO 63 -15.914 -7.147 6.149 1220 HD3 PRO 63 HD1 PRO 63 -15.829 -6.070 7.556 1221 H ALA 64 HN ALA 64 -17.112 -10.980 9.992 1222 HA ALA 64 HA ALA 64 -15.403 -12.874 8.806 1223 HB1 ALA 64 HB1 ALA 64 -17.758 -13.337 10.634 1224 HB2 ALA 64 HB2 ALA 64 -16.104 -13.003 11.147 1225 HB3 ALA 64 HB3 ALA 64 -16.475 -14.495 10.283 1226 H GLY 65 HN GLY 65 -15.667 -13.583 6.803 1227 HA2 GLY 65 HA3 GLY 65 -16.813 -15.144 5.374 1228 HA3 GLY 65 HA2 GLY 65 -18.335 -14.560 6.030 1229 H SER 66 HN SER 66 -16.965 -11.749 5.743 1230 HA SER 66 HA SER 66 -17.948 -11.371 3.014 1231 HB2 SER 66 HB2 SER 66 -18.593 -9.876 5.047 1232 HB3 SER 66 HB1 SER 66 -16.999 -9.162 4.811 1233 HG SER 66 HG SER 66 -18.227 -7.920 3.560 1234 H ASP 67 HN ASP 67 -16.730 -9.377 2.061 1235 HA ASP 67 HA ASP 67 -13.875 -10.041 1.815 1236 HB2 ASP 67 HB2 ASP 67 -15.999 -8.900 0.056 1237 HB3 ASP 67 HB1 ASP 67 -14.320 -8.493 -0.289 1238 H VAL 68 HN VAL 68 -12.343 -8.259 2.080 1239 HA VAL 68 HA VAL 68 -13.437 -6.219 3.735 1240 HB VAL 68 HB VAL 68 -11.429 -5.642 4.442 1241 HG11 VAL 68 HG11 VAL 68 -9.738 -7.255 4.403 1242 HG12 VAL 68 HG12 VAL 68 -10.272 -7.910 2.846 1243 HG13 VAL 68 HG13 VAL 68 -11.264 -8.134 4.299 1244 HG21 VAL 68 HG21 VAL 68 -9.525 -5.141 2.993 1245 HG22 VAL 68 HG22 VAL 68 -11.000 -4.283 2.539 1246 HG23 VAL 68 HG23 VAL 68 -10.474 -5.686 1.599 1247 H ILE 69 HN ILE 69 -12.446 -6.539 0.461 1248 HA ILE 69 HA ILE 69 -12.348 -3.901 -0.335 1249 HB ILE 69 HB ILE 69 -13.190 -6.355 -1.846 1250 HG12 ILE 69 HG12 ILE 69 -10.908 -6.553 -1.366 1251 HG13 ILE 69 HG11 ILE 69 -10.916 -5.819 -2.964 1252 HG21 ILE 69 HG21 ILE 69 -14.252 -4.550 -2.990 1253 HG22 ILE 69 HG22 ILE 69 -12.809 -4.961 -3.921 1254 HG23 ILE 69 HG23 ILE 69 -12.813 -3.539 -2.875 1255 HD11 ILE 69 HD11 ILE 69 -10.579 -3.623 -1.933 1256 HD12 ILE 69 HD12 ILE 69 -9.274 -4.766 -1.587 1257 HD13 ILE 69 HD13 ILE 69 -10.494 -4.407 -0.356 1258 H SER 70 HN SER 70 -15.058 -6.098 -0.381 1259 HA SER 70 HA SER 70 -17.071 -4.581 -1.393 1260 HB2 SER 70 HB2 SER 70 -17.252 -6.946 -0.630 1261 HB3 SER 70 HB1 SER 70 -17.276 -6.381 1.036 1262 HG SER 70 HG SER 70 -19.378 -6.808 -0.016 1263 H GLU 71 HN GLU 71 -15.660 -4.380 1.809 1264 HA GLU 71 HA GLU 71 -17.614 -2.493 2.789 1265 HB2 GLU 71 HB2 GLU 71 -15.093 -3.196 4.218 1266 HB3 GLU 71 HB1 GLU 71 -16.707 -2.933 4.871 1267 HG2 GLU 71 HG2 GLU 71 -16.230 -5.264 3.097 1268 HG3 GLU 71 HG1 GLU 71 -15.665 -5.330 4.752 1269 H TYR 72 HN TYR 72 -14.384 -2.585 1.593 1270 HA TYR 72 HA TYR 72 -13.613 0.001 2.508 1271 HB2 TYR 72 HB2 TYR 72 -12.459 -1.986 0.564 1272 HB3 TYR 72 HB1 TYR 72 -11.759 -0.387 0.763 1273 HD1 TYR 72 HD1 TYR 72 -13.205 -1.872 3.715 1274 HD2 TYR 72 HD2 TYR 72 -9.659 -1.555 1.405 1275 HE1 TYR 72 HE1 TYR 72 -11.896 -2.685 5.613 1276 HE2 TYR 72 HE2 TYR 72 -8.337 -2.386 3.303 1277 HH TYR 72 HH TYR 72 -9.858 -3.706 6.132 1278 H VAL 73 HN VAL 73 -14.834 -1.387 -0.465 1279 HA VAL 73 HA VAL 73 -14.853 1.025 -1.947 1280 HB VAL 73 HB VAL 73 -16.024 -0.001 -3.627 1281 HG11 VAL 73 HG11 VAL 73 -14.644 -2.216 -2.183 1282 HG12 VAL 73 HG12 VAL 73 -14.011 -1.181 -3.460 1283 HG13 VAL 73 HG13 VAL 73 -15.272 -2.356 -3.823 1284 HG21 VAL 73 HG21 VAL 73 -17.192 -2.126 -1.874 1285 HG22 VAL 73 HG22 VAL 73 -17.676 -1.641 -3.508 1286 HG23 VAL 73 HG23 VAL 73 -17.976 -0.569 -2.138 1287 H LYS 74 HN LYS 74 -16.997 -0.596 0.245 1288 HA LYS 74 HA LYS 74 -19.271 1.068 -0.030 1289 HB2 LYS 74 HB2 LYS 74 -18.515 -1.187 1.446 1290 HB3 LYS 74 HB1 LYS 74 -18.841 0.064 2.639 1291 HG2 LYS 74 HG2 LYS 74 -20.925 -0.808 2.488 1292 HG3 LYS 74 HG1 LYS 74 -21.031 0.379 1.189 1293 HD2 LYS 74 HD2 LYS 74 -20.247 -2.502 0.777 1294 HD3 LYS 74 HD1 LYS 74 -21.897 -1.901 0.610 1295 HE2 LYS 74 HE2 LYS 74 -19.542 -0.869 -0.955 1296 HE3 LYS 74 HE1 LYS 74 -20.650 -2.109 -1.538 1297 HZ1 LYS 74 HZ1 LYS 74 -22.452 -0.547 -1.437 1298 HZ2 LYS 74 HZ2 LYS 74 -21.200 0.132 -2.345 1299 HZ3 LYS 74 HZ3 LYS 74 -21.462 0.637 -0.753 1300 H ALA 75 HN ALA 75 -16.294 1.213 1.765 1301 HA ALA 75 HA ALA 75 -16.945 3.313 3.544 1302 HB1 ALA 75 HB1 ALA 75 -14.301 2.469 2.362 1303 HB2 ALA 75 HB2 ALA 75 -15.000 1.921 3.884 1304 HB3 ALA 75 HB3 ALA 75 -14.487 3.598 3.706 1305 H CYS 76 HN CYS 76 -15.446 3.238 0.365 1306 HA CYS 76 HA CYS 76 -15.470 6.129 0.175 1307 HB2 CYS 76 HB2 CYS 76 -14.532 4.146 -1.883 1308 HB3 CYS 76 HB1 CYS 76 -13.973 5.786 -1.595 1309 HG CYS 76 HG CYS 76 -13.266 2.991 0.193 1310 H ASP 77 HN ASP 77 -17.745 3.932 -0.163 1311 HA ASP 77 HA ASP 77 -18.833 4.290 -2.710 1312 HB2 ASP 77 HB2 ASP 77 -19.621 2.485 -1.426 1313 HB3 ASP 77 HB1 ASP 77 -20.033 3.494 -0.049 1314 H GLY 78 HN GLY 78 -18.932 6.313 0.123 1315 HA2 GLY 78 HA3 GLY 78 -20.862 8.117 -1.124 1316 HA3 GLY 78 HA2 GLY 78 -20.177 8.280 0.486 1317 H ILE 79 HN ILE 79 -17.624 7.601 -1.409 1318 HA ILE 79 HA ILE 79 -16.861 10.401 -1.543 1319 HB ILE 79 HB ILE 79 -15.205 7.901 -1.771 1320 HG12 ILE 79 HG12 ILE 79 -15.264 9.997 0.406 1321 HG13 ILE 79 HG11 ILE 79 -16.089 8.442 0.502 1322 HG21 ILE 79 HG21 ILE 79 -14.209 9.640 -3.123 1323 HG22 ILE 79 HG22 ILE 79 -13.248 9.394 -1.662 1324 HG23 ILE 79 HG23 ILE 79 -14.327 10.781 -1.784 1325 HD11 ILE 79 HD11 ILE 79 -14.059 7.269 0.576 1326 HD12 ILE 79 HD12 ILE 79 -13.857 8.652 1.657 1327 HD13 ILE 79 HD13 ILE 79 -13.142 8.677 0.049 1328 H GLY 80 HN GLY 80 -16.746 11.452 -3.409 1329 HA2 GLY 80 HA3 GLY 80 -15.511 10.671 -5.695 1330 HA3 GLY 80 HA2 GLY 80 -17.152 10.100 -5.905 1331 H GLY 81 HN GLY 81 -16.446 13.002 -4.109 1332 HA2 GLY 81 HA3 GLY 81 -16.140 14.981 -5.835 1333 HA3 GLY 81 HA2 GLY 81 -17.827 14.582 -6.121 1334 H ALA 82 HN ALA 82 -19.327 15.436 -4.823 1335 HA ALA 82 HA ALA 82 -18.726 17.711 -3.358 1336 HB1 ALA 82 HB1 ALA 82 -21.209 16.028 -3.141 1337 HB2 ALA 82 HB2 ALA 82 -20.897 17.238 -4.383 1338 HB3 ALA 82 HB3 ALA 82 -21.047 17.727 -2.697 1339 H MET 83 HN MET 83 -19.715 14.530 -2.069 1340 HA MET 83 HA MET 83 -19.415 15.340 0.637 1341 HB2 MET 83 HB2 MET 83 -19.406 12.534 -0.491 1342 HB3 MET 83 HB1 MET 83 -19.630 12.967 1.196 1343 HG2 MET 83 HG2 MET 83 -21.679 14.194 0.565 1344 HG3 MET 83 HG1 MET 83 -21.469 13.626 -1.089 1345 HE1 MET 83 HE1 MET 83 -24.143 13.181 0.598 1346 HE2 MET 83 HE2 MET 83 -24.513 11.511 0.166 1347 HE3 MET 83 HE3 MET 83 -23.921 12.629 -1.063 1348 H HIS 84 HN HIS 84 -17.289 13.938 -1.736 1349 HA HIS 84 HA HIS 84 -15.127 13.238 -0.077 1350 HB2 HIS 84 HB2 HIS 84 -15.057 12.479 -2.330 1351 HB3 HIS 84 HB1 HIS 84 -15.322 14.093 -2.968 1352 HD1 HIS 84 HD1 HIS 84 -13.287 14.537 -4.298 1353 HD2 HIS 84 HD2 HIS 84 -12.377 12.989 -0.556 1354 HE1 HIS 84 HE1 HIS 84 -10.789 14.643 -4.116 1355 HE2 HIS 84 HE2 HIS 84 -10.245 13.625 -1.877 1356 H LYS 85 HN LYS 85 -16.149 16.345 -1.412 1357 HA LYS 85 HA LYS 85 -13.714 17.656 -0.592 1358 HB2 LYS 85 HB2 LYS 85 -16.317 18.912 -1.472 1359 HB3 LYS 85 HB1 LYS 85 -14.742 19.692 -1.404 1360 HG2 LYS 85 HG2 LYS 85 -15.523 17.419 -3.220 1361 HG3 LYS 85 HG1 LYS 85 -15.328 19.111 -3.688 1362 HD2 LYS 85 HD2 LYS 85 -12.967 19.008 -3.161 1363 HD3 LYS 85 HD1 LYS 85 -13.145 17.358 -2.560 1364 HE2 LYS 85 HE2 LYS 85 -12.259 17.197 -4.760 1365 HE3 LYS 85 HE1 LYS 85 -13.952 16.710 -4.842 1366 HZ1 LYS 85 HZ1 LYS 85 -14.518 18.883 -5.695 1367 HZ2 LYS 85 HZ2 LYS 85 -13.326 18.181 -6.669 1368 HZ3 LYS 85 HZ3 LYS 85 -12.911 19.394 -5.570 1369 H ALA 86 HN ALA 86 -16.682 16.822 0.842 1370 HA ALA 86 HA ALA 86 -16.519 18.780 2.971 1371 HB1 ALA 86 HB1 ALA 86 -18.479 17.680 3.873 1372 HB2 ALA 86 HB2 ALA 86 -18.297 16.358 2.720 1373 HB3 ALA 86 HB3 ALA 86 -18.703 17.978 2.149 1374 H MET 87 HN MET 87 -16.162 15.300 2.578 1375 HA MET 87 HA MET 87 -15.394 14.875 5.310 1376 HB2 MET 87 HB2 MET 87 -15.366 13.034 2.908 1377 HB3 MET 87 HB1 MET 87 -15.109 12.528 4.579 1378 HG2 MET 87 HG2 MET 87 -17.520 14.039 4.425 1379 HG3 MET 87 HG1 MET 87 -17.540 12.793 3.182 1380 HE1 MET 87 HE1 MET 87 -19.746 11.315 6.091 1381 HE2 MET 87 HE2 MET 87 -19.706 11.763 4.386 1382 HE3 MET 87 HE3 MET 87 -19.609 13.011 5.629 1383 H LEU 88 HN LEU 88 -13.789 15.816 2.508 1384 HA LEU 88 HA LEU 88 -11.323 14.696 2.542 1385 HB2 LEU 88 HB2 LEU 88 -12.434 16.643 1.173 1386 HB3 LEU 88 HB1 LEU 88 -11.540 17.654 2.287 1387 HG LEU 88 HG LEU 88 -9.577 17.268 1.245 1388 HD11 LEU 88 HD11 LEU 88 -9.438 14.941 2.018 1389 HD12 LEU 88 HD12 LEU 88 -8.865 15.104 0.361 1390 HD13 LEU 88 HD13 LEU 88 -10.466 14.437 0.676 1391 HD21 LEU 88 HD21 LEU 88 -9.871 16.720 -1.138 1392 HD22 LEU 88 HD22 LEU 88 -11.055 17.890 -0.552 1393 HD23 LEU 88 HD23 LEU 88 -11.518 16.202 -0.775 1394 H MET 89 HN MET 89 -12.471 17.332 4.638 1395 HA MET 89 HA MET 89 -9.904 17.546 5.958 1396 HB2 MET 89 HB2 MET 89 -11.356 19.524 5.553 1397 HB3 MET 89 HB1 MET 89 -12.535 18.855 6.670 1398 HG2 MET 89 HG2 MET 89 -10.874 18.974 8.472 1399 HG3 MET 89 HG1 MET 89 -9.723 19.687 7.344 1400 HE1 MET 89 HE1 MET 89 -10.070 22.050 6.182 1401 HE2 MET 89 HE2 MET 89 -11.451 23.103 6.488 1402 HE3 MET 89 HE3 MET 89 -11.675 21.588 5.615 1403 H ALA 90 HN ALA 90 -12.631 15.581 6.277 1404 HA ALA 90 HA ALA 90 -12.393 15.318 9.182 1405 HB1 ALA 90 HB1 ALA 90 -14.466 14.067 9.060 1406 HB2 ALA 90 HB2 ALA 90 -14.387 14.054 7.296 1407 HB3 ALA 90 HB3 ALA 90 -14.634 15.576 8.161 1408 H GLN 91 HN GLN 91 -12.040 13.430 6.240 1409 HA GLN 91 HA GLN 91 -11.227 11.114 7.836 1410 HB2 GLN 91 HB2 GLN 91 -11.912 11.347 4.913 1411 HB3 GLN 91 HB1 GLN 91 -11.539 9.855 5.765 1412 HG2 GLN 91 HG2 GLN 91 -13.491 10.116 7.144 1413 HG3 GLN 91 HG1 GLN 91 -13.858 11.658 6.379 1414 HE21 GLN 91 HE21 GLN 91 -13.124 10.946 3.783 1415 HE22 GLN 91 HE22 GLN 91 -14.272 9.803 3.206 1416 H LEU 92 HN LEU 92 -10.225 12.846 4.883 1417 HA LEU 92 HA LEU 92 -7.713 11.669 4.618 1418 HB2 LEU 92 HB2 LEU 92 -9.001 13.038 2.943 1419 HB3 LEU 92 HB1 LEU 92 -8.418 14.460 3.781 1420 HG LEU 92 HG LEU 92 -7.207 13.254 1.649 1421 HD11 LEU 92 HD11 LEU 92 -6.864 15.541 2.380 1422 HD12 LEU 92 HD12 LEU 92 -5.317 14.731 2.130 1423 HD13 LEU 92 HD13 LEU 92 -5.932 14.972 3.765 1424 HD21 LEU 92 HD21 LEU 92 -5.076 12.351 2.486 1425 HD22 LEU 92 HD22 LEU 92 -6.460 11.348 2.918 1426 HD23 LEU 92 HD23 LEU 92 -5.725 12.403 4.125 1427 H GLU 93 HN GLU 93 -8.848 13.595 7.055 1428 HA GLU 93 HA GLU 93 -7.108 15.489 7.803 1429 HB2 GLU 93 HB2 GLU 93 -7.576 14.823 10.176 1430 HB3 GLU 93 HB1 GLU 93 -9.008 15.012 9.167 1431 HG2 GLU 93 HG2 GLU 93 -9.375 12.706 9.062 1432 HG3 GLU 93 HG1 GLU 93 -7.750 12.323 9.628 Start of MODEL 7 1 H2 PRO 1 HT1 PRO 1 -5.005 -4.324 13.398 2 H3 PRO 1 HT2 PRO 1 -5.471 -2.909 14.068 3 HA PRO 1 HA PRO 1 -6.183 -2.604 12.050 4 HB2 PRO 1 HB2 PRO 1 -4.138 -1.369 10.852 5 HB3 PRO 1 HB1 PRO 1 -4.895 -0.688 12.293 6 HG2 PRO 1 HG2 PRO 1 -2.277 -1.980 11.997 7 HG3 PRO 1 HG1 PRO 1 -2.857 -0.896 13.272 8 HD2 PRO 1 HD2 PRO 1 -2.698 -3.799 13.271 9 HD3 PRO 1 HD1 PRO 1 -3.120 -2.713 14.612 10 H SER 2 HN SER 2 -4.446 -2.404 9.649 11 HA SER 2 HA SER 2 -4.142 -5.052 8.738 12 HB2 SER 2 HB2 SER 2 -2.412 -2.710 7.930 13 HB3 SER 2 HB1 SER 2 -2.785 -4.133 6.985 14 HG SER 2 HG SER 2 -3.980 -1.935 6.773 15 H PHE 3 HN PHE 3 -2.012 -6.158 8.417 16 HA PHE 3 HA PHE 3 -0.229 -5.882 10.610 17 HB2 PHE 3 HB2 PHE 3 1.266 -6.997 8.568 18 HB3 PHE 3 HB1 PHE 3 0.317 -7.905 9.746 19 HD1 PHE 3 HD1 PHE 3 0.753 -6.934 6.314 20 HD2 PHE 3 HD2 PHE 3 -1.991 -8.668 9.080 21 HE1 PHE 3 HE1 PHE 3 -0.529 -7.896 4.468 22 HE2 PHE 3 HE2 PHE 3 -3.286 -9.608 7.218 23 HZ PHE 3 HZ PHE 3 -2.555 -9.223 4.901 24 H ASN 4 HN ASN 4 -0.170 -4.905 7.251 25 HA ASN 4 HA ASN 4 2.512 -3.866 7.483 26 HB2 ASN 4 HB2 ASN 4 2.314 -3.632 5.059 27 HB3 ASN 4 HB1 ASN 4 1.816 -5.243 5.578 28 HD21 ASN 4 HD21 ASN 4 0.694 -2.110 4.498 29 HD22 ASN 4 HD22 ASN 4 -0.915 -2.609 4.089 30 H THR 5 HN THR 5 -0.452 -2.462 8.063 31 HA THR 5 HA THR 5 -0.315 -0.187 6.386 32 HB THR 5 HB THR 5 -2.409 -0.921 7.389 33 HG1 THR 5 HG1 THR 5 -2.100 1.324 6.786 34 HG21 THR 5 HG21 THR 5 -0.979 -0.103 9.860 35 HG22 THR 5 HG22 THR 5 -1.678 -1.674 9.460 36 HG23 THR 5 HG23 THR 5 -2.732 -0.296 9.800 37 H VAL 6 HN VAL 6 1.631 -1.064 8.950 38 HA VAL 6 HA VAL 6 2.225 1.501 10.005 39 HB VAL 6 HB VAL 6 4.075 0.512 11.069 40 HG11 VAL 6 HG11 VAL 6 3.268 -1.599 11.996 41 HG12 VAL 6 HG12 VAL 6 2.068 -1.697 10.707 42 HG13 VAL 6 HG13 VAL 6 1.985 -0.394 11.893 43 HG21 VAL 6 HG21 VAL 6 4.020 -1.812 9.154 44 HG22 VAL 6 HG22 VAL 6 5.253 -1.446 10.371 45 HG23 VAL 6 HG23 VAL 6 5.064 -0.402 8.955 46 H ARG 7 HN ARG 7 3.656 3.062 9.181 47 HA ARG 7 HA ARG 7 5.425 2.205 7.106 48 HB2 ARG 7 HB2 ARG 7 4.537 3.943 5.491 49 HB3 ARG 7 HB1 ARG 7 3.765 2.398 5.675 50 HG2 ARG 7 HG2 ARG 7 2.418 4.081 7.422 51 HG3 ARG 7 HG1 ARG 7 2.650 4.982 5.918 52 HD2 ARG 7 HD2 ARG 7 1.869 2.914 4.713 53 HD3 ARG 7 HD1 ARG 7 1.336 2.289 6.273 54 HE ARG 7 HE ARG 7 -0.035 4.088 4.606 55 HH11 ARG 7 HH11 ARG 7 0.652 3.719 8.029 56 HH12 ARG 7 HH12 ARG 7 -0.735 4.634 8.520 57 HH21 ARG 7 HH21 ARG 7 -1.845 5.257 5.258 58 HH22 ARG 7 HH22 ARG 7 -2.163 5.494 6.947 59 H GLN 8 HN GLN 8 6.769 3.724 6.211 60 HA GLN 8 HA GLN 8 8.390 5.032 7.879 61 HB2 GLN 8 HB2 GLN 8 8.133 4.699 5.119 62 HB3 GLN 8 HB1 GLN 8 8.292 6.438 5.338 63 HG2 GLN 8 HG2 GLN 8 10.344 6.104 6.598 64 HG3 GLN 8 HG1 GLN 8 10.180 4.358 6.418 65 HE21 GLN 8 HE21 GLN 8 12.351 6.020 5.577 66 HE22 GLN 8 HE22 GLN 8 12.466 5.849 3.848 67 H GLY 9 HN GLY 9 7.950 6.504 9.317 68 HA2 GLY 9 HA3 GLY 9 6.040 8.625 8.847 69 HA3 GLY 9 HA2 GLY 9 7.017 8.376 10.285 70 H SER 10 HN SER 10 7.709 10.490 10.477 71 HA SER 10 HA SER 10 8.739 12.060 8.404 72 HB2 SER 10 HB2 SER 10 9.887 13.295 10.329 73 HB3 SER 10 HB1 SER 10 8.131 13.158 10.410 74 HG SER 10 HG SER 10 9.897 11.338 11.681 75 H LYS 11 HN LYS 11 10.159 11.080 7.113 76 HA LYS 11 HA LYS 11 11.940 9.914 6.348 77 HB2 LYS 11 HB2 LYS 11 14.042 10.957 6.765 78 HB3 LYS 11 HB1 LYS 11 12.823 12.202 6.694 79 HG2 LYS 11 HG2 LYS 11 12.821 12.352 9.101 80 HG3 LYS 11 HG1 LYS 11 14.015 11.071 9.216 81 HD2 LYS 11 HD2 LYS 11 15.592 12.483 7.951 82 HD3 LYS 11 HD1 LYS 11 14.390 13.774 7.933 83 HE2 LYS 11 HE2 LYS 11 14.435 13.872 10.362 84 HE3 LYS 11 HE1 LYS 11 15.588 12.540 10.408 85 HZ1 LYS 11 HZ1 LYS 11 17.195 13.908 9.275 86 HZ2 LYS 11 HZ2 LYS 11 16.655 14.708 10.662 87 HZ3 LYS 11 HZ3 LYS 11 16.086 15.176 9.139 88 H GLU 12 HN GLU 12 10.677 8.432 8.315 89 HA GLU 12 HA GLU 12 12.294 7.284 10.271 90 HB2 GLU 12 HB2 GLU 12 9.892 6.852 10.032 91 HB3 GLU 12 HB1 GLU 12 10.169 6.006 8.524 92 HG2 GLU 12 HG2 GLU 12 11.429 4.249 9.773 93 HG3 GLU 12 HG1 GLU 12 11.048 5.125 11.266 94 HA PRO 13 HA PRO 13 15.532 5.152 8.025 95 HB2 PRO 13 HB2 PRO 13 15.102 2.919 9.872 96 HB3 PRO 13 HB1 PRO 13 16.561 3.868 9.600 97 HG2 PRO 13 HG2 PRO 13 14.946 4.049 11.827 98 HG3 PRO 13 HG1 PRO 13 16.078 5.288 11.286 99 HD2 PRO 13 HD2 PRO 13 13.169 5.297 11.238 100 HD3 PRO 13 HD1 PRO 13 14.293 6.646 11.007 101 H TYR 14 HN TYR 14 15.166 4.059 6.205 102 HA TYR 14 HA TYR 14 12.579 3.081 5.743 103 HB2 TYR 14 HB2 TYR 14 13.874 4.147 3.971 104 HB3 TYR 14 HB1 TYR 14 15.005 2.799 3.981 105 HD1 TYR 14 HD1 TYR 14 14.018 0.485 3.629 106 HD2 TYR 14 HD2 TYR 14 12.008 4.046 2.542 107 HE1 TYR 14 HE1 TYR 14 12.618 -0.813 2.119 108 HE2 TYR 14 HE2 TYR 14 10.579 2.769 1.005 109 HH TYR 14 HH TYR 14 10.206 0.763 0.091 110 HA PRO 15 HA PRO 15 14.626 -1.324 5.434 111 HB2 PRO 15 HB2 PRO 15 16.815 -1.136 7.379 112 HB3 PRO 15 HB1 PRO 15 16.807 -1.862 5.773 113 HG2 PRO 15 HG2 PRO 15 18.097 0.438 6.330 114 HG3 PRO 15 HG1 PRO 15 17.418 0.081 4.747 115 HD2 PRO 15 HD2 PRO 15 16.402 1.900 6.874 116 HD3 PRO 15 HD1 PRO 15 16.276 2.025 5.113 117 H ASP 16 HN ASP 16 14.278 0.788 7.976 118 HA ASP 16 HA ASP 16 13.647 -1.177 10.006 119 HB2 ASP 16 HB2 ASP 16 14.859 0.987 10.492 120 HB3 ASP 16 HB1 ASP 16 13.374 1.825 10.169 121 H PHE 17 HN PHE 17 12.115 1.435 8.225 122 HA PHE 17 HA PHE 17 9.523 1.213 9.181 123 HB2 PHE 17 HB2 PHE 17 9.400 2.965 7.755 124 HB3 PHE 17 HB1 PHE 17 10.878 2.464 6.946 125 HD1 PHE 17 HD1 PHE 17 10.821 1.493 4.810 126 HD2 PHE 17 HD2 PHE 17 7.226 1.973 7.014 127 HE1 PHE 17 HE1 PHE 17 9.525 0.872 2.821 128 HE2 PHE 17 HE2 PHE 17 5.913 1.365 5.027 129 HZ PHE 17 HZ PHE 17 7.063 0.813 2.926 130 H VAL 18 HN VAL 18 11.197 -0.500 6.618 131 HA VAL 18 HA VAL 18 8.898 -2.093 6.017 132 HB VAL 18 HB VAL 18 10.220 -1.713 4.127 133 HG11 VAL 18 HG11 VAL 18 12.613 -2.295 4.019 134 HG12 VAL 18 HG12 VAL 18 12.572 -2.664 5.756 135 HG13 VAL 18 HG13 VAL 18 12.271 -1.017 5.195 136 HG21 VAL 18 HG21 VAL 18 10.748 -4.457 5.235 137 HG22 VAL 18 HG22 VAL 18 11.096 -3.986 3.565 138 HG23 VAL 18 HG23 VAL 18 9.435 -3.956 4.160 139 H ALA 19 HN ALA 19 11.909 -2.553 7.871 140 HA ALA 19 HA ALA 19 11.680 -5.322 8.245 141 HB1 ALA 19 HB1 ALA 19 12.675 -3.302 10.267 142 HB2 ALA 19 HB2 ALA 19 13.641 -4.037 8.987 143 HB3 ALA 19 HB3 ALA 19 12.990 -5.037 10.286 144 H ARG 20 HN ARG 20 9.958 -2.689 9.911 145 HA ARG 20 HA ARG 20 8.734 -4.591 11.705 146 HB2 ARG 20 HB2 ARG 20 7.352 -2.712 12.491 147 HB3 ARG 20 HB1 ARG 20 9.065 -2.342 12.562 148 HG2 ARG 20 HG2 ARG 20 8.935 -0.788 10.855 149 HG3 ARG 20 HG1 ARG 20 7.441 -1.477 10.206 150 HD2 ARG 20 HD2 ARG 20 6.157 -0.608 11.988 151 HD3 ARG 20 HD1 ARG 20 7.587 -0.212 12.924 152 HE ARG 20 HE ARG 20 7.900 1.342 10.757 153 HH11 ARG 20 HH11 ARG 20 5.161 0.804 12.873 154 HH12 ARG 20 HH12 ARG 20 4.555 2.421 12.713 155 HH21 ARG 20 HH21 ARG 20 7.113 3.488 10.565 156 HH22 ARG 20 HH22 ARG 20 5.657 3.935 11.404 157 H LEU 21 HN LEU 21 8.141 -2.973 8.722 158 HA LEU 21 HA LEU 21 5.507 -3.549 8.204 159 HB2 LEU 21 HB2 LEU 21 7.330 -2.314 6.840 160 HB3 LEU 21 HB1 LEU 21 7.683 -3.881 6.161 161 HG LEU 21 HG LEU 21 5.652 -3.967 5.000 162 HD11 LEU 21 HD11 LEU 21 3.892 -2.233 5.274 163 HD12 LEU 21 HD12 LEU 21 4.777 -1.631 6.679 164 HD13 LEU 21 HD13 LEU 21 4.109 -3.262 6.690 165 HD21 LEU 21 HD21 LEU 21 7.260 -2.527 3.975 166 HD22 LEU 21 HD22 LEU 21 6.737 -1.170 4.970 167 HD23 LEU 21 HD23 LEU 21 5.654 -1.834 3.751 168 H GLN 22 HN GLN 22 8.383 -5.509 7.667 169 HA GLN 22 HA GLN 22 7.104 -7.846 6.775 170 HB2 GLN 22 HB2 GLN 22 9.687 -7.789 8.269 171 HB3 GLN 22 HB1 GLN 22 9.160 -8.880 6.964 172 HG2 GLN 22 HG2 GLN 22 9.213 -6.866 5.499 173 HG3 GLN 22 HG1 GLN 22 10.003 -6.014 6.805 174 HE21 GLN 22 HE21 GLN 22 11.027 -6.458 4.266 175 HE22 GLN 22 HE22 GLN 22 12.455 -7.418 4.410 176 H ASP 23 HN ASP 23 8.589 -6.965 9.809 177 HA ASP 23 HA ASP 23 8.210 -9.218 11.302 178 HB2 ASP 23 HB2 ASP 23 7.956 -6.340 11.974 179 HB3 ASP 23 HB1 ASP 23 7.727 -7.553 13.216 180 H VAL 24 HN VAL 24 5.849 -6.608 10.845 181 HA VAL 24 HA VAL 24 4.057 -7.973 12.595 182 HB VAL 24 HB VAL 24 4.093 -5.533 12.666 183 HG11 VAL 24 HG11 VAL 24 3.215 -4.220 10.797 184 HG12 VAL 24 HG12 VAL 24 3.080 -5.696 9.839 185 HG13 VAL 24 HG13 VAL 24 4.666 -5.116 10.348 186 HG21 VAL 24 HG21 VAL 24 1.510 -6.714 11.658 187 HG22 VAL 24 HG22 VAL 24 1.632 -5.110 12.386 188 HG23 VAL 24 HG23 VAL 24 2.023 -6.547 13.336 189 H ALA 25 HN ALA 25 4.623 -7.657 9.208 190 HA ALA 25 HA ALA 25 2.109 -8.632 8.284 191 HB1 ALA 25 HB1 ALA 25 4.838 -8.784 6.980 192 HB2 ALA 25 HB2 ALA 25 3.668 -7.483 6.762 193 HB3 ALA 25 HB3 ALA 25 3.301 -9.104 6.179 194 H GLN 26 HN GLN 26 5.005 -9.876 9.558 195 HA GLN 26 HA GLN 26 4.627 -12.596 8.805 196 HB2 GLN 26 HB2 GLN 26 6.802 -12.452 9.246 197 HB3 GLN 26 HB1 GLN 26 6.563 -10.914 10.058 198 HG2 GLN 26 HG2 GLN 26 7.433 -12.087 11.763 199 HG3 GLN 26 HG1 GLN 26 5.739 -12.491 12.008 200 HE21 GLN 26 HE21 GLN 26 5.663 -14.202 9.659 201 HE22 GLN 26 HE22 GLN 26 6.468 -15.657 10.090 202 H LYS 27 HN LYS 27 3.961 -10.592 11.568 203 HA LYS 27 HA LYS 27 3.175 -12.572 13.403 204 HB2 LYS 27 HB2 LYS 27 2.219 -9.708 13.223 205 HB3 LYS 27 HB1 LYS 27 2.182 -10.737 14.655 206 HG2 LYS 27 HG2 LYS 27 4.632 -9.732 13.236 207 HG3 LYS 27 HG1 LYS 27 4.009 -9.163 14.783 208 HD2 LYS 27 HD2 LYS 27 4.687 -11.066 15.897 209 HD3 LYS 27 HD1 LYS 27 4.683 -12.052 14.434 210 HE2 LYS 27 HE2 LYS 27 6.677 -11.092 13.653 211 HE3 LYS 27 HE1 LYS 27 6.585 -9.772 14.813 212 HZ1 LYS 27 HZ1 LYS 27 7.014 -11.351 16.589 213 HZ2 LYS 27 HZ2 LYS 27 8.248 -11.423 15.438 214 HZ3 LYS 27 HZ3 LYS 27 7.062 -12.625 15.484 215 H SER 28 HN SER 28 1.377 -10.813 10.914 216 HA SER 28 HA SER 28 -1.092 -12.025 11.918 217 HB2 SER 28 HB2 SER 28 -0.695 -9.734 10.000 218 HB3 SER 28 HB1 SER 28 -2.250 -10.297 10.617 219 HG SER 28 HG SER 28 -0.497 -9.800 12.625 220 H ILE 29 HN ILE 29 1.237 -12.363 9.562 221 HA ILE 29 HA ILE 29 -0.634 -13.778 7.790 222 HB ILE 29 HB ILE 29 2.060 -12.585 7.176 223 HG12 ILE 29 HG12 ILE 29 -0.665 -11.883 6.088 224 HG13 ILE 29 HG11 ILE 29 0.220 -10.963 7.309 225 HG21 ILE 29 HG21 ILE 29 1.632 -13.229 4.848 226 HG22 ILE 29 HG22 ILE 29 0.242 -14.177 5.399 227 HG23 ILE 29 HG23 ILE 29 1.872 -14.599 5.932 228 HD11 ILE 29 HD11 ILE 29 0.423 -10.054 5.021 229 HD12 ILE 29 HD12 ILE 29 1.264 -11.543 4.561 230 HD13 ILE 29 HD13 ILE 29 1.959 -10.470 5.782 231 H ALA 30 HN ALA 30 -0.517 -15.926 7.898 232 HA ALA 30 HA ALA 30 1.807 -17.230 9.053 233 HB1 ALA 30 HB1 ALA 30 -0.454 -17.962 9.661 234 HB2 ALA 30 HB2 ALA 30 0.477 -19.261 8.916 235 HB3 ALA 30 HB3 ALA 30 -0.754 -18.408 7.983 236 H ASP 31 HN ASP 31 1.129 -16.030 6.128 237 HA ASP 31 HA ASP 31 2.230 -18.277 4.580 238 HB2 ASP 31 HB2 ASP 31 -0.029 -17.232 4.007 239 HB3 ASP 31 HB1 ASP 31 0.895 -15.827 3.496 240 H GLU 32 HN GLU 32 4.304 -18.114 4.067 241 HA GLU 32 HA GLU 32 5.895 -15.825 4.427 242 HB2 GLU 32 HB2 GLU 32 7.606 -17.055 3.173 243 HB3 GLU 32 HB1 GLU 32 6.795 -18.121 4.315 244 HG2 GLU 32 HG2 GLU 32 5.413 -19.016 2.509 245 HG3 GLU 32 HG1 GLU 32 6.222 -17.945 1.366 246 H LYS 33 HN LYS 33 3.885 -16.805 1.730 247 HA LYS 33 HA LYS 33 5.353 -15.239 -0.196 248 HB2 LYS 33 HB2 LYS 33 2.624 -16.525 -0.384 249 HB3 LYS 33 HB1 LYS 33 3.415 -15.686 -1.708 250 HG2 LYS 33 HG2 LYS 33 4.060 -17.765 -2.263 251 HG3 LYS 33 HG1 LYS 33 5.334 -17.447 -1.085 252 HD2 LYS 33 HD2 LYS 33 4.372 -19.627 -0.675 253 HD3 LYS 33 HD1 LYS 33 3.967 -18.537 0.650 254 HE2 LYS 33 HE2 LYS 33 2.058 -19.922 -0.018 255 HE3 LYS 33 HE1 LYS 33 1.744 -18.207 -0.257 256 HZ1 LYS 33 HZ1 LYS 33 0.944 -19.345 -2.151 257 HZ2 LYS 33 HZ2 LYS 33 2.378 -20.232 -2.326 258 HZ3 LYS 33 HZ3 LYS 33 2.373 -18.573 -2.636 259 H ALA 34 HN ALA 34 2.167 -15.046 1.330 260 HA ALA 34 HA ALA 34 1.558 -12.451 0.480 261 HB1 ALA 34 HB1 ALA 34 -0.109 -13.970 1.421 262 HB2 ALA 34 HB2 ALA 34 -0.097 -12.430 2.281 263 HB3 ALA 34 HB3 ALA 34 0.662 -13.849 3.001 264 H ARG 35 HN ARG 35 3.656 -13.603 3.013 265 HA ARG 35 HA ARG 35 3.788 -11.180 4.532 266 HB2 ARG 35 HB2 ARG 35 4.631 -13.674 5.041 267 HB3 ARG 35 HB1 ARG 35 6.130 -13.018 4.400 268 HG2 ARG 35 HG2 ARG 35 4.649 -11.597 6.594 269 HG3 ARG 35 HG1 ARG 35 5.721 -12.949 6.946 270 HD2 ARG 35 HD2 ARG 35 6.452 -10.329 5.635 271 HD3 ARG 35 HD1 ARG 35 6.909 -10.896 7.246 272 HE ARG 35 HE ARG 35 7.800 -12.354 4.846 273 HH11 ARG 35 HH11 ARG 35 8.500 -10.664 7.831 274 HH12 ARG 35 HH12 ARG 35 10.208 -10.931 7.729 275 HH21 ARG 35 HH21 ARG 35 10.049 -12.700 4.708 276 HH22 ARG 35 HH22 ARG 35 11.089 -12.089 5.958 277 H LYS 36 HN LYS 36 6.000 -12.692 2.190 278 HA LYS 36 HA LYS 36 7.771 -10.557 1.869 279 HB2 LYS 36 HB2 LYS 36 6.792 -12.406 -0.293 280 HB3 LYS 36 HB1 LYS 36 8.263 -11.447 -0.335 281 HG2 LYS 36 HG2 LYS 36 9.392 -12.866 0.975 282 HG3 LYS 36 HG1 LYS 36 7.947 -13.328 1.903 283 HD2 LYS 36 HD2 LYS 36 8.739 -15.158 0.449 284 HD3 LYS 36 HD1 LYS 36 7.103 -14.579 0.046 285 HE2 LYS 36 HE2 LYS 36 7.940 -13.312 -1.806 286 HE3 LYS 36 HE1 LYS 36 9.617 -13.619 -1.359 287 HZ1 LYS 36 HZ1 LYS 36 8.967 -15.024 -3.187 288 HZ2 LYS 36 HZ2 LYS 36 7.642 -15.626 -2.329 289 HZ3 LYS 36 HZ3 LYS 36 9.214 -15.993 -1.822 290 H VAL 37 HN VAL 37 4.995 -11.428 -0.147 291 HA VAL 37 HA VAL 37 5.385 -9.447 -2.027 292 HB VAL 37 HB VAL 37 3.127 -9.765 -2.810 293 HG11 VAL 37 HG11 VAL 37 4.675 -11.529 -3.346 294 HG12 VAL 37 HG12 VAL 37 3.085 -12.226 -3.030 295 HG13 VAL 37 HG13 VAL 37 4.351 -12.328 -1.805 296 HG21 VAL 37 HG21 VAL 37 1.559 -11.248 -1.531 297 HG22 VAL 37 HG22 VAL 37 1.839 -9.659 -0.822 298 HG23 VAL 37 HG23 VAL 37 2.641 -11.076 -0.150 299 H ILE 38 HN ILE 38 3.704 -9.233 1.068 300 HA ILE 38 HA ILE 38 2.781 -6.592 0.355 301 HB ILE 38 HB ILE 38 1.638 -8.443 1.978 302 HG12 ILE 38 HG12 ILE 38 1.255 -5.475 2.279 303 HG13 ILE 38 HG11 ILE 38 0.760 -6.342 0.831 304 HG21 ILE 38 HG21 ILE 38 2.803 -6.351 3.811 305 HG22 ILE 38 HG22 ILE 38 3.348 -8.028 3.736 306 HG23 ILE 38 HG23 ILE 38 1.702 -7.654 4.261 307 HD11 ILE 38 HD11 ILE 38 -1.170 -6.182 2.055 308 HD12 ILE 38 HD12 ILE 38 -0.340 -6.409 3.584 309 HD13 ILE 38 HD13 ILE 38 -0.585 -7.786 2.503 310 H VAL 39 HN VAL 39 5.343 -7.982 2.381 311 HA VAL 39 HA VAL 39 6.026 -5.462 3.491 312 HB VAL 39 HB VAL 39 8.012 -6.372 4.293 313 HG11 VAL 39 HG11 VAL 39 6.073 -8.654 4.039 314 HG12 VAL 39 HG12 VAL 39 6.105 -7.425 5.303 315 HG13 VAL 39 HG13 VAL 39 7.424 -8.596 5.167 316 HG21 VAL 39 HG21 VAL 39 9.019 -7.172 2.234 317 HG22 VAL 39 HG22 VAL 39 7.901 -8.536 2.199 318 HG23 VAL 39 HG23 VAL 39 9.102 -8.411 3.486 319 H GLU 40 HN GLU 40 7.307 -7.254 0.731 320 HA GLU 40 HA GLU 40 8.985 -5.360 -0.344 321 HB2 GLU 40 HB2 GLU 40 7.405 -7.596 -1.554 322 HB3 GLU 40 HB1 GLU 40 8.578 -6.669 -2.459 323 HG2 GLU 40 HG2 GLU 40 10.346 -7.463 -1.260 324 HG3 GLU 40 HG1 GLU 40 9.378 -7.867 0.136 325 H LEU 41 HN LEU 41 5.490 -5.648 -0.636 326 HA LEU 41 HA LEU 41 5.421 -3.662 -2.744 327 HB2 LEU 41 HB2 LEU 41 3.649 -5.630 -1.838 328 HB3 LEU 41 HB1 LEU 41 2.856 -4.096 -1.539 329 HG LEU 41 HG LEU 41 2.125 -4.682 -3.662 330 HD11 LEU 41 HD11 LEU 41 3.042 -2.390 -3.544 331 HD12 LEU 41 HD12 LEU 41 3.031 -3.077 -5.163 332 HD13 LEU 41 HD13 LEU 41 4.538 -2.992 -4.257 333 HD21 LEU 41 HD21 LEU 41 4.949 -5.472 -4.344 334 HD22 LEU 41 HD22 LEU 41 3.564 -5.539 -5.434 335 HD23 LEU 41 HD23 LEU 41 3.612 -6.571 -4.004 336 H MET 42 HN MET 42 4.313 -3.806 0.644 337 HA MET 42 HA MET 42 3.362 -1.141 0.711 338 HB2 MET 42 HB2 MET 42 4.281 -2.901 2.984 339 HB3 MET 42 HB1 MET 42 3.378 -1.392 3.172 340 HG2 MET 42 HG2 MET 42 2.477 -3.963 1.905 341 HG3 MET 42 HG1 MET 42 1.858 -3.190 3.353 342 HE1 MET 42 HE1 MET 42 -1.154 -2.949 0.914 343 HE2 MET 42 HE2 MET 42 -0.592 -3.497 2.498 344 HE3 MET 42 HE3 MET 42 0.012 -4.268 1.028 345 H ALA 43 HN ALA 43 6.439 -2.586 0.979 346 HA ALA 43 HA ALA 43 8.037 -0.694 2.107 347 HB1 ALA 43 HB1 ALA 43 9.729 -1.414 0.406 348 HB2 ALA 43 HB2 ALA 43 8.445 -2.359 -0.359 349 HB3 ALA 43 HB3 ALA 43 8.943 -2.724 1.291 350 H TYR 44 HN TYR 44 6.336 -0.589 -0.953 351 HA TYR 44 HA TYR 44 7.426 2.089 -1.523 352 HB2 TYR 44 HB2 TYR 44 7.519 0.596 -3.439 353 HB3 TYR 44 HB1 TYR 44 5.849 0.134 -3.175 354 HD1 TYR 44 HD1 TYR 44 8.057 2.532 -4.777 355 HD2 TYR 44 HD2 TYR 44 4.018 1.754 -3.716 356 HE1 TYR 44 HE1 TYR 44 7.320 4.204 -6.411 357 HE2 TYR 44 HE2 TYR 44 3.262 3.432 -5.337 358 HH TYR 44 HH TYR 44 5.203 4.686 -7.742 359 H GLU 45 HN GLU 45 4.367 0.350 -1.822 360 HA GLU 45 HA GLU 45 2.694 2.466 -2.112 361 HB2 GLU 45 HB2 GLU 45 2.034 -0.085 -0.684 362 HB3 GLU 45 HB1 GLU 45 0.910 0.954 -1.546 363 HG2 GLU 45 HG2 GLU 45 3.164 -0.623 -2.752 364 HG3 GLU 45 HG1 GLU 45 1.461 -1.037 -2.843 365 H ASN 46 HN ASN 46 4.099 1.326 0.888 366 HA ASN 46 HA ASN 46 2.270 3.039 2.380 367 HB2 ASN 46 HB2 ASN 46 3.809 0.548 3.026 368 HB3 ASN 46 HB1 ASN 46 3.381 1.658 4.310 369 HD21 ASN 46 HD21 ASN 46 1.857 0.397 5.366 370 HD22 ASN 46 HD22 ASN 46 0.403 -0.100 4.613 371 H ALA 47 HN ALA 47 5.529 2.710 1.326 372 HA ALA 47 HA ALA 47 6.940 3.863 3.449 373 HB1 ALA 47 HB1 ALA 47 7.582 3.999 0.515 374 HB2 ALA 47 HB2 ALA 47 8.060 2.716 1.628 375 HB3 ALA 47 HB3 ALA 47 8.697 4.350 1.834 376 H ASN 48 HN ASN 48 8.269 5.904 3.069 377 HA ASN 48 HA ASN 48 6.631 8.175 3.153 378 HB2 ASN 48 HB2 ASN 48 9.550 7.636 3.016 379 HB3 ASN 48 HB1 ASN 48 9.033 9.238 2.494 380 HD21 ASN 48 HD21 ASN 48 10.516 8.185 4.934 381 HD22 ASN 48 HD22 ASN 48 9.649 8.881 6.260 382 HA PRO 49 HA PRO 49 5.437 8.872 -0.981 383 HB2 PRO 49 HB2 PRO 49 5.682 11.657 -0.968 384 HB3 PRO 49 HB1 PRO 49 4.258 10.738 -0.479 385 HG2 PRO 49 HG2 PRO 49 6.408 11.948 1.189 386 HG3 PRO 49 HG1 PRO 49 4.676 11.784 1.529 387 HD2 PRO 49 HD2 PRO 49 6.491 10.194 2.695 388 HD3 PRO 49 HD1 PRO 49 4.895 9.579 2.217 389 H GLU 50 HN GLU 50 8.412 10.190 0.184 390 HA GLU 50 HA GLU 50 9.546 10.666 -2.416 391 HB2 GLU 50 HB2 GLU 50 10.352 12.210 -0.915 392 HB3 GLU 50 HB1 GLU 50 10.381 11.070 0.421 393 HG2 GLU 50 HG2 GLU 50 12.552 10.917 0.087 394 HG3 GLU 50 HG1 GLU 50 12.170 10.054 -1.387 395 H CYS 51 HN CYS 51 9.574 8.266 0.116 396 HA CYS 51 HA CYS 51 11.999 7.033 -0.731 397 HB2 CYS 51 HB2 CYS 51 9.908 6.233 1.310 398 HB3 CYS 51 HB1 CYS 51 11.440 5.399 1.048 399 HG CYS 51 HG CYS 51 13.034 7.184 2.175 400 H GLN 52 HN GLN 52 8.562 6.467 -1.043 401 HA GLN 52 HA GLN 52 8.871 3.995 -2.456 402 HB2 GLN 52 HB2 GLN 52 6.543 4.177 -2.969 403 HB3 GLN 52 HB1 GLN 52 6.758 4.673 -1.299 404 HG2 GLN 52 HG2 GLN 52 6.668 7.027 -2.028 405 HG3 GLN 52 HG1 GLN 52 6.360 6.478 -3.674 406 HE21 GLN 52 HE21 GLN 52 4.852 4.195 -2.648 407 HE22 GLN 52 HE22 GLN 52 3.317 4.794 -2.185 408 H SER 53 HN SER 53 8.809 7.326 -3.078 409 HA SER 53 HA SER 53 8.795 7.210 -5.901 410 HB2 SER 53 HB2 SER 53 9.396 9.278 -3.843 411 HB3 SER 53 HB1 SER 53 9.688 9.606 -5.559 412 HG SER 53 HG SER 53 7.375 9.620 -4.197 413 H ALA 54 HN ALA 54 11.211 6.821 -3.462 414 HA ALA 54 HA ALA 54 13.379 6.835 -5.344 415 HB1 ALA 54 HB1 ALA 54 13.073 5.644 -2.603 416 HB2 ALA 54 HB2 ALA 54 13.867 7.158 -3.029 417 HB3 ALA 54 HB3 ALA 54 14.580 5.624 -3.524 418 H ILE 55 HN ILE 55 10.919 4.710 -4.390 419 HA ILE 55 HA ILE 55 12.287 2.329 -5.249 420 HB ILE 55 HB ILE 55 9.646 2.830 -3.951 421 HG12 ILE 55 HG12 ILE 55 11.878 1.162 -2.899 422 HG13 ILE 55 HG11 ILE 55 12.021 2.923 -2.858 423 HG21 ILE 55 HG21 ILE 55 9.439 0.383 -3.730 424 HG22 ILE 55 HG22 ILE 55 10.815 0.197 -4.815 425 HG23 ILE 55 HG23 ILE 55 9.323 0.930 -5.401 426 HD11 ILE 55 HD11 ILE 55 9.672 1.437 -1.721 427 HD12 ILE 55 HD12 ILE 55 10.134 3.131 -1.477 428 HD13 ILE 55 HD13 ILE 55 11.131 1.836 -0.799 429 H LYS 56 HN LYS 56 9.671 4.357 -6.578 430 HA LYS 56 HA LYS 56 8.241 2.581 -8.030 431 HB2 LYS 56 HB2 LYS 56 8.749 4.685 -9.899 432 HB3 LYS 56 HB1 LYS 56 7.278 4.287 -9.037 433 HG2 LYS 56 HG2 LYS 56 7.600 6.448 -8.397 434 HG3 LYS 56 HG1 LYS 56 8.446 5.600 -7.097 435 HD2 LYS 56 HD2 LYS 56 10.467 6.239 -7.794 436 HD3 LYS 56 HD1 LYS 56 10.032 6.210 -9.502 437 HE2 LYS 56 HE2 LYS 56 9.468 8.409 -7.484 438 HE3 LYS 56 HE1 LYS 56 10.504 8.475 -8.907 439 HZ1 LYS 56 HZ1 LYS 56 8.515 8.136 -10.293 440 HZ2 LYS 56 HZ2 LYS 56 8.470 9.576 -9.412 441 HZ3 LYS 56 HZ3 LYS 56 7.547 8.248 -8.912 442 HA PRO 57 HA PRO 57 11.522 2.305 -11.667 443 HB2 PRO 57 HB2 PRO 57 14.097 2.296 -10.810 444 HB3 PRO 57 HB1 PRO 57 13.281 3.764 -11.368 445 HG2 PRO 57 HG2 PRO 57 13.570 2.732 -8.558 446 HG3 PRO 57 HG1 PRO 57 13.990 4.346 -9.181 447 HD2 PRO 57 HD2 PRO 57 11.691 3.972 -7.942 448 HD3 PRO 57 HD1 PRO 57 11.702 4.932 -9.429 449 H LEU 58 HN LEU 58 12.020 1.134 -8.397 450 HA LEU 58 HA LEU 58 12.958 -1.479 -9.327 451 HB2 LEU 58 HB2 LEU 58 12.450 -0.931 -6.461 452 HB3 LEU 58 HB1 LEU 58 13.735 -1.886 -7.190 453 HG LEU 58 HG LEU 58 13.596 1.132 -7.068 454 HD11 LEU 58 HD11 LEU 58 13.955 0.184 -4.892 455 HD12 LEU 58 HD12 LEU 58 15.481 0.848 -5.482 456 HD13 LEU 58 HD13 LEU 58 15.200 -0.893 -5.521 457 HD21 LEU 58 HD21 LEU 58 15.804 -0.681 -8.046 458 HD22 LEU 58 HD22 LEU 58 15.896 1.072 -7.887 459 HD23 LEU 58 HD23 LEU 58 14.788 0.353 -9.053 460 H LYS 59 HN LYS 59 10.259 0.255 -8.357 461 HA LYS 59 HA LYS 59 8.676 -1.599 -7.044 462 HB2 LYS 59 HB2 LYS 59 7.999 0.712 -7.298 463 HB3 LYS 59 HB1 LYS 59 7.863 0.506 -9.035 464 HG2 LYS 59 HG2 LYS 59 5.677 0.255 -8.548 465 HG3 LYS 59 HG1 LYS 59 6.187 -1.398 -8.230 466 HD2 LYS 59 HD2 LYS 59 5.915 0.770 -6.183 467 HD3 LYS 59 HD1 LYS 59 4.773 -0.553 -6.428 468 HE2 LYS 59 HE2 LYS 59 7.657 -0.779 -5.558 469 HE3 LYS 59 HE1 LYS 59 6.243 -1.023 -4.547 470 HZ1 LYS 59 HZ1 LYS 59 7.230 -3.114 -5.259 471 HZ2 LYS 59 HZ2 LYS 59 6.974 -2.697 -6.878 472 HZ3 LYS 59 HZ3 LYS 59 5.653 -2.947 -5.858 473 H GLY 60 HN GLY 60 8.401 -3.627 -7.631 474 HA2 GLY 60 HA3 GLY 60 7.208 -5.237 -8.915 475 HA3 GLY 60 HA2 GLY 60 7.326 -4.168 -10.307 476 H LYS 61 HN LYS 61 10.235 -3.702 -9.520 477 HA LYS 61 HA LYS 61 11.262 -6.085 -10.900 478 HB2 LYS 61 HB2 LYS 61 12.897 -3.629 -10.474 479 HB3 LYS 61 HB1 LYS 61 12.862 -4.720 -11.847 480 HG2 LYS 61 HG2 LYS 61 10.718 -2.734 -11.183 481 HG3 LYS 61 HG1 LYS 61 11.992 -2.481 -12.364 482 HD2 LYS 61 HD2 LYS 61 9.935 -4.682 -12.462 483 HD3 LYS 61 HD1 LYS 61 9.876 -3.191 -13.406 484 HE2 LYS 61 HE2 LYS 61 11.946 -3.774 -14.508 485 HE3 LYS 61 HE1 LYS 61 12.091 -5.224 -13.518 486 HZ1 LYS 61 HZ1 LYS 61 10.066 -6.074 -14.521 487 HZ2 LYS 61 HZ2 LYS 61 11.228 -5.743 -15.704 488 HZ3 LYS 61 HZ3 LYS 61 9.931 -4.682 -15.478 489 H VAL 62 HN VAL 62 12.070 -7.536 -9.481 490 HA VAL 62 HA VAL 62 14.014 -6.472 -7.554 491 HB VAL 62 HB VAL 62 12.158 -7.531 -6.357 492 HG11 VAL 62 HG11 VAL 62 11.369 -9.098 -8.021 493 HG12 VAL 62 HG12 VAL 62 11.743 -9.942 -6.517 494 HG13 VAL 62 HG13 VAL 62 12.859 -10.032 -7.881 495 HG21 VAL 62 HG21 VAL 62 13.462 -9.168 -5.039 496 HG22 VAL 62 HG22 VAL 62 14.328 -7.663 -5.343 497 HG23 VAL 62 HG23 VAL 62 14.723 -9.109 -6.273 498 HA PRO 63 HA PRO 63 17.183 -8.761 -9.821 499 HB2 PRO 63 HB2 PRO 63 18.140 -9.163 -7.031 500 HB3 PRO 63 HB1 PRO 63 19.041 -8.670 -8.447 501 HG2 PRO 63 HG2 PRO 63 18.366 -6.878 -6.620 502 HG3 PRO 63 HG1 PRO 63 18.270 -6.476 -8.344 503 HD2 PRO 63 HD2 PRO 63 16.081 -7.112 -6.423 504 HD3 PRO 63 HD1 PRO 63 16.087 -5.992 -7.800 505 H ALA 64 HN ALA 64 17.346 -10.869 -10.322 506 HA ALA 64 HA ALA 64 15.464 -12.695 -9.291 507 HB1 ALA 64 HB1 ALA 64 17.879 -13.233 -11.014 508 HB2 ALA 64 HB2 ALA 64 16.273 -12.793 -11.591 509 HB3 ALA 64 HB3 ALA 64 16.520 -14.329 -10.762 510 H GLY 65 HN GLY 65 15.598 -13.406 -7.266 511 HA2 GLY 65 HA3 GLY 65 16.516 -15.140 -5.866 512 HA3 GLY 65 HA2 GLY 65 18.113 -14.703 -6.454 513 H SER 66 HN SER 66 17.047 -11.778 -6.112 514 HA SER 66 HA SER 66 18.005 -11.573 -3.362 515 HB2 SER 66 HB2 SER 66 17.476 -9.395 -5.394 516 HB3 SER 66 HB1 SER 66 18.291 -9.201 -3.843 517 HG SER 66 HG SER 66 19.799 -10.866 -4.715 518 H ASP 67 HN ASP 67 17.003 -9.765 -2.071 519 HA ASP 67 HA ASP 67 14.110 -10.113 -1.931 520 HB2 ASP 67 HB2 ASP 67 15.972 -9.967 0.004 521 HB3 ASP 67 HB1 ASP 67 15.600 -8.258 -0.142 522 H VAL 68 HN VAL 68 12.614 -8.340 -2.239 523 HA VAL 68 HA VAL 68 13.744 -6.281 -3.919 524 HB VAL 68 HB VAL 68 11.710 -5.855 -4.704 525 HG11 VAL 68 HG11 VAL 68 11.623 -8.274 -4.621 526 HG12 VAL 68 HG12 VAL 68 10.020 -7.564 -4.449 527 HG13 VAL 68 HG13 VAL 68 10.858 -8.201 -3.035 528 HG21 VAL 68 HG21 VAL 68 9.702 -5.477 -3.271 529 HG22 VAL 68 HG22 VAL 68 11.078 -4.424 -2.920 530 HG23 VAL 68 HG23 VAL 68 10.721 -5.793 -1.865 531 H ILE 69 HN ILE 69 12.778 -6.689 -0.644 532 HA ILE 69 HA ILE 69 12.481 -4.012 0.077 533 HB ILE 69 HB ILE 69 13.323 -6.408 1.678 534 HG12 ILE 69 HG12 ILE 69 11.056 -6.628 1.051 535 HG13 ILE 69 HG11 ILE 69 11.005 -5.964 2.677 536 HG21 ILE 69 HG21 ILE 69 12.806 -3.586 2.633 537 HG22 ILE 69 HG22 ILE 69 14.299 -4.511 2.780 538 HG23 ILE 69 HG23 ILE 69 12.871 -4.991 3.701 539 HD11 ILE 69 HD11 ILE 69 10.705 -3.720 1.704 540 HD12 ILE 69 HD12 ILE 69 9.393 -4.848 1.345 541 HD13 ILE 69 HD13 ILE 69 10.608 -4.474 0.113 542 H SER 70 HN SER 70 15.245 -6.122 0.198 543 HA SER 70 HA SER 70 17.199 -4.520 1.206 544 HB2 SER 70 HB2 SER 70 17.601 -6.836 0.590 545 HB3 SER 70 HB1 SER 70 17.384 -6.463 -1.116 546 HG SER 70 HG SER 70 19.427 -5.388 0.550 547 H GLU 71 HN GLU 71 15.805 -4.389 -2.012 548 HA GLU 71 HA GLU 71 17.656 -2.436 -3.006 549 HB2 GLU 71 HB2 GLU 71 15.105 -3.398 -4.261 550 HB3 GLU 71 HB1 GLU 71 16.551 -2.785 -5.061 551 HG2 GLU 71 HG2 GLU 71 16.786 -5.202 -3.371 552 HG3 GLU 71 HG1 GLU 71 16.023 -5.350 -4.943 553 H TYR 72 HN TYR 72 14.458 -2.614 -1.730 554 HA TYR 72 HA TYR 72 13.637 -0.037 -2.630 555 HB2 TYR 72 HB2 TYR 72 12.516 -2.093 -0.741 556 HB3 TYR 72 HB1 TYR 72 11.775 -0.507 -0.897 557 HD1 TYR 72 HD1 TYR 72 13.283 -1.896 -3.875 558 HD2 TYR 72 HD2 TYR 72 9.709 -1.676 -1.598 559 HE1 TYR 72 HE1 TYR 72 12.004 -2.687 -5.807 560 HE2 TYR 72 HE2 TYR 72 8.418 -2.486 -3.526 561 HH TYR 72 HH TYR 72 10.010 -3.661 -6.411 562 H VAL 73 HN VAL 73 14.962 -1.438 0.287 563 HA VAL 73 HA VAL 73 14.975 0.971 1.798 564 HB VAL 73 HB VAL 73 16.161 -0.060 3.459 565 HG11 VAL 73 HG11 VAL 73 14.163 -1.302 3.215 566 HG12 VAL 73 HG12 VAL 73 15.460 -2.407 3.662 567 HG13 VAL 73 HG13 VAL 73 14.897 -2.335 1.992 568 HG21 VAL 73 HG21 VAL 73 18.103 -0.584 1.854 569 HG22 VAL 73 HG22 VAL 73 17.379 -2.194 1.764 570 HG23 VAL 73 HG23 VAL 73 17.911 -1.545 3.324 571 H LYS 74 HN LYS 74 17.012 -0.572 -0.522 572 HA LYS 74 HA LYS 74 19.296 1.105 -0.249 573 HB2 LYS 74 HB2 LYS 74 19.510 -1.073 -1.154 574 HB3 LYS 74 HB1 LYS 74 18.271 -0.772 -2.354 575 HG2 LYS 74 HG2 LYS 74 20.018 1.140 -3.000 576 HG3 LYS 74 HG1 LYS 74 21.118 -0.061 -2.326 577 HD2 LYS 74 HD2 LYS 74 20.889 -0.423 -4.712 578 HD3 LYS 74 HD1 LYS 74 20.156 -1.760 -3.822 579 HE2 LYS 74 HE2 LYS 74 17.941 -0.710 -4.111 580 HE3 LYS 74 HE1 LYS 74 18.700 0.572 -5.059 581 HZ1 LYS 74 HZ1 LYS 74 18.650 -2.318 -5.779 582 HZ2 LYS 74 HZ2 LYS 74 19.442 -1.106 -6.657 583 HZ3 LYS 74 HZ3 LYS 74 17.760 -1.079 -6.521 584 H ALA 75 HN ALA 75 16.278 1.206 -1.910 585 HA ALA 75 HA ALA 75 16.805 3.334 -3.694 586 HB1 ALA 75 HB1 ALA 75 14.834 1.915 -3.880 587 HB2 ALA 75 HB2 ALA 75 14.364 3.608 -3.734 588 HB3 ALA 75 HB3 ALA 75 14.229 2.529 -2.343 589 H CYS 76 HN CYS 76 15.505 3.230 -0.402 590 HA CYS 76 HA CYS 76 15.743 6.135 -0.189 591 HB2 CYS 76 HB2 CYS 76 13.733 5.241 0.680 592 HB3 CYS 76 HB1 CYS 76 14.569 4.023 1.626 593 HG CYS 76 HG CYS 76 15.829 6.367 3.060 594 H ASP 77 HN ASP 77 17.897 3.781 -0.041 595 HA ASP 77 HA ASP 77 19.245 4.202 2.391 596 HB2 ASP 77 HB2 ASP 77 19.807 2.291 1.096 597 HB3 ASP 77 HB1 ASP 77 20.225 3.255 -0.312 598 H GLY 78 HN GLY 78 18.944 6.122 -0.429 599 HA2 GLY 78 HA3 GLY 78 20.978 7.979 0.595 600 HA3 GLY 78 HA2 GLY 78 20.286 8.018 -1.019 601 H ILE 79 HN ILE 79 17.757 7.443 1.077 602 HA ILE 79 HA ILE 79 17.048 10.272 1.048 603 HB ILE 79 HB ILE 79 15.375 7.807 1.358 604 HG12 ILE 79 HG12 ILE 79 15.347 9.947 -0.770 605 HG13 ILE 79 HG11 ILE 79 16.171 8.394 -0.927 606 HG21 ILE 79 HG21 ILE 79 13.414 9.284 1.389 607 HG22 ILE 79 HG22 ILE 79 14.484 10.683 1.471 608 HG23 ILE 79 HG23 ILE 79 14.450 9.519 2.798 609 HD11 ILE 79 HD11 ILE 79 13.251 8.596 -0.326 610 HD12 ILE 79 HD12 ILE 79 14.159 7.217 -0.953 611 HD13 ILE 79 HD13 ILE 79 13.879 8.633 -1.969 612 H GLY 80 HN GLY 80 16.772 11.422 2.835 613 HA2 GLY 80 HA3 GLY 80 15.438 10.788 5.082 614 HA3 GLY 80 HA2 GLY 80 17.069 10.245 5.449 615 H GLY 81 HN GLY 81 18.478 12.218 4.063 616 HA2 GLY 81 HA3 GLY 81 18.236 14.307 6.090 617 HA3 GLY 81 HA2 GLY 81 19.620 13.976 5.084 618 H ALA 82 HN ALA 82 20.051 15.867 4.444 619 HA ALA 82 HA ALA 82 18.255 17.786 3.458 620 HB1 ALA 82 HB1 ALA 82 20.314 18.866 2.626 621 HB2 ALA 82 HB2 ALA 82 21.204 17.403 3.068 622 HB3 ALA 82 HB3 ALA 82 20.415 18.363 4.315 623 H MET 83 HN MET 83 19.960 15.121 1.980 624 HA MET 83 HA MET 83 19.402 15.873 -0.707 625 HB2 MET 83 HB2 MET 83 19.936 13.117 0.414 626 HB3 MET 83 HB1 MET 83 19.962 13.554 -1.285 627 HG2 MET 83 HG2 MET 83 21.800 15.154 -0.754 628 HG3 MET 83 HG1 MET 83 21.833 14.484 0.868 629 HE1 MET 83 HE1 MET 83 22.490 12.000 1.447 630 HE2 MET 83 HE2 MET 83 22.912 10.784 0.241 631 HE3 MET 83 HE3 MET 83 21.260 11.391 0.340 632 H HIS 84 HN HIS 84 17.643 14.247 1.823 633 HA HIS 84 HA HIS 84 15.518 13.275 0.262 634 HB2 HIS 84 HB2 HIS 84 15.665 12.505 2.523 635 HB3 HIS 84 HB1 HIS 84 15.644 14.143 3.153 636 HD1 HIS 84 HD1 HIS 84 13.604 13.924 4.620 637 HD2 HIS 84 HD2 HIS 84 12.891 12.762 0.694 638 HE1 HIS 84 HE1 HIS 84 11.128 13.556 4.460 639 HE2 HIS 84 HE2 HIS 84 10.705 12.915 2.067 640 H LYS 85 HN LYS 85 16.321 16.445 1.494 641 HA LYS 85 HA LYS 85 13.744 17.542 0.785 642 HB2 LYS 85 HB2 LYS 85 16.282 18.811 1.805 643 HB3 LYS 85 HB1 LYS 85 14.873 19.753 1.341 644 HG2 LYS 85 HG2 LYS 85 14.636 19.534 3.635 645 HG3 LYS 85 HG1 LYS 85 13.588 18.267 3.001 646 HD2 LYS 85 HD2 LYS 85 15.615 16.714 3.284 647 HD3 LYS 85 HD1 LYS 85 16.296 17.999 4.283 648 HE2 LYS 85 HE2 LYS 85 13.660 16.612 4.728 649 HE3 LYS 85 HE1 LYS 85 15.140 16.324 5.637 650 HZ1 LYS 85 HZ1 LYS 85 13.677 17.783 6.853 651 HZ2 LYS 85 HZ2 LYS 85 13.601 18.864 5.557 652 HZ3 LYS 85 HZ3 LYS 85 15.056 18.641 6.385 653 H ALA 86 HN ALA 86 16.783 17.028 -0.707 654 HA ALA 86 HA ALA 86 16.405 18.935 -2.832 655 HB1 ALA 86 HB1 ALA 86 18.319 16.613 -2.700 656 HB2 ALA 86 HB2 ALA 86 18.651 18.222 -2.054 657 HB3 ALA 86 HB3 ALA 86 18.408 17.999 -3.787 658 H MET 87 HN MET 87 16.180 15.451 -2.431 659 HA MET 87 HA MET 87 15.371 15.007 -5.155 660 HB2 MET 87 HB2 MET 87 15.443 13.150 -2.761 661 HB3 MET 87 HB1 MET 87 15.189 12.649 -4.436 662 HG2 MET 87 HG2 MET 87 17.558 14.227 -4.295 663 HG3 MET 87 HG1 MET 87 17.623 12.989 -3.046 664 HE1 MET 87 HE1 MET 87 17.374 13.749 -6.866 665 HE2 MET 87 HE2 MET 87 15.876 12.857 -6.598 666 HE3 MET 87 HE3 MET 87 17.167 12.142 -7.561 667 H LEU 88 HN LEU 88 13.821 15.855 -2.275 668 HA LEU 88 HA LEU 88 11.371 14.630 -2.355 669 HB2 LEU 88 HB2 LEU 88 12.507 16.515 -0.835 670 HB3 LEU 88 HB1 LEU 88 11.411 17.525 -1.754 671 HG LEU 88 HG LEU 88 9.607 16.820 -0.596 672 HD11 LEU 88 HD11 LEU 88 9.582 14.603 -1.625 673 HD12 LEU 88 HD12 LEU 88 9.207 14.495 0.093 674 HD13 LEU 88 HD13 LEU 88 10.813 14.055 -0.487 675 HD21 LEU 88 HD21 LEU 88 10.157 16.056 1.675 676 HD22 LEU 88 HD22 LEU 88 11.190 17.382 1.142 677 HD23 LEU 88 HD23 LEU 88 11.803 15.729 1.134 678 H MET 89 HN MET 89 12.580 17.249 -4.348 679 HA MET 89 HA MET 89 9.988 17.819 -5.506 680 HB2 MET 89 HB2 MET 89 11.662 19.604 -5.141 681 HB3 MET 89 HB1 MET 89 12.732 18.816 -6.290 682 HG2 MET 89 HG2 MET 89 11.035 19.142 -8.046 683 HG3 MET 89 HG1 MET 89 10.032 20.006 -6.883 684 HE1 MET 89 HE1 MET 89 10.861 21.257 -9.685 685 HE2 MET 89 HE2 MET 89 11.259 22.900 -9.183 686 HE3 MET 89 HE3 MET 89 9.869 22.075 -8.480 687 H ALA 90 HN ALA 90 12.593 15.681 -6.103 688 HA ALA 90 HA ALA 90 12.016 15.483 -8.970 689 HB1 ALA 90 HB1 ALA 90 14.368 15.690 -8.190 690 HB2 ALA 90 HB2 ALA 90 14.070 14.220 -9.120 691 HB3 ALA 90 HB3 ALA 90 14.190 14.141 -7.357 692 H GLN 91 HN GLN 91 12.317 13.381 -6.144 693 HA GLN 91 HA GLN 91 11.513 11.079 -7.603 694 HB2 GLN 91 HB2 GLN 91 12.220 11.706 -4.826 695 HB3 GLN 91 HB1 GLN 91 11.684 10.118 -5.285 696 HG2 GLN 91 HG2 GLN 91 13.430 10.049 -6.909 697 HG3 GLN 91 HG1 GLN 91 14.015 11.606 -6.390 698 HE21 GLN 91 HE21 GLN 91 13.417 11.057 -3.604 699 HE22 GLN 91 HE22 GLN 91 14.660 9.989 -3.071 700 H LEU 92 HN LEU 92 10.353 12.456 -4.609 701 HA LEU 92 HA LEU 92 7.816 11.496 -4.409 702 HB2 LEU 92 HB2 LEU 92 9.153 13.326 -3.055 703 HB3 LEU 92 HB1 LEU 92 8.236 14.439 -4.042 704 HG LEU 92 HG LEU 92 7.377 12.768 -1.762 705 HD11 LEU 92 HD11 LEU 92 5.944 14.711 -1.361 706 HD12 LEU 92 HD12 LEU 92 6.512 15.425 -2.870 707 HD13 LEU 92 HD13 LEU 92 7.641 15.153 -1.544 708 HD21 LEU 92 HD21 LEU 92 5.544 13.319 -4.094 709 HD22 LEU 92 HD22 LEU 92 5.006 12.833 -2.489 710 HD23 LEU 92 HD23 LEU 92 5.999 11.740 -3.452 711 H GLU 93 HN GLU 93 9.122 13.811 -6.602 712 HA GLU 93 HA GLU 93 8.128 15.509 -7.859 713 HB2 GLU 93 HB2 GLU 93 7.307 14.340 -9.968 714 HB3 GLU 93 HB1 GLU 93 8.946 13.979 -9.415 715 HG2 GLU 93 HG2 GLU 93 8.279 11.872 -8.566 716 HG3 GLU 93 HG1 GLU 93 6.576 12.252 -8.751 717 H2 PRO 1 HT1 PRO 1 5.119 -4.356 -13.599 718 H3 PRO 1 HT2 PRO 1 5.593 -2.942 -14.267 719 HA PRO 1 HA PRO 1 6.311 -2.647 -12.249 720 HB2 PRO 1 HB2 PRO 1 4.276 -1.402 -11.044 721 HB3 PRO 1 HB1 PRO 1 5.036 -0.723 -12.485 722 HG2 PRO 1 HG2 PRO 1 2.409 -1.997 -12.187 723 HG3 PRO 1 HG1 PRO 1 2.994 -0.916 -13.462 724 HD2 PRO 1 HD2 PRO 1 2.818 -3.818 -13.462 725 HD3 PRO 1 HD1 PRO 1 3.241 -2.732 -14.802 726 H SER 2 HN SER 2 4.576 -2.436 -9.844 727 HA SER 2 HA SER 2 4.258 -5.085 -8.933 728 HB2 SER 2 HB2 SER 2 2.549 -2.727 -8.121 729 HB3 SER 2 HB1 SER 2 2.906 -4.155 -7.178 730 HG SER 2 HG SER 2 4.124 -1.972 -6.956 731 H PHE 3 HN PHE 3 2.118 -6.171 -8.606 732 HA PHE 3 HA PHE 3 0.334 -5.886 -10.797 733 HB2 PHE 3 HB2 PHE 3 -1.164 -6.993 -8.754 734 HB3 PHE 3 HB1 PHE 3 -0.221 -7.906 -9.932 735 HD1 PHE 3 HD1 PHE 3 -0.648 -6.932 -6.499 736 HD2 PHE 3 HD2 PHE 3 2.081 -8.682 -9.270 737 HE1 PHE 3 HE1 PHE 3 0.631 -7.901 -4.654 738 HE2 PHE 3 HE2 PHE 3 3.374 -9.630 -7.410 739 HZ PHE 3 HZ PHE 3 2.648 -9.241 -5.091 740 H ASN 4 HN ASN 4 0.288 -4.907 -7.436 741 HA ASN 4 HA ASN 4 -2.389 -3.851 -7.668 742 HB2 ASN 4 HB2 ASN 4 -2.185 -3.618 -5.246 743 HB3 ASN 4 HB1 ASN 4 -1.698 -5.232 -5.765 744 HD21 ASN 4 HD21 ASN 4 -0.558 -2.109 -4.686 745 HD22 ASN 4 HD22 ASN 4 1.047 -2.616 -4.276 746 H THR 5 HN THR 5 0.587 -2.467 -8.247 747 HA THR 5 HA THR 5 0.465 -0.189 -6.576 748 HB THR 5 HB THR 5 2.555 -0.937 -7.580 749 HG1 THR 5 HG1 THR 5 2.269 1.310 -6.980 750 HG21 THR 5 HG21 THR 5 1.124 -0.114 -10.048 751 HG22 THR 5 HG22 THR 5 1.816 -1.689 -9.648 752 HG23 THR 5 HG23 THR 5 2.876 -0.316 -9.992 753 H VAL 6 HN VAL 6 -1.488 -1.056 -9.135 754 HA VAL 6 HA VAL 6 -2.068 1.513 -10.194 755 HB VAL 6 HB VAL 6 -3.925 0.533 -11.255 756 HG11 VAL 6 HG11 VAL 6 -3.130 -1.585 -12.179 757 HG12 VAL 6 HG12 VAL 6 -1.926 -1.686 -10.894 758 HG13 VAL 6 HG13 VAL 6 -1.842 -0.383 -12.082 759 HG21 VAL 6 HG21 VAL 6 -3.882 -1.791 -9.339 760 HG22 VAL 6 HG22 VAL 6 -5.113 -1.417 -10.554 761 HG23 VAL 6 HG23 VAL 6 -4.916 -0.374 -9.139 762 H ARG 7 HN ARG 7 -3.493 3.080 -9.370 763 HA ARG 7 HA ARG 7 -5.261 2.236 -7.291 764 HB2 ARG 7 HB2 ARG 7 -4.359 3.972 -5.679 765 HB3 ARG 7 HB1 ARG 7 -3.600 2.421 -5.860 766 HG2 ARG 7 HG2 ARG 7 -2.242 4.092 -7.610 767 HG3 ARG 7 HG1 ARG 7 -2.468 4.996 -6.108 768 HD2 ARG 7 HD2 ARG 7 -1.698 2.925 -4.901 769 HD3 ARG 7 HD1 ARG 7 -1.170 2.296 -6.460 770 HE ARG 7 HE ARG 7 0.215 4.082 -4.791 771 HH11 ARG 7 HH11 ARG 7 -0.488 3.734 -8.209 772 HH12 ARG 7 HH12 ARG 7 0.907 4.633 -8.707 773 HH21 ARG 7 HH21 ARG 7 2.036 5.246 -5.450 774 HH22 ARG 7 HH22 ARG 7 2.350 5.482 -7.136 775 H GLN 8 HN GLN 8 -6.594 3.765 -6.398 776 HA GLN 8 HA GLN 8 -8.208 5.083 -8.064 777 HB2 GLN 8 HB2 GLN 8 -7.952 4.751 -5.303 778 HB3 GLN 8 HB1 GLN 8 -8.098 6.491 -5.526 779 HG2 GLN 8 HG2 GLN 8 -10.154 6.171 -6.782 780 HG3 GLN 8 HG1 GLN 8 -10.001 4.424 -6.602 781 HE21 GLN 8 HE21 GLN 8 -12.162 6.095 -5.763 782 HE22 GLN 8 HE22 GLN 8 -12.280 5.926 -4.035 783 H GLY 9 HN GLY 9 -7.763 6.554 -9.501 784 HA2 GLY 9 HA3 GLY 9 -5.839 8.662 -9.032 785 HA3 GLY 9 HA2 GLY 9 -6.817 8.419 -10.471 786 H SER 10 HN SER 10 -7.486 10.538 -10.657 787 HA SER 10 HA SER 10 -8.510 12.117 -8.592 788 HB2 SER 10 HB2 SER 10 -9.645 13.360 -10.516 789 HB3 SER 10 HB1 SER 10 -7.891 13.196 -10.611 790 HG SER 10 HG SER 10 -9.691 11.391 -11.854 791 H LYS 11 HN LYS 11 -9.937 11.147 -7.297 792 HA LYS 11 HA LYS 11 -11.723 9.993 -6.528 793 HB2 LYS 11 HB2 LYS 11 -13.820 11.047 -6.947 794 HB3 LYS 11 HB1 LYS 11 -12.595 12.287 -6.879 795 HG2 LYS 11 HG2 LYS 11 -12.594 12.431 -9.288 796 HG3 LYS 11 HG1 LYS 11 -13.797 11.157 -9.397 797 HD2 LYS 11 HD2 LYS 11 -15.362 12.581 -8.133 798 HD3 LYS 11 HD1 LYS 11 -14.152 13.865 -8.117 799 HE2 LYS 11 HE2 LYS 11 -14.200 13.969 -10.543 800 HE3 LYS 11 HE1 LYS 11 -15.355 12.637 -10.595 801 HZ1 LYS 11 HZ1 LYS 11 -16.961 14.005 -9.458 802 HZ2 LYS 11 HZ2 LYS 11 -16.421 14.807 -10.845 803 HZ3 LYS 11 HZ3 LYS 11 -15.853 15.274 -9.324 804 H GLU 12 HN GLU 12 -10.474 8.499 -8.499 805 HA GLU 12 HA GLU 12 -12.103 7.363 -10.454 806 HB2 GLU 12 HB2 GLU 12 -9.704 6.912 -10.220 807 HB3 GLU 12 HB1 GLU 12 -9.983 6.072 -8.710 808 HG2 GLU 12 HG2 GLU 12 -11.259 4.321 -9.954 809 HG3 GLU 12 HG1 GLU 12 -10.873 5.192 -11.448 810 HA PRO 13 HA PRO 13 -15.353 5.247 -8.198 811 HB2 PRO 13 HB2 PRO 13 -14.939 3.010 -10.046 812 HB3 PRO 13 HB1 PRO 13 -16.391 3.970 -9.775 813 HG2 PRO 13 HG2 PRO 13 -14.772 4.138 -12.001 814 HG3 PRO 13 HG1 PRO 13 -15.898 5.384 -11.462 815 HD2 PRO 13 HD2 PRO 13 -12.990 5.378 -11.413 816 HD3 PRO 13 HD1 PRO 13 -14.109 6.733 -11.182 817 H TYR 14 HN TYR 14 -14.987 4.156 -6.377 818 HA TYR 14 HA TYR 14 -12.407 3.159 -5.922 819 HB2 TYR 14 HB2 TYR 14 -13.695 4.234 -4.150 820 HB3 TYR 14 HB1 TYR 14 -14.835 2.893 -4.158 821 HD1 TYR 14 HD1 TYR 14 -13.862 0.573 -3.805 822 HD2 TYR 14 HD2 TYR 14 -11.828 4.123 -2.725 823 HE1 TYR 14 HE1 TYR 14 -12.468 -0.732 -2.297 824 HE2 TYR 14 HE2 TYR 14 -10.405 2.836 -1.188 825 HH TYR 14 HH TYR 14 -10.047 0.829 -0.270 826 HA PRO 15 HA PRO 15 -14.484 -1.229 -5.610 827 HB2 PRO 15 HB2 PRO 15 -16.672 -1.027 -7.553 828 HB3 PRO 15 HB1 PRO 15 -16.667 -1.754 -5.949 829 HG2 PRO 15 HG2 PRO 15 -17.944 0.551 -6.504 830 HG3 PRO 15 HG1 PRO 15 -17.270 0.190 -4.921 831 HD2 PRO 15 HD2 PRO 15 -16.243 2.005 -7.044 832 HD3 PRO 15 HD1 PRO 15 -16.118 2.130 -5.281 833 H ASP 16 HN ASP 16 -14.121 0.882 -8.154 834 HA ASP 16 HA ASP 16 -13.509 -1.090 -10.186 835 HB2 ASP 16 HB2 ASP 16 -14.708 1.079 -10.675 836 HB3 ASP 16 HB1 ASP 16 -13.221 1.911 -10.341 837 H PHE 17 HN PHE 17 -11.957 1.513 -8.406 838 HA PHE 17 HA PHE 17 -9.368 1.271 -9.363 839 HB2 PHE 17 HB2 PHE 17 -9.234 3.022 -7.938 840 HB3 PHE 17 HB1 PHE 17 -10.713 2.530 -7.127 841 HD1 PHE 17 HD1 PHE 17 -10.660 1.561 -4.993 842 HD2 PHE 17 HD2 PHE 17 -7.063 2.017 -7.199 843 HE1 PHE 17 HE1 PHE 17 -9.368 0.932 -3.005 844 HE2 PHE 17 HE2 PHE 17 -5.755 1.400 -5.212 845 HZ PHE 17 HZ PHE 17 -6.906 0.856 -3.111 846 H VAL 18 HN VAL 18 -11.053 -0.432 -6.799 847 HA VAL 18 HA VAL 18 -8.762 -2.038 -6.200 848 HB VAL 18 HB VAL 18 -10.078 -1.650 -4.309 849 HG11 VAL 18 HG11 VAL 18 -12.475 -2.216 -4.199 850 HG12 VAL 18 HG12 VAL 18 -12.439 -2.583 -5.935 851 HG13 VAL 18 HG13 VAL 18 -12.127 -0.939 -5.373 852 HG21 VAL 18 HG21 VAL 18 -10.624 -4.390 -5.414 853 HG22 VAL 18 HG22 VAL 18 -10.970 -3.915 -3.746 854 HG23 VAL 18 HG23 VAL 18 -9.308 -3.896 -4.339 855 H ALA 19 HN ALA 19 -11.778 -2.483 -8.048 856 HA ALA 19 HA ALA 19 -11.565 -5.250 -8.424 857 HB1 ALA 19 HB1 ALA 19 -12.548 -3.224 -10.443 858 HB2 ALA 19 HB2 ALA 19 -13.517 -3.957 -9.164 859 HB3 ALA 19 HB3 ALA 19 -12.872 -4.958 -10.465 860 H ARG 20 HN ARG 20 -9.827 -2.630 -10.092 861 HA ARG 20 HA ARG 20 -8.616 -4.540 -11.886 862 HB2 ARG 20 HB2 ARG 20 -7.225 -2.668 -12.672 863 HB3 ARG 20 HB1 ARG 20 -8.936 -2.290 -12.743 864 HG2 ARG 20 HG2 ARG 20 -8.797 -0.738 -11.035 865 HG3 ARG 20 HG1 ARG 20 -7.307 -1.434 -10.389 866 HD2 ARG 20 HD2 ARG 20 -6.019 -0.572 -12.169 867 HD3 ARG 20 HD1 ARG 20 -7.446 -0.170 -13.106 868 HE ARG 20 HE ARG 20 -7.750 1.389 -10.940 869 HH11 ARG 20 HH11 ARG 20 -5.029 0.823 -13.068 870 HH12 ARG 20 HH12 ARG 20 -4.401 2.432 -12.908 871 HH21 ARG 20 HH21 ARG 20 -6.941 3.524 -10.741 872 HH22 ARG 20 HH22 ARG 20 -5.478 3.957 -11.578 873 H LEU 21 HN LEU 21 -8.016 -2.930 -8.902 874 HA LEU 21 HA LEU 21 -5.381 -3.516 -8.388 875 HB2 LEU 21 HB2 LEU 21 -7.196 -2.269 -7.023 876 HB3 LEU 21 HB1 LEU 21 -7.558 -3.833 -6.342 877 HG LEU 21 HG LEU 21 -5.526 -3.932 -5.185 878 HD11 LEU 21 HD11 LEU 21 -3.754 -2.211 -5.462 879 HD12 LEU 21 HD12 LEU 21 -4.638 -1.603 -6.866 880 HD13 LEU 21 HD13 LEU 21 -3.982 -3.239 -6.877 881 HD21 LEU 21 HD21 LEU 21 -7.124 -2.482 -4.159 882 HD22 LEU 21 HD22 LEU 21 -6.594 -1.129 -5.156 883 HD23 LEU 21 HD23 LEU 21 -5.514 -1.798 -3.937 884 H GLN 22 HN GLN 22 -8.270 -5.458 -7.847 885 HA GLN 22 HA GLN 22 -7.006 -7.803 -6.957 886 HB2 GLN 22 HB2 GLN 22 -9.590 -7.727 -8.449 887 HB3 GLN 22 HB1 GLN 22 -9.071 -8.823 -7.146 888 HG2 GLN 22 HG2 GLN 22 -9.108 -6.808 -5.680 889 HG3 GLN 22 HG1 GLN 22 -9.892 -5.952 -6.987 890 HE21 GLN 22 HE21 GLN 22 -10.914 -6.393 -4.443 891 HE22 GLN 22 HE22 GLN 22 -12.352 -7.334 -4.589 892 H ASP 23 HN ASP 23 -8.489 -6.912 -9.991 893 HA ASP 23 HA ASP 23 -8.125 -9.167 -11.484 894 HB2 ASP 23 HB2 ASP 23 -7.849 -6.292 -12.157 895 HB3 ASP 23 HB1 ASP 23 -7.618 -7.504 -13.399 896 H VAL 24 HN VAL 24 -5.749 -6.575 -11.024 897 HA VAL 24 HA VAL 24 -3.967 -7.952 -12.779 898 HB VAL 24 HB VAL 24 -3.986 -5.512 -12.852 899 HG11 VAL 24 HG11 VAL 24 -3.096 -4.204 -10.986 900 HG12 VAL 24 HG12 VAL 24 -2.969 -5.679 -10.028 901 HG13 VAL 24 HG13 VAL 24 -4.552 -5.088 -10.534 902 HG21 VAL 24 HG21 VAL 24 -1.408 -6.712 -11.849 903 HG22 VAL 24 HG22 VAL 24 -1.520 -5.105 -12.575 904 HG23 VAL 24 HG23 VAL 24 -1.923 -6.539 -13.527 905 H ALA 25 HN ALA 25 -4.530 -7.631 -9.394 906 HA ALA 25 HA ALA 25 -2.021 -8.622 -8.469 907 HB1 ALA 25 HB1 ALA 25 -4.750 -8.756 -7.162 908 HB2 ALA 25 HB2 ALA 25 -3.571 -7.463 -6.945 909 HB3 ALA 25 HB3 ALA 25 -3.213 -9.087 -6.363 910 H GLN 26 HN GLN 26 -4.921 -9.847 -9.743 911 HA GLN 26 HA GLN 26 -4.562 -12.568 -8.985 912 HB2 GLN 26 HB2 GLN 26 -6.737 -12.412 -9.427 913 HB3 GLN 26 HB1 GLN 26 -6.487 -10.876 -10.239 914 HG2 GLN 26 HG2 GLN 26 -7.365 -12.041 -11.945 915 HG3 GLN 26 HG1 GLN 26 -5.672 -12.456 -12.189 916 HE21 GLN 26 HE21 GLN 26 -5.617 -14.176 -9.842 917 HE22 GLN 26 HE22 GLN 26 -6.438 -15.621 -10.282 918 H LYS 27 HN LYS 27 -3.884 -10.574 -11.751 919 HA LYS 27 HA LYS 27 -3.116 -12.557 -13.586 920 HB2 LYS 27 HB2 LYS 27 -2.139 -9.699 -13.407 921 HB3 LYS 27 HB1 LYS 27 -2.111 -10.727 -14.842 922 HG2 LYS 27 HG2 LYS 27 -4.554 -9.704 -13.418 923 HG3 LYS 27 HG1 LYS 27 -3.929 -9.140 -14.966 924 HD2 LYS 27 HD2 LYS 27 -4.623 -11.036 -16.079 925 HD3 LYS 27 HD1 LYS 27 -4.617 -12.021 -14.617 926 HE2 LYS 27 HE2 LYS 27 -6.603 -11.048 -13.824 927 HE3 LYS 27 HE1 LYS 27 -6.513 -9.735 -14.993 928 HZ1 LYS 27 HZ1 LYS 27 -6.960 -11.321 -16.756 929 HZ2 LYS 27 HZ2 LYS 27 -8.185 -11.386 -15.595 930 HZ3 LYS 27 HZ3 LYS 27 -7.004 -12.593 -15.643 931 H SER 28 HN SER 28 -1.300 -10.809 -11.104 932 HA SER 28 HA SER 28 1.161 -12.030 -12.110 933 HB2 SER 28 HB2 SER 28 0.776 -9.746 -10.179 934 HB3 SER 28 HB1 SER 28 2.326 -10.312 -10.807 935 HG SER 28 HG SER 28 0.587 -9.803 -12.814 936 H ILE 29 HN ILE 29 -1.171 -12.358 -9.750 937 HA ILE 29 HA ILE 29 0.696 -13.782 -7.980 938 HB ILE 29 HB ILE 29 -1.991 -12.572 -7.362 939 HG12 ILE 29 HG12 ILE 29 0.739 -11.890 -6.273 940 HG13 ILE 29 HG11 ILE 29 -0.139 -10.964 -7.494 941 HG21 ILE 29 HG21 ILE 29 -1.568 -13.222 -5.036 942 HG22 ILE 29 HG22 ILE 29 -0.183 -14.176 -5.585 943 HG23 ILE 29 HG23 ILE 29 -1.815 -14.589 -6.121 944 HD11 ILE 29 HD11 ILE 29 -0.337 -10.055 -5.205 945 HD12 ILE 29 HD12 ILE 29 -1.191 -11.537 -4.746 946 HD13 ILE 29 HD13 ILE 29 -1.876 -10.459 -5.967 947 H ALA 30 HN ALA 30 0.563 -15.930 -8.075 948 HA ALA 30 HA ALA 30 -1.768 -17.222 -9.236 949 HB1 ALA 30 HB1 ALA 30 0.488 -17.972 -9.844 950 HB2 ALA 30 HB2 ALA 30 -0.454 -19.263 -9.095 951 HB3 ALA 30 HB3 ALA 30 0.783 -18.418 -8.164 952 H ASP 31 HN ASP 31 -1.087 -16.027 -6.311 953 HA ASP 31 HA ASP 31 -2.202 -18.266 -4.761 954 HB2 ASP 31 HB2 ASP 31 0.068 -17.235 -4.191 955 HB3 ASP 31 HB1 ASP 31 -0.849 -15.827 -3.673 956 H GLU 32 HN GLU 32 -4.272 -18.082 -4.249 957 HA GLU 32 HA GLU 32 -5.845 -15.783 -4.607 958 HB2 GLU 32 HB2 GLU 32 -7.562 -17.001 -3.355 959 HB3 GLU 32 HB1 GLU 32 -6.760 -18.073 -4.497 960 HG2 GLU 32 HG2 GLU 32 -5.386 -18.977 -2.690 961 HG3 GLU 32 HG1 GLU 32 -6.188 -17.901 -1.546 962 H LYS 33 HN LYS 33 -3.843 -16.780 -1.911 963 HA LYS 33 HA LYS 33 -5.299 -15.208 0.016 964 HB2 LYS 33 HB2 LYS 33 -2.577 -16.512 0.198 965 HB3 LYS 33 HB1 LYS 33 -3.358 -15.667 1.525 966 HG2 LYS 33 HG2 LYS 33 -4.019 -17.742 2.083 967 HG3 LYS 33 HG1 LYS 33 -5.292 -17.416 0.907 968 HD2 LYS 33 HD2 LYS 33 -4.345 -19.604 0.501 969 HD3 LYS 33 HD1 LYS 33 -3.940 -18.518 -0.829 970 HE2 LYS 33 HE2 LYS 33 -2.035 -19.912 -0.172 971 HE3 LYS 33 HE1 LYS 33 -1.709 -18.200 0.068 972 HZ1 LYS 33 HZ1 LYS 33 -0.905 -19.338 1.955 973 HZ2 LYS 33 HZ2 LYS 33 -2.336 -20.226 2.135 974 HZ3 LYS 33 HZ3 LYS 33 -2.330 -18.567 2.448 975 H ALA 34 HN ALA 34 -2.118 -15.034 -1.519 976 HA ALA 34 HA ALA 34 -1.485 -12.444 -0.666 977 HB1 ALA 34 HB1 ALA 34 0.170 -13.974 -1.609 978 HB2 ALA 34 HB2 ALA 34 0.167 -12.434 -2.469 979 HB3 ALA 34 HB3 ALA 34 -0.603 -13.847 -3.188 980 H ARG 35 HN ARG 35 -3.591 -13.580 -3.199 981 HA ARG 35 HA ARG 35 -3.710 -11.155 -4.719 982 HB2 ARG 35 HB2 ARG 35 -4.569 -13.645 -5.224 983 HB3 ARG 35 HB1 ARG 35 -6.064 -12.978 -4.579 984 HG2 ARG 35 HG2 ARG 35 -4.579 -11.567 -6.777 985 HG3 ARG 35 HG1 ARG 35 -5.660 -12.913 -7.128 986 HD2 ARG 35 HD2 ARG 35 -6.371 -10.289 -5.816 987 HD3 ARG 35 HD1 ARG 35 -6.834 -10.851 -7.427 988 HE ARG 35 HE ARG 35 -7.733 -12.304 -5.027 989 HH11 ARG 35 HH11 ARG 35 -8.418 -10.611 -8.011 990 HH12 ARG 35 HH12 ARG 35 -10.127 -10.860 -7.912 991 HH21 ARG 35 HH21 ARG 35 -9.988 -12.632 -4.889 992 HH22 ARG 35 HH22 ARG 35 -11.023 -12.009 -6.134 993 H LYS 36 HN LYS 36 -5.930 -12.654 -2.374 994 HA LYS 36 HA LYS 36 -7.688 -10.507 -2.050 995 HB2 LYS 36 HB2 LYS 36 -6.717 -12.361 0.110 996 HB3 LYS 36 HB1 LYS 36 -8.182 -11.392 0.153 997 HG2 LYS 36 HG2 LYS 36 -9.322 -12.805 -1.152 998 HG3 LYS 36 HG1 LYS 36 -7.883 -13.276 -2.084 999 HD2 LYS 36 HD2 LYS 36 -8.679 -15.100 -0.627 1000 HD3 LYS 36 HD1 LYS 36 -7.040 -14.529 -0.228 1001 HE2 LYS 36 HE2 LYS 36 -7.864 -13.261 1.629 1002 HE3 LYS 36 HE1 LYS 36 -9.544 -13.553 1.182 1003 HZ1 LYS 36 HZ1 LYS 36 -8.908 -14.973 3.003 1004 HZ2 LYS 36 HZ2 LYS 36 -7.587 -15.576 2.139 1005 HZ3 LYS 36 HZ3 LYS 36 -9.158 -15.930 1.630 1006 H VAL 37 HN VAL 37 -4.915 -11.398 -0.035 1007 HA VAL 37 HA VAL 37 -5.292 -9.413 1.843 1008 HB VAL 37 HB VAL 37 -3.037 -9.745 2.626 1009 HG11 VAL 37 HG11 VAL 37 -4.598 -11.500 3.162 1010 HG12 VAL 37 HG12 VAL 37 -3.012 -12.207 2.848 1011 HG13 VAL 37 HG13 VAL 37 -4.276 -12.301 1.621 1012 HG21 VAL 37 HG21 VAL 37 -1.476 -11.236 1.350 1013 HG22 VAL 37 HG22 VAL 37 -1.750 -9.648 0.634 1014 HG23 VAL 37 HG23 VAL 37 -2.559 -11.065 -0.032 1015 H ILE 38 HN ILE 38 -3.611 -9.211 -1.253 1016 HA ILE 38 HA ILE 38 -2.672 -6.575 -0.541 1017 HB ILE 38 HB ILE 38 -1.541 -8.434 -2.162 1018 HG12 ILE 38 HG12 ILE 38 -1.139 -5.469 -2.468 1019 HG13 ILE 38 HG11 ILE 38 -0.650 -6.338 -1.019 1020 HG21 ILE 38 HG21 ILE 38 -2.693 -6.336 -3.996 1021 HG22 ILE 38 HG22 ILE 38 -3.249 -8.009 -3.921 1022 HG23 ILE 38 HG23 ILE 38 -1.602 -7.648 -4.446 1023 HD11 ILE 38 HD11 ILE 38 1.281 -6.192 -2.243 1024 HD12 ILE 38 HD12 ILE 38 0.449 -6.416 -3.771 1025 HD13 ILE 38 HD13 ILE 38 0.685 -7.793 -2.690 1026 H VAL 39 HN VAL 39 -5.243 -7.949 -2.567 1027 HA VAL 39 HA VAL 39 -5.912 -5.425 -3.676 1028 HB VAL 39 HB VAL 39 -7.903 -6.322 -4.476 1029 HG11 VAL 39 HG11 VAL 39 -5.981 -8.618 -4.220 1030 HG12 VAL 39 HG12 VAL 39 -6.002 -7.388 -5.483 1031 HG13 VAL 39 HG13 VAL 39 -7.329 -8.549 -5.350 1032 HG21 VAL 39 HG21 VAL 39 -8.915 -7.114 -2.414 1033 HG22 VAL 39 HG22 VAL 39 -7.808 -8.487 -2.381 1034 HG23 VAL 39 HG23 VAL 39 -9.009 -8.352 -3.668 1035 H GLU 40 HN GLU 40 -7.196 -7.208 -0.913 1036 HA GLU 40 HA GLU 40 -8.865 -5.306 0.162 1037 HB2 GLU 40 HB2 GLU 40 -7.300 -7.553 1.373 1038 HB3 GLU 40 HB1 GLU 40 -8.467 -6.619 2.279 1039 HG2 GLU 40 HG2 GLU 40 -10.241 -7.398 1.079 1040 HG3 GLU 40 HG1 GLU 40 -9.276 -7.810 -0.318 1041 H LEU 41 HN LEU 41 -5.374 -5.616 0.456 1042 HA LEU 41 HA LEU 41 -5.290 -3.628 2.561 1043 HB2 LEU 41 HB2 LEU 41 -3.532 -5.608 1.651 1044 HB3 LEU 41 HB1 LEU 41 -2.729 -4.079 1.352 1045 HG LEU 41 HG LEU 41 -1.998 -4.671 3.473 1046 HD11 LEU 41 HD11 LEU 41 -2.902 -2.372 3.355 1047 HD12 LEU 41 HD12 LEU 41 -2.892 -3.058 4.974 1048 HD13 LEU 41 HD13 LEU 41 -4.400 -2.964 4.070 1049 HD21 LEU 41 HD21 LEU 41 -4.828 -5.440 4.159 1050 HD22 LEU 41 HD22 LEU 41 -3.443 -5.516 5.249 1051 HD23 LEU 41 HD23 LEU 41 -3.499 -6.549 3.821 1052 H MET 42 HN MET 42 -4.183 -3.781 -0.829 1053 HA MET 42 HA MET 42 -3.215 -1.121 -0.898 1054 HB2 MET 42 HB2 MET 42 -4.149 -2.876 -3.169 1055 HB3 MET 42 HB1 MET 42 -3.236 -1.372 -3.358 1056 HG2 MET 42 HG2 MET 42 -2.350 -3.947 -2.090 1057 HG3 MET 42 HG1 MET 42 -1.729 -3.179 -3.541 1058 HE1 MET 42 HE1 MET 42 1.288 -2.955 -1.101 1059 HE2 MET 42 HE2 MET 42 0.723 -3.504 -2.685 1060 HE3 MET 42 HE3 MET 42 0.114 -4.267 -1.213 1061 H ALA 43 HN ALA 43 -6.301 -2.545 -1.162 1062 HA ALA 43 HA ALA 43 -7.888 -0.643 -2.290 1063 HB1 ALA 43 HB1 ALA 43 -9.583 -1.354 -0.587 1064 HB2 ALA 43 HB2 ALA 43 -8.304 -2.306 0.178 1065 HB3 ALA 43 HB3 ALA 43 -8.807 -2.669 -1.473 1066 H TYR 44 HN TYR 44 -6.185 -0.553 0.770 1067 HA TYR 44 HA TYR 44 -7.256 2.134 1.339 1068 HB2 TYR 44 HB2 TYR 44 -7.357 0.643 3.256 1069 HB3 TYR 44 HB1 TYR 44 -5.689 0.171 2.992 1070 HD1 TYR 44 HD1 TYR 44 -7.882 2.581 4.593 1071 HD2 TYR 44 HD2 TYR 44 -3.848 1.782 3.530 1072 HE1 TYR 44 HE1 TYR 44 -7.136 4.250 6.226 1073 HE2 TYR 44 HE2 TYR 44 -3.083 3.457 5.151 1074 HH TYR 44 HH TYR 44 -5.007 4.710 7.559 1075 H GLU 45 HN GLU 45 -4.210 0.372 1.633 1076 HA GLU 45 HA GLU 45 -2.523 2.480 1.920 1077 HB2 GLU 45 HB2 GLU 45 -1.878 -0.078 0.497 1078 HB3 GLU 45 HB1 GLU 45 -0.749 0.959 1.356 1079 HG2 GLU 45 HG2 GLU 45 -3.010 -0.603 2.567 1080 HG3 GLU 45 HG1 GLU 45 -1.309 -1.026 2.658 1081 H ASN 46 HN ASN 46 -3.941 1.353 -1.074 1082 HA ASN 46 HA ASN 46 -2.102 3.049 -2.567 1083 HB2 ASN 46 HB2 ASN 46 -3.652 0.567 -3.213 1084 HB3 ASN 46 HB1 ASN 46 -3.219 1.676 -4.496 1085 HD21 ASN 46 HD21 ASN 46 -1.703 0.402 -5.551 1086 HD22 ASN 46 HD22 ASN 46 -0.251 -0.103 -4.801 1087 H ALA 47 HN ALA 47 -5.360 2.743 -1.510 1088 HA ALA 47 HA ALA 47 -6.763 3.907 -3.634 1089 HB1 ALA 47 HB1 ALA 47 -7.403 4.048 -0.699 1090 HB2 ALA 47 HB2 ALA 47 -7.889 2.767 -1.812 1091 HB3 ALA 47 HB3 ALA 47 -8.516 4.405 -2.018 1092 H ASN 48 HN ASN 48 -8.078 5.954 -3.249 1093 HA ASN 48 HA ASN 48 -6.428 8.216 -3.337 1094 HB2 ASN 48 HB2 ASN 48 -9.349 7.691 -3.199 1095 HB3 ASN 48 HB1 ASN 48 -8.824 9.290 -2.678 1096 HD21 ASN 48 HD21 ASN 48 -10.317 8.251 -5.116 1097 HD22 ASN 48 HD22 ASN 48 -9.442 8.933 -6.446 1098 HA PRO 49 HA PRO 49 -5.228 8.899 0.795 1099 HB2 PRO 49 HB2 PRO 49 -5.446 11.687 0.783 1100 HB3 PRO 49 HB1 PRO 49 -4.032 10.756 0.292 1101 HG2 PRO 49 HG2 PRO 49 -6.173 11.983 -1.371 1102 HG3 PRO 49 HG1 PRO 49 -4.444 11.806 -1.714 1103 HD2 PRO 49 HD2 PRO 49 -6.274 10.234 -2.881 1104 HD3 PRO 49 HD1 PRO 49 -4.681 9.604 -2.404 1105 H GLU 50 HN GLU 50 -8.193 10.240 -0.372 1106 HA GLU 50 HA GLU 50 -9.320 10.727 2.230 1107 HB2 GLU 50 HB2 GLU 50 -10.116 12.274 0.729 1108 HB3 GLU 50 HB1 GLU 50 -10.154 11.134 -0.606 1109 HG2 GLU 50 HG2 GLU 50 -12.325 10.997 -0.270 1110 HG3 GLU 50 HG1 GLU 50 -11.949 10.132 1.202 1111 H CYS 51 HN CYS 51 -9.368 8.324 -0.302 1112 HA CYS 51 HA CYS 51 -11.800 7.107 0.552 1113 HB2 CYS 51 HB2 CYS 51 -9.717 6.294 -1.494 1114 HB3 CYS 51 HB1 CYS 51 -11.254 5.470 -1.228 1115 HG CYS 51 HG CYS 51 -12.837 7.258 -2.362 1116 H GLN 52 HN GLN 52 -8.364 6.522 0.860 1117 HA GLN 52 HA GLN 52 -8.686 4.052 2.274 1118 HB2 GLN 52 HB2 GLN 52 -6.356 4.223 2.787 1119 HB3 GLN 52 HB1 GLN 52 -6.569 4.717 1.115 1120 HG2 GLN 52 HG2 GLN 52 -6.465 7.072 1.838 1121 HG3 GLN 52 HG1 GLN 52 -6.159 6.525 3.486 1122 HE21 GLN 52 HE21 GLN 52 -4.668 4.232 2.456 1123 HE22 GLN 52 HE22 GLN 52 -3.126 4.822 2.012 1124 H SER 53 HN SER 53 -8.606 7.382 2.893 1125 HA SER 53 HA SER 53 -8.588 7.272 5.716 1126 HB2 SER 53 HB2 SER 53 -9.181 9.339 3.654 1127 HB3 SER 53 HB1 SER 53 -9.481 9.670 5.369 1128 HG SER 53 HG SER 53 -7.149 9.643 4.006 1129 H ALA 54 HN ALA 54 -11.010 6.893 3.278 1130 HA ALA 54 HA ALA 54 -13.178 6.924 5.161 1131 HB1 ALA 54 HB1 ALA 54 -12.879 5.730 2.421 1132 HB2 ALA 54 HB2 ALA 54 -13.667 7.247 2.849 1133 HB3 ALA 54 HB3 ALA 54 -14.386 5.716 3.343 1134 H ILE 55 HN ILE 55 -10.732 4.780 4.207 1135 HA ILE 55 HA ILE 55 -12.115 2.407 5.067 1136 HB ILE 55 HB ILE 55 -9.471 2.894 3.769 1137 HG12 ILE 55 HG12 ILE 55 -11.714 1.237 2.716 1138 HG13 ILE 55 HG11 ILE 55 -11.846 3.001 2.676 1139 HG21 ILE 55 HG21 ILE 55 -9.276 0.446 3.549 1140 HG22 ILE 55 HG22 ILE 55 -10.655 0.266 4.632 1141 HG23 ILE 55 HG23 ILE 55 -9.161 0.993 5.221 1142 HD11 ILE 55 HD11 ILE 55 -9.507 1.499 1.538 1143 HD12 ILE 55 HD12 ILE 55 -9.957 3.196 1.295 1144 HD13 ILE 55 HD13 ILE 55 -10.963 1.908 0.616 1145 H LYS 56 HN LYS 56 -9.484 4.417 6.395 1146 HA LYS 56 HA LYS 56 -8.064 2.633 7.844 1147 HB2 LYS 56 HB2 LYS 56 -8.558 4.738 9.712 1148 HB3 LYS 56 HB1 LYS 56 -7.090 4.331 8.850 1149 HG2 LYS 56 HG2 LYS 56 -7.399 6.496 8.212 1150 HG3 LYS 56 HG1 LYS 56 -8.251 5.656 6.912 1151 HD2 LYS 56 HD2 LYS 56 -10.266 6.308 7.610 1152 HD3 LYS 56 HD1 LYS 56 -9.833 6.269 9.318 1153 HE2 LYS 56 HE2 LYS 56 -9.256 8.474 7.310 1154 HE3 LYS 56 HE1 LYS 56 -10.285 8.541 8.739 1155 HZ1 LYS 56 HZ1 LYS 56 -8.282 8.170 10.112 1156 HZ2 LYS 56 HZ2 LYS 56 -8.245 9.623 9.250 1157 HZ3 LYS 56 HZ3 LYS 56 -7.330 8.303 8.722 1158 HA PRO 57 HA PRO 57 -11.339 2.380 11.487 1159 HB2 PRO 57 HB2 PRO 57 -13.916 2.390 10.636 1160 HB3 PRO 57 HB1 PRO 57 -13.089 3.856 11.189 1161 HG2 PRO 57 HG2 PRO 57 -13.391 2.816 8.382 1162 HG3 PRO 57 HG1 PRO 57 -13.801 4.435 9.002 1163 HD2 PRO 57 HD2 PRO 57 -11.509 4.046 7.759 1164 HD3 PRO 57 HD1 PRO 57 -11.510 5.007 9.247 1165 H LEU 58 HN LEU 58 -11.847 1.214 8.216 1166 HA LEU 58 HA LEU 58 -12.805 -1.389 9.149 1167 HB2 LEU 58 HB2 LEU 58 -12.296 -0.849 6.282 1168 HB3 LEU 58 HB1 LEU 58 -13.584 -1.797 7.012 1169 HG LEU 58 HG LEU 58 -13.431 1.219 6.889 1170 HD11 LEU 58 HD11 LEU 58 -13.795 0.276 4.713 1171 HD12 LEU 58 HD12 LEU 58 -15.318 0.945 5.303 1172 HD13 LEU 58 HD13 LEU 58 -15.045 -0.797 5.340 1173 HD21 LEU 58 HD21 LEU 58 -15.646 -0.584 7.872 1174 HD22 LEU 58 HD22 LEU 58 -15.733 1.172 7.709 1175 HD23 LEU 58 HD23 LEU 58 -14.626 0.449 8.875 1176 H LYS 59 HN LYS 59 -10.095 0.323 8.179 1177 HA LYS 59 HA LYS 59 -8.526 -1.541 6.862 1178 HB2 LYS 59 HB2 LYS 59 -7.834 0.763 7.116 1179 HB3 LYS 59 HB1 LYS 59 -7.697 0.558 8.852 1180 HG2 LYS 59 HG2 LYS 59 -5.514 0.294 8.361 1181 HG3 LYS 59 HG1 LYS 59 -6.033 -1.355 8.047 1182 HD2 LYS 59 HD2 LYS 59 -5.752 0.807 5.995 1183 HD3 LYS 59 HD1 LYS 59 -4.618 -0.522 6.241 1184 HE2 LYS 59 HE2 LYS 59 -7.504 -0.731 5.376 1185 HE3 LYS 59 HE1 LYS 59 -6.092 -0.988 4.364 1186 HZ1 LYS 59 HZ1 LYS 59 -7.097 -3.072 5.090 1187 HZ2 LYS 59 HZ2 LYS 59 -6.828 -2.652 6.701 1188 HZ3 LYS 59 HZ3 LYS 59 -5.517 -2.916 5.676 1189 H GLY 60 HN GLY 60 -8.251 -3.572 7.448 1190 HA2 GLY 60 HA3 GLY 60 -7.082 -5.189 8.732 1191 HA3 GLY 60 HA2 GLY 60 -7.186 -4.117 10.122 1192 H LYS 61 HN LYS 61 -10.093 -3.632 9.340 1193 HA LYS 61 HA LYS 61 -11.133 -6.009 10.721 1194 HB2 LYS 61 HB2 LYS 61 -12.754 -3.544 10.296 1195 HB3 LYS 61 HB1 LYS 61 -12.726 -4.636 11.669 1196 HG2 LYS 61 HG2 LYS 61 -10.570 -2.664 11.005 1197 HG3 LYS 61 HG1 LYS 61 -11.843 -2.401 12.183 1198 HD2 LYS 61 HD2 LYS 61 -9.801 -4.614 12.288 1199 HD3 LYS 61 HD1 LYS 61 -9.733 -3.122 13.229 1200 HE2 LYS 61 HE2 LYS 61 -11.807 -3.692 14.332 1201 HE3 LYS 61 HE1 LYS 61 -11.963 -5.140 13.343 1202 HZ1 LYS 61 HZ1 LYS 61 -9.943 -6.002 14.348 1203 HZ2 LYS 61 HZ2 LYS 61 -11.105 -5.667 15.528 1204 HZ3 LYS 61 HZ3 LYS 61 -9.801 -4.616 15.306 1205 H VAL 62 HN VAL 62 -11.955 -7.455 9.304 1206 HA VAL 62 HA VAL 62 -13.896 -6.383 7.375 1207 HB VAL 62 HB VAL 62 -12.049 -7.454 6.178 1208 HG11 VAL 62 HG11 VAL 62 -11.270 -9.025 7.845 1209 HG12 VAL 62 HG12 VAL 62 -11.644 -9.866 6.339 1210 HG13 VAL 62 HG13 VAL 62 -12.763 -9.952 7.702 1211 HG21 VAL 62 HG21 VAL 62 -13.366 -9.085 4.863 1212 HG22 VAL 62 HG22 VAL 62 -14.220 -7.573 5.166 1213 HG23 VAL 62 HG23 VAL 62 -14.624 -9.014 6.098 1214 HA PRO 63 HA PRO 63 -17.080 -8.651 9.643 1215 HB2 PRO 63 HB2 PRO 63 -18.039 -9.044 6.853 1216 HB3 PRO 63 HB1 PRO 63 -18.937 -8.544 8.271 1217 HG2 PRO 63 HG2 PRO 63 -18.248 -6.753 6.448 1218 HG3 PRO 63 HG1 PRO 63 -18.147 -6.357 8.172 1219 HD2 PRO 63 HD2 PRO 63 -15.968 -7.012 6.247 1220 HD3 PRO 63 HD1 PRO 63 -15.963 -5.889 7.621 1221 H ALA 64 HN ALA 64 -17.264 -10.762 10.145 1222 HA ALA 64 HA ALA 64 -15.388 -12.596 9.117 1223 HB1 ALA 64 HB1 ALA 64 -17.805 -13.125 10.844 1224 HB2 ALA 64 HB2 ALA 64 -16.194 -12.697 11.419 1225 HB3 ALA 64 HB3 ALA 64 -16.453 -14.230 10.588 1226 H GLY 65 HN GLY 65 -15.523 -13.311 7.090 1227 HA2 GLY 65 HA3 GLY 65 -16.457 -15.036 5.689 1228 HA3 GLY 65 HA2 GLY 65 -18.051 -14.591 6.277 1229 H SER 66 HN SER 66 -16.966 -11.669 5.937 1230 HA SER 66 HA SER 66 -17.926 -11.461 3.186 1231 HB2 SER 66 HB2 SER 66 -17.386 -9.285 5.219 1232 HB3 SER 66 HB1 SER 66 -18.195 -9.085 3.664 1233 HG SER 66 HG SER 66 -19.712 -10.753 4.542 1234 H ASP 67 HN ASP 67 -16.914 -9.649 1.903 1235 HA ASP 67 HA ASP 67 -14.022 -10.022 1.759 1236 HB2 ASP 67 HB2 ASP 67 -15.887 -9.856 -0.173 1237 HB3 ASP 67 HB1 ASP 67 -15.493 -8.152 -0.029 1238 H VAL 68 HN VAL 68 -12.514 -8.257 2.063 1239 HA VAL 68 HA VAL 68 -13.626 -6.188 3.743 1240 HB VAL 68 HB VAL 68 -11.587 -5.777 4.524 1241 HG11 VAL 68 HG11 VAL 68 -11.518 -8.197 4.445 1242 HG12 VAL 68 HG12 VAL 68 -9.911 -7.499 4.269 1243 HG13 VAL 68 HG13 VAL 68 -10.756 -8.133 2.858 1244 HG21 VAL 68 HG21 VAL 68 -9.580 -5.416 3.090 1245 HG22 VAL 68 HG22 VAL 68 -10.948 -4.353 2.739 1246 HG23 VAL 68 HG23 VAL 68 -10.603 -5.723 1.684 1247 H ILE 69 HN ILE 69 -12.664 -6.604 0.466 1248 HA ILE 69 HA ILE 69 -12.352 -3.931 -0.255 1249 HB ILE 69 HB ILE 69 -13.212 -6.322 -1.854 1250 HG12 ILE 69 HG12 ILE 69 -10.945 -6.557 -1.228 1251 HG13 ILE 69 HG11 ILE 69 -10.890 -5.895 -2.855 1252 HG21 ILE 69 HG21 ILE 69 -12.674 -3.504 -2.810 1253 HG22 ILE 69 HG22 ILE 69 -14.174 -4.417 -2.954 1254 HG23 ILE 69 HG23 ILE 69 -12.751 -4.909 -3.878 1255 HD11 ILE 69 HD11 ILE 69 -10.576 -3.651 -1.883 1256 HD12 ILE 69 HD12 ILE 69 -9.270 -4.788 -1.526 1257 HD13 ILE 69 HD13 ILE 69 -10.481 -4.406 -0.292 1258 H SER 70 HN SER 70 -15.131 -6.023 -0.373 1259 HA SER 70 HA SER 70 -17.073 -4.403 -1.379 1260 HB2 SER 70 HB2 SER 70 -17.496 -6.719 -0.769 1261 HB3 SER 70 HB1 SER 70 -17.280 -6.350 0.939 1262 HG SER 70 HG SER 70 -19.310 -5.274 -0.741 1263 H GLU 71 HN GLU 71 -15.678 -4.289 1.839 1264 HA GLU 71 HA GLU 71 -17.516 -2.323 2.835 1265 HB2 GLU 71 HB2 GLU 71 -14.971 -3.301 4.090 1266 HB3 GLU 71 HB1 GLU 71 -16.413 -2.680 4.891 1267 HG2 GLU 71 HG2 GLU 71 -16.659 -5.092 3.194 1268 HG3 GLU 71 HG1 GLU 71 -15.903 -5.248 4.769 1269 H TYR 72 HN TYR 72 -14.322 -2.520 1.553 1270 HA TYR 72 HA TYR 72 -13.481 0.052 2.450 1271 HB2 TYR 72 HB2 TYR 72 -12.380 -2.013 0.561 1272 HB3 TYR 72 HB1 TYR 72 -11.627 -0.433 0.713 1273 HD1 TYR 72 HD1 TYR 72 -13.141 -1.811 3.694 1274 HD2 TYR 72 HD2 TYR 72 -9.567 -1.613 1.417 1275 HE1 TYR 72 HE1 TYR 72 -11.866 -2.609 5.627 1276 HE2 TYR 72 HE2 TYR 72 -8.280 -2.428 3.346 1277 HH TYR 72 HH TYR 72 -9.868 -3.602 6.224 1278 H VAL 73 HN VAL 73 -14.818 -1.341 -0.466 1279 HA VAL 73 HA VAL 73 -14.816 1.069 -1.975 1280 HB VAL 73 HB VAL 73 -16.007 0.043 -3.635 1281 HG11 VAL 73 HG11 VAL 73 -14.017 -1.211 -3.391 1282 HG12 VAL 73 HG12 VAL 73 -15.321 -2.308 -3.840 1283 HG13 VAL 73 HG13 VAL 73 -14.758 -2.240 -2.169 1284 HG21 VAL 73 HG21 VAL 73 -17.952 -0.467 -2.032 1285 HG22 VAL 73 HG22 VAL 73 -17.239 -2.082 -1.939 1286 HG23 VAL 73 HG23 VAL 73 -17.766 -1.430 -3.499 1287 H LYS 74 HN LYS 74 -16.861 -0.463 0.346 1288 HA LYS 74 HA LYS 74 -19.134 1.229 0.071 1289 HB2 LYS 74 HB2 LYS 74 -19.364 -0.950 0.975 1290 HB3 LYS 74 HB1 LYS 74 -18.123 -0.654 2.177 1291 HG2 LYS 74 HG2 LYS 74 -19.856 1.272 2.819 1292 HG3 LYS 74 HG1 LYS 74 -20.966 0.078 2.147 1293 HD2 LYS 74 HD2 LYS 74 -20.739 -0.283 4.531 1294 HD3 LYS 74 HD1 LYS 74 -20.010 -1.622 3.643 1295 HE2 LYS 74 HE2 LYS 74 -17.793 -0.591 3.936 1296 HE3 LYS 74 HE1 LYS 74 -18.544 0.700 4.876 1297 HZ1 LYS 74 HZ1 LYS 74 -18.509 -2.186 5.603 1298 HZ2 LYS 74 HZ2 LYS 74 -19.305 -0.971 6.476 1299 HZ3 LYS 74 HZ3 LYS 74 -17.623 -0.948 6.348 1300 H ALA 75 HN ALA 75 -16.115 1.309 1.732 1301 HA ALA 75 HA ALA 75 -16.626 3.444 3.514 1302 HB1 ALA 75 HB1 ALA 75 -14.666 2.013 3.700 1303 HB2 ALA 75 HB2 ALA 75 -14.186 3.701 3.551 1304 HB3 ALA 75 HB3 ALA 75 -14.058 2.620 2.163 1305 H CYS 76 HN CYS 76 -15.333 3.329 0.221 1306 HA CYS 76 HA CYS 76 -15.551 6.234 0.009 1307 HB2 CYS 76 HB2 CYS 76 -13.546 5.324 -0.858 1308 HB3 CYS 76 HB1 CYS 76 -14.392 4.120 -1.812 1309 HG CYS 76 HG CYS 76 -15.629 6.447 -3.263 1310 H ASP 77 HN ASP 77 -17.717 3.891 -0.142 1311 HA ASP 77 HA ASP 77 -19.058 4.319 -2.575 1312 HB2 ASP 77 HB2 ASP 77 -19.624 2.411 -1.275 1313 HB3 ASP 77 HB1 ASP 77 -20.044 3.377 0.129 1314 H GLY 78 HN GLY 78 -18.736 6.238 0.235 1315 HA2 GLY 78 HA3 GLY 78 -20.770 8.108 -0.769 1316 HA3 GLY 78 HA2 GLY 78 -20.073 8.137 0.842 1317 H ILE 79 HN ILE 79 -17.553 7.557 -1.262 1318 HA ILE 79 HA ILE 79 -16.828 10.382 -1.228 1319 HB ILE 79 HB ILE 79 -15.171 7.906 -1.541 1320 HG12 ILE 79 HG12 ILE 79 -15.127 10.044 0.588 1321 HG13 ILE 79 HG11 ILE 79 -15.961 8.496 0.745 1322 HG21 ILE 79 HG21 ILE 79 -13.200 9.369 -1.571 1323 HG22 ILE 79 HG22 ILE 79 -14.262 10.777 -1.651 1324 HG23 ILE 79 HG23 ILE 79 -14.234 9.614 -2.978 1325 HD11 ILE 79 HD11 ILE 79 -13.039 8.681 0.146 1326 HD12 ILE 79 HD12 ILE 79 -13.955 7.306 0.772 1327 HD13 ILE 79 HD13 ILE 79 -13.668 8.722 1.789 1328 H GLY 80 HN GLY 80 -16.546 11.531 -3.014 1329 HA2 GLY 80 HA3 GLY 80 -15.216 10.892 -5.261 1330 HA3 GLY 80 HA2 GLY 80 -16.849 10.360 -5.629 1331 H GLY 81 HN GLY 81 -18.247 12.339 -4.238 1332 HA2 GLY 81 HA3 GLY 81 -17.993 14.423 -6.269 1333 HA3 GLY 81 HA2 GLY 81 -19.380 14.101 -5.261 1334 H ALA 82 HN ALA 82 -19.799 15.997 -4.620 1335 HA ALA 82 HA ALA 82 -17.984 17.899 -3.637 1336 HB1 ALA 82 HB1 ALA 82 -20.033 19.000 -2.803 1337 HB2 ALA 82 HB2 ALA 82 -20.937 17.545 -3.241 1338 HB3 ALA 82 HB3 ALA 82 -20.141 18.498 -4.490 1339 H MET 83 HN MET 83 -19.717 15.250 -2.155 1340 HA MET 83 HA MET 83 -19.144 15.997 0.530 1341 HB2 MET 83 HB2 MET 83 -19.700 13.246 -0.591 1342 HB3 MET 83 HB1 MET 83 -19.721 13.682 1.108 1343 HG2 MET 83 HG2 MET 83 -21.544 15.299 0.584 1344 HG3 MET 83 HG1 MET 83 -21.586 14.631 -1.043 1345 HE1 MET 83 HE1 MET 83 -22.263 12.150 -1.623 1346 HE2 MET 83 HE2 MET 83 -22.687 10.936 -0.418 1347 HE3 MET 83 HE3 MET 83 -21.031 11.533 -0.522 1348 H HIS 84 HN HIS 84 -17.395 14.369 -2.001 1349 HA HIS 84 HA HIS 84 -15.278 13.375 -0.440 1350 HB2 HIS 84 HB2 HIS 84 -15.429 12.603 -2.700 1351 HB3 HIS 84 HB1 HIS 84 -15.398 14.240 -3.332 1352 HD1 HIS 84 HD1 HIS 84 -13.361 14.006 -4.802 1353 HD2 HIS 84 HD2 HIS 84 -12.648 12.845 -0.874 1354 HE1 HIS 84 HE1 HIS 84 -10.884 13.627 -4.645 1355 HE2 HIS 84 HE2 HIS 84 -10.462 12.988 -2.250 1356 H LYS 85 HN LYS 85 -16.062 16.552 -1.664 1357 HA LYS 85 HA LYS 85 -13.471 17.628 -0.964 1358 HB2 LYS 85 HB2 LYS 85 -16.002 18.911 -1.984 1359 HB3 LYS 85 HB1 LYS 85 -14.588 19.847 -1.521 1360 HG2 LYS 85 HG2 LYS 85 -14.357 19.624 -3.816 1361 HG3 LYS 85 HG1 LYS 85 -13.313 18.354 -3.183 1362 HD2 LYS 85 HD2 LYS 85 -15.346 16.809 -3.461 1363 HD3 LYS 85 HD1 LYS 85 -16.025 18.096 -4.455 1364 HE2 LYS 85 HE2 LYS 85 -13.397 16.701 -4.909 1365 HE3 LYS 85 HE1 LYS 85 -14.880 16.418 -5.815 1366 HZ1 LYS 85 HZ1 LYS 85 -13.406 17.872 -7.030 1367 HZ2 LYS 85 HZ2 LYS 85 -13.334 18.956 -5.737 1368 HZ3 LYS 85 HZ3 LYS 85 -14.787 18.732 -6.571 1369 H ALA 86 HN ALA 86 -16.520 17.143 0.523 1370 HA ALA 86 HA ALA 86 -16.122 19.044 2.650 1371 HB1 ALA 86 HB1 ALA 86 -18.053 16.736 2.521 1372 HB2 ALA 86 HB2 ALA 86 -18.372 18.345 1.872 1373 HB3 ALA 86 HB3 ALA 86 -18.130 18.125 3.605 1374 H MET 87 HN MET 87 -15.925 15.554 2.251 1375 HA MET 87 HA MET 87 -15.112 15.105 4.974 1376 HB2 MET 87 HB2 MET 87 -15.198 13.246 2.581 1377 HB3 MET 87 HB1 MET 87 -14.947 12.746 4.257 1378 HG2 MET 87 HG2 MET 87 -17.303 14.340 4.118 1379 HG3 MET 87 HG1 MET 87 -17.381 13.105 2.868 1380 HE1 MET 87 HE1 MET 87 -17.125 13.856 6.691 1381 HE2 MET 87 HE2 MET 87 -15.632 12.957 6.419 1382 HE3 MET 87 HE3 MET 87 -16.927 12.247 7.382 1383 H LEU 88 HN LEU 88 -13.562 15.943 2.092 1384 HA LEU 88 HA LEU 88 -11.119 14.704 2.170 1385 HB2 LEU 88 HB2 LEU 88 -12.242 16.599 0.654 1386 HB3 LEU 88 HB1 LEU 88 -11.139 17.599 1.573 1387 HG LEU 88 HG LEU 88 -9.340 16.884 0.413 1388 HD11 LEU 88 HD11 LEU 88 -9.329 14.665 1.441 1389 HD12 LEU 88 HD12 LEU 88 -8.958 14.555 -0.277 1390 HD13 LEU 88 HD13 LEU 88 -10.566 14.125 0.305 1391 HD21 LEU 88 HD21 LEU 88 -9.897 16.122 -1.858 1392 HD22 LEU 88 HD22 LEU 88 -10.923 17.455 -1.325 1393 HD23 LEU 88 HD23 LEU 88 -11.545 15.805 -1.316 1394 H MET 89 HN MET 89 -12.306 17.331 4.164 1395 HA MET 89 HA MET 89 -9.713 17.885 5.322 1396 HB2 MET 89 HB2 MET 89 -11.376 19.678 4.959 1397 HB3 MET 89 HB1 MET 89 -12.450 18.896 6.110 1398 HG2 MET 89 HG2 MET 89 -10.758 19.217 7.866 1399 HG3 MET 89 HG1 MET 89 -9.743 20.067 6.703 1400 HE1 MET 89 HE1 MET 89 -10.564 21.321 9.493 1401 HE2 MET 89 HE2 MET 89 -10.954 22.967 8.997 1402 HE3 MET 89 HE3 MET 89 -9.566 22.140 8.291 1403 H ALA 90 HN ALA 90 -12.324 15.757 5.924 1404 HA ALA 90 HA ALA 90 -11.746 15.562 8.794 1405 HB1 ALA 90 HB1 ALA 90 -14.097 15.784 8.015 1406 HB2 ALA 90 HB2 ALA 90 -13.812 14.311 8.941 1407 HB3 ALA 90 HB3 ALA 90 -13.933 14.235 7.180 1408 H GLN 91 HN GLN 91 -12.062 13.466 5.965 1409 HA GLN 91 HA GLN 91 -11.280 11.154 7.419 1410 HB2 GLN 91 HB2 GLN 91 -11.983 11.789 4.644 1411 HB3 GLN 91 HB1 GLN 91 -11.459 10.197 5.101 1412 HG2 GLN 91 HG2 GLN 91 -13.202 10.142 6.729 1413 HG3 GLN 91 HG1 GLN 91 -13.777 11.703 6.205 1414 HE21 GLN 91 HE21 GLN 91 -13.183 11.141 3.418 1415 HE22 GLN 91 HE22 GLN 91 -14.438 10.082 2.894 1416 H LEU 92 HN LEU 92 -10.115 12.518 4.421 1417 HA LEU 92 HA LEU 92 -7.588 11.544 4.218 1418 HB2 LEU 92 HB2 LEU 92 -8.911 13.387 2.870 1419 HB3 LEU 92 HB1 LEU 92 -7.985 14.490 3.858 1420 HG LEU 92 HG LEU 92 -7.139 12.814 1.577 1421 HD11 LEU 92 HD11 LEU 92 -5.690 14.748 1.175 1422 HD12 LEU 92 HD12 LEU 92 -6.260 15.468 2.681 1423 HD13 LEU 92 HD13 LEU 92 -7.385 15.198 1.352 1424 HD21 LEU 92 HD21 LEU 92 -5.301 13.353 3.908 1425 HD22 LEU 92 HD22 LEU 92 -4.769 12.864 2.301 1426 HD23 LEU 92 HD23 LEU 92 -5.767 11.778 3.266 1427 H GLU 93 HN GLU 93 -8.867 13.873 6.416 1428 HA GLU 93 HA GLU 93 -7.848 15.564 7.665 1429 HB2 GLU 93 HB2 GLU 93 -7.043 14.394 9.777 1430 HB3 GLU 93 HB1 GLU 93 -8.683 14.043 9.222 1431 HG2 GLU 93 HG2 GLU 93 -8.026 11.932 8.370 1432 HG3 GLU 93 HG1 GLU 93 -6.320 12.293 8.583 Start of MODEL 8 1 H2 PRO 1 HT1 PRO 1 -5.191 -4.271 13.375 2 H3 PRO 1 HT2 PRO 1 -5.667 -2.813 13.938 3 HA PRO 1 HA PRO 1 -6.327 -2.644 11.884 4 HB2 PRO 1 HB2 PRO 1 -4.256 -1.484 10.660 5 HB3 PRO 1 HB1 PRO 1 -5.044 -0.714 12.045 6 HG2 PRO 1 HG2 PRO 1 -2.425 -2.035 11.881 7 HG3 PRO 1 HG1 PRO 1 -3.020 -0.866 13.072 8 HD2 PRO 1 HD2 PRO 1 -2.883 -3.762 13.270 9 HD3 PRO 1 HD1 PRO 1 -3.331 -2.586 14.524 10 H SER 2 HN SER 2 -4.707 -2.590 9.484 11 HA SER 2 HA SER 2 -4.273 -5.293 8.786 12 HB2 SER 2 HB2 SER 2 -2.941 -2.822 7.668 13 HB3 SER 2 HB1 SER 2 -2.994 -4.393 6.900 14 HG SER 2 HG SER 2 -5.409 -4.082 7.130 15 H PHE 3 HN PHE 3 -2.072 -6.219 8.359 16 HA PHE 3 HA PHE 3 -0.333 -5.823 10.563 17 HB2 PHE 3 HB2 PHE 3 1.210 -6.960 8.581 18 HB3 PHE 3 HB1 PHE 3 0.277 -7.846 9.784 19 HD1 PHE 3 HD1 PHE 3 0.763 -7.052 6.330 20 HD2 PHE 3 HD2 PHE 3 -2.037 -8.650 9.120 21 HE1 PHE 3 HE1 PHE 3 -0.463 -8.127 4.506 22 HE2 PHE 3 HE2 PHE 3 -3.278 -9.706 7.280 23 HZ PHE 3 HZ PHE 3 -2.490 -9.445 4.963 24 H ASN 4 HN ASN 4 -0.167 -4.982 7.164 25 HA ASN 4 HA ASN 4 2.496 -3.927 7.483 26 HB2 ASN 4 HB2 ASN 4 2.390 -3.733 5.043 27 HB3 ASN 4 HB1 ASN 4 1.901 -5.340 5.580 28 HD21 ASN 4 HD21 ASN 4 0.746 -2.228 4.466 29 HD22 ASN 4 HD22 ASN 4 -0.817 -2.776 3.961 30 H THR 5 HN THR 5 -0.488 -2.543 7.923 31 HA THR 5 HA THR 5 -0.260 -0.236 6.312 32 HB THR 5 HB THR 5 -2.405 -0.927 7.180 33 HG1 THR 5 HG1 THR 5 -1.928 1.383 6.787 34 HG21 THR 5 HG21 THR 5 -1.824 -1.848 9.215 35 HG22 THR 5 HG22 THR 5 -2.798 -0.428 9.629 36 HG23 THR 5 HG23 THR 5 -1.034 -0.367 9.747 37 H VAL 6 HN VAL 6 1.592 -1.204 8.898 38 HA VAL 6 HA VAL 6 2.218 1.365 9.967 39 HB VAL 6 HB VAL 6 3.931 0.335 11.166 40 HG11 VAL 6 HG11 VAL 6 1.953 -1.869 10.647 41 HG12 VAL 6 HG12 VAL 6 1.795 -0.579 11.838 42 HG13 VAL 6 HG13 VAL 6 3.064 -1.789 12.013 43 HG21 VAL 6 HG21 VAL 6 5.195 -1.569 10.528 44 HG22 VAL 6 HG22 VAL 6 5.037 -0.555 9.081 45 HG23 VAL 6 HG23 VAL 6 4.028 -1.992 9.269 46 H ARG 7 HN ARG 7 3.694 2.851 9.135 47 HA ARG 7 HA ARG 7 5.493 1.948 7.103 48 HB2 ARG 7 HB2 ARG 7 4.562 3.377 5.322 49 HB3 ARG 7 HB1 ARG 7 3.629 1.970 5.788 50 HG2 ARG 7 HG2 ARG 7 2.552 3.957 7.338 51 HG3 ARG 7 HG1 ARG 7 2.865 4.740 5.781 52 HD2 ARG 7 HD2 ARG 7 1.771 2.834 4.657 53 HD3 ARG 7 HD1 ARG 7 1.337 2.164 6.233 54 HE ARG 7 HE ARG 7 -0.078 4.096 4.772 55 HH11 ARG 7 HH11 ARG 7 0.955 3.647 8.097 56 HH12 ARG 7 HH12 ARG 7 -0.305 4.652 8.741 57 HH21 ARG 7 HH21 ARG 7 -1.727 5.374 5.632 58 HH22 ARG 7 HH22 ARG 7 -1.837 5.610 7.346 59 H GLN 8 HN GLN 8 6.816 3.494 6.188 60 HA GLN 8 HA GLN 8 8.269 5.068 7.764 61 HB2 GLN 8 HB2 GLN 8 7.995 4.653 4.991 62 HB3 GLN 8 HB1 GLN 8 8.096 6.396 5.222 63 HG2 GLN 8 HG2 GLN 8 10.152 6.108 6.498 64 HG3 GLN 8 HG1 GLN 8 10.051 4.364 6.267 65 HE21 GLN 8 HE21 GLN 8 12.151 6.140 5.482 66 HE22 GLN 8 HE22 GLN 8 12.283 6.026 3.750 67 H GLY 9 HN GLY 9 7.660 6.563 9.146 68 HA2 GLY 9 HA3 GLY 9 5.634 8.540 8.472 69 HA3 GLY 9 HA2 GLY 9 6.488 8.386 9.999 70 H SER 10 HN SER 10 7.167 10.487 10.233 71 HA SER 10 HA SER 10 8.164 12.127 8.195 72 HB2 SER 10 HB2 SER 10 8.855 12.239 11.140 73 HB3 SER 10 HB1 SER 10 8.979 13.563 9.981 74 HG SER 10 HG SER 10 6.871 12.830 11.426 75 H LYS 11 HN LYS 11 9.667 11.263 6.919 76 HA LYS 11 HA LYS 11 11.469 10.100 6.184 77 HB2 LYS 11 HB2 LYS 11 13.537 11.191 6.579 78 HB3 LYS 11 HB1 LYS 11 12.304 12.423 6.497 79 HG2 LYS 11 HG2 LYS 11 12.350 12.684 8.859 80 HG3 LYS 11 HG1 LYS 11 13.434 11.319 9.057 81 HD2 LYS 11 HD2 LYS 11 15.095 12.594 7.655 82 HD3 LYS 11 HD1 LYS 11 14.025 13.990 7.803 83 HE2 LYS 11 HE2 LYS 11 15.322 12.487 10.073 84 HE3 LYS 11 HE1 LYS 11 15.800 14.071 9.469 85 HZ1 LYS 11 HZ1 LYS 11 14.455 14.277 11.448 86 HZ2 LYS 11 HZ2 LYS 11 13.197 13.406 10.731 87 HZ3 LYS 11 HZ3 LYS 11 13.626 14.922 10.124 88 H GLU 12 HN GLU 12 10.253 8.606 8.148 89 HA GLU 12 HA GLU 12 11.896 7.581 10.157 90 HB2 GLU 12 HB2 GLU 12 9.497 7.094 9.914 91 HB3 GLU 12 HB1 GLU 12 9.818 6.194 8.445 92 HG2 GLU 12 HG2 GLU 12 11.052 4.523 9.724 93 HG3 GLU 12 HG1 GLU 12 10.768 5.444 11.201 94 HA PRO 13 HA PRO 13 15.223 5.565 7.936 95 HB2 PRO 13 HB2 PRO 13 14.948 3.424 9.940 96 HB3 PRO 13 HB1 PRO 13 16.366 4.384 9.525 97 HG2 PRO 13 HG2 PRO 13 14.981 4.743 11.817 98 HG3 PRO 13 HG1 PRO 13 15.825 6.052 10.985 99 HD2 PRO 13 HD2 PRO 13 12.928 5.494 11.173 100 HD3 PRO 13 HD1 PRO 13 13.768 7.034 10.933 101 H TYR 14 HN TYR 14 15.023 4.291 6.202 102 HA TYR 14 HA TYR 14 12.457 3.240 5.753 103 HB2 TYR 14 HB2 TYR 14 13.708 4.326 3.961 104 HB3 TYR 14 HB1 TYR 14 14.891 3.025 3.986 105 HD1 TYR 14 HD1 TYR 14 13.880 0.642 3.741 106 HD2 TYR 14 HD2 TYR 14 11.965 4.174 2.412 107 HE1 TYR 14 HE1 TYR 14 12.533 -0.706 2.226 108 HE2 TYR 14 HE2 TYR 14 10.587 2.845 0.869 109 HH TYR 14 HH TYR 14 10.174 0.797 0.074 110 HA PRO 15 HA PRO 15 14.587 -1.129 5.416 111 HB2 PRO 15 HB2 PRO 15 16.776 -0.870 7.360 112 HB3 PRO 15 HB1 PRO 15 16.763 -1.667 5.790 113 HG2 PRO 15 HG2 PRO 15 18.044 0.656 6.223 114 HG3 PRO 15 HG1 PRO 15 17.335 0.237 4.669 115 HD2 PRO 15 HD2 PRO 15 16.381 2.152 6.727 116 HD3 PRO 15 HD1 PRO 15 16.183 2.182 4.969 117 H ASP 16 HN ASP 16 14.311 0.941 8.036 118 HA ASP 16 HA ASP 16 13.680 -1.107 9.984 119 HB2 ASP 16 HB2 ASP 16 14.078 1.858 10.129 120 HB3 ASP 16 HB1 ASP 16 13.248 1.029 11.434 121 H PHE 17 HN PHE 17 12.122 1.536 8.243 122 HA PHE 17 HA PHE 17 9.562 1.332 9.347 123 HB2 PHE 17 HB2 PHE 17 9.221 3.019 7.849 124 HB3 PHE 17 HB1 PHE 17 10.793 2.667 7.151 125 HD1 PHE 17 HD1 PHE 17 7.303 1.295 6.981 126 HD2 PHE 17 HD2 PHE 17 10.896 2.246 4.928 127 HE1 PHE 17 HE1 PHE 17 6.275 0.605 4.847 128 HE2 PHE 17 HE2 PHE 17 9.865 1.561 2.816 129 HZ PHE 17 HZ PHE 17 7.549 0.760 2.776 130 H VAL 18 HN VAL 18 11.100 -0.374 6.685 131 HA VAL 18 HA VAL 18 8.805 -1.980 6.166 132 HB VAL 18 HB VAL 18 10.053 -1.638 4.245 133 HG11 VAL 18 HG11 VAL 18 12.498 -2.431 5.817 134 HG12 VAL 18 HG12 VAL 18 12.083 -0.805 5.265 135 HG13 VAL 18 HG13 VAL 18 12.466 -2.071 4.084 136 HG21 VAL 18 HG21 VAL 18 9.414 -3.902 4.278 137 HG22 VAL 18 HG22 VAL 18 10.706 -4.324 5.409 138 HG23 VAL 18 HG23 VAL 18 11.098 -3.877 3.745 139 H ALA 19 HN ALA 19 11.809 -2.428 7.978 140 HA ALA 19 HA ALA 19 11.596 -5.183 8.393 141 HB1 ALA 19 HB1 ALA 19 13.564 -3.862 9.049 142 HB2 ALA 19 HB2 ALA 19 12.976 -4.868 10.373 143 HB3 ALA 19 HB3 ALA 19 12.636 -3.138 10.361 144 H ARG 20 HN ARG 20 9.792 -2.562 9.963 145 HA ARG 20 HA ARG 20 8.578 -4.484 11.768 146 HB2 ARG 20 HB2 ARG 20 7.168 -2.620 12.550 147 HB3 ARG 20 HB1 ARG 20 8.879 -2.258 12.676 148 HG2 ARG 20 HG2 ARG 20 8.800 -0.684 10.977 149 HG3 ARG 20 HG1 ARG 20 7.296 -1.333 10.314 150 HD2 ARG 20 HD2 ARG 20 6.027 -0.485 12.129 151 HD3 ARG 20 HD1 ARG 20 7.472 -0.100 13.046 152 HE ARG 20 HE ARG 20 7.824 1.501 10.980 153 HH11 ARG 20 HH11 ARG 20 4.897 0.837 12.787 154 HH12 ARG 20 HH12 ARG 20 4.214 2.403 12.498 155 HH21 ARG 20 HH21 ARG 20 6.929 3.578 10.625 156 HH22 ARG 20 HH22 ARG 20 5.351 3.944 11.258 157 H LEU 21 HN LEU 21 8.038 -2.880 8.774 158 HA LEU 21 HA LEU 21 5.416 -3.491 8.189 159 HB2 LEU 21 HB2 LEU 21 7.199 -2.234 6.834 160 HB3 LEU 21 HB1 LEU 21 7.705 -3.800 6.257 161 HG LEU 21 HG LEU 21 5.718 -4.101 5.025 162 HD11 LEU 21 HD11 LEU 21 4.695 -1.664 6.449 163 HD12 LEU 21 HD12 LEU 21 4.066 -3.308 6.561 164 HD13 LEU 21 HD13 LEU 21 3.907 -2.404 5.055 165 HD21 LEU 21 HD21 LEU 21 7.291 -2.743 3.905 166 HD22 LEU 21 HD22 LEU 21 6.796 -1.319 4.816 167 HD23 LEU 21 HD23 LEU 21 5.701 -2.028 3.632 168 H GLN 22 HN GLN 22 8.329 -5.418 7.711 169 HA GLN 22 HA GLN 22 7.060 -7.789 6.890 170 HB2 GLN 22 HB2 GLN 22 9.707 -7.738 8.274 171 HB3 GLN 22 HB1 GLN 22 9.144 -8.767 6.949 172 HG2 GLN 22 HG2 GLN 22 9.216 -6.782 5.507 173 HG3 GLN 22 HG1 GLN 22 9.882 -5.866 6.843 174 HE21 GLN 22 HE21 GLN 22 11.021 -6.268 4.363 175 HE22 GLN 22 HE22 GLN 22 12.506 -7.124 4.549 176 H ASP 23 HN ASP 23 8.427 -6.690 9.914 177 HA ASP 23 HA ASP 23 8.185 -8.924 11.482 178 HB2 ASP 23 HB2 ASP 23 9.054 -6.661 12.167 179 HB3 ASP 23 HB1 ASP 23 7.369 -6.188 12.387 180 H VAL 24 HN VAL 24 5.651 -6.483 10.984 181 HA VAL 24 HA VAL 24 3.874 -8.026 12.640 182 HB VAL 24 HB VAL 24 3.795 -5.603 12.838 183 HG11 VAL 24 HG11 VAL 24 2.979 -5.627 9.943 184 HG12 VAL 24 HG12 VAL 24 4.494 -5.012 10.605 185 HG13 VAL 24 HG13 VAL 24 2.972 -4.211 10.993 186 HG21 VAL 24 HG21 VAL 24 1.361 -5.223 12.503 187 HG22 VAL 24 HG22 VAL 24 1.717 -6.758 13.300 188 HG23 VAL 24 HG23 VAL 24 1.288 -6.733 11.591 189 H ALA 25 HN ALA 25 4.613 -7.630 9.311 190 HA ALA 25 HA ALA 25 2.180 -8.771 8.291 191 HB1 ALA 25 HB1 ALA 25 3.427 -9.051 6.193 192 HB2 ALA 25 HB2 ALA 25 4.919 -8.601 7.017 193 HB3 ALA 25 HB3 ALA 25 3.623 -7.419 6.830 194 H GLN 26 HN GLN 26 4.984 -9.769 9.835 195 HA GLN 26 HA GLN 26 4.794 -12.535 9.051 196 HB2 GLN 26 HB2 GLN 26 6.959 -12.277 9.506 197 HB3 GLN 26 HB1 GLN 26 6.646 -10.761 10.333 198 HG2 GLN 26 HG2 GLN 26 7.549 -11.945 12.021 199 HG3 GLN 26 HG1 GLN 26 5.855 -12.359 12.257 200 HE21 GLN 26 HE21 GLN 26 5.810 -14.060 9.895 201 HE22 GLN 26 HE22 GLN 26 6.615 -15.511 10.333 202 H LYS 27 HN LYS 27 4.095 -10.472 11.780 203 HA LYS 27 HA LYS 27 3.282 -12.447 13.619 204 HB2 LYS 27 HB2 LYS 27 2.366 -9.574 13.446 205 HB3 LYS 27 HB1 LYS 27 2.311 -10.609 14.874 206 HG2 LYS 27 HG2 LYS 27 4.789 -9.650 13.466 207 HG3 LYS 27 HG1 LYS 27 4.159 -9.047 14.999 208 HD2 LYS 27 HD2 LYS 27 4.750 -10.975 16.139 209 HD3 LYS 27 HD1 LYS 27 4.790 -11.951 14.670 210 HE2 LYS 27 HE2 LYS 27 6.829 -11.070 13.989 211 HE3 LYS 27 HE1 LYS 27 6.698 -9.688 15.072 212 HZ1 LYS 27 HZ1 LYS 27 6.999 -11.201 16.949 213 HZ2 LYS 27 HZ2 LYS 27 8.310 -11.288 15.884 214 HZ3 LYS 27 HZ3 LYS 27 7.143 -12.511 15.888 215 H SER 28 HN SER 28 1.548 -10.761 11.070 216 HA SER 28 HA SER 28 -0.977 -11.797 12.135 217 HB2 SER 28 HB2 SER 28 -0.483 -9.619 10.113 218 HB3 SER 28 HB1 SER 28 -2.051 -10.061 10.793 219 HG SER 28 HG SER 28 0.187 -9.050 12.231 220 H ILE 29 HN ILE 29 1.337 -12.384 9.830 221 HA ILE 29 HA ILE 29 -0.611 -13.746 8.089 222 HB ILE 29 HB ILE 29 2.130 -12.690 7.432 223 HG12 ILE 29 HG12 ILE 29 -0.572 -11.926 6.326 224 HG13 ILE 29 HG11 ILE 29 0.368 -10.994 7.494 225 HG21 ILE 29 HG21 ILE 29 0.261 -14.263 5.687 226 HG22 ILE 29 HG22 ILE 29 1.865 -14.743 6.258 227 HG23 ILE 29 HG23 ILE 29 1.699 -13.397 5.129 228 HD11 ILE 29 HD11 ILE 29 0.559 -10.223 5.135 229 HD12 ILE 29 HD12 ILE 29 1.399 -11.745 4.786 230 HD13 ILE 29 HD13 ILE 29 2.084 -10.595 5.943 231 H ALA 30 HN ALA 30 -0.551 -15.902 8.105 232 HA ALA 30 HA ALA 30 1.565 -17.277 9.530 233 HB1 ALA 30 HB1 ALA 30 0.184 -19.263 9.243 234 HB2 ALA 30 HB2 ALA 30 -0.893 -18.375 8.165 235 HB3 ALA 30 HB3 ALA 30 -0.779 -17.924 9.867 236 H ASP 31 HN ASP 31 1.157 -16.169 6.462 237 HA ASP 31 HA ASP 31 2.554 -18.416 5.180 238 HB2 ASP 31 HB2 ASP 31 0.397 -17.579 4.217 239 HB3 ASP 31 HB1 ASP 31 1.221 -16.056 3.901 240 H GLU 32 HN GLU 32 4.522 -18.183 4.320 241 HA GLU 32 HA GLU 32 6.078 -15.836 4.912 242 HB2 GLU 32 HB2 GLU 32 7.890 -17.053 3.812 243 HB3 GLU 32 HB1 GLU 32 7.037 -18.117 4.924 244 HG2 GLU 32 HG2 GLU 32 5.708 -18.927 2.921 245 HG3 GLU 32 HG1 GLU 32 6.879 -18.056 1.927 246 H LYS 33 HN LYS 33 4.294 -17.047 2.157 247 HA LYS 33 HA LYS 33 5.695 -15.487 0.200 248 HB2 LYS 33 HB2 LYS 33 2.901 -16.553 -0.127 249 HB3 LYS 33 HB1 LYS 33 4.115 -16.294 -1.358 250 HG2 LYS 33 HG2 LYS 33 4.949 -18.302 -1.118 251 HG3 LYS 33 HG1 LYS 33 4.967 -18.178 0.640 252 HD2 LYS 33 HD2 LYS 33 2.534 -18.606 0.631 253 HD3 LYS 33 HD1 LYS 33 2.622 -18.871 -1.113 254 HE2 LYS 33 HE2 LYS 33 2.643 -20.969 0.033 255 HE3 LYS 33 HE1 LYS 33 4.218 -20.685 -0.709 256 HZ1 LYS 33 HZ1 LYS 33 5.155 -20.169 1.368 257 HZ2 LYS 33 HZ2 LYS 33 4.235 -21.562 1.635 258 HZ3 LYS 33 HZ3 LYS 33 3.646 -20.053 2.127 259 H ALA 34 HN ALA 34 2.445 -15.334 1.609 260 HA ALA 34 HA ALA 34 1.767 -12.790 0.704 261 HB1 ALA 34 HB1 ALA 34 0.083 -12.778 2.461 262 HB2 ALA 34 HB2 ALA 34 0.893 -14.122 3.264 263 HB3 ALA 34 HB3 ALA 34 0.158 -14.355 1.679 264 H ARG 35 HN ARG 35 3.878 -13.769 3.301 265 HA ARG 35 HA ARG 35 3.873 -11.318 4.757 266 HB2 ARG 35 HB2 ARG 35 4.879 -13.734 5.324 267 HB3 ARG 35 HB1 ARG 35 6.328 -13.016 4.642 268 HG2 ARG 35 HG2 ARG 35 4.848 -11.535 6.775 269 HG3 ARG 35 HG1 ARG 35 5.848 -12.913 7.219 270 HD2 ARG 35 HD2 ARG 35 6.748 -10.418 5.778 271 HD3 ARG 35 HD1 ARG 35 7.089 -10.863 7.455 272 HE ARG 35 HE ARG 35 8.037 -12.621 5.301 273 HH11 ARG 35 HH11 ARG 35 8.707 -10.425 7.940 274 HH12 ARG 35 HH12 ARG 35 10.415 -10.712 7.921 275 HH21 ARG 35 HH21 ARG 35 10.293 -13.010 5.283 276 HH22 ARG 35 HH22 ARG 35 11.315 -12.174 6.406 277 H LYS 36 HN LYS 36 6.189 -12.756 2.483 278 HA LYS 36 HA LYS 36 7.837 -10.534 2.109 279 HB2 LYS 36 HB2 LYS 36 7.038 -12.510 -0.013 280 HB3 LYS 36 HB1 LYS 36 8.482 -11.505 0.004 281 HG2 LYS 36 HG2 LYS 36 9.570 -12.844 1.426 282 HG3 LYS 36 HG1 LYS 36 8.089 -13.308 2.296 283 HD2 LYS 36 HD2 LYS 36 8.929 -15.197 1.032 284 HD3 LYS 36 HD1 LYS 36 7.389 -14.612 0.359 285 HE2 LYS 36 HE2 LYS 36 8.724 -14.895 -1.550 286 HE3 LYS 36 HE1 LYS 36 8.892 -13.171 -1.186 287 HZ1 LYS 36 HZ1 LYS 36 11.022 -14.209 -1.706 288 HZ2 LYS 36 HZ2 LYS 36 10.843 -15.274 -0.405 289 HZ3 LYS 36 HZ3 LYS 36 10.995 -13.613 -0.123 290 H VAL 37 HN VAL 37 5.118 -11.635 0.115 291 HA VAL 37 HA VAL 37 5.434 -9.752 -1.874 292 HB VAL 37 HB VAL 37 3.160 -10.165 -2.606 293 HG11 VAL 37 HG11 VAL 37 4.703 -11.892 -3.173 294 HG12 VAL 37 HG12 VAL 37 3.206 -12.679 -2.662 295 HG13 VAL 37 HG13 VAL 37 4.591 -12.612 -1.562 296 HG21 VAL 37 HG21 VAL 37 1.891 -10.050 -0.619 297 HG22 VAL 37 HG22 VAL 37 2.788 -11.374 0.117 298 HG23 VAL 37 HG23 VAL 37 1.698 -11.694 -1.234 299 H ILE 38 HN ILE 38 3.756 -9.435 1.212 300 HA ILE 38 HA ILE 38 2.795 -6.842 0.385 301 HB ILE 38 HB ILE 38 1.671 -8.663 2.062 302 HG12 ILE 38 HG12 ILE 38 1.162 -5.713 2.280 303 HG13 ILE 38 HG11 ILE 38 0.777 -6.604 0.813 304 HG21 ILE 38 HG21 ILE 38 1.638 -7.721 4.304 305 HG22 ILE 38 HG22 ILE 38 2.781 -6.471 3.813 306 HG23 ILE 38 HG23 ILE 38 3.286 -8.163 3.855 307 HD11 ILE 38 HD11 ILE 38 -0.572 -8.111 2.438 308 HD12 ILE 38 HD12 ILE 38 -1.214 -6.549 1.939 309 HD13 ILE 38 HD13 ILE 38 -0.454 -6.714 3.511 310 H VAL 39 HN VAL 39 5.377 -8.092 2.446 311 HA VAL 39 HA VAL 39 5.945 -5.514 3.507 312 HB VAL 39 HB VAL 39 7.907 -6.330 4.418 313 HG11 VAL 39 HG11 VAL 39 6.030 -7.456 5.379 314 HG12 VAL 39 HG12 VAL 39 7.395 -8.577 5.299 315 HG13 VAL 39 HG13 VAL 39 6.085 -8.700 4.131 316 HG21 VAL 39 HG21 VAL 39 9.052 -7.109 2.428 317 HG22 VAL 39 HG22 VAL 39 8.003 -8.526 2.356 318 HG23 VAL 39 HG23 VAL 39 9.133 -8.329 3.699 319 H GLU 40 HN GLU 40 7.314 -7.336 0.803 320 HA GLU 40 HA GLU 40 9.007 -5.357 -0.174 321 HB2 GLU 40 HB2 GLU 40 7.632 -7.543 -1.721 322 HB3 GLU 40 HB1 GLU 40 9.136 -6.765 -2.135 323 HG2 GLU 40 HG2 GLU 40 9.264 -7.835 0.498 324 HG3 GLU 40 HG1 GLU 40 8.764 -9.058 -0.644 325 H LEU 41 HN LEU 41 5.577 -5.872 -0.617 326 HA LEU 41 HA LEU 41 5.383 -3.974 -2.788 327 HB2 LEU 41 HB2 LEU 41 3.746 -5.959 -1.746 328 HB3 LEU 41 HB1 LEU 41 2.919 -4.473 -1.324 329 HG LEU 41 HG LEU 41 1.992 -5.058 -3.366 330 HD11 LEU 41 HD11 LEU 41 2.754 -2.740 -3.299 331 HD12 LEU 41 HD12 LEU 41 2.679 -3.399 -4.928 332 HD13 LEU 41 HD13 LEU 41 4.234 -3.226 -4.119 333 HD21 LEU 41 HD21 LEU 41 3.517 -6.856 -3.934 334 HD22 LEU 41 HD22 LEU 41 4.759 -5.683 -4.372 335 HD23 LEU 41 HD23 LEU 41 3.271 -5.786 -5.314 336 H MET 42 HN MET 42 4.314 -3.982 0.627 337 HA MET 42 HA MET 42 3.324 -1.333 0.610 338 HB2 MET 42 HB2 MET 42 4.276 -3.030 2.921 339 HB3 MET 42 HB1 MET 42 3.369 -1.518 3.094 340 HG2 MET 42 HG2 MET 42 2.465 -4.102 1.846 341 HG3 MET 42 HG1 MET 42 1.874 -3.344 3.314 342 HE1 MET 42 HE1 MET 42 -0.593 -3.705 2.454 343 HE2 MET 42 HE2 MET 42 0.037 -4.435 0.974 344 HE3 MET 42 HE3 MET 42 -1.164 -3.146 0.877 345 H ALA 43 HN ALA 43 6.419 -2.702 0.899 346 HA ALA 43 HA ALA 43 8.002 -0.804 2.006 347 HB1 ALA 43 HB1 ALA 43 8.885 -2.825 1.140 348 HB2 ALA 43 HB2 ALA 43 9.687 -1.484 0.312 349 HB3 ALA 43 HB3 ALA 43 8.410 -2.398 -0.502 350 H TYR 44 HN TYR 44 6.340 -0.718 -1.098 351 HA TYR 44 HA TYR 44 7.399 1.979 -1.655 352 HB2 TYR 44 HB2 TYR 44 7.462 0.494 -3.598 353 HB3 TYR 44 HB1 TYR 44 5.788 0.045 -3.320 354 HD1 TYR 44 HD1 TYR 44 8.012 2.442 -4.893 355 HD2 TYR 44 HD2 TYR 44 3.969 1.697 -3.839 356 HE1 TYR 44 HE1 TYR 44 7.300 4.125 -6.525 357 HE2 TYR 44 HE2 TYR 44 3.233 3.392 -5.459 358 HH TYR 44 HH TYR 44 5.162 4.590 -7.870 359 H GLU 45 HN GLU 45 4.360 0.206 -1.849 360 HA GLU 45 HA GLU 45 2.657 2.281 -2.215 361 HB2 GLU 45 HB2 GLU 45 2.002 -0.153 -0.613 362 HB3 GLU 45 HB1 GLU 45 0.908 0.788 -1.621 363 HG2 GLU 45 HG2 GLU 45 3.194 -0.921 -2.515 364 HG3 GLU 45 HG1 GLU 45 1.489 -1.273 -2.728 365 H ASN 46 HN ASN 46 4.040 1.187 0.805 366 HA ASN 46 HA ASN 46 2.232 2.920 2.294 367 HB2 ASN 46 HB2 ASN 46 3.794 0.451 2.943 368 HB3 ASN 46 HB1 ASN 46 3.381 1.578 4.221 369 HD21 ASN 46 HD21 ASN 46 1.916 0.219 5.286 370 HD22 ASN 46 HD22 ASN 46 0.423 -0.216 4.562 371 H ALA 47 HN ALA 47 5.465 2.603 1.210 372 HA ALA 47 HA ALA 47 6.887 3.821 3.289 373 HB1 ALA 47 HB1 ALA 47 8.591 4.360 1.620 374 HB2 ALA 47 HB2 ALA 47 7.460 3.929 0.337 375 HB3 ALA 47 HB3 ALA 47 8.021 2.696 1.468 376 H ASN 48 HN ASN 48 8.093 5.912 2.924 377 HA ASN 48 HA ASN 48 6.354 8.097 2.986 378 HB2 ASN 48 HB2 ASN 48 9.284 7.678 2.897 379 HB3 ASN 48 HB1 ASN 48 8.720 9.254 2.339 380 HD21 ASN 48 HD21 ASN 48 10.149 8.213 4.840 381 HD22 ASN 48 HD22 ASN 48 9.233 8.914 6.131 382 HA PRO 49 HA PRO 49 5.126 8.923 -1.136 383 HB2 PRO 49 HB2 PRO 49 5.856 11.730 -0.461 384 HB3 PRO 49 HB1 PRO 49 4.347 11.088 -1.116 385 HG2 PRO 49 HG2 PRO 49 4.590 11.811 1.464 386 HG3 PRO 49 HG1 PRO 49 3.558 10.466 0.951 387 HD2 PRO 49 HD2 PRO 49 6.151 10.410 2.385 388 HD3 PRO 49 HD1 PRO 49 4.839 9.216 2.355 389 H GLU 50 HN GLU 50 8.124 10.222 0.052 390 HA GLU 50 HA GLU 50 9.258 10.673 -2.548 391 HB2 GLU 50 HB2 GLU 50 10.005 12.266 -1.070 392 HB3 GLU 50 HB1 GLU 50 10.052 11.148 0.285 393 HG2 GLU 50 HG2 GLU 50 12.227 11.071 -0.025 394 HG3 GLU 50 HG1 GLU 50 11.891 10.147 -1.469 395 H CYS 51 HN CYS 51 9.319 8.303 0.012 396 HA CYS 51 HA CYS 51 11.779 7.121 -0.828 397 HB2 CYS 51 HB2 CYS 51 9.740 6.270 1.241 398 HB3 CYS 51 HB1 CYS 51 11.320 5.527 0.986 399 HG CYS 51 HG CYS 51 12.797 7.373 2.135 400 H GLN 52 HN GLN 52 8.355 6.482 -1.138 401 HA GLN 52 HA GLN 52 8.746 4.003 -2.527 402 HB2 GLN 52 HB2 GLN 52 6.427 4.110 -3.080 403 HB3 GLN 52 HB1 GLN 52 6.588 4.635 -1.413 404 HG2 GLN 52 HG2 GLN 52 6.446 6.977 -2.190 405 HG3 GLN 52 HG1 GLN 52 6.170 6.384 -3.827 406 HE21 GLN 52 HE21 GLN 52 4.738 4.068 -2.739 407 HE22 GLN 52 HE22 GLN 52 3.173 4.620 -2.316 408 H SER 53 HN SER 53 8.593 7.332 -3.158 409 HA SER 53 HA SER 53 8.707 7.219 -5.977 410 HB2 SER 53 HB2 SER 53 9.220 9.294 -3.898 411 HB3 SER 53 HB1 SER 53 9.574 9.624 -5.602 412 HG SER 53 HG SER 53 7.192 9.545 -4.310 413 H ALA 54 HN ALA 54 11.050 6.835 -3.455 414 HA ALA 54 HA ALA 54 13.272 6.874 -5.267 415 HB1 ALA 54 HB1 ALA 54 14.417 5.624 -3.427 416 HB2 ALA 54 HB2 ALA 54 12.884 5.663 -2.546 417 HB3 ALA 54 HB3 ALA 54 13.711 7.164 -2.946 418 H ILE 55 HN ILE 55 10.797 4.712 -4.413 419 HA ILE 55 HA ILE 55 12.218 2.356 -5.256 420 HB ILE 55 HB ILE 55 9.558 2.825 -3.994 421 HG12 ILE 55 HG12 ILE 55 11.768 1.134 -2.940 422 HG13 ILE 55 HG11 ILE 55 11.939 2.893 -2.897 423 HG21 ILE 55 HG21 ILE 55 10.727 0.223 -4.943 424 HG22 ILE 55 HG22 ILE 55 9.201 0.955 -5.445 425 HG23 ILE 55 HG23 ILE 55 9.395 0.353 -3.798 426 HD11 ILE 55 HD11 ILE 55 11.045 1.865 -0.836 427 HD12 ILE 55 HD12 ILE 55 9.594 1.412 -1.748 428 HD13 ILE 55 HD13 ILE 55 10.021 3.117 -1.543 429 H LYS 56 HN LYS 56 9.575 4.331 -6.615 430 HA LYS 56 HA LYS 56 8.237 2.579 -8.151 431 HB2 LYS 56 HB2 LYS 56 8.791 4.688 -9.986 432 HB3 LYS 56 HB1 LYS 56 7.298 4.288 -9.161 433 HG2 LYS 56 HG2 LYS 56 7.606 6.442 -8.497 434 HG3 LYS 56 HG1 LYS 56 8.434 5.589 -7.187 435 HD2 LYS 56 HD2 LYS 56 10.475 6.180 -7.887 436 HD3 LYS 56 HD1 LYS 56 10.023 6.247 -9.590 437 HE2 LYS 56 HE2 LYS 56 9.724 8.360 -7.452 438 HE3 LYS 56 HE1 LYS 56 10.452 8.470 -9.053 439 HZ1 LYS 56 HZ1 LYS 56 8.283 8.340 -10.064 440 HZ2 LYS 56 HZ2 LYS 56 8.332 9.619 -8.959 441 HZ3 LYS 56 HZ3 LYS 56 7.543 8.182 -8.552 442 HA PRO 57 HA PRO 57 11.630 2.296 -11.677 443 HB2 PRO 57 HB2 PRO 57 14.178 2.283 -10.746 444 HB3 PRO 57 HB1 PRO 57 13.379 3.755 -11.321 445 HG2 PRO 57 HG2 PRO 57 13.583 2.708 -8.508 446 HG3 PRO 57 HG1 PRO 57 14.027 4.324 -9.112 447 HD2 PRO 57 HD2 PRO 57 11.692 3.952 -7.942 448 HD3 PRO 57 HD1 PRO 57 11.748 4.918 -9.425 449 H LEU 58 HN LEU 58 11.915 1.086 -8.412 450 HA LEU 58 HA LEU 58 12.861 -1.543 -9.325 451 HB2 LEU 58 HB2 LEU 58 12.364 -0.970 -6.460 452 HB3 LEU 58 HB1 LEU 58 13.636 -1.946 -7.184 453 HG LEU 58 HG LEU 58 13.543 1.075 -7.064 454 HD11 LEU 58 HD11 LEU 58 15.405 0.779 -5.473 455 HD12 LEU 58 HD12 LEU 58 15.134 -0.964 -5.526 456 HD13 LEU 58 HD13 LEU 58 13.882 0.103 -4.892 457 HD21 LEU 58 HD21 LEU 58 15.696 -0.781 -8.075 458 HD22 LEU 58 HD22 LEU 58 15.863 0.961 -7.859 459 HD23 LEU 58 HD23 LEU 58 14.723 0.326 -9.044 460 H LYS 59 HN LYS 59 10.235 0.280 -8.392 461 HA LYS 59 HA LYS 59 8.551 -1.379 -7.015 462 HB2 LYS 59 HB2 LYS 59 7.911 0.860 -7.415 463 HB3 LYS 59 HB1 LYS 59 8.001 0.650 -9.155 464 HG2 LYS 59 HG2 LYS 59 5.748 0.579 -8.899 465 HG3 LYS 59 HG1 LYS 59 6.121 -1.121 -8.657 466 HD2 LYS 59 HD2 LYS 59 5.727 0.910 -6.497 467 HD3 LYS 59 HD1 LYS 59 4.568 -0.339 -6.964 468 HE2 LYS 59 HE2 LYS 59 6.694 -1.882 -6.493 469 HE3 LYS 59 HE1 LYS 59 7.096 -0.540 -5.418 470 HZ1 LYS 59 HZ1 LYS 59 4.659 -0.822 -4.650 471 HZ2 LYS 59 HZ2 LYS 59 5.833 -1.914 -4.088 472 HZ3 LYS 59 HZ3 LYS 59 4.793 -2.361 -5.346 473 H GLY 60 HN GLY 60 8.163 -3.427 -7.401 474 HA2 GLY 60 HA3 GLY 60 6.990 -5.144 -8.498 475 HA3 GLY 60 HA2 GLY 60 7.018 -4.195 -9.976 476 H LYS 61 HN LYS 61 9.992 -3.723 -9.374 477 HA LYS 61 HA LYS 61 10.856 -6.178 -10.740 478 HB2 LYS 61 HB2 LYS 61 12.623 -3.794 -10.536 479 HB3 LYS 61 HB1 LYS 61 12.365 -4.881 -11.893 480 HG2 LYS 61 HG2 LYS 61 10.417 -2.783 -11.004 481 HG3 LYS 61 HG1 LYS 61 11.597 -2.565 -12.286 482 HD2 LYS 61 HD2 LYS 61 9.431 -4.663 -12.265 483 HD3 LYS 61 HD1 LYS 61 9.340 -3.125 -13.127 484 HE2 LYS 61 HE2 LYS 61 11.410 -3.777 -14.347 485 HE3 LYS 61 HE1 LYS 61 11.297 -5.362 -13.588 486 HZ1 LYS 61 HZ1 LYS 61 9.098 -5.621 -14.619 487 HZ2 LYS 61 HZ2 LYS 61 10.326 -5.432 -15.767 488 HZ3 LYS 61 HZ3 LYS 61 9.299 -4.137 -15.409 489 H VAL 62 HN VAL 62 11.704 -7.594 -9.327 490 HA VAL 62 HA VAL 62 13.735 -6.556 -7.474 491 HB VAL 62 HB VAL 62 11.866 -7.473 -6.205 492 HG11 VAL 62 HG11 VAL 62 11.264 -9.849 -6.318 493 HG12 VAL 62 HG12 VAL 62 12.343 -10.044 -7.701 494 HG13 VAL 62 HG13 VAL 62 10.925 -9.003 -7.830 495 HG21 VAL 62 HG21 VAL 62 14.046 -7.755 -5.240 496 HG22 VAL 62 HG22 VAL 62 14.303 -9.240 -6.154 497 HG23 VAL 62 HG23 VAL 62 13.074 -9.185 -4.890 498 HA PRO 63 HA PRO 63 16.819 -9.051 -9.651 499 HB2 PRO 63 HB2 PRO 63 17.631 -9.499 -6.818 500 HB3 PRO 63 HB1 PRO 63 18.626 -9.105 -8.203 501 HG2 PRO 63 HG2 PRO 63 18.012 -7.237 -6.428 502 HG3 PRO 63 HG1 PRO 63 18.037 -6.858 -8.159 503 HD2 PRO 63 HD2 PRO 63 15.717 -7.232 -6.341 504 HD3 PRO 63 HD1 PRO 63 15.876 -6.197 -7.775 505 H ALA 64 HN ALA 64 16.954 -11.187 -10.113 506 HA ALA 64 HA ALA 64 14.905 -12.898 -9.254 507 HB1 ALA 64 HB1 ALA 64 15.971 -13.086 -11.445 508 HB2 ALA 64 HB2 ALA 64 16.021 -14.617 -10.571 509 HB3 ALA 64 HB3 ALA 64 17.467 -13.612 -10.674 510 H GLY 65 HN GLY 65 14.804 -13.447 -7.153 511 HA2 GLY 65 HA3 GLY 65 15.343 -15.223 -5.643 512 HA3 GLY 65 HA2 GLY 65 17.017 -15.108 -6.164 513 H SER 66 HN SER 66 16.294 -12.000 -5.896 514 HA SER 66 HA SER 66 17.327 -11.883 -3.162 515 HB2 SER 66 HB2 SER 66 16.973 -9.654 -5.174 516 HB3 SER 66 HB1 SER 66 17.894 -9.585 -3.672 517 HG SER 66 HG SER 66 19.001 -11.542 -4.764 518 H ASP 67 HN ASP 67 16.569 -10.096 -1.815 519 HA ASP 67 HA ASP 67 13.685 -10.042 -1.563 520 HB2 ASP 67 HB2 ASP 67 16.048 -9.086 0.012 521 HB3 ASP 67 HB1 ASP 67 14.458 -8.442 0.396 522 H VAL 68 HN VAL 68 12.374 -8.304 -2.119 523 HA VAL 68 HA VAL 68 13.563 -6.331 -3.785 524 HB VAL 68 HB VAL 68 11.569 -5.738 -4.550 525 HG11 VAL 68 HG11 VAL 68 10.398 -7.977 -2.915 526 HG12 VAL 68 HG12 VAL 68 11.359 -8.209 -4.386 527 HG13 VAL 68 HG13 VAL 68 9.834 -7.329 -4.465 528 HG21 VAL 68 HG21 VAL 68 11.089 -4.319 -2.705 529 HG22 VAL 68 HG22 VAL 68 10.567 -5.691 -1.716 530 HG23 VAL 68 HG23 VAL 68 9.625 -5.204 -3.140 531 H ILE 69 HN ILE 69 12.514 -6.544 -0.525 532 HA ILE 69 HA ILE 69 12.366 -3.885 0.192 533 HB ILE 69 HB ILE 69 13.229 -6.288 1.770 534 HG12 ILE 69 HG12 ILE 69 10.949 -6.474 1.205 535 HG13 ILE 69 HG11 ILE 69 10.958 -5.853 2.843 536 HG21 ILE 69 HG21 ILE 69 12.850 -4.875 3.817 537 HG22 ILE 69 HG22 ILE 69 12.790 -3.461 2.760 538 HG23 ILE 69 HG23 ILE 69 14.264 -4.423 2.862 539 HD11 ILE 69 HD11 ILE 69 10.530 -3.603 2.006 540 HD12 ILE 69 HD12 ILE 69 9.279 -4.757 1.521 541 HD13 ILE 69 HD13 ILE 69 10.513 -4.242 0.359 542 H SER 70 HN SER 70 15.120 -6.025 0.262 543 HA SER 70 HA SER 70 17.081 -4.419 1.271 544 HB2 SER 70 HB2 SER 70 17.340 -6.801 0.620 545 HB3 SER 70 HB1 SER 70 17.358 -6.319 -1.073 546 HG SER 70 HG SER 70 19.400 -5.946 -0.852 547 H GLU 71 HN GLU 71 15.669 -4.330 -1.936 548 HA GLU 71 HA GLU 71 17.567 -2.431 -2.988 549 HB2 GLU 71 HB2 GLU 71 15.012 -3.301 -4.284 550 HB3 GLU 71 HB1 GLU 71 16.544 -2.872 -5.041 551 HG2 GLU 71 HG2 GLU 71 16.454 -5.220 -3.237 552 HG3 GLU 71 HG1 GLU 71 15.765 -5.367 -4.843 553 H TYR 72 HN TYR 72 14.373 -2.555 -1.709 554 HA TYR 72 HA TYR 72 13.566 0.007 -2.673 555 HB2 TYR 72 HB2 TYR 72 12.414 -1.994 -0.745 556 HB3 TYR 72 HB1 TYR 72 11.697 -0.402 -0.946 557 HD1 TYR 72 HD1 TYR 72 13.193 -1.894 -3.884 558 HD2 TYR 72 HD2 TYR 72 9.616 -1.557 -1.628 559 HE1 TYR 72 HE1 TYR 72 11.906 -2.709 -5.800 560 HE2 TYR 72 HE2 TYR 72 8.315 -2.390 -3.538 561 HH TYR 72 HH TYR 72 9.872 -3.689 -6.369 562 H VAL 73 HN VAL 73 14.807 -1.341 0.318 563 HA VAL 73 HA VAL 73 14.814 1.084 1.786 564 HB VAL 73 HB VAL 73 16.048 0.093 3.448 565 HG11 VAL 73 HG11 VAL 73 15.354 -2.258 3.712 566 HG12 VAL 73 HG12 VAL 73 14.722 -2.202 2.067 567 HG13 VAL 73 HG13 VAL 73 14.051 -1.147 3.306 568 HG21 VAL 73 HG21 VAL 73 17.227 -2.052 1.731 569 HG22 VAL 73 HG22 VAL 73 17.768 -1.455 3.310 570 HG23 VAL 73 HG23 VAL 73 17.970 -0.457 1.865 571 H LYS 74 HN LYS 74 16.925 -0.529 -0.420 572 HA LYS 74 HA LYS 74 19.192 1.138 -0.247 573 HB2 LYS 74 HB2 LYS 74 18.816 -1.192 -1.305 574 HB3 LYS 74 HB1 LYS 74 18.249 -0.297 -2.698 575 HG2 LYS 74 HG2 LYS 74 20.305 0.170 -3.373 576 HG3 LYS 74 HG1 LYS 74 20.813 0.664 -1.756 577 HD2 LYS 74 HD2 LYS 74 20.543 -2.198 -2.669 578 HD3 LYS 74 HD1 LYS 74 22.062 -1.298 -2.636 579 HE2 LYS 74 HE2 LYS 74 20.342 -1.581 -0.191 580 HE3 LYS 74 HE1 LYS 74 21.518 -2.819 -0.641 581 HZ1 LYS 74 HZ1 LYS 74 22.405 -1.199 0.945 582 HZ2 LYS 74 HZ2 LYS 74 22.158 0.044 -0.174 583 HZ3 LYS 74 HZ3 LYS 74 23.265 -1.187 -0.509 584 H ALA 75 HN ALA 75 16.182 1.247 -1.969 585 HA ALA 75 HA ALA 75 16.727 3.365 -3.744 586 HB1 ALA 75 HB1 ALA 75 14.287 3.627 -3.831 587 HB2 ALA 75 HB2 ALA 75 14.133 2.561 -2.432 588 HB3 ALA 75 HB3 ALA 75 14.769 1.935 -3.951 589 H CYS 76 HN CYS 76 15.303 3.318 -0.495 590 HA CYS 76 HA CYS 76 15.501 6.220 -0.326 591 HB2 CYS 76 HB2 CYS 76 13.506 5.299 0.545 592 HB3 CYS 76 HB1 CYS 76 14.364 4.123 1.525 593 HG CYS 76 HG CYS 76 15.561 6.484 2.947 594 H ASP 77 HN ASP 77 17.687 3.877 -0.059 595 HA ASP 77 HA ASP 77 19.053 4.457 2.316 596 HB2 ASP 77 HB2 ASP 77 19.656 2.503 1.142 597 HB3 ASP 77 HB1 ASP 77 19.939 3.361 -0.364 598 H GLY 78 HN GLY 78 18.583 6.275 -0.518 599 HA2 GLY 78 HA3 GLY 78 20.688 8.174 0.228 600 HA3 GLY 78 HA2 GLY 78 19.779 8.188 -1.273 601 H ILE 79 HN ILE 79 17.411 7.654 0.851 602 HA ILE 79 HA ILE 79 16.759 10.487 0.989 603 HB ILE 79 HB ILE 79 15.079 8.039 1.442 604 HG12 ILE 79 HG12 ILE 79 15.029 10.021 -0.836 605 HG13 ILE 79 HG11 ILE 79 15.835 8.454 -0.901 606 HG21 ILE 79 HG21 ILE 79 14.252 9.922 2.762 607 HG22 ILE 79 HG22 ILE 79 13.144 9.503 1.454 608 HG23 ILE 79 HG23 ILE 79 14.194 10.912 1.301 609 HD11 ILE 79 HD11 ILE 79 13.819 7.296 -0.813 610 HD12 ILE 79 HD12 ILE 79 13.516 8.650 -1.908 611 HD13 ILE 79 HD13 ILE 79 12.935 8.713 -0.247 612 H GLY 80 HN GLY 80 16.257 11.538 2.905 613 HA2 GLY 80 HA3 GLY 80 15.406 10.678 5.261 614 HA3 GLY 80 HA2 GLY 80 17.092 10.208 5.348 615 H GLY 81 HN GLY 81 15.036 13.006 4.653 616 HA2 GLY 81 HA3 GLY 81 15.132 14.986 5.958 617 HA3 GLY 81 HA2 GLY 81 16.803 14.617 6.350 618 H ALA 82 HN ALA 82 18.351 15.617 5.235 619 HA ALA 82 HA ALA 82 17.773 17.867 3.721 620 HB1 ALA 82 HB1 ALA 82 20.148 17.990 3.255 621 HB2 ALA 82 HB2 ALA 82 20.347 16.309 3.747 622 HB3 ALA 82 HB3 ALA 82 19.870 17.524 4.931 623 H MET 83 HN MET 83 18.954 14.718 2.560 624 HA MET 83 HA MET 83 18.905 15.481 -0.175 625 HB2 MET 83 HB2 MET 83 18.859 12.723 1.059 626 HB3 MET 83 HB1 MET 83 19.168 13.073 -0.636 627 HG2 MET 83 HG2 MET 83 21.141 14.404 0.051 628 HG3 MET 83 HG1 MET 83 20.857 13.895 1.712 629 HE1 MET 83 HE1 MET 83 21.967 11.006 -1.710 630 HE2 MET 83 HE2 MET 83 21.674 12.731 -1.920 631 HE3 MET 83 HE3 MET 83 20.339 11.652 -1.519 632 H HIS 84 HN HIS 84 16.554 14.189 2.012 633 HA HIS 84 HA HIS 84 14.600 13.354 0.126 634 HB2 HIS 84 HB2 HIS 84 14.315 12.565 2.342 635 HB3 HIS 84 HB1 HIS 84 14.530 14.163 3.036 636 HD1 HIS 84 HD1 HIS 84 12.410 14.719 4.155 637 HD2 HIS 84 HD2 HIS 84 11.766 12.970 0.453 638 HE1 HIS 84 HE1 HIS 84 9.927 14.759 3.822 639 HE2 HIS 84 HE2 HIS 84 9.548 13.511 1.668 640 H LYS 85 HN LYS 85 15.481 16.467 1.487 641 HA LYS 85 HA LYS 85 13.075 17.744 0.525 642 HB2 LYS 85 HB2 LYS 85 15.600 19.032 1.570 643 HB3 LYS 85 HB1 LYS 85 14.016 19.783 1.420 644 HG2 LYS 85 HG2 LYS 85 14.702 17.485 3.243 645 HG3 LYS 85 HG1 LYS 85 14.520 19.172 3.733 646 HD2 LYS 85 HD2 LYS 85 12.181 19.124 3.072 647 HD3 LYS 85 HD1 LYS 85 12.360 17.468 2.491 648 HE2 LYS 85 HE2 LYS 85 11.336 17.414 4.666 649 HE3 LYS 85 HE1 LYS 85 12.975 16.773 4.790 650 HZ1 LYS 85 HZ1 LYS 85 12.470 18.279 6.611 651 HZ2 LYS 85 HZ2 LYS 85 12.141 19.530 5.524 652 HZ3 LYS 85 HZ3 LYS 85 13.705 18.909 5.648 653 H ALA 86 HN ALA 86 16.169 16.975 -0.682 654 HA ALA 86 HA ALA 86 16.134 18.930 -2.812 655 HB1 ALA 86 HB1 ALA 86 17.960 16.571 -2.397 656 HB2 ALA 86 HB2 ALA 86 18.259 18.207 -1.810 657 HB3 ALA 86 HB3 ALA 86 18.199 17.890 -3.543 658 H MET 87 HN MET 87 15.638 15.484 -2.400 659 HA MET 87 HA MET 87 15.155 15.070 -5.224 660 HB2 MET 87 HB2 MET 87 15.023 13.187 -2.863 661 HB3 MET 87 HB1 MET 87 14.878 12.706 -4.553 662 HG2 MET 87 HG2 MET 87 17.248 14.280 -4.142 663 HG3 MET 87 HG1 MET 87 17.207 12.915 -3.034 664 HE1 MET 87 HE1 MET 87 19.503 13.248 -5.131 665 HE2 MET 87 HE2 MET 87 19.620 11.630 -5.821 666 HE3 MET 87 HE3 MET 87 19.378 11.833 -4.086 667 H LEU 88 HN LEU 88 13.340 15.942 -2.537 668 HA LEU 88 HA LEU 88 10.926 14.723 -2.736 669 HB2 LEU 88 HB2 LEU 88 11.854 16.689 -1.265 670 HB3 LEU 88 HB1 LEU 88 11.020 17.689 -2.435 671 HG LEU 88 HG LEU 88 9.026 17.293 -1.495 672 HD11 LEU 88 HD11 LEU 88 9.814 14.396 -1.165 673 HD12 LEU 88 HD12 LEU 88 8.890 15.073 -2.510 674 HD13 LEU 88 HD13 LEU 88 8.209 15.068 -0.883 675 HD21 LEU 88 HD21 LEU 88 9.119 16.519 0.840 676 HD22 LEU 88 HD22 LEU 88 10.373 17.701 0.461 677 HD23 LEU 88 HD23 LEU 88 10.779 15.987 0.561 678 H MET 89 HN MET 89 12.086 17.432 -4.720 679 HA MET 89 HA MET 89 9.608 17.600 -6.186 680 HB2 MET 89 HB2 MET 89 10.990 19.600 -5.763 681 HB3 MET 89 HB1 MET 89 12.288 18.901 -6.719 682 HG2 MET 89 HG2 MET 89 10.812 18.924 -8.690 683 HG3 MET 89 HG1 MET 89 9.564 19.704 -7.718 684 HE1 MET 89 HE1 MET 89 10.808 22.583 -10.081 685 HE2 MET 89 HE2 MET 89 9.421 21.632 -9.550 686 HE3 MET 89 HE3 MET 89 10.702 20.871 -10.491 687 H ALA 90 HN ALA 90 12.392 15.680 -6.344 688 HA ALA 90 HA ALA 90 12.320 15.368 -9.240 689 HB1 ALA 90 HB1 ALA 90 14.346 14.084 -8.968 690 HB2 ALA 90 HB2 ALA 90 14.139 14.072 -7.216 691 HB3 ALA 90 HB3 ALA 90 14.476 15.588 -8.056 692 H GLN 91 HN GLN 91 11.683 13.500 -6.321 693 HA GLN 91 HA GLN 91 11.122 11.152 -7.983 694 HB2 GLN 91 HB2 GLN 91 11.608 11.335 -5.024 695 HB3 GLN 91 HB1 GLN 91 11.442 9.856 -5.962 696 HG2 GLN 91 HG2 GLN 91 13.439 10.381 -7.198 697 HG3 GLN 91 HG1 GLN 91 13.581 11.915 -6.340 698 HE21 GLN 91 HE21 GLN 91 12.801 10.988 -3.824 699 HE22 GLN 91 HE22 GLN 91 14.017 9.925 -3.232 700 H LEU 92 HN LEU 92 9.803 12.786 -5.084 701 HA LEU 92 HA LEU 92 7.514 11.423 -4.595 702 HB2 LEU 92 HB2 LEU 92 8.461 13.712 -3.686 703 HB3 LEU 92 HB1 LEU 92 7.308 14.401 -4.803 704 HG LEU 92 HG LEU 92 6.839 12.937 -2.246 705 HD11 LEU 92 HD11 LEU 92 6.807 15.358 -2.303 706 HD12 LEU 92 HD12 LEU 92 5.200 14.724 -1.946 707 HD13 LEU 92 HD13 LEU 92 5.574 15.329 -3.561 708 HD21 LEU 92 HD21 LEU 92 4.481 12.580 -2.811 709 HD22 LEU 92 HD22 LEU 92 5.548 11.596 -3.812 710 HD23 LEU 92 HD23 LEU 92 4.811 13.054 -4.477 711 H GLU 93 HN GLU 93 8.215 13.576 -7.222 712 HA GLU 93 HA GLU 93 6.993 14.531 -8.872 713 HB2 GLU 93 HB2 GLU 93 6.705 11.607 -8.962 714 HB3 GLU 93 HB1 GLU 93 5.994 12.571 -10.247 715 HG2 GLU 93 HG2 GLU 93 8.860 12.878 -9.448 716 HG3 GLU 93 HG1 GLU 93 8.356 11.593 -10.530 717 H2 PRO 1 HT1 PRO 1 5.295 -4.310 -13.590 718 H3 PRO 1 HT2 PRO 1 5.776 -2.853 -14.157 719 HA PRO 1 HA PRO 1 6.438 -2.690 -12.103 720 HB2 PRO 1 HB2 PRO 1 4.375 -1.521 -10.876 721 HB3 PRO 1 HB1 PRO 1 5.163 -0.753 -12.261 722 HG2 PRO 1 HG2 PRO 1 2.538 -2.063 -12.095 723 HG3 PRO 1 HG1 PRO 1 3.137 -0.898 -13.287 724 HD2 PRO 1 HD2 PRO 1 2.988 -3.793 -13.481 725 HD3 PRO 1 HD1 PRO 1 3.438 -2.622 -14.737 726 H SER 2 HN SER 2 4.831 -2.627 -9.699 727 HA SER 2 HA SER 2 4.373 -5.324 -9.000 728 HB2 SER 2 HB2 SER 2 3.062 -2.846 -7.877 729 HB3 SER 2 HB1 SER 2 3.110 -4.416 -7.111 730 HG SER 2 HG SER 2 5.521 -4.128 -7.345 731 H PHE 3 HN PHE 3 2.173 -6.241 -8.571 732 HA PHE 3 HA PHE 3 0.429 -5.833 -10.767 733 HB2 PHE 3 HB2 PHE 3 -1.118 -6.957 -8.779 734 HB3 PHE 3 HB1 PHE 3 -0.193 -7.849 -9.982 735 HD1 PHE 3 HD1 PHE 3 -0.666 -7.047 -6.528 736 HD2 PHE 3 HD2 PHE 3 2.113 -8.670 -9.325 737 HE1 PHE 3 HE1 PHE 3 0.560 -8.128 -4.706 738 HE2 PHE 3 HE2 PHE 3 3.353 -9.732 -7.487 739 HZ PHE 3 HZ PHE 3 2.575 -9.461 -5.167 740 H ASN 4 HN ASN 4 0.278 -4.982 -7.368 741 HA ASN 4 HA ASN 4 -2.380 -3.914 -7.682 742 HB2 ASN 4 HB2 ASN 4 -2.265 -3.716 -5.243 743 HB3 ASN 4 HB1 ASN 4 -1.787 -5.327 -5.779 744 HD21 ASN 4 HD21 ASN 4 -0.610 -2.223 -4.671 745 HD22 ASN 4 HD22 ASN 4 0.953 -2.781 -4.170 746 H THR 5 HN THR 5 0.606 -2.545 -8.136 747 HA THR 5 HA THR 5 0.405 -0.238 -6.523 748 HB THR 5 HB THR 5 2.541 -0.938 -7.399 749 HG1 THR 5 HG1 THR 5 2.083 1.376 -7.017 750 HG21 THR 5 HG21 THR 5 1.948 -1.867 -9.426 751 HG22 THR 5 HG22 THR 5 2.926 -0.454 -9.852 752 HG23 THR 5 HG23 THR 5 1.164 -0.386 -9.964 753 H VAL 6 HN VAL 6 -1.464 -1.197 -9.101 754 HA VAL 6 HA VAL 6 -2.080 1.375 -10.171 755 HB VAL 6 HB VAL 6 -3.802 0.354 -11.366 756 HG11 VAL 6 HG11 VAL 6 -1.834 -1.861 -10.856 757 HG12 VAL 6 HG12 VAL 6 -1.671 -0.568 -12.045 758 HG13 VAL 6 HG13 VAL 6 -2.947 -1.773 -12.220 759 HG21 VAL 6 HG21 VAL 6 -5.073 -1.544 -10.725 760 HG22 VAL 6 HG22 VAL 6 -4.905 -0.530 -9.279 761 HG23 VAL 6 HG23 VAL 6 -3.905 -1.973 -9.468 762 H ARG 7 HN ARG 7 -3.536 2.866 -9.331 763 HA ARG 7 HA ARG 7 -5.343 1.980 -7.301 764 HB2 ARG 7 HB2 ARG 7 -4.396 3.407 -5.527 765 HB3 ARG 7 HB1 ARG 7 -3.477 1.991 -5.990 766 HG2 ARG 7 HG2 ARG 7 -2.385 3.969 -7.548 767 HG3 ARG 7 HG1 ARG 7 -2.691 4.753 -5.993 768 HD2 ARG 7 HD2 ARG 7 -1.608 2.843 -4.867 769 HD3 ARG 7 HD1 ARG 7 -1.180 2.169 -6.442 770 HE ARG 7 HE ARG 7 0.249 4.090 -4.982 771 HH11 ARG 7 HH11 ARG 7 -0.794 3.644 -8.312 772 HH12 ARG 7 HH12 ARG 7 0.469 4.640 -8.957 773 HH21 ARG 7 HH21 ARG 7 1.900 5.367 -5.845 774 HH22 ARG 7 HH22 ARG 7 2.011 5.600 -7.557 775 H GLN 8 HN GLN 8 -6.650 3.539 -6.385 776 HA GLN 8 HA GLN 8 -8.098 5.119 -7.960 777 HB2 GLN 8 HB2 GLN 8 -7.819 4.706 -5.188 778 HB3 GLN 8 HB1 GLN 8 -7.912 6.448 -5.421 779 HG2 GLN 8 HG2 GLN 8 -9.972 6.171 -6.690 780 HG3 GLN 8 HG1 GLN 8 -9.880 4.427 -6.456 781 HE21 GLN 8 HE21 GLN 8 -11.965 6.219 -5.668 782 HE22 GLN 8 HE22 GLN 8 -12.094 6.109 -3.935 783 H GLY 9 HN GLY 9 -7.489 6.608 -9.346 784 HA2 GLY 9 HA3 GLY 9 -5.448 8.575 -8.682 785 HA3 GLY 9 HA2 GLY 9 -6.307 8.423 -10.207 786 H SER 10 HN SER 10 -6.969 10.527 -10.439 787 HA SER 10 HA SER 10 -7.943 12.177 -8.402 788 HB2 SER 10 HB2 SER 10 -8.640 12.280 -11.344 789 HB3 SER 10 HB1 SER 10 -8.765 13.609 -10.193 790 HG SER 10 HG SER 10 -6.656 12.863 -11.630 791 H LYS 11 HN LYS 11 -9.447 11.310 -7.118 792 HA LYS 11 HA LYS 11 -11.265 10.173 -6.378 793 HB2 LYS 11 HB2 LYS 11 -13.324 11.279 -6.772 794 HB3 LYS 11 HB1 LYS 11 -12.081 12.502 -6.694 795 HG2 LYS 11 HG2 LYS 11 -12.132 12.761 -9.056 796 HG3 LYS 11 HG1 LYS 11 -13.222 11.399 -9.251 797 HD2 LYS 11 HD2 LYS 11 -14.875 12.685 -7.845 798 HD3 LYS 11 HD1 LYS 11 -13.798 14.074 -7.994 799 HE2 LYS 11 HE2 LYS 11 -15.113 12.583 -10.260 800 HE3 LYS 11 HE1 LYS 11 -15.576 14.170 -9.653 801 HZ1 LYS 11 HZ1 LYS 11 -14.245 14.370 -11.636 802 HZ2 LYS 11 HZ2 LYS 11 -12.991 13.477 -10.937 803 HZ3 LYS 11 HZ3 LYS 11 -13.391 14.997 -10.318 804 H GLU 12 HN GLU 12 -10.064 8.673 -8.348 805 HA GLU 12 HA GLU 12 -11.716 7.652 -10.349 806 HB2 GLU 12 HB2 GLU 12 -9.320 7.153 -10.108 807 HB3 GLU 12 HB1 GLU 12 -9.644 6.257 -8.638 808 HG2 GLU 12 HG2 GLU 12 -10.880 4.586 -9.911 809 HG3 GLU 12 HG1 GLU 12 -10.602 5.508 -11.390 810 HA PRO 13 HA PRO 13 -15.050 5.658 -8.115 811 HB2 PRO 13 HB2 PRO 13 -14.796 3.511 -10.118 812 HB3 PRO 13 HB1 PRO 13 -16.204 4.482 -9.699 813 HG2 PRO 13 HG2 PRO 13 -14.825 4.828 -11.997 814 HG3 PRO 13 HG1 PRO 13 -15.658 6.144 -11.165 815 HD2 PRO 13 HD2 PRO 13 -12.764 5.570 -11.359 816 HD3 PRO 13 HD1 PRO 13 -13.597 7.114 -11.121 817 H TYR 14 HN TYR 14 -14.858 4.377 -6.381 818 HA TYR 14 HA TYR 14 -12.292 3.319 -5.937 819 HB2 TYR 14 HB2 TYR 14 -13.531 4.415 -4.142 820 HB3 TYR 14 HB1 TYR 14 -14.722 3.122 -4.161 821 HD1 TYR 14 HD1 TYR 14 -13.726 0.734 -3.917 822 HD2 TYR 14 HD2 TYR 14 -11.785 4.255 -2.598 823 HE1 TYR 14 HE1 TYR 14 -12.385 -0.620 -2.403 824 HE2 TYR 14 HE2 TYR 14 -10.411 2.920 -1.057 825 HH TYR 14 HH TYR 14 -10.013 0.870 -0.258 826 HA PRO 15 HA PRO 15 -14.446 -1.035 -5.587 827 HB2 PRO 15 HB2 PRO 15 -16.643 -0.770 -7.520 828 HB3 PRO 15 HB1 PRO 15 -16.627 -1.560 -5.948 829 HG2 PRO 15 HG2 PRO 15 -17.896 0.770 -6.386 830 HG3 PRO 15 HG1 PRO 15 -17.186 0.350 -4.833 831 HD2 PRO 15 HD2 PRO 15 -16.226 2.254 -6.897 832 HD3 PRO 15 HD1 PRO 15 -16.022 2.286 -5.140 833 H ASP 16 HN ASP 16 -14.165 1.030 -8.212 834 HA ASP 16 HA ASP 16 -13.555 -1.028 -10.155 835 HB2 ASP 16 HB2 ASP 16 -13.934 1.940 -10.310 836 HB3 ASP 16 HB1 ASP 16 -13.123 1.096 -11.620 837 H PHE 17 HN PHE 17 -11.973 1.612 -8.429 838 HA PHE 17 HA PHE 17 -9.418 1.387 -9.538 839 HB2 PHE 17 HB2 PHE 17 -9.062 3.074 -8.040 840 HB3 PHE 17 HB1 PHE 17 -10.636 2.734 -7.342 841 HD1 PHE 17 HD1 PHE 17 -7.155 1.338 -7.175 842 HD2 PHE 17 HD2 PHE 17 -10.737 2.315 -5.115 843 HE1 PHE 17 HE1 PHE 17 -6.126 0.646 -5.043 844 HE2 PHE 17 HE2 PHE 17 -9.704 1.628 -3.003 845 HZ PHE 17 HZ PHE 17 -7.393 0.813 -2.968 846 H VAL 18 HN VAL 18 -10.960 -0.303 -6.867 847 HA VAL 18 HA VAL 18 -8.674 -1.926 -6.351 848 HB VAL 18 HB VAL 18 -9.915 -1.573 -4.428 849 HG11 VAL 18 HG11 VAL 18 -12.370 -2.355 -5.991 850 HG12 VAL 18 HG12 VAL 18 -11.945 -0.730 -5.444 851 HG13 VAL 18 HG13 VAL 18 -12.331 -1.990 -4.257 852 HG21 VAL 18 HG21 VAL 18 -9.290 -3.841 -4.460 853 HG22 VAL 18 HG22 VAL 18 -10.588 -4.254 -5.585 854 HG23 VAL 18 HG23 VAL 18 -10.970 -3.804 -3.920 855 H ALA 19 HN ALA 19 -11.684 -2.357 -8.156 856 HA ALA 19 HA ALA 19 -11.487 -5.116 -8.564 857 HB1 ALA 19 HB1 ALA 19 -13.451 -3.786 -9.213 858 HB2 ALA 19 HB2 ALA 19 -12.871 -4.790 -10.543 859 HB3 ALA 19 HB3 ALA 19 -12.525 -3.061 -10.526 860 H ARG 20 HN ARG 20 -9.669 -2.507 -10.138 861 HA ARG 20 HA ARG 20 -8.478 -4.440 -11.947 862 HB2 ARG 20 HB2 ARG 20 -7.051 -2.589 -12.734 863 HB3 ARG 20 HB1 ARG 20 -8.758 -2.214 -12.862 864 HG2 ARG 20 HG2 ARG 20 -8.671 -0.637 -11.166 865 HG3 ARG 20 HG1 ARG 20 -7.170 -1.292 -10.503 866 HD2 ARG 20 HD2 ARG 20 -5.898 -0.456 -12.321 867 HD3 ARG 20 HD1 ARG 20 -7.341 -0.066 -13.239 868 HE ARG 20 HE ARG 20 -7.686 1.540 -11.175 869 HH11 ARG 20 HH11 ARG 20 -4.774 0.860 -12.999 870 HH12 ARG 20 HH12 ARG 20 -4.076 2.421 -12.713 871 HH21 ARG 20 HH21 ARG 20 -6.786 3.607 -10.823 872 HH22 ARG 20 HH22 ARG 20 -5.214 3.976 -11.467 873 H LEU 21 HN LEU 21 -7.917 -2.828 -8.959 874 HA LEU 21 HA LEU 21 -5.301 -3.462 -8.380 875 HB2 LEU 21 HB2 LEU 21 -7.071 -2.190 -7.022 876 HB3 LEU 21 HB1 LEU 21 -7.587 -3.751 -6.441 877 HG LEU 21 HG LEU 21 -5.597 -4.065 -5.214 878 HD11 LEU 21 HD11 LEU 21 -4.565 -1.635 -6.645 879 HD12 LEU 21 HD12 LEU 21 -3.947 -3.285 -6.754 880 HD13 LEU 21 HD13 LEU 21 -3.777 -2.377 -5.253 881 HD21 LEU 21 HD21 LEU 21 -7.158 -2.693 -4.090 882 HD22 LEU 21 HD22 LEU 21 -6.657 -1.274 -5.005 883 HD23 LEU 21 HD23 LEU 21 -5.564 -1.988 -3.824 884 H GLN 22 HN GLN 22 -8.226 -5.370 -7.897 885 HA GLN 22 HA GLN 22 -6.966 -7.747 -7.073 886 HB2 GLN 22 HB2 GLN 22 -9.618 -7.681 -8.448 887 HB3 GLN 22 HB1 GLN 22 -9.058 -8.712 -7.124 888 HG2 GLN 22 HG2 GLN 22 -9.113 -6.723 -5.684 889 HG3 GLN 22 HG1 GLN 22 -9.781 -5.808 -7.020 890 HE21 GLN 22 HE21 GLN 22 -10.911 -6.197 -4.536 891 HE22 GLN 22 HE22 GLN 22 -12.397 -7.051 -4.713 892 H ASP 23 HN ASP 23 -8.335 -6.639 -10.095 893 HA ASP 23 HA ASP 23 -8.113 -8.877 -11.661 894 HB2 ASP 23 HB2 ASP 23 -8.966 -6.604 -12.337 895 HB3 ASP 23 HB1 ASP 23 -7.279 -6.148 -12.569 896 H VAL 24 HN VAL 24 -5.561 -6.452 -11.173 897 HA VAL 24 HA VAL 24 -3.798 -8.009 -12.830 898 HB VAL 24 HB VAL 24 -3.704 -5.586 -13.028 899 HG11 VAL 24 HG11 VAL 24 -2.883 -5.614 -10.136 900 HG12 VAL 24 HG12 VAL 24 -4.395 -4.989 -10.797 901 HG13 VAL 24 HG13 VAL 24 -2.867 -4.199 -11.190 902 HG21 VAL 24 HG21 VAL 24 -1.268 -5.224 -12.704 903 HG22 VAL 24 HG22 VAL 24 -1.639 -6.759 -13.495 904 HG23 VAL 24 HG23 VAL 24 -1.203 -6.733 -11.788 905 H ALA 25 HN ALA 25 -4.522 -7.599 -9.497 906 HA ALA 25 HA ALA 25 -2.099 -8.762 -8.483 907 HB1 ALA 25 HB1 ALA 25 -3.342 -9.031 -6.383 908 HB2 ALA 25 HB2 ALA 25 -4.833 -8.572 -7.202 909 HB3 ALA 25 HB3 ALA 25 -3.530 -7.398 -7.021 910 H GLN 26 HN GLN 26 -4.913 -9.742 -10.020 911 HA GLN 26 HA GLN 26 -4.737 -12.507 -9.234 912 HB2 GLN 26 HB2 GLN 26 -6.902 -12.236 -9.680 913 HB3 GLN 26 HB1 GLN 26 -6.582 -10.725 -10.512 914 HG2 GLN 26 HG2 GLN 26 -7.499 -11.906 -12.194 915 HG3 GLN 26 HG1 GLN 26 -5.810 -12.334 -12.435 916 HE21 GLN 26 HE21 GLN 26 -5.767 -14.036 -10.068 917 HE22 GLN 26 HE22 GLN 26 -6.590 -15.481 -10.501 918 H LYS 27 HN LYS 27 -4.031 -10.453 -11.968 919 HA LYS 27 HA LYS 27 -3.238 -12.438 -13.804 920 HB2 LYS 27 HB2 LYS 27 -2.300 -9.570 -13.642 921 HB3 LYS 27 HB1 LYS 27 -2.258 -10.608 -15.069 922 HG2 LYS 27 HG2 LYS 27 -4.725 -9.629 -13.652 923 HG3 LYS 27 HG1 LYS 27 -4.095 -9.036 -15.191 924 HD2 LYS 27 HD2 LYS 27 -4.704 -10.964 -16.322 925 HD3 LYS 27 HD1 LYS 27 -4.746 -11.934 -14.850 926 HE2 LYS 27 HE2 LYS 27 -6.778 -11.035 -14.165 927 HE3 LYS 27 HE1 LYS 27 -6.639 -9.660 -15.256 928 HZ1 LYS 27 HZ1 LYS 27 -6.951 -11.181 -17.126 929 HZ2 LYS 27 HZ2 LYS 27 -8.263 -11.249 -16.062 930 HZ3 LYS 27 HZ3 LYS 27 -7.106 -12.484 -16.057 931 H SER 28 HN SER 28 -1.486 -10.757 -11.261 932 HA SER 28 HA SER 28 1.027 -11.816 -12.332 933 HB2 SER 28 HB2 SER 28 0.558 -9.629 -10.316 934 HB3 SER 28 HB1 SER 28 2.118 -10.079 -11.006 935 HG SER 28 HG SER 28 -0.126 -9.051 -12.417 936 H ILE 29 HN ILE 29 -1.279 -12.385 -10.022 937 HA ILE 29 HA ILE 29 0.665 -13.754 -8.280 938 HB ILE 29 HB ILE 29 -2.070 -12.680 -7.622 939 HG12 ILE 29 HG12 ILE 29 0.638 -11.930 -6.523 940 HG13 ILE 29 HG11 ILE 29 -0.299 -10.995 -7.691 941 HG21 ILE 29 HG21 ILE 29 -0.209 -14.259 -5.875 942 HG22 ILE 29 HG22 ILE 29 -1.812 -14.735 -6.445 943 HG23 ILE 29 HG23 ILE 29 -1.643 -13.386 -5.319 944 HD11 ILE 29 HD11 ILE 29 -0.480 -10.220 -5.331 945 HD12 ILE 29 HD12 ILE 29 -1.328 -11.737 -4.978 946 HD13 ILE 29 HD13 ILE 29 -2.009 -10.582 -6.136 947 H ALA 30 HN ALA 30 0.588 -15.910 -8.284 948 HA ALA 30 HA ALA 30 -1.537 -17.271 -9.716 949 HB1 ALA 30 HB1 ALA 30 -0.173 -19.269 -9.424 950 HB2 ALA 30 HB2 ALA 30 0.913 -18.386 -8.350 951 HB3 ALA 30 HB3 ALA 30 0.798 -17.938 -10.052 952 H ASP 31 HN ASP 31 -1.101 -16.171 -6.643 953 HA ASP 31 HA ASP 31 -2.522 -18.400 -5.359 954 HB2 ASP 31 HB2 ASP 31 -0.361 -17.578 -4.395 955 HB3 ASP 31 HB1 ASP 31 -1.172 -16.045 -4.089 956 H GLU 32 HN GLU 32 -4.487 -18.151 -4.492 957 HA GLU 32 HA GLU 32 -6.026 -15.793 -5.088 958 HB2 GLU 32 HB2 GLU 32 -7.846 -16.993 -3.982 959 HB3 GLU 32 HB1 GLU 32 -7.003 -18.062 -5.097 960 HG2 GLU 32 HG2 GLU 32 -5.674 -18.881 -3.094 961 HG3 GLU 32 HG1 GLU 32 -6.850 -18.011 -2.102 962 H LYS 33 HN LYS 33 -4.250 -17.012 -2.333 963 HA LYS 33 HA LYS 33 -5.634 -15.440 -0.375 964 HB2 LYS 33 HB2 LYS 33 -2.847 -16.526 -0.055 965 HB3 LYS 33 HB1 LYS 33 -4.054 -16.255 1.180 966 HG2 LYS 33 HG2 LYS 33 -4.902 -18.257 0.948 967 HG3 LYS 33 HG1 LYS 33 -4.929 -18.137 -0.811 968 HD2 LYS 33 HD2 LYS 33 -2.497 -18.579 -0.812 969 HD3 LYS 33 HD1 LYS 33 -2.580 -18.841 0.933 970 HE2 LYS 33 HE2 LYS 33 -2.618 -20.940 -0.204 971 HE3 LYS 33 HE1 LYS 33 -4.191 -20.644 0.537 972 HZ1 LYS 33 HZ1 LYS 33 -5.126 -20.134 -1.540 973 HZ2 LYS 33 HZ2 LYS 33 -4.213 -21.532 -1.802 974 HZ3 LYS 33 HZ3 LYS 33 -3.617 -20.026 -2.302 975 H ALA 34 HN ALA 34 -2.387 -15.313 -1.792 976 HA ALA 34 HA ALA 34 -1.689 -12.772 -0.893 977 HB1 ALA 34 HB1 ALA 34 -0.011 -12.770 -2.655 978 HB2 ALA 34 HB2 ALA 34 -0.831 -14.111 -3.453 979 HB3 ALA 34 HB3 ALA 34 -0.093 -14.347 -1.870 980 H ARG 35 HN ARG 35 -3.812 -13.741 -3.484 981 HA ARG 35 HA ARG 35 -3.800 -11.290 -4.943 982 HB2 ARG 35 HB2 ARG 35 -4.819 -13.702 -5.504 983 HB3 ARG 35 HB1 ARG 35 -6.262 -12.976 -4.821 984 HG2 ARG 35 HG2 ARG 35 -4.777 -11.506 -6.958 985 HG3 ARG 35 HG1 ARG 35 -5.788 -12.879 -7.398 986 HD2 ARG 35 HD2 ARG 35 -6.667 -10.373 -5.959 987 HD3 ARG 35 HD1 ARG 35 -7.014 -10.819 -7.636 988 HE ARG 35 HE ARG 35 -7.969 -12.567 -5.477 989 HH11 ARG 35 HH11 ARG 35 -8.629 -10.378 -8.123 990 HH12 ARG 35 HH12 ARG 35 -10.340 -10.651 -8.096 991 HH21 ARG 35 HH21 ARG 35 -10.236 -12.930 -5.447 992 HH22 ARG 35 HH22 ARG 35 -11.251 -12.092 -6.579 993 H LYS 36 HN LYS 36 -6.115 -12.715 -2.656 994 HA LYS 36 HA LYS 36 -7.750 -10.482 -2.284 995 HB2 LYS 36 HB2 LYS 36 -6.963 -12.458 -0.160 996 HB3 LYS 36 HB1 LYS 36 -8.400 -11.445 -0.178 997 HG2 LYS 36 HG2 LYS 36 -9.499 -12.782 -1.594 998 HG3 LYS 36 HG1 LYS 36 -8.022 -13.252 -2.468 999 HD2 LYS 36 HD2 LYS 36 -8.870 -15.138 -1.200 1000 HD3 LYS 36 HD1 LYS 36 -7.322 -14.563 -0.535 1001 HE2 LYS 36 HE2 LYS 36 -8.646 -14.836 1.380 1002 HE3 LYS 36 HE1 LYS 36 -8.811 -13.111 1.015 1003 HZ1 LYS 36 HZ1 LYS 36 -10.936 -14.146 1.553 1004 HZ2 LYS 36 HZ2 LYS 36 -10.775 -15.207 0.248 1005 HZ3 LYS 36 HZ3 LYS 36 -10.924 -13.543 -0.027 1006 H VAL 37 HN VAL 37 -5.034 -11.597 -0.294 1007 HA VAL 37 HA VAL 37 -5.333 -9.709 1.692 1008 HB VAL 37 HB VAL 37 -3.059 -10.133 2.418 1009 HG11 VAL 37 HG11 VAL 37 -4.609 -11.850 2.990 1010 HG12 VAL 37 HG12 VAL 37 -3.117 -12.645 2.479 1011 HG13 VAL 37 HG13 VAL 37 -4.504 -12.573 1.380 1012 HG21 VAL 37 HG21 VAL 37 -1.796 -10.026 0.425 1013 HG22 VAL 37 HG22 VAL 37 -2.702 -11.347 -0.306 1014 HG23 VAL 37 HG23 VAL 37 -1.608 -11.670 1.041 1015 H ILE 38 HN ILE 38 -3.657 -9.405 -1.399 1016 HA ILE 38 HA ILE 38 -2.679 -6.816 -0.580 1017 HB ILE 38 HB ILE 38 -1.571 -8.645 -2.257 1018 HG12 ILE 38 HG12 ILE 38 -1.042 -5.701 -2.483 1019 HG13 ILE 38 HG11 ILE 38 -0.660 -6.591 -1.016 1020 HG21 ILE 38 HG21 ILE 38 -1.539 -7.707 -4.501 1021 HG22 ILE 38 HG22 ILE 38 -2.672 -6.449 -4.006 1022 HG23 ILE 38 HG23 ILE 38 -3.189 -8.137 -4.047 1023 HD11 ILE 38 HD11 ILE 38 0.671 -8.112 -2.641 1024 HD12 ILE 38 HD12 ILE 38 1.329 -6.556 -2.143 1025 HD13 ILE 38 HD13 ILE 38 0.565 -6.715 -3.714 1026 H VAL 39 HN VAL 39 -5.276 -8.053 -2.630 1027 HA VAL 39 HA VAL 39 -5.831 -5.471 -3.695 1028 HB VAL 39 HB VAL 39 -7.800 -6.278 -4.599 1029 HG11 VAL 39 HG11 VAL 39 -5.933 -7.417 -5.565 1030 HG12 VAL 39 HG12 VAL 39 -7.305 -8.528 -5.479 1031 HG13 VAL 39 HG13 VAL 39 -5.992 -8.659 -4.315 1032 HG21 VAL 39 HG21 VAL 39 -8.944 -7.045 -2.607 1033 HG22 VAL 39 HG22 VAL 39 -7.903 -8.466 -2.530 1034 HG23 VAL 39 HG23 VAL 39 -9.034 -8.271 -3.872 1035 H GLU 40 HN GLU 40 -7.202 -7.281 -0.985 1036 HA GLU 40 HA GLU 40 -8.881 -5.292 -0.006 1037 HB2 GLU 40 HB2 GLU 40 -7.514 -7.484 1.538 1038 HB3 GLU 40 HB1 GLU 40 -9.010 -6.696 1.959 1039 HG2 GLU 40 HG2 GLU 40 -9.158 -7.768 -0.673 1040 HG3 GLU 40 HG1 GLU 40 -8.660 -8.992 0.468 1041 H LEU 41 HN LEU 41 -5.453 -5.827 0.426 1042 HA LEU 41 HA LEU 41 -5.241 -3.927 2.595 1043 HB2 LEU 41 HB2 LEU 41 -3.621 -5.925 1.551 1044 HB3 LEU 41 HB1 LEU 41 -2.785 -4.446 1.126 1045 HG LEU 41 HG LEU 41 -1.856 -5.031 3.166 1046 HD11 LEU 41 HD11 LEU 41 -2.603 -2.710 3.098 1047 HD12 LEU 41 HD12 LEU 41 -2.531 -3.366 4.727 1048 HD13 LEU 41 HD13 LEU 41 -4.085 -3.183 3.920 1049 HD21 LEU 41 HD21 LEU 41 -3.393 -6.821 3.739 1050 HD22 LEU 41 HD22 LEU 41 -4.625 -5.638 4.180 1051 HD23 LEU 41 HD23 LEU 41 -3.135 -5.752 5.117 1052 H MET 42 HN MET 42 -4.178 -3.946 -0.822 1053 HA MET 42 HA MET 42 -3.174 -1.303 -0.813 1054 HB2 MET 42 HB2 MET 42 -4.144 -2.998 -3.116 1055 HB3 MET 42 HB1 MET 42 -3.227 -1.494 -3.295 1056 HG2 MET 42 HG2 MET 42 -2.337 -4.082 -2.046 1057 HG3 MET 42 HG1 MET 42 -1.744 -3.329 -3.516 1058 HE1 MET 42 HE1 MET 42 0.725 -3.704 -2.662 1059 HE2 MET 42 HE2 MET 42 0.092 -4.430 -1.180 1060 HE3 MET 42 HE3 MET 42 1.301 -3.148 -1.087 1061 H ALA 43 HN ALA 43 -6.281 -2.655 -1.092 1062 HA ALA 43 HA ALA 43 -7.853 -0.747 -2.195 1063 HB1 ALA 43 HB1 ALA 43 -8.747 -2.762 -1.323 1064 HB2 ALA 43 HB2 ALA 43 -9.536 -1.414 -0.495 1065 HB3 ALA 43 HB3 ALA 43 -8.263 -2.335 0.315 1066 H TYR 44 HN TYR 44 -6.181 -0.668 0.904 1067 HA TYR 44 HA TYR 44 -7.223 2.036 1.461 1068 HB2 TYR 44 HB2 TYR 44 -7.289 0.554 3.405 1069 HB3 TYR 44 HB1 TYR 44 -5.619 0.096 3.124 1070 HD1 TYR 44 HD1 TYR 44 -7.825 2.505 4.700 1071 HD2 TYR 44 HD2 TYR 44 -3.789 1.740 3.634 1072 HE1 TYR 44 HE1 TYR 44 -7.099 4.190 6.323 1073 HE2 TYR 44 HE2 TYR 44 -3.039 3.435 5.244 1074 HH TYR 44 HH TYR 44 -4.895 4.608 7.672 1075 H GLU 45 HN GLU 45 -4.197 0.239 1.643 1076 HA GLU 45 HA GLU 45 -2.481 2.306 2.006 1077 HB2 GLU 45 HB2 GLU 45 -1.841 -0.131 0.406 1078 HB3 GLU 45 HB1 GLU 45 -0.742 0.804 1.412 1079 HG2 GLU 45 HG2 GLU 45 -3.035 -0.892 2.311 1080 HG3 GLU 45 HG1 GLU 45 -1.331 -1.255 2.521 1081 H ASN 46 HN ASN 46 -3.878 1.217 -1.006 1082 HA ASN 46 HA ASN 46 -2.065 2.938 -2.503 1083 HB2 ASN 46 HB2 ASN 46 -3.637 0.474 -3.143 1084 HB3 ASN 46 HB1 ASN 46 -3.226 1.598 -4.424 1085 HD21 ASN 46 HD21 ASN 46 -1.762 0.233 -5.492 1086 HD22 ASN 46 HD22 ASN 46 -0.273 -0.211 -4.767 1087 H ALA 47 HN ALA 47 -5.296 2.640 -1.408 1088 HA ALA 47 HA ALA 47 -6.714 3.866 -3.487 1089 HB1 ALA 47 HB1 ALA 47 -8.411 4.418 -1.814 1090 HB2 ALA 47 HB2 ALA 47 -7.280 3.982 -0.534 1091 HB3 ALA 47 HB3 ALA 47 -7.852 2.751 -1.660 1092 H ASN 48 HN ASN 48 -7.904 5.964 -3.123 1093 HA ASN 48 HA ASN 48 -6.153 8.137 -3.194 1094 HB2 ASN 48 HB2 ASN 48 -9.085 7.738 -3.095 1095 HB3 ASN 48 HB1 ASN 48 -8.511 9.310 -2.539 1096 HD21 ASN 48 HD21 ASN 48 -9.953 8.279 -5.038 1097 HD22 ASN 48 HD22 ASN 48 -9.034 8.973 -6.331 1098 HA PRO 49 HA PRO 49 -4.908 8.963 0.922 1099 HB2 PRO 49 HB2 PRO 49 -5.622 11.773 0.248 1100 HB3 PRO 49 HB1 PRO 49 -4.116 11.122 0.899 1101 HG2 PRO 49 HG2 PRO 49 -4.361 11.846 -1.680 1102 HG3 PRO 49 HG1 PRO 49 -3.335 10.497 -1.168 1103 HD2 PRO 49 HD2 PRO 49 -5.930 10.452 -2.597 1104 HD3 PRO 49 HD1 PRO 49 -4.625 9.249 -2.569 1105 H GLU 50 HN GLU 50 -7.902 10.281 -0.257 1106 HA GLU 50 HA GLU 50 -9.023 10.741 2.347 1107 HB2 GLU 50 HB2 GLU 50 -9.765 12.337 0.870 1108 HB3 GLU 50 HB1 GLU 50 -9.826 11.220 -0.484 1109 HG2 GLU 50 HG2 GLU 50 -11.999 11.157 -0.168 1110 HG3 GLU 50 HG1 GLU 50 -11.666 10.235 1.277 1111 H CYS 51 HN CYS 51 -9.111 8.369 -0.209 1112 HA CYS 51 HA CYS 51 -11.573 7.202 0.640 1113 HB2 CYS 51 HB2 CYS 51 -9.546 6.337 -1.432 1114 HB3 CYS 51 HB1 CYS 51 -11.129 5.605 -1.175 1115 HG CYS 51 HG CYS 51 -12.595 7.460 -2.325 1116 H GLN 52 HN GLN 52 -8.152 6.542 0.939 1117 HA GLN 52 HA GLN 52 -8.555 4.070 2.335 1118 HB2 GLN 52 HB2 GLN 52 -6.234 4.164 2.885 1119 HB3 GLN 52 HB1 GLN 52 -6.396 4.682 1.216 1120 HG2 GLN 52 HG2 GLN 52 -6.240 7.029 1.985 1121 HG3 GLN 52 HG1 GLN 52 -5.954 6.437 3.620 1122 HE21 GLN 52 HE21 GLN 52 -4.542 4.115 2.545 1123 HE22 GLN 52 HE22 GLN 52 -2.976 4.655 2.110 1124 H SER 53 HN SER 53 -8.378 7.399 2.961 1125 HA SER 53 HA SER 53 -8.487 7.290 5.780 1126 HB2 SER 53 HB2 SER 53 -8.991 9.365 3.701 1127 HB3 SER 53 HB1 SER 53 -9.342 9.699 5.403 1128 HG SER 53 HG SER 53 -6.961 9.600 4.109 1129 H ALA 54 HN ALA 54 -10.839 6.916 3.264 1130 HA ALA 54 HA ALA 54 -13.057 6.969 5.083 1131 HB1 ALA 54 HB1 ALA 54 -14.215 5.730 3.248 1132 HB2 ALA 54 HB2 ALA 54 -12.684 5.752 2.361 1133 HB3 ALA 54 HB3 ALA 54 -13.497 7.262 2.762 1134 H ILE 55 HN ILE 55 -10.597 4.793 4.225 1135 HA ILE 55 HA ILE 55 -12.030 2.446 5.073 1136 HB ILE 55 HB ILE 55 -9.371 2.897 3.803 1137 HG12 ILE 55 HG12 ILE 55 -11.595 1.220 2.759 1138 HG13 ILE 55 HG11 ILE 55 -11.755 2.980 2.714 1139 HG21 ILE 55 HG21 ILE 55 -10.554 0.303 4.756 1140 HG22 ILE 55 HG22 ILE 55 -9.025 1.025 5.259 1141 HG23 ILE 55 HG23 ILE 55 -9.221 0.426 3.611 1142 HD11 ILE 55 HD11 ILE 55 -10.871 1.944 0.652 1143 HD12 ILE 55 HD12 ILE 55 -9.421 1.480 1.562 1144 HD13 ILE 55 HD13 ILE 55 -9.836 3.189 1.357 1145 H LYS 56 HN LYS 56 -9.374 4.408 6.422 1146 HA LYS 56 HA LYS 56 -8.043 2.652 7.953 1147 HB2 LYS 56 HB2 LYS 56 -8.578 4.763 9.789 1148 HB3 LYS 56 HB1 LYS 56 -7.089 4.354 8.961 1149 HG2 LYS 56 HG2 LYS 56 -7.386 6.510 8.300 1150 HG3 LYS 56 HG1 LYS 56 -8.220 5.663 6.991 1151 HD2 LYS 56 HD2 LYS 56 -10.256 6.266 7.691 1152 HD3 LYS 56 HD1 LYS 56 -9.805 6.326 9.395 1153 HE2 LYS 56 HE2 LYS 56 -9.498 8.442 7.261 1154 HE3 LYS 56 HE1 LYS 56 -10.215 8.554 8.868 1155 HZ1 LYS 56 HZ1 LYS 56 -8.033 8.402 9.864 1156 HZ2 LYS 56 HZ2 LYS 56 -8.089 9.689 8.768 1157 HZ3 LYS 56 HZ3 LYS 56 -7.310 8.254 8.343 1158 HA PRO 57 HA PRO 57 -11.425 2.393 11.491 1159 HB2 PRO 57 HB2 PRO 57 -13.975 2.395 10.567 1160 HB3 PRO 57 HB1 PRO 57 -13.165 3.863 11.137 1161 HG2 PRO 57 HG2 PRO 57 -13.384 2.815 8.326 1162 HG3 PRO 57 HG1 PRO 57 -13.816 4.433 8.929 1163 HD2 PRO 57 HD2 PRO 57 -11.487 4.046 7.755 1164 HD3 PRO 57 HD1 PRO 57 -11.533 5.013 9.237 1165 H LEU 58 HN LEU 58 -11.726 1.179 8.229 1166 HA LEU 58 HA LEU 58 -12.687 -1.441 9.149 1167 HB2 LEU 58 HB2 LEU 58 -12.192 -0.877 6.282 1168 HB3 LEU 58 HB1 LEU 58 -13.469 -1.843 7.010 1169 HG LEU 58 HG LEU 58 -13.356 1.177 6.883 1170 HD11 LEU 58 HD11 LEU 58 -15.227 0.889 5.299 1171 HD12 LEU 58 HD12 LEU 58 -14.967 -0.854 5.355 1172 HD13 LEU 58 HD13 LEU 58 -13.710 0.203 4.713 1173 HD21 LEU 58 HD21 LEU 58 -15.519 -0.663 7.902 1174 HD22 LEU 58 HD22 LEU 58 -15.674 1.080 7.682 1175 HD23 LEU 58 HD23 LEU 58 -14.535 0.440 8.867 1176 H LYS 59 HN LYS 59 -10.052 0.363 8.209 1177 HA LYS 59 HA LYS 59 -8.382 -1.308 6.831 1178 HB2 LYS 59 HB2 LYS 59 -7.729 0.927 7.225 1179 HB3 LYS 59 HB1 LYS 59 -7.816 0.721 8.964 1180 HG2 LYS 59 HG2 LYS 59 -5.566 0.631 8.702 1181 HG3 LYS 59 HG1 LYS 59 -5.951 -1.065 8.461 1182 HD2 LYS 59 HD2 LYS 59 -5.547 0.965 6.301 1183 HD3 LYS 59 HD1 LYS 59 -4.396 -0.291 6.766 1184 HE2 LYS 59 HE2 LYS 59 -6.531 -1.823 6.299 1185 HE3 LYS 59 HE1 LYS 59 -6.929 -0.479 5.225 1186 HZ1 LYS 59 HZ1 LYS 59 -4.497 -0.771 4.451 1187 HZ2 LYS 59 HZ2 LYS 59 -5.676 -1.858 3.893 1188 HZ3 LYS 59 HZ3 LYS 59 -4.634 -2.310 5.147 1189 H GLY 60 HN GLY 60 -8.010 -3.355 7.218 1190 HA2 GLY 60 HA3 GLY 60 -6.843 -5.082 8.308 1191 HA3 GLY 60 HA2 GLY 60 -6.858 -4.131 9.786 1192 H LYS 61 HN LYS 61 -9.834 -3.638 9.195 1193 HA LYS 61 HA LYS 61 -10.706 -6.087 10.565 1194 HB2 LYS 61 HB2 LYS 61 -12.463 -3.694 10.365 1195 HB3 LYS 61 HB1 LYS 61 -12.206 -4.781 11.723 1196 HG2 LYS 61 HG2 LYS 61 -10.250 -2.693 10.823 1197 HG3 LYS 61 HG1 LYS 61 -11.424 -2.465 12.107 1198 HD2 LYS 61 HD2 LYS 61 -9.272 -4.576 12.085 1199 HD3 LYS 61 HD1 LYS 61 -9.166 -3.037 12.943 1200 HE2 LYS 61 HE2 LYS 61 -11.237 -3.672 14.171 1201 HE3 LYS 61 HE1 LYS 61 -11.136 -5.260 13.417 1202 HZ1 LYS 61 HZ1 LYS 61 -8.927 -5.518 14.442 1203 HZ2 LYS 61 HZ2 LYS 61 -10.156 -5.340 15.587 1204 HZ3 LYS 61 HZ3 LYS 61 -9.134 -4.039 15.238 1205 H VAL 62 HN VAL 62 -11.567 -7.501 9.152 1206 HA VAL 62 HA VAL 62 -13.598 -6.450 7.306 1207 HB VAL 62 HB VAL 62 -11.738 -7.380 6.036 1208 HG11 VAL 62 HG11 VAL 62 -11.150 -9.758 6.151 1209 HG12 VAL 62 HG12 VAL 62 -12.231 -9.947 7.534 1210 HG13 VAL 62 HG13 VAL 62 -10.807 -8.915 7.663 1211 HG21 VAL 62 HG21 VAL 62 -13.923 -7.647 5.078 1212 HG22 VAL 62 HG22 VAL 62 -14.188 -9.131 5.993 1213 HG23 VAL 62 HG23 VAL 62 -12.964 -9.083 4.726 1214 HA PRO 63 HA PRO 63 -16.690 -8.928 9.492 1215 HB2 PRO 63 HB2 PRO 63 -17.521 -9.370 6.664 1216 HB3 PRO 63 HB1 PRO 63 -18.508 -8.967 8.055 1217 HG2 PRO 63 HG2 PRO 63 -17.886 -7.104 6.276 1218 HG3 PRO 63 HG1 PRO 63 -17.901 -6.724 8.006 1219 HD2 PRO 63 HD2 PRO 63 -15.591 -7.116 6.179 1220 HD3 PRO 63 HD1 PRO 63 -15.736 -6.080 7.611 1221 H ALA 64 HN ALA 64 -16.832 -11.057 9.963 1222 HA ALA 64 HA ALA 64 -14.805 -12.790 9.101 1223 HB1 ALA 64 HB1 ALA 64 -15.873 -12.962 11.298 1224 HB2 ALA 64 HB2 ALA 64 -15.934 -14.494 10.429 1225 HB3 ALA 64 HB3 ALA 64 -17.372 -13.479 10.528 1226 H GLY 65 HN GLY 65 -14.712 -13.341 7.005 1227 HA2 GLY 65 HA3 GLY 65 -15.264 -15.104 5.493 1228 HA3 GLY 65 HA2 GLY 65 -16.937 -14.983 6.012 1229 H SER 66 HN SER 66 -16.196 -11.878 5.745 1230 HA SER 66 HA SER 66 -17.239 -11.758 3.016 1231 HB2 SER 66 HB2 SER 66 -16.857 -9.531 5.023 1232 HB3 SER 66 HB1 SER 66 -17.776 -9.451 3.522 1233 HG SER 66 HG SER 66 -18.892 -11.408 4.636 1234 H ASP 67 HN ASP 67 -16.472 -9.971 1.668 1235 HA ASP 67 HA ASP 67 -13.588 -9.944 1.407 1236 HB2 ASP 67 HB2 ASP 67 -15.947 -8.982 -0.172 1237 HB3 ASP 67 HB1 ASP 67 -14.352 -8.353 -0.563 1238 H VAL 68 HN VAL 68 -12.262 -8.206 1.944 1239 HA VAL 68 HA VAL 68 -13.433 -6.229 3.619 1240 HB VAL 68 HB VAL 68 -11.433 -5.646 4.377 1241 HG11 VAL 68 HG11 VAL 68 -10.279 -7.897 2.744 1242 HG12 VAL 68 HG12 VAL 68 -11.238 -8.119 4.218 1243 HG13 VAL 68 HG13 VAL 68 -9.709 -7.248 4.292 1244 HG21 VAL 68 HG21 VAL 68 -10.949 -4.236 2.528 1245 HG22 VAL 68 HG22 VAL 68 -10.440 -5.611 1.540 1246 HG23 VAL 68 HG23 VAL 68 -9.489 -5.128 2.959 1247 H ILE 69 HN ILE 69 -12.392 -6.453 0.356 1248 HA ILE 69 HA ILE 69 -12.233 -3.797 -0.365 1249 HB ILE 69 HB ILE 69 -13.116 -6.196 -1.937 1250 HG12 ILE 69 HG12 ILE 69 -10.835 -6.400 -1.376 1251 HG13 ILE 69 HG11 ILE 69 -10.844 -5.782 -3.016 1252 HG21 ILE 69 HG21 ILE 69 -12.734 -4.792 -3.987 1253 HG22 ILE 69 HG22 ILE 69 -12.662 -3.377 -2.934 1254 HG23 ILE 69 HG23 ILE 69 -14.141 -4.330 -3.029 1255 HD11 ILE 69 HD11 ILE 69 -10.397 -3.533 -2.184 1256 HD12 ILE 69 HD12 ILE 69 -9.152 -4.694 -1.701 1257 HD13 ILE 69 HD13 ILE 69 -10.380 -4.169 -0.536 1258 H SER 70 HN SER 70 -15.000 -5.921 -0.429 1259 HA SER 70 HA SER 70 -16.956 -4.303 -1.428 1260 HB2 SER 70 HB2 SER 70 -17.223 -6.685 -0.775 1261 HB3 SER 70 HB1 SER 70 -17.233 -6.202 0.917 1262 HG SER 70 HG SER 70 -19.272 -5.787 0.709 1263 H GLU 71 HN GLU 71 -15.531 -4.220 1.775 1264 HA GLU 71 HA GLU 71 -17.414 -2.304 2.826 1265 HB2 GLU 71 HB2 GLU 71 -14.863 -3.184 4.122 1266 HB3 GLU 71 HB1 GLU 71 -16.393 -2.747 4.880 1267 HG2 GLU 71 HG2 GLU 71 -16.304 -5.101 3.081 1268 HG3 GLU 71 HG1 GLU 71 -15.628 -5.244 4.691 1269 H TYR 72 HN TYR 72 -14.224 -2.453 1.537 1270 HA TYR 72 HA TYR 72 -13.398 0.104 2.496 1271 HB2 TYR 72 HB2 TYR 72 -12.261 -1.908 0.570 1272 HB3 TYR 72 HB1 TYR 72 -11.533 -0.319 0.766 1273 HD1 TYR 72 HD1 TYR 72 -13.034 -1.798 3.708 1274 HD2 TYR 72 HD2 TYR 72 -9.459 -1.487 1.446 1275 HE1 TYR 72 HE1 TYR 72 -11.749 -2.618 5.624 1276 HE2 TYR 72 HE2 TYR 72 -8.161 -2.325 3.355 1277 HH TYR 72 HH TYR 72 -9.721 -3.611 6.186 1278 H VAL 73 HN VAL 73 -14.659 -1.240 -0.487 1279 HA VAL 73 HA VAL 73 -14.650 1.181 -1.959 1280 HB VAL 73 HB VAL 73 -15.897 0.198 -3.617 1281 HG11 VAL 73 HG11 VAL 73 -15.218 -2.156 -3.883 1282 HG12 VAL 73 HG12 VAL 73 -14.584 -2.105 -2.238 1283 HG13 VAL 73 HG13 VAL 73 -13.907 -1.055 -3.478 1284 HG21 VAL 73 HG21 VAL 73 -17.083 -1.938 -1.895 1285 HG22 VAL 73 HG22 VAL 73 -17.626 -1.337 -3.472 1286 HG23 VAL 73 HG23 VAL 73 -17.817 -0.339 -2.027 1287 H LYS 74 HN LYS 74 -16.769 -0.413 0.253 1288 HA LYS 74 HA LYS 74 -19.026 1.268 0.085 1289 HB2 LYS 74 HB2 LYS 74 -18.657 -1.062 1.148 1290 HB3 LYS 74 HB1 LYS 74 -18.084 -0.167 2.537 1291 HG2 LYS 74 HG2 LYS 74 -20.137 0.314 3.213 1292 HG3 LYS 74 HG1 LYS 74 -20.645 0.805 1.595 1293 HD2 LYS 74 HD2 LYS 74 -20.387 -2.057 2.513 1294 HD3 LYS 74 HD1 LYS 74 -21.901 -1.150 2.483 1295 HE2 LYS 74 HE2 LYS 74 -20.189 -1.444 0.033 1296 HE3 LYS 74 HE1 LYS 74 -21.374 -2.675 0.485 1297 HZ1 LYS 74 HZ1 LYS 74 -22.255 -1.042 -1.095 1298 HZ2 LYS 74 HZ2 LYS 74 -21.998 0.193 0.029 1299 HZ3 LYS 74 HZ3 LYS 74 -23.108 -1.031 0.362 1300 H ALA 75 HN ALA 75 -16.012 1.357 1.802 1301 HA ALA 75 HA ALA 75 -16.536 3.479 3.572 1302 HB1 ALA 75 HB1 ALA 75 -14.093 3.729 3.650 1303 HB2 ALA 75 HB2 ALA 75 -13.951 2.659 2.253 1304 HB3 ALA 75 HB3 ALA 75 -14.587 2.042 3.776 1305 H CYS 76 HN CYS 76 -15.119 3.426 0.321 1306 HA CYS 76 HA CYS 76 -15.302 6.328 0.149 1307 HB2 CYS 76 HB2 CYS 76 -13.314 5.391 -0.726 1308 HB3 CYS 76 HB1 CYS 76 -14.182 4.219 -1.701 1309 HG CYS 76 HG CYS 76 -15.363 6.587 -3.128 1310 H ASP 77 HN ASP 77 -17.498 3.994 -0.115 1311 HA ASP 77 HA ASP 77 -18.864 4.583 -2.488 1312 HB2 ASP 77 HB2 ASP 77 -19.486 2.632 -1.327 1313 HB3 ASP 77 HB1 ASP 77 -19.740 3.480 0.188 1314 H GLY 78 HN GLY 78 -18.389 6.403 0.352 1315 HA2 GLY 78 HA3 GLY 78 -20.486 8.311 -0.403 1316 HA3 GLY 78 HA2 GLY 78 -19.579 8.324 1.102 1317 H ILE 79 HN ILE 79 -17.210 7.769 -1.024 1318 HA ILE 79 HA ILE 79 -16.539 10.598 -1.174 1319 HB ILE 79 HB ILE 79 -14.872 8.139 -1.625 1320 HG12 ILE 79 HG12 ILE 79 -14.804 10.126 0.649 1321 HG13 ILE 79 HG11 ILE 79 -15.620 8.565 0.720 1322 HG21 ILE 79 HG21 ILE 79 -14.038 10.016 -2.950 1323 HG22 ILE 79 HG22 ILE 79 -12.930 9.594 -1.644 1324 HG23 ILE 79 HG23 ILE 79 -13.972 11.008 -1.493 1325 HD11 ILE 79 HD11 ILE 79 -13.611 7.393 0.628 1326 HD12 ILE 79 HD12 ILE 79 -13.299 8.747 1.721 1327 HD13 ILE 79 HD13 ILE 79 -12.720 8.803 0.059 1328 H GLY 80 HN GLY 80 -16.024 11.638 -3.090 1329 HA2 GLY 80 HA3 GLY 80 -15.192 10.777 -5.450 1330 HA3 GLY 80 HA2 GLY 80 -16.880 10.319 -5.531 1331 H GLY 81 HN GLY 81 -14.802 13.105 -4.846 1332 HA2 GLY 81 HA3 GLY 81 -14.891 15.084 -6.151 1333 HA3 GLY 81 HA2 GLY 81 -16.565 14.723 -6.540 1334 H ALA 82 HN ALA 82 -18.115 15.722 -5.407 1335 HA ALA 82 HA ALA 82 -17.509 17.982 -3.912 1336 HB1 ALA 82 HB1 ALA 82 -19.882 18.124 -3.433 1337 HB2 ALA 82 HB2 ALA 82 -20.096 16.443 -3.920 1338 HB3 ALA 82 HB3 ALA 82 -19.614 17.652 -5.110 1339 H MET 83 HN MET 83 -18.710 14.847 -2.738 1340 HA MET 83 HA MET 83 -18.645 15.609 -0.005 1341 HB2 MET 83 HB2 MET 83 -18.620 12.850 -1.240 1342 HB3 MET 83 HB1 MET 83 -18.923 13.200 0.457 1343 HG2 MET 83 HG2 MET 83 -20.888 14.546 -0.230 1344 HG3 MET 83 HG1 MET 83 -20.611 14.030 -1.889 1345 HE1 MET 83 HE1 MET 83 -21.720 11.144 1.535 1346 HE2 MET 83 HE2 MET 83 -21.422 12.868 1.749 1347 HE3 MET 83 HE3 MET 83 -20.092 11.787 1.335 1348 H HIS 84 HN HIS 84 -16.312 14.291 -2.197 1349 HA HIS 84 HA HIS 84 -14.355 13.454 -0.318 1350 HB2 HIS 84 HB2 HIS 84 -14.084 12.659 -2.533 1351 HB3 HIS 84 HB1 HIS 84 -14.291 14.258 -3.230 1352 HD1 HIS 84 HD1 HIS 84 -12.170 14.794 -4.358 1353 HD2 HIS 84 HD2 HIS 84 -11.527 13.052 -0.652 1354 HE1 HIS 84 HE1 HIS 84 -9.686 14.815 -4.033 1355 HE2 HIS 84 HE2 HIS 84 -9.309 13.577 -1.875 1356 H LYS 85 HN LYS 85 -15.216 16.571 -1.687 1357 HA LYS 85 HA LYS 85 -12.802 17.834 -0.726 1358 HB2 LYS 85 HB2 LYS 85 -15.321 19.140 -1.767 1359 HB3 LYS 85 HB1 LYS 85 -13.731 19.878 -1.621 1360 HG2 LYS 85 HG2 LYS 85 -14.437 17.583 -3.438 1361 HG3 LYS 85 HG1 LYS 85 -14.247 19.269 -3.931 1362 HD2 LYS 85 HD2 LYS 85 -11.907 19.210 -3.281 1363 HD3 LYS 85 HD1 LYS 85 -12.091 17.556 -2.695 1364 HE2 LYS 85 HE2 LYS 85 -11.080 17.490 -4.875 1365 HE3 LYS 85 HE1 LYS 85 -12.723 16.860 -4.992 1366 HZ1 LYS 85 HZ1 LYS 85 -12.217 18.361 -6.815 1367 HZ2 LYS 85 HZ2 LYS 85 -11.871 19.611 -5.733 1368 HZ3 LYS 85 HZ3 LYS 85 -13.441 19.004 -5.847 1369 H ALA 86 HN ALA 86 -15.898 17.082 0.489 1370 HA ALA 86 HA ALA 86 -15.846 19.048 2.614 1371 HB1 ALA 86 HB1 ALA 86 -17.690 16.698 2.212 1372 HB2 ALA 86 HB2 ALA 86 -17.980 18.335 1.620 1373 HB3 ALA 86 HB3 ALA 86 -17.916 18.023 3.354 1374 H MET 87 HN MET 87 -15.374 15.595 2.208 1375 HA MET 87 HA MET 87 -14.887 15.182 5.031 1376 HB2 MET 87 HB2 MET 87 -14.769 13.295 2.670 1377 HB3 MET 87 HB1 MET 87 -14.626 12.815 4.360 1378 HG2 MET 87 HG2 MET 87 -16.985 14.403 3.950 1379 HG3 MET 87 HG1 MET 87 -16.955 13.036 2.845 1380 HE1 MET 87 HE1 MET 87 -19.247 13.383 4.940 1381 HE2 MET 87 HE2 MET 87 -19.368 11.770 5.640 1382 HE3 MET 87 HE3 MET 87 -19.127 11.962 3.904 1383 H LEU 88 HN LEU 88 -13.072 16.043 2.337 1384 HA LEU 88 HA LEU 88 -10.666 14.808 2.530 1385 HB2 LEU 88 HB2 LEU 88 -11.584 16.776 1.059 1386 HB3 LEU 88 HB1 LEU 88 -10.740 17.772 2.226 1387 HG LEU 88 HG LEU 88 -8.752 17.360 1.281 1388 HD11 LEU 88 HD11 LEU 88 -9.561 14.470 0.958 1389 HD12 LEU 88 HD12 LEU 88 -8.629 15.139 2.299 1390 HD13 LEU 88 HD13 LEU 88 -7.952 15.129 0.669 1391 HD21 LEU 88 HD21 LEU 88 -8.856 16.581 -1.053 1392 HD22 LEU 88 HD22 LEU 88 -10.095 17.779 -0.673 1393 HD23 LEU 88 HD23 LEU 88 -10.521 16.070 -0.769 1394 H MET 89 HN MET 89 -11.806 17.517 4.523 1395 HA MET 89 HA MET 89 -9.321 17.676 5.976 1396 HB2 MET 89 HB2 MET 89 -10.690 19.681 5.553 1397 HB3 MET 89 HB1 MET 89 -11.990 18.992 6.515 1398 HG2 MET 89 HG2 MET 89 -10.515 19.018 8.481 1399 HG3 MET 89 HG1 MET 89 -9.260 19.777 7.504 1400 HE1 MET 89 HE1 MET 89 -10.486 22.672 9.860 1401 HE2 MET 89 HE2 MET 89 -9.103 21.712 9.333 1402 HE3 MET 89 HE3 MET 89 -10.393 20.958 10.269 1403 H ALA 90 HN ALA 90 -12.120 15.776 6.152 1404 HA ALA 90 HA ALA 90 -12.034 15.460 9.051 1405 HB1 ALA 90 HB1 ALA 90 -14.073 14.188 8.786 1406 HB2 ALA 90 HB2 ALA 90 -13.872 14.171 7.032 1407 HB3 ALA 90 HB3 ALA 90 -14.197 15.692 7.872 1408 H GLN 91 HN GLN 91 -11.424 13.590 6.122 1409 HA GLN 91 HA GLN 91 -10.871 11.238 7.784 1410 HB2 GLN 91 HB2 GLN 91 -11.364 11.427 4.825 1411 HB3 GLN 91 HB1 GLN 91 -11.199 9.946 5.762 1412 HG2 GLN 91 HG2 GLN 91 -13.189 10.483 7.011 1413 HG3 GLN 91 HG1 GLN 91 -13.330 12.013 6.146 1414 HE21 GLN 91 HE21 GLN 91 -12.569 11.087 3.632 1415 HE22 GLN 91 HE22 GLN 91 -13.791 10.026 3.047 1416 H LEU 92 HN LEU 92 -9.547 12.859 4.881 1417 HA LEU 92 HA LEU 92 -7.267 11.484 4.388 1418 HB2 LEU 92 HB2 LEU 92 -8.202 13.782 3.482 1419 HB3 LEU 92 HB1 LEU 92 -7.040 14.460 4.594 1420 HG LEU 92 HG LEU 92 -6.592 12.990 2.038 1421 HD11 LEU 92 HD11 LEU 92 -6.545 15.411 2.087 1422 HD12 LEU 92 HD12 LEU 92 -4.943 14.765 1.727 1423 HD13 LEU 92 HD13 LEU 92 -5.307 15.378 3.341 1424 HD21 LEU 92 HD21 LEU 92 -4.233 12.621 2.596 1425 HD22 LEU 92 HD22 LEU 92 -5.304 11.645 3.602 1426 HD23 LEU 92 HD23 LEU 92 -4.557 13.100 4.262 1427 H GLU 93 HN GLU 93 -7.945 13.650 7.011 1428 HA GLU 93 HA GLU 93 -6.716 14.596 8.660 1429 HB2 GLU 93 HB2 GLU 93 -6.442 11.671 8.754 1430 HB3 GLU 93 HB1 GLU 93 -5.729 12.635 10.039 1431 HG2 GLU 93 HG2 GLU 93 -8.592 12.955 9.233 1432 HG3 GLU 93 HG1 GLU 93 -8.097 11.666 10.316 Start of MODEL 9 1 H2 PRO 1 HT1 PRO 1 -5.224 -3.930 13.191 2 H3 PRO 1 HT2 PRO 1 -5.670 -2.436 13.679 3 HA PRO 1 HA PRO 1 -6.404 -2.393 11.644 4 HB2 PRO 1 HB2 PRO 1 -4.363 -1.335 10.279 5 HB3 PRO 1 HB1 PRO 1 -5.108 -0.469 11.628 6 HG2 PRO 1 HG2 PRO 1 -2.494 -1.795 11.482 7 HG3 PRO 1 HG1 PRO 1 -3.065 -0.564 12.620 8 HD2 PRO 1 HD2 PRO 1 -2.920 -3.448 12.959 9 HD3 PRO 1 HD1 PRO 1 -3.310 -2.208 14.167 10 H SER 2 HN SER 2 -4.818 -2.521 9.190 11 HA SER 2 HA SER 2 -4.408 -5.266 8.677 12 HB2 SER 2 HB2 SER 2 -3.026 -2.904 7.393 13 HB3 SER 2 HB1 SER 2 -3.136 -4.524 6.731 14 HG SER 2 HG SER 2 -5.462 -4.228 6.749 15 H PHE 3 HN PHE 3 -2.112 -6.110 8.183 16 HA PHE 3 HA PHE 3 -0.496 -5.761 10.487 17 HB2 PHE 3 HB2 PHE 3 1.163 -6.825 8.548 18 HB3 PHE 3 HB1 PHE 3 0.182 -7.748 9.683 19 HD1 PHE 3 HD1 PHE 3 0.767 -6.770 6.288 20 HD2 PHE 3 HD2 PHE 3 -2.038 -8.617 8.907 21 HE1 PHE 3 HE1 PHE 3 -0.363 -7.806 4.379 22 HE2 PHE 3 HE2 PHE 3 -3.187 -9.628 6.986 23 HZ PHE 3 HZ PHE 3 -2.346 -9.223 4.707 24 H ASN 4 HN ASN 4 -0.250 -4.688 7.156 25 HA ASN 4 HA ASN 4 2.420 -3.698 7.598 26 HB2 ASN 4 HB2 ASN 4 2.393 -3.341 5.174 27 HB3 ASN 4 HB1 ASN 4 1.898 -4.978 5.603 28 HD21 ASN 4 HD21 ASN 4 0.688 -1.790 4.713 29 HD22 ASN 4 HD22 ASN 4 -0.797 -2.359 4.019 30 H THR 5 HN THR 5 -0.378 -2.233 8.312 31 HA THR 5 HA THR 5 -0.366 0.117 6.733 32 HB THR 5 HB THR 5 -1.533 1.034 8.901 33 HG1 THR 5 HG1 THR 5 -1.092 -0.554 10.358 34 HG21 THR 5 HG21 THR 5 -2.610 -1.094 7.083 35 HG22 THR 5 HG22 THR 5 -2.729 0.654 6.887 36 HG23 THR 5 HG23 THR 5 -3.611 -0.153 8.184 37 H VAL 6 HN VAL 6 1.886 -0.924 8.990 38 HA VAL 6 HA VAL 6 2.629 1.609 10.056 39 HB VAL 6 HB VAL 6 4.410 0.521 11.100 40 HG11 VAL 6 HG11 VAL 6 3.554 -1.627 11.943 41 HG12 VAL 6 HG12 VAL 6 2.324 -1.607 10.679 42 HG13 VAL 6 HG13 VAL 6 2.325 -0.362 11.930 43 HG21 VAL 6 HG21 VAL 6 5.563 -1.411 10.351 44 HG22 VAL 6 HG22 VAL 6 5.352 -0.364 8.936 45 HG23 VAL 6 HG23 VAL 6 4.306 -1.772 9.157 46 H ARG 7 HN ARG 7 4.015 3.114 9.142 47 HA ARG 7 HA ARG 7 5.716 2.230 7.022 48 HB2 ARG 7 HB2 ARG 7 4.754 3.806 5.344 49 HB3 ARG 7 HB1 ARG 7 3.887 2.334 5.714 50 HG2 ARG 7 HG2 ARG 7 2.819 4.239 7.415 51 HG3 ARG 7 HG1 ARG 7 2.996 5.023 5.841 52 HD2 ARG 7 HD2 ARG 7 1.833 3.166 4.774 53 HD3 ARG 7 HD1 ARG 7 1.657 2.366 6.334 54 HE ARG 7 HE ARG 7 0.444 4.646 6.874 55 HH11 ARG 7 HH11 ARG 7 0.184 2.643 4.013 56 HH12 ARG 7 HH12 ARG 7 -1.355 3.278 3.561 57 HH21 ARG 7 HH21 ARG 7 -1.562 5.509 6.264 58 HH22 ARG 7 HH22 ARG 7 -2.350 4.933 4.833 59 H GLN 8 HN GLN 8 7.010 3.748 6.065 60 HA GLN 8 HA GLN 8 8.618 5.180 7.660 61 HB2 GLN 8 HB2 GLN 8 8.301 4.721 4.895 62 HB3 GLN 8 HB1 GLN 8 8.564 6.452 5.073 63 HG2 GLN 8 HG2 GLN 8 10.581 5.977 6.391 64 HG3 GLN 8 HG1 GLN 8 10.328 4.254 6.120 65 HE21 GLN 8 HE21 GLN 8 12.587 5.828 5.384 66 HE22 GLN 8 HE22 GLN 8 12.720 5.726 3.651 67 H GLY 9 HN GLY 9 8.190 6.766 8.982 68 HA2 GLY 9 HA3 GLY 9 6.433 8.969 8.213 69 HA3 GLY 9 HA2 GLY 9 7.228 8.754 9.768 70 H SER 10 HN SER 10 8.025 10.879 9.799 71 HA SER 10 HA SER 10 9.320 12.259 7.801 72 HB2 SER 10 HB2 SER 10 10.536 13.392 9.775 73 HB3 SER 10 HB1 SER 10 8.774 13.453 9.752 74 HG SER 10 HG SER 10 10.228 11.440 11.119 75 H LYS 11 HN LYS 11 10.809 11.390 6.550 76 HA LYS 11 HA LYS 11 12.317 9.802 5.869 77 HB2 LYS 11 HB2 LYS 11 14.490 10.685 5.903 78 HB3 LYS 11 HB1 LYS 11 13.417 12.069 5.962 79 HG2 LYS 11 HG2 LYS 11 14.674 10.938 8.445 80 HG3 LYS 11 HG1 LYS 11 15.496 12.117 7.425 81 HD2 LYS 11 HD2 LYS 11 13.613 13.671 7.750 82 HD3 LYS 11 HD1 LYS 11 12.844 12.491 8.814 83 HE2 LYS 11 HE2 LYS 11 14.803 12.592 10.298 84 HE3 LYS 11 HE1 LYS 11 15.516 13.815 9.251 85 HZ1 LYS 11 HZ1 LYS 11 13.006 14.067 10.810 86 HZ2 LYS 11 HZ2 LYS 11 13.570 15.224 9.716 87 HZ3 LYS 11 HZ3 LYS 11 14.465 14.869 11.106 88 H GLU 12 HN GLU 12 11.054 8.516 7.773 89 HA GLU 12 HA GLU 12 12.523 7.533 9.942 90 HB2 GLU 12 HB2 GLU 12 10.110 7.240 9.680 91 HB3 GLU 12 HB1 GLU 12 10.354 6.238 8.265 92 HG2 GLU 12 HG2 GLU 12 11.469 4.556 9.684 93 HG3 GLU 12 HG1 GLU 12 11.127 5.567 11.090 94 HA PRO 13 HA PRO 13 15.723 5.067 8.036 95 HB2 PRO 13 HB2 PRO 13 15.148 3.101 10.164 96 HB3 PRO 13 HB1 PRO 13 16.672 3.880 9.754 97 HG2 PRO 13 HG2 PRO 13 15.263 4.545 11.946 98 HG3 PRO 13 HG1 PRO 13 16.228 5.716 11.041 99 HD2 PRO 13 HD2 PRO 13 13.288 5.372 11.147 100 HD3 PRO 13 HD1 PRO 13 14.244 6.836 10.872 101 H TYR 14 HN TYR 14 15.401 3.792 6.323 102 HA TYR 14 HA TYR 14 12.765 2.847 5.963 103 HB2 TYR 14 HB2 TYR 14 13.981 3.912 4.151 104 HB3 TYR 14 HB1 TYR 14 15.117 2.569 4.117 105 HD1 TYR 14 HD1 TYR 14 14.105 0.246 3.763 106 HD2 TYR 14 HD2 TYR 14 12.099 3.834 2.832 107 HE1 TYR 14 HE1 TYR 14 12.666 -0.992 2.231 108 HE2 TYR 14 HE2 TYR 14 10.637 2.640 1.272 109 HH TYR 14 HH TYR 14 10.357 0.675 0.185 110 HA PRO 15 HA PRO 15 14.831 -1.567 5.571 111 HB2 PRO 15 HB2 PRO 15 17.018 -1.258 7.527 112 HB3 PRO 15 HB1 PRO 15 16.996 -2.135 6.000 113 HG2 PRO 15 HG2 PRO 15 18.305 0.185 6.294 114 HG3 PRO 15 HG1 PRO 15 17.557 -0.287 4.774 115 HD2 PRO 15 HD2 PRO 15 16.678 1.719 6.776 116 HD3 PRO 15 HD1 PRO 15 16.441 1.689 5.022 117 H ASP 16 HN ASP 16 14.579 0.557 8.147 118 HA ASP 16 HA ASP 16 13.779 -1.432 10.095 119 HB2 ASP 16 HB2 ASP 16 14.457 1.459 10.198 120 HB3 ASP 16 HB1 ASP 16 13.339 0.857 11.414 121 H PHE 17 HN PHE 17 12.414 1.335 8.352 122 HA PHE 17 HA PHE 17 9.803 1.251 9.289 123 HB2 PHE 17 HB2 PHE 17 9.764 2.974 7.814 124 HB3 PHE 17 HB1 PHE 17 11.190 2.368 6.987 125 HD1 PHE 17 HD1 PHE 17 11.020 1.421 4.861 126 HD2 PHE 17 HD2 PHE 17 7.515 1.990 7.184 127 HE1 PHE 17 HE1 PHE 17 9.644 0.813 2.923 128 HE2 PHE 17 HE2 PHE 17 6.124 1.396 5.243 129 HZ PHE 17 HZ PHE 17 7.190 0.805 3.109 130 H VAL 18 HN VAL 18 11.347 -0.559 6.696 131 HA VAL 18 HA VAL 18 8.971 -2.038 6.122 132 HB VAL 18 HB VAL 18 10.298 -1.722 4.223 133 HG11 VAL 18 HG11 VAL 18 12.669 -2.343 4.104 134 HG12 VAL 18 HG12 VAL 18 12.631 -2.774 5.826 135 HG13 VAL 18 HG13 VAL 18 12.375 -1.099 5.330 136 HG21 VAL 18 HG21 VAL 18 9.477 -3.933 4.200 137 HG22 VAL 18 HG22 VAL 18 10.715 -4.478 5.339 138 HG23 VAL 18 HG23 VAL 18 11.165 -4.023 3.687 139 H ALA 19 HN ALA 19 11.957 -2.666 7.949 140 HA ALA 19 HA ALA 19 11.577 -5.402 8.371 141 HB1 ALA 19 HB1 ALA 19 12.954 -5.179 10.359 142 HB2 ALA 19 HB2 ALA 19 12.723 -3.431 10.351 143 HB3 ALA 19 HB3 ALA 19 13.618 -4.207 9.046 144 H ARG 20 HN ARG 20 9.965 -2.668 9.935 145 HA ARG 20 HA ARG 20 8.657 -4.473 11.791 146 HB2 ARG 20 HB2 ARG 20 7.408 -2.494 12.565 147 HB3 ARG 20 HB1 ARG 20 9.142 -2.256 12.639 148 HG2 ARG 20 HG2 ARG 20 9.136 -0.687 10.960 149 HG3 ARG 20 HG1 ARG 20 7.624 -1.282 10.267 150 HD2 ARG 20 HD2 ARG 20 6.349 -0.357 12.038 151 HD3 ARG 20 HD1 ARG 20 7.786 -0.013 12.982 152 HE ARG 20 HE ARG 20 8.229 1.532 10.875 153 HH11 ARG 20 HH11 ARG 20 5.303 1.029 12.732 154 HH12 ARG 20 HH12 ARG 20 4.677 2.614 12.409 155 HH21 ARG 20 HH21 ARG 20 7.436 3.643 10.497 156 HH22 ARG 20 HH22 ARG 20 5.880 4.093 11.135 157 H LEU 21 HN LEU 21 8.208 -2.963 8.754 158 HA LEU 21 HA LEU 21 5.510 -3.415 8.284 159 HB2 LEU 21 HB2 LEU 21 7.378 -2.234 6.889 160 HB3 LEU 21 HB1 LEU 21 7.634 -3.815 6.194 161 HG LEU 21 HG LEU 21 5.594 -3.788 5.064 162 HD11 LEU 21 HD11 LEU 21 3.874 -2.015 5.454 163 HD12 LEU 21 HD12 LEU 21 4.797 -1.525 6.879 164 HD13 LEU 21 HD13 LEU 21 4.085 -3.138 6.799 165 HD21 LEU 21 HD21 LEU 21 5.566 -1.607 3.908 166 HD22 LEU 21 HD22 LEU 21 7.174 -2.321 4.043 167 HD23 LEU 21 HD23 LEU 21 6.701 -1.003 5.114 168 H GLN 22 HN GLN 22 8.342 -5.453 7.744 169 HA GLN 22 HA GLN 22 6.970 -7.766 6.930 170 HB2 GLN 22 HB2 GLN 22 9.621 -7.837 8.307 171 HB3 GLN 22 HB1 GLN 22 9.012 -8.841 6.988 172 HG2 GLN 22 HG2 GLN 22 9.166 -6.874 5.535 173 HG3 GLN 22 HG1 GLN 22 9.864 -5.973 6.865 174 HE21 GLN 22 HE21 GLN 22 10.958 -6.484 4.358 175 HE22 GLN 22 HE22 GLN 22 12.423 -7.378 4.558 176 H ASP 23 HN ASP 23 8.398 -6.758 9.953 177 HA ASP 23 HA ASP 23 8.027 -8.982 11.502 178 HB2 ASP 23 HB2 ASP 23 8.999 -6.747 12.182 179 HB3 ASP 23 HB1 ASP 23 7.336 -6.232 12.455 180 H VAL 24 HN VAL 24 5.616 -6.404 11.021 181 HA VAL 24 HA VAL 24 3.750 -7.844 12.663 182 HB VAL 24 HB VAL 24 3.727 -5.415 12.785 183 HG11 VAL 24 HG11 VAL 24 4.513 -4.916 10.560 184 HG12 VAL 24 HG12 VAL 24 3.001 -4.063 10.870 185 HG13 VAL 24 HG13 VAL 24 3.006 -5.516 9.870 186 HG21 VAL 24 HG21 VAL 24 1.311 -4.985 12.332 187 HG22 VAL 24 HG22 VAL 24 1.605 -6.484 13.217 188 HG23 VAL 24 HG23 VAL 24 1.243 -6.538 11.493 189 H ALA 25 HN ALA 25 4.499 -7.514 9.306 190 HA ALA 25 HA ALA 25 2.041 -8.539 8.287 191 HB1 ALA 25 HB1 ALA 25 4.820 -8.645 7.090 192 HB2 ALA 25 HB2 ALA 25 3.634 -7.371 6.818 193 HB3 ALA 25 HB3 ALA 25 3.322 -9.004 6.234 194 H GLN 26 HN GLN 26 4.884 -9.707 9.725 195 HA GLN 26 HA GLN 26 4.551 -12.456 8.992 196 HB2 GLN 26 HB2 GLN 26 6.728 -12.281 9.416 197 HB3 GLN 26 HB1 GLN 26 6.478 -10.726 10.194 198 HG2 GLN 26 HG2 GLN 26 7.369 -11.839 11.923 199 HG3 GLN 26 HG1 GLN 26 5.684 -12.277 12.185 200 HE21 GLN 26 HE21 GLN 26 5.615 -14.034 9.882 201 HE22 GLN 26 HE22 GLN 26 6.461 -15.462 10.328 202 H LYS 27 HN LYS 27 3.913 -10.404 11.731 203 HA LYS 27 HA LYS 27 3.047 -12.365 13.563 204 HB2 LYS 27 HB2 LYS 27 2.143 -9.489 13.336 205 HB3 LYS 27 HB1 LYS 27 2.034 -10.510 14.775 206 HG2 LYS 27 HG2 LYS 27 4.548 -9.534 13.442 207 HG3 LYS 27 HG1 LYS 27 3.888 -8.988 14.983 208 HD2 LYS 27 HD2 LYS 27 4.495 -10.928 16.073 209 HD3 LYS 27 HD1 LYS 27 4.524 -11.880 14.591 210 HE2 LYS 27 HE2 LYS 27 6.561 -10.945 13.903 211 HE3 LYS 27 HE1 LYS 27 6.451 -9.645 15.085 212 HZ1 LYS 27 HZ1 LYS 27 8.052 -11.324 15.757 213 HZ2 LYS 27 HZ2 LYS 27 6.862 -12.522 15.698 214 HZ3 LYS 27 HZ3 LYS 27 6.757 -11.285 16.844 215 H SER 28 HN SER 28 1.432 -10.760 10.919 216 HA SER 28 HA SER 28 -1.152 -11.723 11.910 217 HB2 SER 28 HB2 SER 28 -0.563 -9.607 9.849 218 HB3 SER 28 HB1 SER 28 -2.139 -9.968 10.556 219 HG SER 28 HG SER 28 0.127 -8.774 11.749 220 H ILE 29 HN ILE 29 1.238 -12.373 9.680 221 HA ILE 29 HA ILE 29 -0.668 -13.712 7.872 222 HB ILE 29 HB ILE 29 2.056 -12.578 7.272 223 HG12 ILE 29 HG12 ILE 29 -0.647 -11.861 6.130 224 HG13 ILE 29 HG11 ILE 29 0.225 -10.929 7.355 225 HG21 ILE 29 HG21 ILE 29 0.254 -14.165 5.464 226 HG22 ILE 29 HG22 ILE 29 1.851 -14.627 6.059 227 HG23 ILE 29 HG23 ILE 29 1.686 -13.265 4.951 228 HD11 ILE 29 HD11 ILE 29 0.458 -10.073 5.032 229 HD12 ILE 29 HD12 ILE 29 1.335 -11.561 4.638 230 HD13 ILE 29 HD13 ILE 29 1.978 -10.441 5.847 231 H ALA 30 HN ALA 30 -0.541 -15.867 7.750 232 HA ALA 30 HA ALA 30 1.683 -17.244 9.055 233 HB1 ALA 30 HB1 ALA 30 -0.900 -18.351 7.956 234 HB2 ALA 30 HB2 ALA 30 -0.617 -17.891 9.635 235 HB3 ALA 30 HB3 ALA 30 0.284 -19.229 8.923 236 H ASP 31 HN ASP 31 1.065 -16.059 6.107 237 HA ASP 31 HA ASP 31 2.326 -18.283 4.624 238 HB2 ASP 31 HB2 ASP 31 0.118 -16.436 4.032 239 HB3 ASP 31 HB1 ASP 31 1.294 -16.577 2.736 240 H GLU 32 HN GLU 32 4.434 -17.891 4.389 241 HA GLU 32 HA GLU 32 5.766 -15.464 4.564 242 HB2 GLU 32 HB2 GLU 32 7.618 -16.545 3.405 243 HB3 GLU 32 HB1 GLU 32 6.885 -17.672 4.536 244 HG2 GLU 32 HG2 GLU 32 6.964 -19.087 2.815 245 HG3 GLU 32 HG1 GLU 32 5.503 -18.262 2.285 246 H LYS 33 HN LYS 33 4.020 -16.859 1.920 247 HA LYS 33 HA LYS 33 5.033 -15.383 -0.227 248 HB2 LYS 33 HB2 LYS 33 2.176 -16.307 0.167 249 HB3 LYS 33 HB1 LYS 33 2.946 -15.945 -1.355 250 HG2 LYS 33 HG2 LYS 33 3.951 -17.903 -1.484 251 HG3 LYS 33 HG1 LYS 33 4.223 -18.010 0.253 252 HD2 LYS 33 HD2 LYS 33 2.046 -18.750 0.654 253 HD3 LYS 33 HD1 LYS 33 1.486 -18.238 -0.941 254 HE2 LYS 33 HE2 LYS 33 3.492 -20.407 -0.452 255 HE3 LYS 33 HE1 LYS 33 1.773 -20.688 -0.696 256 HZ1 LYS 33 HZ1 LYS 33 3.663 -19.494 -2.643 257 HZ2 LYS 33 HZ2 LYS 33 1.992 -19.607 -2.886 258 HZ3 LYS 33 HZ3 LYS 33 2.929 -21.014 -2.752 259 H ALA 34 HN ALA 34 2.054 -14.869 1.614 260 HA ALA 34 HA ALA 34 1.570 -12.304 0.554 261 HB1 ALA 34 HB1 ALA 34 -0.235 -13.657 1.444 262 HB2 ALA 34 HB2 ALA 34 -0.138 -12.131 2.325 263 HB3 ALA 34 HB3 ALA 34 0.491 -13.611 3.050 264 H ARG 35 HN ARG 35 3.608 -13.475 3.075 265 HA ARG 35 HA ARG 35 3.686 -11.041 4.605 266 HB2 ARG 35 HB2 ARG 35 4.344 -13.478 5.322 267 HB3 ARG 35 HB1 ARG 35 5.902 -13.059 4.628 268 HG2 ARG 35 HG2 ARG 35 4.683 -11.194 6.613 269 HG3 ARG 35 HG1 ARG 35 5.393 -12.700 7.186 270 HD2 ARG 35 HD2 ARG 35 6.777 -10.523 5.618 271 HD3 ARG 35 HD1 ARG 35 7.025 -10.948 7.321 272 HE ARG 35 HE ARG 35 7.684 -13.232 6.255 273 HH11 ARG 35 HH11 ARG 35 8.428 -10.060 4.970 274 HH12 ARG 35 HH12 ARG 35 9.907 -10.566 4.220 275 HH21 ARG 35 HH21 ARG 35 9.620 -13.909 5.262 276 HH22 ARG 35 HH22 ARG 35 10.586 -12.762 4.389 277 H LYS 36 HN LYS 36 5.903 -12.660 2.332 278 HA LYS 36 HA LYS 36 7.779 -10.569 2.142 279 HB2 LYS 36 HB2 LYS 36 6.948 -12.432 -0.076 280 HB3 LYS 36 HB1 LYS 36 8.470 -11.558 0.058 281 HG2 LYS 36 HG2 LYS 36 9.355 -13.044 1.475 282 HG3 LYS 36 HG1 LYS 36 7.799 -13.373 2.271 283 HD2 LYS 36 HD2 LYS 36 8.513 -15.322 0.997 284 HD3 LYS 36 HD1 LYS 36 7.060 -14.585 0.284 285 HE2 LYS 36 HE2 LYS 36 8.769 -13.245 -1.171 286 HE3 LYS 36 HE1 LYS 36 9.898 -14.517 -0.688 287 HZ1 LYS 36 HZ1 LYS 36 8.880 -15.098 -2.771 288 HZ2 LYS 36 HZ2 LYS 36 7.333 -14.933 -2.116 289 HZ3 LYS 36 HZ3 LYS 36 8.348 -16.172 -1.579 290 H VAL 37 HN VAL 37 5.065 -11.431 0.026 291 HA VAL 37 HA VAL 37 5.548 -9.499 -1.880 292 HB VAL 37 HB VAL 37 3.274 -9.746 -2.684 293 HG11 VAL 37 HG11 VAL 37 3.179 -12.271 -2.794 294 HG12 VAL 37 HG12 VAL 37 4.587 -12.279 -1.726 295 HG13 VAL 37 HG13 VAL 37 4.691 -11.527 -3.320 296 HG21 VAL 37 HG21 VAL 37 1.968 -9.645 -0.719 297 HG22 VAL 37 HG22 VAL 37 2.772 -11.051 -0.027 298 HG23 VAL 37 HG23 VAL 37 1.696 -11.245 -1.412 299 H ILE 38 HN ILE 38 3.769 -9.224 1.155 300 HA ILE 38 HA ILE 38 2.857 -6.608 0.372 301 HB ILE 38 HB ILE 38 1.705 -8.444 2.009 302 HG12 ILE 38 HG12 ILE 38 1.246 -5.482 2.207 303 HG13 ILE 38 HG11 ILE 38 0.831 -6.393 0.762 304 HG21 ILE 38 HG21 ILE 38 1.683 -7.567 4.268 305 HG22 ILE 38 HG22 ILE 38 2.775 -6.263 3.800 306 HG23 ILE 38 HG23 ILE 38 3.350 -7.932 3.806 307 HD11 ILE 38 HD11 ILE 38 -0.396 -6.355 3.445 308 HD12 ILE 38 HD12 ILE 38 -0.512 -7.829 2.477 309 HD13 ILE 38 HD13 ILE 38 -1.147 -6.308 1.859 310 H VAL 39 HN VAL 39 5.379 -7.926 2.458 311 HA VAL 39 HA VAL 39 5.999 -5.365 3.515 312 HB VAL 39 HB VAL 39 7.990 -6.229 4.373 313 HG11 VAL 39 HG11 VAL 39 7.336 -8.421 5.328 314 HG12 VAL 39 HG12 VAL 39 5.960 -8.432 4.228 315 HG13 VAL 39 HG13 VAL 39 6.096 -7.168 5.451 316 HG21 VAL 39 HG21 VAL 39 7.853 -8.516 2.414 317 HG22 VAL 39 HG22 VAL 39 9.051 -8.326 3.695 318 HG23 VAL 39 HG23 VAL 39 8.991 -7.171 2.365 319 H GLU 40 HN GLU 40 7.339 -7.251 0.829 320 HA GLU 40 HA GLU 40 9.007 -5.294 -0.221 321 HB2 GLU 40 HB2 GLU 40 7.656 -7.698 -1.394 322 HB3 GLU 40 HB1 GLU 40 8.809 -6.729 -2.290 323 HG2 GLU 40 HG2 GLU 40 10.540 -7.215 -0.773 324 HG3 GLU 40 HG1 GLU 40 9.442 -7.901 0.387 325 H LEU 41 HN LEU 41 5.585 -5.678 -0.453 326 HA LEU 41 HA LEU 41 5.343 -3.854 -2.690 327 HB2 LEU 41 HB2 LEU 41 3.694 -5.778 -1.564 328 HB3 LEU 41 HB1 LEU 41 2.917 -4.264 -1.148 329 HG LEU 41 HG LEU 41 1.923 -4.874 -3.158 330 HD11 LEU 41 HD11 LEU 41 2.805 -2.561 -3.087 331 HD12 LEU 41 HD12 LEU 41 2.518 -3.208 -4.695 332 HD13 LEU 41 HD13 LEU 41 4.159 -3.115 -4.064 333 HD21 LEU 41 HD21 LEU 41 3.396 -6.693 -3.758 334 HD22 LEU 41 HD22 LEU 41 4.658 -5.547 -4.211 335 HD23 LEU 41 HD23 LEU 41 3.158 -5.618 -5.136 336 H MET 42 HN MET 42 4.315 -3.778 0.724 337 HA MET 42 HA MET 42 3.428 -1.096 0.701 338 HB2 MET 42 HB2 MET 42 4.344 -2.807 3.008 339 HB3 MET 42 HB1 MET 42 3.473 -1.277 3.177 340 HG2 MET 42 HG2 MET 42 2.510 -3.864 1.991 341 HG3 MET 42 HG1 MET 42 1.912 -3.023 3.412 342 HE1 MET 42 HE1 MET 42 -1.050 -2.879 0.870 343 HE2 MET 42 HE2 MET 42 -0.539 -3.393 2.481 344 HE3 MET 42 HE3 MET 42 0.131 -4.178 1.047 345 H ALA 43 HN ALA 43 6.479 -2.589 1.046 346 HA ALA 43 HA ALA 43 8.130 -0.691 2.063 347 HB1 ALA 43 HB1 ALA 43 8.465 -2.441 -0.363 348 HB2 ALA 43 HB2 ALA 43 8.985 -2.768 1.291 349 HB3 ALA 43 HB3 ALA 43 9.774 -1.497 0.352 350 H TYR 44 HN TYR 44 6.294 -0.619 -0.924 351 HA TYR 44 HA TYR 44 7.469 2.001 -1.628 352 HB2 TYR 44 HB2 TYR 44 7.521 0.456 -3.508 353 HB3 TYR 44 HB1 TYR 44 5.837 0.049 -3.245 354 HD1 TYR 44 HD1 TYR 44 8.129 2.225 -4.919 355 HD2 TYR 44 HD2 TYR 44 4.071 1.833 -3.768 356 HE1 TYR 44 HE1 TYR 44 7.499 3.880 -6.615 357 HE2 TYR 44 HE2 TYR 44 3.425 3.491 -5.457 358 HH TYR 44 HH TYR 44 4.540 5.401 -6.687 359 H GLU 45 HN GLU 45 4.352 0.348 -1.936 360 HA GLU 45 HA GLU 45 2.732 2.464 -2.209 361 HB2 GLU 45 HB2 GLU 45 1.844 0.211 -0.501 362 HB3 GLU 45 HB1 GLU 45 0.948 1.069 -1.748 363 HG2 GLU 45 HG2 GLU 45 3.190 -0.851 -2.130 364 HG3 GLU 45 HG1 GLU 45 1.502 -1.172 -2.459 365 H ASN 46 HN ASN 46 4.100 1.320 0.828 366 HA ASN 46 HA ASN 46 2.370 3.153 2.296 367 HB2 ASN 46 HB2 ASN 46 3.760 0.593 2.956 368 HB3 ASN 46 HB1 ASN 46 3.490 1.760 4.240 369 HD21 ASN 46 HD21 ASN 46 1.975 0.492 5.354 370 HD22 ASN 46 HD22 ASN 46 0.412 0.183 4.717 371 H ALA 47 HN ALA 47 5.589 2.647 1.235 372 HA ALA 47 HA ALA 47 7.113 3.807 3.265 373 HB1 ALA 47 HB1 ALA 47 8.791 4.266 1.551 374 HB2 ALA 47 HB2 ALA 47 7.606 3.888 0.303 375 HB3 ALA 47 HB3 ALA 47 8.139 2.631 1.421 376 H ASN 48 HN ASN 48 8.455 5.813 2.799 377 HA ASN 48 HA ASN 48 6.883 8.105 2.988 378 HB2 ASN 48 HB2 ASN 48 9.760 7.492 2.617 379 HB3 ASN 48 HB1 ASN 48 9.251 9.096 2.085 380 HD21 ASN 48 HD21 ASN 48 10.808 7.934 4.485 381 HD22 ASN 48 HD22 ASN 48 10.074 8.739 5.835 382 HA PRO 49 HA PRO 49 5.344 8.708 -1.061 383 HB2 PRO 49 HB2 PRO 49 5.406 11.501 -1.029 384 HB3 PRO 49 HB1 PRO 49 4.081 10.491 -0.450 385 HG2 PRO 49 HG2 PRO 49 6.247 11.846 1.073 386 HG3 PRO 49 HG1 PRO 49 4.564 11.542 1.535 387 HD2 PRO 49 HD2 PRO 49 6.612 10.098 2.537 388 HD3 PRO 49 HD1 PRO 49 5.014 9.382 2.225 389 H GLU 50 HN GLU 50 8.266 10.163 -0.016 390 HA GLU 50 HA GLU 50 9.310 10.711 -2.627 391 HB2 GLU 50 HB2 GLU 50 10.159 12.209 -1.111 392 HB3 GLU 50 HB1 GLU 50 10.200 11.042 0.199 393 HG2 GLU 50 HG2 GLU 50 12.391 11.123 -0.192 394 HG3 GLU 50 HG1 GLU 50 11.990 9.972 -1.429 395 H CYS 51 HN CYS 51 9.571 8.258 -0.103 396 HA CYS 51 HA CYS 51 11.937 7.118 -1.128 397 HB2 CYS 51 HB2 CYS 51 11.455 6.998 1.204 398 HB3 CYS 51 HB1 CYS 51 9.950 6.137 0.921 399 HG CYS 51 HG CYS 51 11.676 4.176 -0.594 400 H GLN 52 HN GLN 52 8.537 6.462 -1.289 401 HA GLN 52 HA GLN 52 8.832 3.998 -2.701 402 HB2 GLN 52 HB2 GLN 52 6.482 4.170 -3.198 403 HB3 GLN 52 HB1 GLN 52 6.732 4.606 -1.516 404 HG2 GLN 52 HG2 GLN 52 6.612 6.997 -2.182 405 HG3 GLN 52 HG1 GLN 52 6.213 6.471 -3.820 406 HE21 GLN 52 HE21 GLN 52 4.800 4.146 -2.737 407 HE22 GLN 52 HE22 GLN 52 3.289 4.712 -2.161 408 H SER 53 HN SER 53 8.725 7.307 -3.297 409 HA SER 53 HA SER 53 8.712 7.206 -6.121 410 HB2 SER 53 HB2 SER 53 9.296 9.268 -4.042 411 HB3 SER 53 HB1 SER 53 9.485 9.622 -5.766 412 HG SER 53 HG SER 53 7.244 9.542 -4.296 413 H ALA 54 HN ALA 54 11.145 6.866 -3.644 414 HA ALA 54 HA ALA 54 13.274 6.841 -5.586 415 HB1 ALA 54 HB1 ALA 54 13.720 7.349 -3.253 416 HB2 ALA 54 HB2 ALA 54 14.610 5.910 -3.761 417 HB3 ALA 54 HB3 ALA 54 13.142 5.747 -2.791 418 H ILE 55 HN ILE 55 10.837 4.701 -4.565 419 HA ILE 55 HA ILE 55 12.307 2.321 -5.257 420 HB ILE 55 HB ILE 55 9.638 2.793 -4.002 421 HG12 ILE 55 HG12 ILE 55 11.891 1.197 -2.892 422 HG13 ILE 55 HG11 ILE 55 12.020 2.961 -2.923 423 HG21 ILE 55 HG21 ILE 55 9.426 0.377 -3.755 424 HG22 ILE 55 HG22 ILE 55 10.882 0.150 -4.723 425 HG23 ILE 55 HG23 ILE 55 9.437 0.842 -5.457 426 HD11 ILE 55 HD11 ILE 55 9.738 1.443 -1.686 427 HD12 ILE 55 HD12 ILE 55 10.063 3.183 -1.595 428 HD13 ILE 55 HD13 ILE 55 11.156 2.036 -0.807 429 H LYS 56 HN LYS 56 9.630 4.193 -6.713 430 HA LYS 56 HA LYS 56 8.473 2.270 -8.226 431 HB2 LYS 56 HB2 LYS 56 7.838 3.846 -9.957 432 HB3 LYS 56 HB1 LYS 56 7.523 4.427 -8.339 433 HG2 LYS 56 HG2 LYS 56 10.049 5.128 -9.596 434 HG3 LYS 56 HG1 LYS 56 8.599 5.951 -10.147 435 HD2 LYS 56 HD2 LYS 56 8.222 6.186 -7.584 436 HD3 LYS 56 HD1 LYS 56 9.979 6.071 -7.569 437 HE2 LYS 56 HE2 LYS 56 9.454 8.360 -7.773 438 HE3 LYS 56 HE1 LYS 56 10.016 7.833 -9.346 439 HZ1 LYS 56 HZ1 LYS 56 8.064 9.237 -9.543 440 HZ2 LYS 56 HZ2 LYS 56 7.175 8.189 -8.558 441 HZ3 LYS 56 HZ3 LYS 56 7.714 7.669 -10.071 442 HA PRO 57 HA PRO 57 12.039 2.347 -11.623 443 HB2 PRO 57 HB2 PRO 57 14.458 2.248 -10.333 444 HB3 PRO 57 HB1 PRO 57 13.787 3.721 -11.050 445 HG2 PRO 57 HG2 PRO 57 13.569 2.745 -8.210 446 HG3 PRO 57 HG1 PRO 57 14.106 4.343 -8.787 447 HD2 PRO 57 HD2 PRO 57 11.624 4.074 -7.957 448 HD3 PRO 57 HD1 PRO 57 11.902 4.902 -9.499 449 H LEU 58 HN LEU 58 12.090 1.018 -8.371 450 HA LEU 58 HA LEU 58 13.077 -1.578 -9.326 451 HB2 LEU 58 HB2 LEU 58 12.534 -1.108 -6.463 452 HB3 LEU 58 HB1 LEU 58 13.845 -2.018 -7.200 453 HG LEU 58 HG LEU 58 13.655 0.998 -7.008 454 HD11 LEU 58 HD11 LEU 58 15.475 0.740 -5.361 455 HD12 LEU 58 HD12 LEU 58 15.253 -1.009 -5.437 456 HD13 LEU 58 HD13 LEU 58 13.952 0.018 -4.835 457 HD21 LEU 58 HD21 LEU 58 14.922 0.293 -8.959 458 HD22 LEU 58 HD22 LEU 58 15.912 -0.767 -7.953 459 HD23 LEU 58 HD23 LEU 58 15.989 0.983 -7.737 460 H LYS 59 HN LYS 59 10.381 0.171 -8.366 461 HA LYS 59 HA LYS 59 8.739 -1.623 -7.093 462 HB2 LYS 59 HB2 LYS 59 8.093 0.665 -7.395 463 HB3 LYS 59 HB1 LYS 59 8.062 0.478 -9.139 464 HG2 LYS 59 HG2 LYS 59 5.844 0.323 -8.757 465 HG3 LYS 59 HG1 LYS 59 6.273 -1.360 -8.495 466 HD2 LYS 59 HD2 LYS 59 5.965 0.722 -6.364 467 HD3 LYS 59 HD1 LYS 59 4.794 -0.553 -6.727 468 HE2 LYS 59 HE2 LYS 59 7.032 -2.022 -6.365 469 HE3 LYS 59 HE1 LYS 59 7.371 -0.672 -5.280 470 HZ1 LYS 59 HZ1 LYS 59 4.997 -1.095 -4.440 471 HZ2 LYS 59 HZ2 LYS 59 6.220 -2.178 -3.968 472 HZ3 LYS 59 HZ3 LYS 59 5.149 -2.601 -5.209 473 H GLY 60 HN GLY 60 8.351 -3.646 -7.616 474 HA2 GLY 60 HA3 GLY 60 7.267 -5.304 -8.894 475 HA3 GLY 60 HA2 GLY 60 7.416 -4.278 -10.313 476 H LYS 61 HN LYS 61 10.328 -3.811 -9.502 477 HA LYS 61 HA LYS 61 11.318 -6.252 -10.798 478 HB2 LYS 61 HB2 LYS 61 12.991 -3.808 -10.451 479 HB3 LYS 61 HB1 LYS 61 12.957 -4.958 -11.777 480 HG2 LYS 61 HG2 LYS 61 10.839 -2.913 -11.219 481 HG3 LYS 61 HG1 LYS 61 12.121 -2.738 -12.404 482 HD2 LYS 61 HD2 LYS 61 10.025 -4.906 -12.410 483 HD3 LYS 61 HD1 LYS 61 9.989 -3.456 -13.416 484 HE2 LYS 61 HE2 LYS 61 12.052 -4.129 -14.493 485 HE3 LYS 61 HE1 LYS 61 12.157 -5.545 -13.450 486 HZ1 LYS 61 HZ1 LYS 61 10.021 -5.011 -15.441 487 HZ2 LYS 61 HZ2 LYS 61 10.090 -6.356 -14.422 488 HZ3 LYS 61 HZ3 LYS 61 11.273 -6.136 -15.606 489 H VAL 62 HN VAL 62 12.051 -7.662 -9.359 490 HA VAL 62 HA VAL 62 14.005 -6.679 -7.390 491 HB VAL 62 HB VAL 62 12.064 -7.601 -6.233 492 HG11 VAL 62 HG11 VAL 62 12.552 -10.134 -7.785 493 HG12 VAL 62 HG12 VAL 62 11.167 -9.054 -7.945 494 HG13 VAL 62 HG13 VAL 62 11.416 -9.955 -6.447 495 HG21 VAL 62 HG21 VAL 62 13.158 -9.425 -4.938 496 HG22 VAL 62 HG22 VAL 62 14.145 -7.979 -5.130 497 HG23 VAL 62 HG23 VAL 62 14.474 -9.405 -6.115 498 HA PRO 63 HA PRO 63 17.092 -9.479 -9.333 499 HB2 PRO 63 HB2 PRO 63 17.434 -10.150 -6.447 500 HB3 PRO 63 HB1 PRO 63 18.661 -9.899 -7.671 501 HG2 PRO 63 HG2 PRO 63 18.133 -7.987 -5.909 502 HG3 PRO 63 HG1 PRO 63 18.435 -7.579 -7.606 503 HD2 PRO 63 HD2 PRO 63 15.877 -7.602 -6.097 504 HD3 PRO 63 HD1 PRO 63 16.372 -6.589 -7.466 505 H ALA 64 HN ALA 64 16.960 -11.619 -9.885 506 HA ALA 64 HA ALA 64 14.461 -12.826 -9.592 507 HB1 ALA 64 HB1 ALA 64 17.023 -14.103 -10.520 508 HB2 ALA 64 HB2 ALA 64 15.920 -13.163 -11.523 509 HB3 ALA 64 HB3 ALA 64 15.390 -14.693 -10.825 510 H GLY 65 HN GLY 65 13.800 -13.360 -7.587 511 HA2 GLY 65 HA3 GLY 65 13.451 -15.138 -6.086 512 HA3 GLY 65 HA2 GLY 65 15.070 -15.722 -6.435 513 H SER 66 HN SER 66 15.457 -12.499 -5.959 514 HA SER 66 HA SER 66 16.359 -12.977 -3.207 515 HB2 SER 66 HB2 SER 66 16.847 -10.514 -4.843 516 HB3 SER 66 HB1 SER 66 17.834 -11.193 -3.548 517 HG SER 66 HG SER 66 17.739 -13.088 -5.297 518 H ASP 67 HN ASP 67 16.506 -10.209 -2.685 519 HA ASP 67 HA ASP 67 13.898 -9.949 -1.416 520 HB2 ASP 67 HB2 ASP 67 15.391 -8.237 -0.070 521 HB3 ASP 67 HB1 ASP 67 15.548 -9.956 0.206 522 H VAL 68 HN VAL 68 12.475 -8.361 -2.183 523 HA VAL 68 HA VAL 68 13.665 -6.326 -3.872 524 HB VAL 68 HB VAL 68 11.656 -5.801 -4.655 525 HG11 VAL 68 HG11 VAL 68 11.491 -8.246 -4.553 526 HG12 VAL 68 HG12 VAL 68 9.928 -7.436 -4.514 527 HG13 VAL 68 HG13 VAL 68 10.615 -8.097 -3.031 528 HG21 VAL 68 HG21 VAL 68 11.123 -4.403 -2.792 529 HG22 VAL 68 HG22 VAL 68 10.600 -5.794 -1.840 530 HG23 VAL 68 HG23 VAL 68 9.685 -5.309 -3.270 531 H ILE 69 HN ILE 69 12.722 -6.733 -0.608 532 HA ILE 69 HA ILE 69 12.497 -4.077 0.182 533 HB ILE 69 HB ILE 69 13.354 -6.519 1.707 534 HG12 ILE 69 HG12 ILE 69 11.075 -6.682 1.137 535 HG13 ILE 69 HG11 ILE 69 11.071 -6.056 2.774 536 HG21 ILE 69 HG21 ILE 69 12.969 -5.140 3.778 537 HG22 ILE 69 HG22 ILE 69 12.938 -3.708 2.743 538 HG23 ILE 69 HG23 ILE 69 14.398 -4.692 2.843 539 HD11 ILE 69 HD11 ILE 69 9.445 -4.883 1.499 540 HD12 ILE 69 HD12 ILE 69 10.643 -4.496 0.255 541 HD13 ILE 69 HD13 ILE 69 10.779 -3.781 1.860 542 H SER 70 HN SER 70 15.270 -6.188 0.168 543 HA SER 70 HA SER 70 17.184 -4.537 1.225 544 HB2 SER 70 HB2 SER 70 17.583 -6.880 0.699 545 HB3 SER 70 HB1 SER 70 17.441 -6.556 -1.023 546 HG SER 70 HG SER 70 19.562 -6.175 0.675 547 H GLU 71 HN GLU 71 15.792 -4.445 -1.983 548 HA GLU 71 HA GLU 71 17.636 -2.517 -3.036 549 HB2 GLU 71 HB2 GLU 71 15.025 -3.427 -4.207 550 HB3 GLU 71 HB1 GLU 71 16.441 -2.814 -5.056 551 HG2 GLU 71 HG2 GLU 71 16.777 -5.245 -3.427 552 HG3 GLU 71 HG1 GLU 71 15.855 -5.388 -4.914 553 H TYR 72 HN TYR 72 14.467 -2.688 -1.690 554 HA TYR 72 HA TYR 72 13.642 -0.098 -2.561 555 HB2 TYR 72 HB2 TYR 72 12.522 -2.186 -0.713 556 HB3 TYR 72 HB1 TYR 72 11.794 -0.585 -0.811 557 HD1 TYR 72 HD1 TYR 72 13.276 -2.011 -3.810 558 HD2 TYR 72 HD2 TYR 72 9.695 -1.611 -1.568 559 HE1 TYR 72 HE1 TYR 72 11.982 -2.753 -5.748 560 HE2 TYR 72 HE2 TYR 72 8.385 -2.365 -3.503 561 HH TYR 72 HH TYR 72 9.892 -3.708 -6.309 562 H VAL 73 HN VAL 73 14.997 -1.523 0.338 563 HA VAL 73 HA VAL 73 14.925 0.816 1.918 564 HB VAL 73 HB VAL 73 16.304 -0.174 3.484 565 HG11 VAL 73 HG11 VAL 73 15.660 -2.510 3.745 566 HG12 VAL 73 HG12 VAL 73 15.045 -2.508 2.093 567 HG13 VAL 73 HG13 VAL 73 14.301 -1.478 3.310 568 HG21 VAL 73 HG21 VAL 73 17.449 -2.231 1.648 569 HG22 VAL 73 HG22 VAL 73 18.066 -1.638 3.200 570 HG23 VAL 73 HG23 VAL 73 18.147 -0.615 1.761 571 H LYS 74 HN LYS 74 17.092 -0.594 -0.378 572 HA LYS 74 HA LYS 74 19.207 1.271 -0.236 573 HB2 LYS 74 HB2 LYS 74 19.585 -0.839 -1.088 574 HB3 LYS 74 HB1 LYS 74 18.220 -0.771 -2.193 575 HG2 LYS 74 HG2 LYS 74 19.444 0.923 -3.505 576 HG3 LYS 74 HG1 LYS 74 20.825 0.720 -2.419 577 HD2 LYS 74 HD2 LYS 74 19.611 -1.265 -4.318 578 HD3 LYS 74 HD1 LYS 74 21.291 -0.716 -4.222 579 HE2 LYS 74 HE2 LYS 74 21.625 -1.867 -2.163 580 HE3 LYS 74 HE1 LYS 74 19.896 -2.213 -2.024 581 HZ1 LYS 74 HZ1 LYS 74 21.695 -3.293 -4.137 582 HZ2 LYS 74 HZ2 LYS 74 20.068 -3.705 -3.911 583 HZ3 LYS 74 HZ3 LYS 74 21.224 -4.138 -2.754 584 H ALA 75 HN ALA 75 16.185 1.144 -1.965 585 HA ALA 75 HA ALA 75 16.578 3.327 -3.696 586 HB1 ALA 75 HB1 ALA 75 14.091 2.371 -2.283 587 HB2 ALA 75 HB2 ALA 75 14.637 1.909 -3.894 588 HB3 ALA 75 HB3 ALA 75 14.106 3.562 -3.586 589 H CYS 76 HN CYS 76 15.440 3.106 -0.373 590 HA CYS 76 HA CYS 76 15.502 5.976 -0.049 591 HB2 CYS 76 HB2 CYS 76 13.743 4.869 1.063 592 HB3 CYS 76 HB1 CYS 76 14.819 3.698 1.784 593 HG CYS 76 HG CYS 76 16.088 5.803 3.355 594 H ASP 77 HN ASP 77 17.889 3.604 -0.051 595 HA ASP 77 HA ASP 77 19.635 4.808 1.826 596 HB2 ASP 77 HB2 ASP 77 20.201 2.697 0.779 597 HB3 ASP 77 HB1 ASP 77 20.209 3.432 -0.817 598 H GLY 78 HN GLY 78 17.963 6.233 -0.568 599 HA2 GLY 78 HA3 GLY 78 19.980 8.358 -0.892 600 HA3 GLY 78 HA2 GLY 78 18.808 7.952 -2.133 601 H ILE 79 HN ILE 79 16.941 7.593 0.487 602 HA ILE 79 HA ILE 79 15.635 10.080 0.126 603 HB ILE 79 HB ILE 79 15.242 8.177 2.395 604 HG12 ILE 79 HG12 ILE 79 14.312 6.826 0.926 605 HG13 ILE 79 HG11 ILE 79 13.030 7.994 0.921 606 HG21 ILE 79 HG21 ILE 79 13.131 9.280 2.775 607 HG22 ILE 79 HG22 ILE 79 13.411 10.335 1.389 608 HG23 ILE 79 HG23 ILE 79 14.432 10.473 2.826 609 HD11 ILE 79 HD11 ILE 79 13.873 7.141 -1.264 610 HD12 ILE 79 HD12 ILE 79 15.255 8.211 -0.977 611 HD13 ILE 79 HD13 ILE 79 13.618 8.880 -1.076 612 H GLY 80 HN GLY 80 16.600 8.890 3.328 613 HA2 GLY 80 HA3 GLY 80 17.035 10.082 5.230 614 HA3 GLY 80 HA2 GLY 80 18.384 10.658 4.272 615 H GLY 81 HN GLY 81 18.583 12.743 4.557 616 HA2 GLY 81 HA3 GLY 81 16.124 14.360 4.750 617 HA3 GLY 81 HA2 GLY 81 17.621 14.741 5.585 618 H ALA 82 HN ALA 82 19.550 14.893 3.984 619 HA ALA 82 HA ALA 82 19.159 17.290 2.635 620 HB1 ALA 82 HB1 ALA 82 21.312 16.544 3.508 621 HB2 ALA 82 HB2 ALA 82 21.423 17.031 1.817 622 HB3 ALA 82 HB3 ALA 82 21.396 15.320 2.242 623 H MET 83 HN MET 83 19.763 14.088 1.173 624 HA MET 83 HA MET 83 19.416 15.021 -1.487 625 HB2 MET 83 HB2 MET 83 19.108 12.191 -0.466 626 HB3 MET 83 HB1 MET 83 19.423 12.681 -2.125 627 HG2 MET 83 HG2 MET 83 21.594 13.574 -1.450 628 HG3 MET 83 HG1 MET 83 21.276 13.077 0.210 629 HE1 MET 83 HE1 MET 83 23.490 11.716 0.391 630 HE2 MET 83 HE2 MET 83 23.930 12.229 -1.237 631 HE3 MET 83 HE3 MET 83 24.021 10.525 -0.795 632 H HIS 84 HN HIS 84 17.289 13.552 0.873 633 HA HIS 84 HA HIS 84 15.008 13.109 -0.645 634 HB2 HIS 84 HB2 HIS 84 15.046 12.297 1.577 635 HB3 HIS 84 HB1 HIS 84 15.470 13.866 2.239 636 HD1 HIS 84 HD1 HIS 84 13.609 14.362 3.772 637 HD2 HIS 84 HD2 HIS 84 12.260 12.995 0.095 638 HE1 HIS 84 HE1 HIS 84 11.113 14.612 3.845 639 HE2 HIS 84 HE2 HIS 84 10.301 13.655 1.660 640 H LYS 85 HN LYS 85 16.248 16.156 0.677 641 HA LYS 85 HA LYS 85 13.814 17.564 0.015 642 HB2 LYS 85 HB2 LYS 85 16.502 18.744 0.727 643 HB3 LYS 85 HB1 LYS 85 14.938 19.546 0.800 644 HG2 LYS 85 HG2 LYS 85 15.834 17.234 2.508 645 HG3 LYS 85 HG1 LYS 85 15.687 18.919 3.017 646 HD2 LYS 85 HD2 LYS 85 13.305 18.846 2.728 647 HD3 LYS 85 HD1 LYS 85 13.399 17.240 1.999 648 HE2 LYS 85 HE2 LYS 85 12.687 17.013 4.282 649 HE3 LYS 85 HE1 LYS 85 14.320 16.372 4.129 650 HZ1 LYS 85 HZ1 LYS 85 13.620 19.063 5.176 651 HZ2 LYS 85 HZ2 LYS 85 15.179 18.427 5.047 652 HZ3 LYS 85 HZ3 LYS 85 14.070 17.729 6.113 653 H ALA 86 HN ALA 86 16.651 16.643 -1.609 654 HA ALA 86 HA ALA 86 16.422 18.626 -3.716 655 HB1 ALA 86 HB1 ALA 86 18.311 17.531 -4.706 656 HB2 ALA 86 HB2 ALA 86 18.115 16.126 -3.654 657 HB3 ALA 86 HB3 ALA 86 18.619 17.679 -2.975 658 H MET 87 HN MET 87 15.844 15.194 -3.215 659 HA MET 87 HA MET 87 15.021 14.773 -5.961 660 HB2 MET 87 HB2 MET 87 14.996 12.814 -3.659 661 HB3 MET 87 HB1 MET 87 14.988 12.441 -5.384 662 HG2 MET 87 HG2 MET 87 17.241 13.762 -5.370 663 HG3 MET 87 HG1 MET 87 17.214 13.390 -3.653 664 HE1 MET 87 HE1 MET 87 17.130 9.475 -3.655 665 HE2 MET 87 HE2 MET 87 15.740 10.563 -3.640 666 HE3 MET 87 HE3 MET 87 17.160 10.931 -2.661 667 H LEU 88 HN LEU 88 13.566 15.594 -3.042 668 HA LEU 88 HA LEU 88 11.127 14.415 -2.976 669 HB2 LEU 88 HB2 LEU 88 12.253 16.312 -1.585 670 HB3 LEU 88 HB1 LEU 88 11.310 17.363 -2.618 671 HG LEU 88 HG LEU 88 9.336 16.808 -1.610 672 HD11 LEU 88 HD11 LEU 88 8.918 14.635 -0.489 673 HD12 LEU 88 HD12 LEU 88 10.538 14.115 -0.948 674 HD13 LEU 88 HD13 LEU 88 9.332 14.447 -2.190 675 HD21 LEU 88 HD21 LEU 88 10.758 17.701 0.094 676 HD22 LEU 88 HD22 LEU 88 11.450 16.107 0.387 677 HD23 LEU 88 HD23 LEU 88 9.763 16.425 0.803 678 H MET 89 HN MET 89 12.104 17.128 -5.047 679 HA MET 89 HA MET 89 9.465 17.394 -6.191 680 HB2 MET 89 HB2 MET 89 10.898 19.359 -5.857 681 HB3 MET 89 HB1 MET 89 12.094 18.682 -6.950 682 HG2 MET 89 HG2 MET 89 10.485 18.821 -8.788 683 HG3 MET 89 HG1 MET 89 9.298 19.516 -7.686 684 HE1 MET 89 HE1 MET 89 12.813 20.001 -9.357 685 HE2 MET 89 HE2 MET 89 13.179 20.282 -7.655 686 HE3 MET 89 HE3 MET 89 13.256 21.615 -8.806 687 H ALA 90 HN ALA 90 12.156 15.416 -6.760 688 HA ALA 90 HA ALA 90 11.667 15.228 -9.641 689 HB1 ALA 90 HB1 ALA 90 13.775 14.069 -9.760 690 HB2 ALA 90 HB2 ALA 90 13.843 13.924 -8.000 691 HB3 ALA 90 HB3 ALA 90 13.989 15.512 -8.765 692 H GLN 91 HN GLN 91 11.453 13.339 -6.710 693 HA GLN 91 HA GLN 91 10.714 10.986 -8.291 694 HB2 GLN 91 HB2 GLN 91 11.496 11.211 -5.393 695 HB3 GLN 91 HB1 GLN 91 11.196 9.717 -6.269 696 HG2 GLN 91 HG2 GLN 91 13.078 10.158 -7.714 697 HG3 GLN 91 HG1 GLN 91 13.375 11.682 -6.883 698 HE21 GLN 91 HE21 GLN 91 12.731 10.758 -4.308 699 HE22 GLN 91 HE22 GLN 91 13.980 9.694 -3.809 700 H LEU 92 HN LEU 92 9.759 12.550 -5.222 701 HA LEU 92 HA LEU 92 7.362 11.352 -4.687 702 HB2 LEU 92 HB2 LEU 92 8.681 13.346 -3.582 703 HB3 LEU 92 HB1 LEU 92 7.569 14.331 -4.499 704 HG LEU 92 HG LEU 92 7.101 12.681 -2.081 705 HD11 LEU 92 HD11 LEU 92 7.307 15.064 -1.912 706 HD12 LEU 92 HD12 LEU 92 5.648 14.589 -1.549 707 HD13 LEU 92 HD13 LEU 92 6.044 15.293 -3.118 708 HD21 LEU 92 HD21 LEU 92 4.971 13.132 -4.169 709 HD22 LEU 92 HD22 LEU 92 4.656 12.665 -2.499 710 HD23 LEU 92 HD23 LEU 92 5.551 11.581 -3.563 711 H GLU 93 HN GLU 93 8.214 13.587 -7.142 712 HA GLU 93 HA GLU 93 6.344 15.221 -7.864 713 HB2 GLU 93 HB2 GLU 93 6.827 14.769 -10.270 714 HB3 GLU 93 HB1 GLU 93 8.262 14.936 -9.260 715 HG2 GLU 93 HG2 GLU 93 8.779 12.692 -9.404 716 HG3 GLU 93 HG1 GLU 93 7.138 12.229 -9.851 717 H2 PRO 1 HT1 PRO 1 5.352 -3.985 -13.378 718 H3 PRO 1 HT2 PRO 1 5.803 -2.495 -13.873 719 HA PRO 1 HA PRO 1 6.538 -2.453 -11.835 720 HB2 PRO 1 HB2 PRO 1 4.502 -1.379 -10.473 721 HB3 PRO 1 HB1 PRO 1 5.253 -0.520 -11.823 722 HG2 PRO 1 HG2 PRO 1 2.629 -1.828 -11.676 723 HG3 PRO 1 HG1 PRO 1 3.211 -0.604 -12.818 724 HD2 PRO 1 HD2 PRO 1 3.048 -3.491 -13.144 725 HD3 PRO 1 HD1 PRO 1 3.441 -2.258 -14.358 726 H SER 2 HN SER 2 4.946 -2.567 -9.384 727 HA SER 2 HA SER 2 4.521 -5.311 -8.871 728 HB2 SER 2 HB2 SER 2 3.164 -2.938 -7.582 729 HB3 SER 2 HB1 SER 2 3.251 -4.561 -6.925 730 HG SER 2 HG SER 2 5.588 -4.294 -6.949 731 H PHE 3 HN PHE 3 2.220 -6.139 -8.375 732 HA PHE 3 HA PHE 3 0.602 -5.778 -10.676 733 HB2 PHE 3 HB2 PHE 3 -1.062 -6.831 -8.736 734 HB3 PHE 3 HB1 PHE 3 -0.088 -7.762 -9.871 735 HD1 PHE 3 HD1 PHE 3 -0.665 -6.775 -6.475 736 HD2 PHE 3 HD2 PHE 3 2.125 -8.646 -9.095 737 HE1 PHE 3 HE1 PHE 3 0.460 -7.817 -4.566 738 HE2 PHE 3 HE2 PHE 3 3.268 -9.664 -7.173 739 HZ PHE 3 HZ PHE 3 2.433 -9.248 -4.895 740 H ASN 4 HN ASN 4 0.368 -4.703 -7.343 741 HA ASN 4 HA ASN 4 -2.295 -3.692 -7.782 742 HB2 ASN 4 HB2 ASN 4 -2.263 -3.332 -5.360 743 HB3 ASN 4 HB1 ASN 4 -1.781 -4.974 -5.785 744 HD21 ASN 4 HD21 ASN 4 -0.544 -1.792 -4.905 745 HD22 ASN 4 HD22 ASN 4 0.935 -2.372 -4.211 746 H THR 5 HN THR 5 0.514 -2.246 -8.506 747 HA THR 5 HA THR 5 0.522 0.104 -6.927 748 HB THR 5 HB THR 5 1.693 1.012 -9.097 749 HG1 THR 5 HG1 THR 5 1.219 -0.585 -10.549 750 HG21 THR 5 HG21 THR 5 2.754 -1.126 -7.280 751 HG22 THR 5 HG22 THR 5 2.887 0.621 -7.082 752 HG23 THR 5 HG23 THR 5 3.763 -0.190 -8.381 753 H VAL 6 HN VAL 6 -1.738 -0.920 -9.182 754 HA VAL 6 HA VAL 6 -2.470 1.617 -10.248 755 HB VAL 6 HB VAL 6 -4.257 0.539 -11.287 756 HG11 VAL 6 HG11 VAL 6 -3.420 -1.612 -12.128 757 HG12 VAL 6 HG12 VAL 6 -2.189 -1.603 -10.866 758 HG13 VAL 6 HG13 VAL 6 -2.182 -0.358 -12.116 759 HG21 VAL 6 HG21 VAL 6 -5.422 -1.387 -10.536 760 HG22 VAL 6 HG22 VAL 6 -5.208 -0.337 -9.125 761 HG23 VAL 6 HG23 VAL 6 -4.170 -1.751 -9.340 762 H ARG 7 HN ARG 7 -3.846 3.129 -9.333 763 HA ARG 7 HA ARG 7 -5.549 2.258 -7.211 764 HB2 ARG 7 HB2 ARG 7 -4.573 3.830 -5.535 765 HB3 ARG 7 HB1 ARG 7 -3.718 2.351 -5.904 766 HG2 ARG 7 HG2 ARG 7 -2.637 4.247 -7.608 767 HG3 ARG 7 HG1 ARG 7 -2.809 5.033 -6.035 768 HD2 ARG 7 HD2 ARG 7 -1.654 3.173 -4.967 769 HD3 ARG 7 HD1 ARG 7 -1.486 2.367 -6.525 770 HE ARG 7 HE ARG 7 -0.263 4.638 -7.073 771 HH11 ARG 7 HH11 ARG 7 -0.012 2.642 -4.214 772 HH12 ARG 7 HH12 ARG 7 1.529 3.269 -3.756 773 HH21 ARG 7 HH21 ARG 7 1.770 5.486 -6.465 774 HH22 ARG 7 HH22 ARG 7 2.543 4.907 -5.029 775 H GLN 8 HN GLN 8 -6.832 3.787 -6.254 776 HA GLN 8 HA GLN 8 -8.429 5.230 -7.848 777 HB2 GLN 8 HB2 GLN 8 -8.111 4.771 -5.084 778 HB3 GLN 8 HB1 GLN 8 -8.362 6.504 -5.263 779 HG2 GLN 8 HG2 GLN 8 -10.385 6.043 -6.579 780 HG3 GLN 8 HG1 GLN 8 -10.144 4.319 -6.308 781 HE21 GLN 8 HE21 GLN 8 -12.391 5.909 -5.570 782 HE22 GLN 8 HE22 GLN 8 -12.524 5.807 -3.837 783 H GLY 9 HN GLY 9 -7.987 6.808 -9.176 784 HA2 GLY 9 HA3 GLY 9 -6.218 9.001 -8.407 785 HA3 GLY 9 HA2 GLY 9 -7.012 8.787 -9.964 786 H SER 10 HN SER 10 -7.800 10.916 -10.006 787 HA SER 10 HA SER 10 -9.079 12.312 -8.003 788 HB2 SER 10 HB2 SER 10 -10.289 13.459 -9.965 789 HB3 SER 10 HB1 SER 10 -8.526 13.491 -9.965 790 HG SER 10 HG SER 10 -10.022 11.491 -11.308 791 H LYS 11 HN LYS 11 -10.573 11.456 -6.744 792 HA LYS 11 HA LYS 11 -12.095 9.879 -6.061 793 HB2 LYS 11 HB2 LYS 11 -14.263 10.779 -6.097 794 HB3 LYS 11 HB1 LYS 11 -13.179 12.157 -6.158 795 HG2 LYS 11 HG2 LYS 11 -14.449 11.029 -8.636 796 HG3 LYS 11 HG1 LYS 11 -15.254 12.222 -7.620 797 HD2 LYS 11 HD2 LYS 11 -13.354 13.751 -7.957 798 HD3 LYS 11 HD1 LYS 11 -12.602 12.561 -9.018 799 HE2 LYS 11 HE2 LYS 11 -14.556 12.678 -10.503 800 HE3 LYS 11 HE1 LYS 11 -15.269 13.899 -9.453 801 HZ1 LYS 11 HZ1 LYS 11 -12.755 14.160 -11.005 802 HZ2 LYS 11 HZ2 LYS 11 -13.335 15.318 -9.920 803 HZ3 LYS 11 HZ3 LYS 11 -14.215 14.950 -11.310 804 H GLU 12 HN GLU 12 -10.842 8.581 -7.963 805 HA GLU 12 HA GLU 12 -12.319 7.607 -10.132 806 HB2 GLU 12 HB2 GLU 12 -9.909 7.299 -9.873 807 HB3 GLU 12 HB1 GLU 12 -10.157 6.301 -8.455 808 HG2 GLU 12 HG2 GLU 12 -11.281 4.621 -9.870 809 HG3 GLU 12 HG1 GLU 12 -10.936 5.627 -11.280 810 HA PRO 13 HA PRO 13 -15.533 5.168 -8.218 811 HB2 PRO 13 HB2 PRO 13 -14.980 3.195 -10.347 812 HB3 PRO 13 HB1 PRO 13 -16.498 3.989 -9.934 813 HG2 PRO 13 HG2 PRO 13 -15.086 4.638 -12.128 814 HG3 PRO 13 HG1 PRO 13 -16.040 5.818 -11.224 815 HD2 PRO 13 HD2 PRO 13 -13.101 5.451 -11.336 816 HD3 PRO 13 HD1 PRO 13 -14.046 6.923 -11.060 817 H TYR 14 HN TYR 14 -15.217 3.886 -6.510 818 HA TYR 14 HA TYR 14 -12.589 2.924 -6.149 819 HB2 TYR 14 HB2 TYR 14 -13.798 4.003 -4.341 820 HB3 TYR 14 HB1 TYR 14 -14.943 2.667 -4.304 821 HD1 TYR 14 HD1 TYR 14 -13.947 0.340 -3.947 822 HD2 TYR 14 HD2 TYR 14 -11.914 3.914 -3.018 823 HE1 TYR 14 HE1 TYR 14 -12.518 -0.907 -2.413 824 HE2 TYR 14 HE2 TYR 14 -10.462 2.711 -1.458 825 HH TYR 14 HH TYR 14 -10.195 0.743 -0.369 826 HA PRO 15 HA PRO 15 -14.693 -1.475 -5.753 827 HB2 PRO 15 HB2 PRO 15 -16.877 -1.143 -7.711 828 HB3 PRO 15 HB1 PRO 15 -16.863 -2.024 -6.186 829 HG2 PRO 15 HG2 PRO 15 -18.151 0.308 -6.472 830 HG3 PRO 15 HG1 PRO 15 -17.405 -0.175 -4.953 831 HD2 PRO 15 HD2 PRO 15 -16.509 1.828 -6.949 832 HD3 PRO 15 HD1 PRO 15 -16.271 1.790 -5.196 833 H ASP 16 HN ASP 16 -14.424 0.648 -8.329 834 HA ASP 16 HA ASP 16 -13.638 -1.348 -10.279 835 HB2 ASP 16 HB2 ASP 16 -14.303 1.547 -10.381 836 HB3 ASP 16 HB1 ASP 16 -13.178 0.944 -11.590 837 H PHE 17 HN PHE 17 -12.255 1.409 -8.534 838 HA PHE 17 HA PHE 17 -9.644 1.309 -9.475 839 HB2 PHE 17 HB2 PHE 17 -9.591 3.033 -8.001 840 HB3 PHE 17 HB1 PHE 17 -11.022 2.436 -7.172 841 HD1 PHE 17 HD1 PHE 17 -10.855 1.490 -5.047 842 HD2 PHE 17 HD2 PHE 17 -7.349 2.032 -7.374 843 HE1 PHE 17 HE1 PHE 17 -9.481 0.874 -3.110 844 HE2 PHE 17 HE2 PHE 17 -5.960 1.431 -5.433 845 HZ PHE 17 HZ PHE 17 -7.028 0.850 -3.298 846 H VAL 18 HN VAL 18 -11.200 -0.489 -6.880 847 HA VAL 18 HA VAL 18 -8.833 -1.983 -6.304 848 HB VAL 18 HB VAL 18 -10.157 -1.658 -4.407 849 HG11 VAL 18 HG11 VAL 18 -12.533 -2.262 -4.285 850 HG12 VAL 18 HG12 VAL 18 -12.498 -2.693 -6.007 851 HG13 VAL 18 HG13 VAL 18 -12.231 -1.021 -5.510 852 HG21 VAL 18 HG21 VAL 18 -9.350 -3.873 -4.384 853 HG22 VAL 18 HG22 VAL 18 -10.596 -4.411 -5.518 854 HG23 VAL 18 HG23 VAL 18 -11.039 -3.950 -3.868 855 H ALA 19 HN ALA 19 -11.821 -2.593 -8.129 856 HA ALA 19 HA ALA 19 -11.460 -5.331 -8.552 857 HB1 ALA 19 HB1 ALA 19 -12.841 -5.102 -10.536 858 HB2 ALA 19 HB2 ALA 19 -12.599 -3.354 -10.533 859 HB3 ALA 19 HB3 ALA 19 -13.496 -4.122 -9.223 860 H ARG 20 HN ARG 20 -9.833 -2.610 -10.120 861 HA ARG 20 HA ARG 20 -8.539 -4.427 -11.974 862 HB2 ARG 20 HB2 ARG 20 -7.285 -2.455 -12.758 863 HB3 ARG 20 HB1 ARG 20 -9.019 -2.207 -12.826 864 HG2 ARG 20 HG2 ARG 20 -8.996 -0.636 -11.148 865 HG3 ARG 20 HG1 ARG 20 -7.490 -1.246 -10.454 866 HD2 ARG 20 HD2 ARG 20 -6.206 -0.331 -12.221 867 HD3 ARG 20 HD1 ARG 20 -7.637 0.029 -13.166 868 HE ARG 20 HE ARG 20 -8.065 1.573 -11.054 869 HH11 ARG 20 HH11 ARG 20 -5.148 1.049 -12.923 870 HH12 ARG 20 HH12 ARG 20 -4.512 2.632 -12.606 871 HH21 ARG 20 HH21 ARG 20 -7.255 3.679 -10.682 872 HH22 ARG 20 HH22 ARG 20 -5.696 4.114 -11.321 873 H LEU 21 HN LEU 21 -8.085 -2.922 -8.936 874 HA LEU 21 HA LEU 21 -5.385 -3.384 -8.471 875 HB2 LEU 21 HB2 LEU 21 -7.242 -2.191 -7.074 876 HB3 LEU 21 HB1 LEU 21 -7.510 -3.769 -6.379 877 HG LEU 21 HG LEU 21 -5.468 -3.758 -5.251 878 HD11 LEU 21 HD11 LEU 21 -3.734 -1.998 -5.645 879 HD12 LEU 21 HD12 LEU 21 -4.658 -1.502 -7.067 880 HD13 LEU 21 HD13 LEU 21 -3.959 -3.120 -6.990 881 HD21 LEU 21 HD21 LEU 21 -5.424 -1.575 -4.098 882 HD22 LEU 21 HD22 LEU 21 -7.035 -2.280 -4.228 883 HD23 LEU 21 HD23 LEU 21 -6.556 -0.965 -5.301 884 H GLN 22 HN GLN 22 -8.231 -5.404 -7.931 885 HA GLN 22 HA GLN 22 -6.872 -7.725 -7.109 886 HB2 GLN 22 HB2 GLN 22 -9.524 -7.777 -8.485 887 HB3 GLN 22 HB1 GLN 22 -8.922 -8.784 -7.165 888 HG2 GLN 22 HG2 GLN 22 -9.054 -6.815 -5.716 889 HG3 GLN 22 HG1 GLN 22 -9.751 -5.911 -7.045 890 HE21 GLN 22 HE21 GLN 22 -10.847 -6.408 -4.536 891 HE22 GLN 22 HE22 GLN 22 -12.321 -7.287 -4.741 892 H ASP 23 HN ASP 23 -8.296 -6.711 -10.134 893 HA ASP 23 HA ASP 23 -7.943 -8.939 -11.682 894 HB2 ASP 23 HB2 ASP 23 -8.900 -6.695 -12.360 895 HB3 ASP 23 HB1 ASP 23 -7.232 -6.194 -12.639 896 H VAL 24 HN VAL 24 -5.513 -6.378 -11.207 897 HA VAL 24 HA VAL 24 -3.658 -7.834 -12.847 898 HB VAL 24 HB VAL 24 -3.622 -5.405 -12.972 899 HG11 VAL 24 HG11 VAL 24 -4.399 -4.899 -10.743 900 HG12 VAL 24 HG12 VAL 24 -2.882 -4.057 -11.058 901 HG13 VAL 24 HG13 VAL 24 -2.895 -5.509 -10.057 902 HG21 VAL 24 HG21 VAL 24 -1.201 -4.989 -12.519 903 HG22 VAL 24 HG22 VAL 24 -1.510 -6.482 -13.408 904 HG23 VAL 24 HG23 VAL 24 -1.143 -6.546 -11.685 905 H ALA 25 HN ALA 25 -4.404 -7.496 -9.493 906 HA ALA 25 HA ALA 25 -1.953 -8.535 -8.471 907 HB1 ALA 25 HB1 ALA 25 -4.733 -8.622 -7.273 908 HB2 ALA 25 HB2 ALA 25 -3.538 -7.354 -7.003 909 HB3 ALA 25 HB3 ALA 25 -3.237 -8.988 -6.416 910 H GLN 26 HN GLN 26 -4.803 -9.685 -9.910 911 HA GLN 26 HA GLN 26 -4.488 -12.435 -9.170 912 HB2 GLN 26 HB2 GLN 26 -6.664 -12.245 -9.596 913 HB3 GLN 26 HB1 GLN 26 -6.405 -10.694 -10.375 914 HG2 GLN 26 HG2 GLN 26 -7.304 -11.804 -12.102 915 HG3 GLN 26 HG1 GLN 26 -5.622 -12.249 -12.365 916 HE21 GLN 26 HE21 GLN 26 -5.563 -14.006 -10.057 917 HE22 GLN 26 HE22 GLN 26 -6.417 -15.428 -10.501 918 H LYS 27 HN LYS 27 -3.839 -10.392 -11.913 919 HA LYS 27 HA LYS 27 -2.990 -12.362 -13.743 920 HB2 LYS 27 HB2 LYS 27 -2.065 -9.491 -13.521 921 HB3 LYS 27 HB1 LYS 27 -1.964 -10.514 -14.958 922 HG2 LYS 27 HG2 LYS 27 -4.470 -9.521 -13.626 923 HG3 LYS 27 HG1 LYS 27 -3.808 -8.981 -15.168 924 HD2 LYS 27 HD2 LYS 27 -4.430 -10.919 -16.256 925 HD3 LYS 27 HD1 LYS 27 -4.466 -11.867 -14.770 926 HE2 LYS 27 HE2 LYS 27 -6.493 -10.920 -14.083 927 HE3 LYS 27 HE1 LYS 27 -6.374 -9.617 -15.261 928 HZ1 LYS 27 HZ1 LYS 27 -7.991 -11.276 -15.941 929 HZ2 LYS 27 HZ2 LYS 27 -6.812 -12.488 -15.883 930 HZ3 LYS 27 HZ3 LYS 27 -6.694 -11.247 -17.025 931 H SER 28 HN SER 28 -1.360 -10.765 -11.104 932 HA SER 28 HA SER 28 1.216 -11.746 -12.096 933 HB2 SER 28 HB2 SER 28 0.641 -9.620 -10.041 934 HB3 SER 28 HB1 SER 28 2.215 -9.992 -10.751 935 HG SER 28 HG SER 28 -0.047 -8.777 -11.932 936 H ILE 29 HN ILE 29 -1.176 -12.380 -9.864 937 HA ILE 29 HA ILE 29 0.724 -13.728 -8.056 938 HB ILE 29 HB ILE 29 -1.992 -12.574 -7.453 939 HG12 ILE 29 HG12 ILE 29 0.715 -11.876 -6.313 940 HG13 ILE 29 HG11 ILE 29 -0.149 -10.938 -7.539 941 HG21 ILE 29 HG21 ILE 29 -0.202 -14.171 -5.644 942 HG22 ILE 29 HG22 ILE 29 -1.801 -14.623 -6.240 943 HG23 ILE 29 HG23 ILE 29 -1.627 -13.260 -5.133 944 HD11 ILE 29 HD11 ILE 29 -0.377 -10.078 -5.217 945 HD12 ILE 29 HD12 ILE 29 -1.263 -11.559 -4.821 946 HD13 ILE 29 HD13 ILE 29 -1.901 -10.438 -6.031 947 H ALA 30 HN ALA 30 0.573 -15.879 -7.930 948 HA ALA 30 HA ALA 30 -1.659 -17.248 -9.230 949 HB1 ALA 30 HB1 ALA 30 0.916 -18.368 -8.123 950 HB2 ALA 30 HB2 ALA 30 0.640 -17.909 -9.804 951 HB3 ALA 30 HB3 ALA 30 -0.273 -19.240 -9.091 952 H ASP 31 HN ASP 31 -1.024 -16.060 -6.284 953 HA ASP 31 HA ASP 31 -2.302 -18.273 -4.801 954 HB2 ASP 31 HB2 ASP 31 -0.079 -16.446 -4.209 955 HB3 ASP 31 HB1 ASP 31 -1.259 -16.573 -2.914 956 H GLU 32 HN GLU 32 -4.401 -17.872 -4.557 957 HA GLU 32 HA GLU 32 -5.717 -15.433 -4.745 958 HB2 GLU 32 HB2 GLU 32 -7.578 -16.500 -3.591 959 HB3 GLU 32 HB1 GLU 32 -6.853 -17.635 -4.719 960 HG2 GLU 32 HG2 GLU 32 -6.945 -19.046 -2.994 961 HG3 GLU 32 HG1 GLU 32 -5.482 -18.224 -2.456 962 H LYS 33 HN LYS 33 -3.981 -16.840 -2.098 963 HA LYS 33 HA LYS 33 -4.988 -15.355 0.048 964 HB2 LYS 33 HB2 LYS 33 -2.138 -16.300 -0.346 965 HB3 LYS 33 HB1 LYS 33 -2.904 -15.930 1.176 966 HG2 LYS 33 HG2 LYS 33 -3.924 -17.881 1.309 967 HG3 LYS 33 HG1 LYS 33 -4.197 -17.988 -0.427 968 HD2 LYS 33 HD2 LYS 33 -2.025 -18.744 -0.830 969 HD3 LYS 33 HD1 LYS 33 -1.460 -18.235 0.765 970 HE2 LYS 33 HE2 LYS 33 -3.483 -20.389 0.278 971 HE3 LYS 33 HE1 LYS 33 -1.767 -20.687 0.517 972 HZ1 LYS 33 HZ1 LYS 33 -3.641 -19.470 2.468 973 HZ2 LYS 33 HZ2 LYS 33 -1.968 -19.604 2.708 974 HZ3 LYS 33 HZ3 LYS 33 -2.923 -20.999 2.577 975 H ALA 34 HN ALA 34 -2.004 -14.863 -1.794 976 HA ALA 34 HA ALA 34 -1.503 -12.299 -0.734 977 HB1 ALA 34 HB1 ALA 34 0.292 -13.663 -1.627 978 HB2 ALA 34 HB2 ALA 34 0.203 -12.138 -2.510 979 HB3 ALA 34 HB3 ALA 34 -0.435 -13.615 -3.232 980 H ARG 35 HN ARG 35 -3.551 -13.458 -3.255 981 HA ARG 35 HA ARG 35 -3.614 -11.023 -4.787 982 HB2 ARG 35 HB2 ARG 35 -4.292 -13.459 -5.500 983 HB3 ARG 35 HB1 ARG 35 -5.846 -13.025 -4.807 984 HG2 ARG 35 HG2 ARG 35 -4.612 -11.174 -6.796 985 HG3 ARG 35 HG1 ARG 35 -5.333 -12.678 -7.367 986 HD2 ARG 35 HD2 ARG 35 -6.698 -10.487 -5.801 987 HD3 ARG 35 HD1 ARG 35 -6.951 -10.913 -7.503 988 HE ARG 35 HE ARG 35 -7.632 -13.191 -6.437 989 HH11 ARG 35 HH11 ARG 35 -8.344 -10.009 -5.153 990 HH12 ARG 35 HH12 ARG 35 -9.829 -10.504 -4.408 991 HH21 ARG 35 HH21 ARG 35 -9.577 -13.843 -5.443 992 HH22 ARG 35 HH22 ARG 35 -10.527 -12.683 -4.568 993 H LYS 36 HN LYS 36 -5.842 -12.628 -2.513 994 HA LYS 36 HA LYS 36 -7.700 -10.522 -2.320 995 HB2 LYS 36 HB2 LYS 36 -6.882 -12.389 -0.101 996 HB3 LYS 36 HB1 LYS 36 -8.397 -11.504 -0.237 997 HG2 LYS 36 HG2 LYS 36 -9.295 -12.985 -1.651 998 HG3 LYS 36 HG1 LYS 36 -7.742 -13.326 -2.448 999 HD2 LYS 36 HD2 LYS 36 -8.467 -15.268 -1.170 1000 HD3 LYS 36 HD1 LYS 36 -7.008 -14.542 -0.460 1001 HE2 LYS 36 HE2 LYS 36 -8.704 -13.188 0.995 1002 HE3 LYS 36 HE1 LYS 36 -9.843 -14.452 0.517 1003 HZ1 LYS 36 HZ1 LYS 36 -8.824 -15.036 2.595 1004 HZ2 LYS 36 HZ2 LYS 36 -7.276 -14.887 1.941 1005 HZ3 LYS 36 HZ3 LYS 36 -8.306 -16.117 1.406 1006 H VAL 37 HN VAL 37 -4.992 -11.403 -0.203 1007 HA VAL 37 HA VAL 37 -5.462 -9.467 1.703 1008 HB VAL 37 HB VAL 37 -3.187 -9.727 2.503 1009 HG11 VAL 37 HG11 VAL 37 -3.111 -12.253 2.616 1010 HG12 VAL 37 HG12 VAL 37 -4.519 -12.253 1.546 1011 HG13 VAL 37 HG13 VAL 37 -4.618 -11.498 3.140 1012 HG21 VAL 37 HG21 VAL 37 -1.884 -9.635 0.536 1013 HG22 VAL 37 HG22 VAL 37 -2.697 -11.036 -0.154 1014 HG23 VAL 37 HG23 VAL 37 -1.621 -11.237 1.230 1015 H ILE 38 HN ILE 38 -3.678 -9.205 -1.332 1016 HA ILE 38 HA ILE 38 -2.749 -6.594 -0.557 1017 HB ILE 38 HB ILE 38 -1.610 -8.439 -2.195 1018 HG12 ILE 38 HG12 ILE 38 -1.130 -5.479 -2.393 1019 HG13 ILE 38 HG11 ILE 38 -0.721 -6.393 -0.949 1020 HG21 ILE 38 HG21 ILE 38 -1.586 -7.565 -4.452 1021 HG22 ILE 38 HG22 ILE 38 -2.665 -6.250 -3.985 1022 HG23 ILE 38 HG23 ILE 38 -3.255 -7.914 -3.989 1023 HD11 ILE 38 HD11 ILE 38 0.503 -6.367 -3.634 1024 HD12 ILE 38 HD12 ILE 38 0.611 -7.840 -2.663 1025 HD13 ILE 38 HD13 ILE 38 1.257 -6.320 -2.050 1026 H VAL 39 HN VAL 39 -5.281 -7.895 -2.641 1027 HA VAL 39 HA VAL 39 -5.885 -5.333 -3.699 1028 HB VAL 39 HB VAL 39 -7.883 -6.180 -4.553 1029 HG11 VAL 39 HG11 VAL 39 -7.246 -8.378 -5.510 1030 HG12 VAL 39 HG12 VAL 39 -5.870 -8.400 -4.410 1031 HG13 VAL 39 HG13 VAL 39 -5.995 -7.136 -5.632 1032 HG21 VAL 39 HG21 VAL 39 -7.761 -8.469 -2.595 1033 HG22 VAL 39 HG22 VAL 39 -8.961 -8.271 -3.873 1034 HG23 VAL 39 HG23 VAL 39 -8.889 -7.115 -2.544 1035 H GLU 40 HN GLU 40 -7.239 -7.203 -1.011 1036 HA GLU 40 HA GLU 40 -8.890 -5.233 0.038 1037 HB2 GLU 40 HB2 GLU 40 -7.554 -7.645 1.214 1038 HB3 GLU 40 HB1 GLU 40 -8.701 -6.668 2.108 1039 HG2 GLU 40 HG2 GLU 40 -10.436 -7.146 0.593 1040 HG3 GLU 40 HG1 GLU 40 -9.341 -7.835 -0.568 1041 H LEU 41 HN LEU 41 -5.471 -5.642 0.270 1042 HA LEU 41 HA LEU 41 -5.211 -3.817 2.505 1043 HB2 LEU 41 HB2 LEU 41 -3.577 -5.755 1.379 1044 HB3 LEU 41 HB1 LEU 41 -2.790 -4.246 0.960 1045 HG LEU 41 HG LEU 41 -1.796 -4.861 2.968 1046 HD11 LEU 41 HD11 LEU 41 -2.665 -2.543 2.898 1047 HD12 LEU 41 HD12 LEU 41 -2.381 -3.190 4.507 1048 HD13 LEU 41 HD13 LEU 41 -4.023 -3.087 3.877 1049 HD21 LEU 41 HD21 LEU 41 -3.282 -6.669 3.575 1050 HD22 LEU 41 HD22 LEU 41 -4.533 -5.513 4.031 1051 HD23 LEU 41 HD23 LEU 41 -3.031 -5.594 4.950 1052 H MET 42 HN MET 42 -4.188 -3.752 -0.912 1053 HA MET 42 HA MET 42 -3.279 -1.077 -0.890 1054 HB2 MET 42 HB2 MET 42 -4.208 -2.783 -3.195 1055 HB3 MET 42 HB1 MET 42 -3.326 -1.260 -3.367 1056 HG2 MET 42 HG2 MET 42 -2.381 -3.852 -2.179 1057 HG3 MET 42 HG1 MET 42 -1.776 -3.016 -3.600 1058 HE1 MET 42 HE1 MET 42 1.186 -2.896 -1.060 1059 HE2 MET 42 HE2 MET 42 0.667 -3.403 -2.671 1060 HE3 MET 42 HE3 MET 42 -0.008 -4.184 -1.238 1061 H ALA 43 HN ALA 43 -6.340 -2.548 -1.231 1062 HA ALA 43 HA ALA 43 -7.979 -0.640 -2.248 1063 HB1 ALA 43 HB1 ALA 43 -8.325 -2.385 0.179 1064 HB2 ALA 43 HB2 ALA 43 -8.849 -2.709 -1.474 1065 HB3 ALA 43 HB3 ALA 43 -9.627 -1.431 -0.535 1066 H TYR 44 HN TYR 44 -6.140 -0.579 0.738 1067 HA TYR 44 HA TYR 44 -7.298 2.050 1.439 1068 HB2 TYR 44 HB2 TYR 44 -7.359 0.507 3.321 1069 HB3 TYR 44 HB1 TYR 44 -5.676 0.088 3.056 1070 HD1 TYR 44 HD1 TYR 44 -7.952 2.284 4.730 1071 HD2 TYR 44 HD2 TYR 44 -3.898 1.862 3.577 1072 HE1 TYR 44 HE1 TYR 44 -7.311 3.937 6.424 1073 HE2 TYR 44 HE2 TYR 44 -3.240 3.519 5.264 1074 HH TYR 44 HH TYR 44 -4.312 5.423 6.496 1075 H GLU 45 HN GLU 45 -4.191 0.377 1.747 1076 HA GLU 45 HA GLU 45 -2.555 2.481 2.016 1077 HB2 GLU 45 HB2 GLU 45 -1.688 0.218 0.309 1078 HB3 GLU 45 HB1 GLU 45 -0.782 1.071 1.554 1079 HG2 GLU 45 HG2 GLU 45 -3.039 -0.830 1.942 1080 HG3 GLU 45 HG1 GLU 45 -1.354 -1.164 2.269 1081 H ASN 46 HN ASN 46 -3.933 1.345 -1.017 1082 HA ASN 46 HA ASN 46 -2.191 3.161 -2.489 1083 HB2 ASN 46 HB2 ASN 46 -3.599 0.611 -3.143 1084 HB3 ASN 46 HB1 ASN 46 -3.326 1.775 -4.431 1085 HD21 ASN 46 HD21 ASN 46 -1.816 0.498 -5.547 1086 HD22 ASN 46 HD22 ASN 46 -0.256 0.178 -4.911 1087 H ALA 47 HN ALA 47 -5.410 2.689 -1.419 1088 HA ALA 47 HA ALA 47 -6.929 3.848 -3.456 1089 HB1 ALA 47 HB1 ALA 47 -8.602 4.323 -1.741 1090 HB2 ALA 47 HB2 ALA 47 -7.417 3.940 -0.494 1091 HB3 ALA 47 HB3 ALA 47 -7.959 2.684 -1.609 1092 H ASN 48 HN ASN 48 -8.262 5.867 -2.985 1093 HA ASN 48 HA ASN 48 -6.672 8.148 -3.183 1094 HB2 ASN 48 HB2 ASN 48 -9.552 7.557 -2.811 1095 HB3 ASN 48 HB1 ASN 48 -9.032 9.158 -2.277 1096 HD21 ASN 48 HD21 ASN 48 -10.594 7.999 -4.680 1097 HD22 ASN 48 HD22 ASN 48 -9.858 8.802 -6.029 1098 HA PRO 49 HA PRO 49 -5.124 8.742 0.865 1099 HB2 PRO 49 HB2 PRO 49 -5.163 11.535 0.828 1100 HB3 PRO 49 HB1 PRO 49 -3.845 10.514 0.252 1101 HG2 PRO 49 HG2 PRO 49 -5.998 11.883 -1.274 1102 HG3 PRO 49 HG1 PRO 49 -4.318 11.565 -1.737 1103 HD2 PRO 49 HD2 PRO 49 -6.377 10.135 -2.735 1104 HD3 PRO 49 HD1 PRO 49 -4.787 9.407 -2.422 1105 H GLU 50 HN GLU 50 -8.036 10.223 -0.177 1106 HA GLU 50 HA GLU 50 -9.076 10.774 2.434 1107 HB2 GLU 50 HB2 GLU 50 -9.913 12.276 0.917 1108 HB3 GLU 50 HB1 GLU 50 -9.963 11.108 -0.391 1109 HG2 GLU 50 HG2 GLU 50 -12.152 11.207 -0.002 1110 HG3 GLU 50 HG1 GLU 50 -11.760 10.052 1.235 1111 H CYS 51 HN CYS 51 -9.352 8.320 -0.088 1112 HA CYS 51 HA CYS 51 -11.729 7.198 0.939 1113 HB2 CYS 51 HB2 CYS 51 -11.249 7.073 -1.394 1114 HB3 CYS 51 HB1 CYS 51 -9.751 6.200 -1.112 1115 HG CYS 51 HG CYS 51 -11.494 4.257 0.407 1116 H GLN 52 HN GLN 52 -8.331 6.516 1.093 1117 HA GLN 52 HA GLN 52 -8.642 4.056 2.512 1118 HB2 GLN 52 HB2 GLN 52 -6.291 4.214 3.008 1119 HB3 GLN 52 HB1 GLN 52 -6.538 4.651 1.325 1120 HG2 GLN 52 HG2 GLN 52 -6.404 7.041 1.992 1121 HG3 GLN 52 HG1 GLN 52 -6.007 6.513 3.629 1122 HE21 GLN 52 HE21 GLN 52 -4.610 4.179 2.546 1123 HE22 GLN 52 HE22 GLN 52 -3.099 4.734 1.963 1124 H SER 53 HN SER 53 -8.515 7.364 3.104 1125 HA SER 53 HA SER 53 -8.499 7.269 5.929 1126 HB2 SER 53 HB2 SER 53 -9.077 9.331 3.849 1127 HB3 SER 53 HB1 SER 53 -9.257 9.689 5.573 1128 HG SER 53 HG SER 53 -7.025 9.592 4.091 1129 H ALA 54 HN ALA 54 -10.936 6.948 3.455 1130 HA ALA 54 HA ALA 54 -13.065 6.937 5.395 1131 HB1 ALA 54 HB1 ALA 54 -13.506 7.445 3.062 1132 HB2 ALA 54 HB2 ALA 54 -14.407 6.014 3.573 1133 HB3 ALA 54 HB3 ALA 54 -12.941 5.838 2.603 1134 H ILE 55 HN ILE 55 -10.645 4.777 4.380 1135 HA ILE 55 HA ILE 55 -12.131 2.407 5.072 1136 HB ILE 55 HB ILE 55 -9.459 2.861 3.817 1137 HG12 ILE 55 HG12 ILE 55 -11.724 1.280 2.705 1138 HG13 ILE 55 HG11 ILE 55 -11.840 3.046 2.736 1139 HG21 ILE 55 HG21 ILE 55 -9.265 0.443 3.569 1140 HG22 ILE 55 HG22 ILE 55 -10.722 0.226 4.539 1141 HG23 ILE 55 HG23 ILE 55 -9.270 0.908 5.270 1142 HD11 ILE 55 HD11 ILE 55 -9.569 1.510 1.497 1143 HD12 ILE 55 HD12 ILE 55 -9.883 3.253 1.407 1144 HD13 ILE 55 HD13 ILE 55 -10.984 2.113 0.620 1145 H LYS 56 HN LYS 56 -9.438 4.261 6.524 1146 HA LYS 56 HA LYS 56 -8.295 2.330 8.036 1147 HB2 LYS 56 HB2 LYS 56 -7.650 3.902 9.766 1148 HB3 LYS 56 HB1 LYS 56 -7.331 4.479 8.148 1149 HG2 LYS 56 HG2 LYS 56 -9.850 5.199 9.406 1150 HG3 LYS 56 HG1 LYS 56 -8.395 6.012 9.956 1151 HD2 LYS 56 HD2 LYS 56 -8.018 6.242 7.390 1152 HD3 LYS 56 HD1 LYS 56 -9.778 6.144 7.379 1153 HE2 LYS 56 HE2 LYS 56 -9.229 8.428 7.583 1154 HE3 LYS 56 HE1 LYS 56 -9.794 7.903 9.156 1155 HZ1 LYS 56 HZ1 LYS 56 -7.825 9.289 9.349 1156 HZ2 LYS 56 HZ2 LYS 56 -6.948 8.225 8.369 1157 HZ3 LYS 56 HZ3 LYS 56 -7.497 7.721 9.883 1158 HA PRO 57 HA PRO 57 -11.858 2.439 11.438 1159 HB2 PRO 57 HB2 PRO 57 -14.278 2.352 10.149 1160 HB3 PRO 57 HB1 PRO 57 -13.597 3.821 10.863 1161 HG2 PRO 57 HG2 PRO 57 -13.388 2.842 8.024 1162 HG3 PRO 57 HG1 PRO 57 -13.913 4.443 8.600 1163 HD2 PRO 57 HD2 PRO 57 -11.434 4.156 7.770 1164 HD3 PRO 57 HD1 PRO 57 -11.704 4.988 9.311 1165 H LEU 58 HN LEU 58 -11.922 1.104 8.187 1166 HA LEU 58 HA LEU 58 -12.927 -1.482 9.144 1167 HB2 LEU 58 HB2 LEU 58 -12.382 -1.016 6.280 1168 HB3 LEU 58 HB1 LEU 58 -13.699 -1.916 7.018 1169 HG LEU 58 HG LEU 58 -13.489 1.099 6.824 1170 HD11 LEU 58 HD11 LEU 58 -15.312 0.848 5.177 1171 HD12 LEU 58 HD12 LEU 58 -15.098 -0.901 5.256 1172 HD13 LEU 58 HD13 LEU 58 -13.792 0.118 4.653 1173 HD21 LEU 58 HD21 LEU 58 -14.758 0.402 8.777 1174 HD22 LEU 58 HD22 LEU 58 -15.755 -0.653 7.773 1175 HD23 LEU 58 HD23 LEU 58 -15.823 1.098 7.555 1176 H LYS 59 HN LYS 59 -10.219 0.246 8.176 1177 HA LYS 59 HA LYS 59 -8.590 -1.559 6.907 1178 HB2 LYS 59 HB2 LYS 59 -7.928 0.724 7.208 1179 HB3 LYS 59 HB1 LYS 59 -7.898 0.535 8.953 1180 HG2 LYS 59 HG2 LYS 59 -5.681 0.365 8.566 1181 HG3 LYS 59 HG1 LYS 59 -6.122 -1.315 8.306 1182 HD2 LYS 59 HD2 LYS 59 -5.800 0.763 6.173 1183 HD3 LYS 59 HD1 LYS 59 -4.639 -0.520 6.536 1184 HE2 LYS 59 HE2 LYS 59 -6.887 -1.973 6.177 1185 HE3 LYS 59 HE1 LYS 59 -7.217 -0.620 5.091 1186 HZ1 LYS 59 HZ1 LYS 59 -4.849 -1.063 4.248 1187 HZ2 LYS 59 HZ2 LYS 59 -6.079 -2.139 3.780 1188 HZ3 LYS 59 HZ3 LYS 59 -5.010 -2.566 5.021 1189 H GLY 60 HN GLY 60 -8.215 -3.586 7.429 1190 HA2 GLY 60 HA3 GLY 60 -7.142 -5.251 8.708 1191 HA3 GLY 60 HA2 GLY 60 -7.279 -4.219 10.125 1192 H LYS 61 HN LYS 61 -10.192 -3.736 9.316 1193 HA LYS 61 HA LYS 61 -11.196 -6.169 10.620 1194 HB2 LYS 61 HB2 LYS 61 -12.857 -3.716 10.266 1195 HB3 LYS 61 HB1 LYS 61 -12.829 -4.863 11.594 1196 HG2 LYS 61 HG2 LYS 61 -10.700 -2.830 11.035 1197 HG3 LYS 61 HG1 LYS 61 -11.982 -2.648 12.219 1198 HD2 LYS 61 HD2 LYS 61 -9.903 -4.826 12.223 1199 HD3 LYS 61 HD1 LYS 61 -9.857 -3.378 13.230 1200 HE2 LYS 61 HE2 LYS 61 -11.921 -4.040 14.314 1201 HE3 LYS 61 HE1 LYS 61 -12.038 -5.453 13.268 1202 HZ1 LYS 61 HZ1 LYS 61 -9.892 -4.941 15.254 1203 HZ2 LYS 61 HZ2 LYS 61 -9.976 -6.284 14.231 1204 HZ3 LYS 61 HZ3 LYS 61 -11.152 -6.054 15.422 1205 H VAL 62 HN VAL 62 -11.944 -7.578 9.186 1206 HA VAL 62 HA VAL 62 -13.889 -6.577 7.216 1207 HB VAL 62 HB VAL 62 -11.959 -7.515 6.057 1208 HG11 VAL 62 HG11 VAL 62 -12.462 -10.046 7.610 1209 HG12 VAL 62 HG12 VAL 62 -11.070 -8.973 7.768 1210 HG13 VAL 62 HG13 VAL 62 -11.325 -9.873 6.270 1211 HG21 VAL 62 HG21 VAL 62 -13.068 -9.333 4.764 1212 HG22 VAL 62 HG22 VAL 62 -14.041 -7.877 4.953 1213 HG23 VAL 62 HG23 VAL 62 -14.384 -9.300 5.940 1214 HA PRO 63 HA PRO 63 -16.998 -9.355 9.159 1215 HB2 PRO 63 HB2 PRO 63 -17.350 -10.024 6.272 1216 HB3 PRO 63 HB1 PRO 63 -18.573 -9.761 7.498 1217 HG2 PRO 63 HG2 PRO 63 -18.028 -7.854 5.735 1218 HG3 PRO 63 HG1 PRO 63 -18.327 -7.443 7.431 1219 HD2 PRO 63 HD2 PRO 63 -15.770 -7.488 5.921 1220 HD3 PRO 63 HD1 PRO 63 -16.256 -6.471 7.291 1221 H ALA 64 HN ALA 64 -16.886 -11.498 9.707 1222 HA ALA 64 HA ALA 64 -14.391 -12.718 9.424 1223 HB1 ALA 64 HB1 ALA 64 -16.963 -13.975 10.351 1224 HB2 ALA 64 HB2 ALA 64 -15.854 -13.042 11.356 1225 HB3 ALA 64 HB3 ALA 64 -15.335 -14.578 10.661 1226 H GLY 65 HN GLY 65 -13.729 -13.265 7.421 1227 HA2 GLY 65 HA3 GLY 65 -13.397 -15.045 5.921 1228 HA3 GLY 65 HA2 GLY 65 -15.021 -15.612 6.265 1229 H SER 66 HN SER 66 -15.396 -12.393 5.789 1230 HA SER 66 HA SER 66 -16.292 -12.868 3.035 1231 HB2 SER 66 HB2 SER 66 -16.769 -10.402 4.675 1232 HB3 SER 66 HB1 SER 66 -17.755 -11.067 3.371 1233 HG SER 66 HG SER 66 -17.661 -12.967 5.130 1234 H ASP 67 HN ASP 67 -16.421 -10.094 2.513 1235 HA ASP 67 HA ASP 67 -13.814 -9.855 1.239 1236 HB2 ASP 67 HB2 ASP 67 -15.297 -8.137 -0.111 1237 HB3 ASP 67 HB1 ASP 67 -15.473 -9.856 -0.379 1238 H VAL 68 HN VAL 68 -12.379 -8.275 2.004 1239 HA VAL 68 HA VAL 68 -13.553 -6.231 3.692 1240 HB VAL 68 HB VAL 68 -11.539 -5.720 4.475 1241 HG11 VAL 68 HG11 VAL 68 -11.392 -8.165 4.373 1242 HG12 VAL 68 HG12 VAL 68 -9.823 -7.368 4.334 1243 HG13 VAL 68 HG13 VAL 68 -10.516 -8.024 2.851 1244 HG21 VAL 68 HG21 VAL 68 -10.996 -4.326 2.611 1245 HG22 VAL 68 HG22 VAL 68 -10.485 -5.720 1.658 1246 HG23 VAL 68 HG23 VAL 68 -9.564 -5.243 3.087 1247 H ILE 69 HN ILE 69 -12.624 -6.653 0.424 1248 HA ILE 69 HA ILE 69 -12.371 -3.994 -0.359 1249 HB ILE 69 HB ILE 69 -13.244 -6.426 -1.888 1250 HG12 ILE 69 HG12 ILE 69 -10.966 -6.606 -1.319 1251 HG13 ILE 69 HG11 ILE 69 -10.959 -5.980 -2.955 1252 HG21 ILE 69 HG21 ILE 69 -12.850 -5.051 -3.958 1253 HG22 ILE 69 HG22 ILE 69 -12.810 -3.620 -2.924 1254 HG23 ILE 69 HG23 ILE 69 -14.276 -4.594 -3.024 1255 HD11 ILE 69 HD11 ILE 69 -9.324 -4.821 -1.682 1256 HD12 ILE 69 HD12 ILE 69 -10.518 -4.422 -0.438 1257 HD13 ILE 69 HD13 ILE 69 -10.648 -3.709 -2.044 1258 H SER 70 HN SER 70 -15.157 -6.085 -0.347 1259 HA SER 70 HA SER 70 -17.061 -4.421 -1.406 1260 HB2 SER 70 HB2 SER 70 -17.484 -6.758 -0.880 1261 HB3 SER 70 HB1 SER 70 -17.322 -6.438 0.841 1262 HG SER 70 HG SER 70 -19.460 -6.030 -0.836 1263 H GLU 71 HN GLU 71 -15.667 -4.339 1.804 1264 HA GLU 71 HA GLU 71 -17.496 -2.392 2.855 1265 HB2 GLU 71 HB2 GLU 71 -14.891 -3.322 4.026 1266 HB3 GLU 71 HB1 GLU 71 -16.300 -2.692 4.876 1267 HG2 GLU 71 HG2 GLU 71 -16.662 -5.129 3.257 1268 HG3 GLU 71 HG1 GLU 71 -15.741 -5.272 4.746 1269 H TYR 72 HN TYR 72 -14.325 -2.592 1.512 1270 HA TYR 72 HA TYR 72 -13.484 -0.006 2.376 1271 HB2 TYR 72 HB2 TYR 72 -12.378 -2.101 0.530 1272 HB3 TYR 72 HB1 TYR 72 -11.640 -0.506 0.627 1273 HD1 TYR 72 HD1 TYR 72 -13.131 -1.918 3.627 1274 HD2 TYR 72 HD2 TYR 72 -9.547 -1.547 1.385 1275 HE1 TYR 72 HE1 TYR 72 -11.844 -2.668 5.565 1276 HE2 TYR 72 HE2 TYR 72 -8.243 -2.310 3.323 1277 HH TYR 72 HH TYR 72 -9.757 -3.648 6.119 1278 H VAL 73 HN VAL 73 -14.854 -1.423 -0.520 1279 HA VAL 73 HA VAL 73 -14.765 0.916 -2.100 1280 HB VAL 73 HB VAL 73 -16.151 -0.064 -3.666 1281 HG11 VAL 73 HG11 VAL 73 -15.522 -2.406 -3.925 1282 HG12 VAL 73 HG12 VAL 73 -14.907 -2.406 -2.272 1283 HG13 VAL 73 HG13 VAL 73 -14.157 -1.381 -3.491 1284 HG21 VAL 73 HG21 VAL 73 -17.308 -2.111 -1.826 1285 HG22 VAL 73 HG22 VAL 73 -17.923 -1.516 -3.380 1286 HG23 VAL 73 HG23 VAL 73 -17.995 -0.490 -1.942 1287 H LYS 74 HN LYS 74 -16.940 -0.473 0.199 1288 HA LYS 74 HA LYS 74 -19.043 1.407 0.057 1289 HB2 LYS 74 HB2 LYS 74 -19.430 -0.703 0.911 1290 HB3 LYS 74 HB1 LYS 74 -18.063 -0.639 2.013 1291 HG2 LYS 74 HG2 LYS 74 -19.277 1.062 3.324 1292 HG3 LYS 74 HG1 LYS 74 -20.661 0.865 2.238 1293 HD2 LYS 74 HD2 LYS 74 -19.458 -1.121 4.138 1294 HD3 LYS 74 HD1 LYS 74 -21.135 -0.564 4.043 1295 HE2 LYS 74 HE2 LYS 74 -21.471 -1.717 1.983 1296 HE3 LYS 74 HE1 LYS 74 -19.747 -2.081 1.852 1297 HZ1 LYS 74 HZ1 LYS 74 -21.563 -3.127 3.968 1298 HZ2 LYS 74 HZ2 LYS 74 -19.937 -3.554 3.749 1299 HZ3 LYS 74 HZ3 LYS 74 -21.096 -3.988 2.592 1300 H ALA 75 HN ALA 75 -16.021 1.255 1.784 1301 HA ALA 75 HA ALA 75 -16.391 3.447 3.506 1302 HB1 ALA 75 HB1 ALA 75 -13.914 2.466 2.095 1303 HB2 ALA 75 HB2 ALA 75 -14.463 2.011 3.708 1304 HB3 ALA 75 HB3 ALA 75 -13.919 3.659 3.396 1305 H CYS 76 HN CYS 76 -15.259 3.209 0.182 1306 HA CYS 76 HA CYS 76 -15.302 6.081 -0.139 1307 HB2 CYS 76 HB2 CYS 76 -13.553 4.963 -1.257 1308 HB3 CYS 76 HB1 CYS 76 -14.637 3.801 -1.977 1309 HG CYS 76 HG CYS 76 -15.900 5.904 -3.547 1310 H ASP 77 HN ASP 77 -17.707 3.723 -0.137 1311 HA ASP 77 HA ASP 77 -19.442 4.948 -2.008 1312 HB2 ASP 77 HB2 ASP 77 -20.043 2.845 -0.970 1313 HB3 ASP 77 HB1 ASP 77 -20.033 3.573 0.631 1314 H GLY 78 HN GLY 78 -17.759 6.360 0.385 1315 HA2 GLY 78 HA3 GLY 78 -19.761 8.498 0.701 1316 HA3 GLY 78 HA2 GLY 78 -18.596 8.086 1.949 1317 H ILE 79 HN ILE 79 -16.735 7.708 -0.682 1318 HA ILE 79 HA ILE 79 -15.402 10.183 -0.311 1319 HB ILE 79 HB ILE 79 -15.026 8.279 -2.583 1320 HG12 ILE 79 HG12 ILE 79 -14.105 6.922 -1.115 1321 HG13 ILE 79 HG11 ILE 79 -12.814 8.080 -1.111 1322 HG21 ILE 79 HG21 ILE 79 -12.910 9.367 -2.966 1323 HG22 ILE 79 HG22 ILE 79 -13.180 10.426 -1.580 1324 HG23 ILE 79 HG23 ILE 79 -14.202 10.567 -3.016 1325 HD11 ILE 79 HD11 ILE 79 -13.663 7.234 1.074 1326 HD12 ILE 79 HD12 ILE 79 -15.036 8.316 0.787 1327 HD13 ILE 79 HD13 ILE 79 -13.392 8.971 0.885 1328 H GLY 80 HN GLY 80 -16.399 8.995 -3.505 1329 HA2 GLY 80 HA3 GLY 80 -16.819 10.190 -5.412 1330 HA3 GLY 80 HA2 GLY 80 -18.161 10.776 -4.453 1331 H GLY 81 HN GLY 81 -18.343 12.865 -4.743 1332 HA2 GLY 81 HA3 GLY 81 -15.869 14.459 -4.942 1333 HA3 GLY 81 HA2 GLY 81 -17.361 14.852 -5.782 1334 H ALA 82 HN ALA 82 -19.292 15.014 -4.168 1335 HA ALA 82 HA ALA 82 -18.879 17.419 -2.831 1336 HB1 ALA 82 HB1 ALA 82 -21.038 16.687 -3.702 1337 HB2 ALA 82 HB2 ALA 82 -21.146 17.172 -2.011 1338 HB3 ALA 82 HB3 ALA 82 -21.129 15.461 -2.438 1339 H MET 83 HN MET 83 -19.498 14.221 -1.365 1340 HA MET 83 HA MET 83 -19.148 15.155 1.295 1341 HB2 MET 83 HB2 MET 83 -18.863 12.319 0.279 1342 HB3 MET 83 HB1 MET 83 -19.175 12.815 1.938 1343 HG2 MET 83 HG2 MET 83 -21.335 13.723 1.258 1344 HG3 MET 83 HG1 MET 83 -21.024 13.219 -0.401 1345 HE1 MET 83 HE1 MET 83 -23.247 11.872 -0.577 1346 HE2 MET 83 HE2 MET 83 -23.685 12.389 1.050 1347 HE3 MET 83 HE3 MET 83 -23.785 10.685 0.611 1348 H HIS 84 HN HIS 84 -17.035 13.672 -1.066 1349 HA HIS 84 HA HIS 84 -14.757 13.211 0.451 1350 HB2 HIS 84 HB2 HIS 84 -14.803 12.401 -1.771 1351 HB3 HIS 84 HB1 HIS 84 -15.216 13.974 -2.432 1352 HD1 HIS 84 HD1 HIS 84 -13.354 14.454 -3.964 1353 HD2 HIS 84 HD2 HIS 84 -12.010 13.077 -0.287 1354 HE1 HIS 84 HE1 HIS 84 -10.856 14.686 -4.038 1355 HE2 HIS 84 HE2 HIS 84 -10.047 13.735 -1.849 1356 H LYS 85 HN LYS 85 -15.976 16.269 -0.865 1357 HA LYS 85 HA LYS 85 -13.529 17.659 -0.215 1358 HB2 LYS 85 HB2 LYS 85 -16.211 18.858 -0.922 1359 HB3 LYS 85 HB1 LYS 85 -14.642 19.650 -0.997 1360 HG2 LYS 85 HG2 LYS 85 -15.554 17.342 -2.702 1361 HG3 LYS 85 HG1 LYS 85 -15.395 19.024 -3.214 1362 HD2 LYS 85 HD2 LYS 85 -13.013 18.937 -2.922 1363 HD3 LYS 85 HD1 LYS 85 -13.118 17.333 -2.192 1364 HE2 LYS 85 HE2 LYS 85 -12.403 17.104 -4.477 1365 HE3 LYS 85 HE1 LYS 85 -14.042 16.468 -4.320 1366 HZ1 LYS 85 HZ1 LYS 85 -13.330 19.155 -5.369 1367 HZ2 LYS 85 HZ2 LYS 85 -14.896 18.534 -5.229 1368 HZ3 LYS 85 HZ3 LYS 85 -13.798 17.826 -6.302 1369 H ALA 86 HN ALA 86 -16.367 16.764 1.417 1370 HA ALA 86 HA ALA 86 -16.125 18.745 3.523 1371 HB1 ALA 86 HB1 ALA 86 -18.022 17.659 4.515 1372 HB2 ALA 86 HB2 ALA 86 -17.833 16.256 3.461 1373 HB3 ALA 86 HB3 ALA 86 -18.328 17.811 2.783 1374 H MET 87 HN MET 87 -15.570 15.311 3.022 1375 HA MET 87 HA MET 87 -14.753 14.881 5.768 1376 HB2 MET 87 HB2 MET 87 -14.743 12.922 3.467 1377 HB3 MET 87 HB1 MET 87 -14.739 12.548 5.192 1378 HG2 MET 87 HG2 MET 87 -16.980 13.892 5.171 1379 HG3 MET 87 HG1 MET 87 -16.955 13.512 3.457 1380 HE1 MET 87 HE1 MET 87 -16.908 9.596 3.476 1381 HE2 MET 87 HE2 MET 87 -15.510 10.672 3.458 1382 HE3 MET 87 HE3 MET 87 -16.924 11.048 2.475 1383 H LEU 88 HN LEU 88 -13.294 15.691 2.847 1384 HA LEU 88 HA LEU 88 -10.867 14.488 2.779 1385 HB2 LEU 88 HB2 LEU 88 -11.978 16.392 1.388 1386 HB3 LEU 88 HB1 LEU 88 -11.030 17.438 2.418 1387 HG LEU 88 HG LEU 88 -9.060 16.868 1.410 1388 HD11 LEU 88 HD11 LEU 88 -8.655 14.694 0.292 1389 HD12 LEU 88 HD12 LEU 88 -10.279 14.185 0.751 1390 HD13 LEU 88 HD13 LEU 88 -9.071 14.509 1.993 1391 HD21 LEU 88 HD21 LEU 88 -10.474 17.771 -0.293 1392 HD22 LEU 88 HD22 LEU 88 -11.179 16.183 -0.585 1393 HD23 LEU 88 HD23 LEU 88 -9.490 16.488 -1.002 1394 H MET 89 HN MET 89 -11.818 17.208 4.853 1395 HA MET 89 HA MET 89 -9.176 17.459 5.995 1396 HB2 MET 89 HB2 MET 89 -10.599 19.432 5.655 1397 HB3 MET 89 HB1 MET 89 -11.797 18.765 6.754 1398 HG2 MET 89 HG2 MET 89 -10.186 18.901 8.589 1399 HG3 MET 89 HG1 MET 89 -8.992 19.580 7.484 1400 HE1 MET 89 HE1 MET 89 -12.493 20.096 9.164 1401 HE2 MET 89 HE2 MET 89 -12.866 20.375 7.464 1402 HE3 MET 89 HE3 MET 89 -12.931 21.711 8.612 1403 H ALA 90 HN ALA 90 -11.887 15.504 6.564 1404 HA ALA 90 HA ALA 90 -11.397 15.310 9.445 1405 HB1 ALA 90 HB1 ALA 90 -13.513 14.166 9.564 1406 HB2 ALA 90 HB2 ALA 90 -13.580 14.018 7.805 1407 HB3 ALA 90 HB3 ALA 90 -13.716 15.607 8.566 1408 H GLN 91 HN GLN 91 -11.190 13.422 6.517 1409 HA GLN 91 HA GLN 91 -10.470 11.062 8.095 1410 HB2 GLN 91 HB2 GLN 91 -11.253 11.292 5.198 1411 HB3 GLN 91 HB1 GLN 91 -10.966 9.797 6.076 1412 HG2 GLN 91 HG2 GLN 91 -12.843 10.254 7.520 1413 HG3 GLN 91 HG1 GLN 91 -13.129 11.780 6.688 1414 HE21 GLN 91 HE21 GLN 91 -12.493 10.847 4.113 1415 HE22 GLN 91 HE22 GLN 91 -13.750 9.791 3.618 1416 H LEU 92 HN LEU 92 -9.508 12.622 5.025 1417 HA LEU 92 HA LEU 92 -7.119 11.407 4.493 1418 HB2 LEU 92 HB2 LEU 92 -8.427 13.404 3.384 1419 HB3 LEU 92 HB1 LEU 92 -7.309 14.385 4.297 1420 HG LEU 92 HG LEU 92 -6.854 12.727 1.882 1421 HD11 LEU 92 HD11 LEU 92 -7.041 15.112 1.711 1422 HD12 LEU 92 HD12 LEU 92 -5.384 14.626 1.348 1423 HD13 LEU 92 HD13 LEU 92 -5.776 15.331 2.918 1424 HD21 LEU 92 HD21 LEU 92 -4.721 13.164 3.969 1425 HD22 LEU 92 HD22 LEU 92 -4.408 12.695 2.300 1426 HD23 LEU 92 HD23 LEU 92 -5.312 11.618 3.364 1427 H GLU 93 HN GLU 93 -7.958 13.654 6.947 1428 HA GLU 93 HA GLU 93 -6.070 15.268 7.670 1429 HB2 GLU 93 HB2 GLU 93 -6.551 14.821 10.080 1430 HB3 GLU 93 HB1 GLU 93 -7.987 15.002 9.072 1431 HG2 GLU 93 HG2 GLU 93 -8.525 12.759 9.213 1432 HG3 GLU 93 HG1 GLU 93 -6.888 12.282 9.662 Start of MODEL 10 1 H2 PRO 1 HT1 PRO 1 -5.297 -3.673 13.234 2 H3 PRO 1 HT2 PRO 1 -5.678 -2.154 13.698 3 HA PRO 1 HA PRO 1 -6.395 -2.115 11.655 4 HB2 PRO 1 HB2 PRO 1 -4.296 -1.145 10.307 5 HB3 PRO 1 HB1 PRO 1 -5.031 -0.241 11.634 6 HG2 PRO 1 HG2 PRO 1 -2.456 -1.640 11.541 7 HG3 PRO 1 HG1 PRO 1 -3.017 -0.396 12.672 8 HD2 PRO 1 HD2 PRO 1 -2.964 -3.291 12.990 9 HD3 PRO 1 HD1 PRO 1 -3.308 -2.042 14.206 10 H SER 2 HN SER 2 -4.707 -2.323 9.243 11 HA SER 2 HA SER 2 -4.440 -5.104 8.774 12 HB2 SER 2 HB2 SER 2 -2.967 -2.804 7.474 13 HB3 SER 2 HB1 SER 2 -3.072 -4.442 6.849 14 HG SER 2 HG SER 2 -5.511 -3.901 7.126 15 H PHE 3 HN PHE 3 -2.093 -5.941 8.235 16 HA PHE 3 HA PHE 3 -0.511 -5.618 10.601 17 HB2 PHE 3 HB2 PHE 3 1.105 -6.834 8.747 18 HB3 PHE 3 HB1 PHE 3 0.022 -7.681 9.848 19 HD1 PHE 3 HD1 PHE 3 0.728 -6.684 6.468 20 HD2 PHE 3 HD2 PHE 3 -2.182 -8.480 9.002 21 HE1 PHE 3 HE1 PHE 3 -0.443 -7.563 4.509 22 HE2 PHE 3 HE2 PHE 3 -3.363 -9.366 7.033 23 HZ PHE 3 HZ PHE 3 -2.494 -8.905 4.775 24 H ASN 4 HN ASN 4 -0.164 -4.822 7.203 25 HA ASN 4 HA ASN 4 2.476 -3.773 7.599 26 HB2 ASN 4 HB2 ASN 4 2.429 -3.472 5.168 27 HB3 ASN 4 HB1 ASN 4 1.928 -5.097 5.627 28 HD21 ASN 4 HD21 ASN 4 0.702 -1.912 4.741 29 HD22 ASN 4 HD22 ASN 4 -0.777 -2.485 4.043 30 H THR 5 HN THR 5 -0.327 -2.365 8.321 31 HA THR 5 HA THR 5 -0.353 -0.015 6.738 32 HB THR 5 HB THR 5 -1.549 0.829 8.954 33 HG1 THR 5 HG1 THR 5 -1.229 -0.855 10.315 34 HG21 THR 5 HG21 THR 5 -3.616 -0.329 8.081 35 HG22 THR 5 HG22 THR 5 -2.558 -1.080 6.884 36 HG23 THR 5 HG23 THR 5 -2.726 0.672 6.936 37 H VAL 6 HN VAL 6 1.899 -1.028 8.993 38 HA VAL 6 HA VAL 6 2.576 1.558 9.998 39 HB VAL 6 HB VAL 6 4.345 0.550 11.130 40 HG11 VAL 6 HG11 VAL 6 2.240 -0.302 11.960 41 HG12 VAL 6 HG12 VAL 6 3.497 -1.531 12.100 42 HG13 VAL 6 HG13 VAL 6 2.305 -1.633 10.805 43 HG21 VAL 6 HG21 VAL 6 4.290 -1.827 9.292 44 HG22 VAL 6 HG22 VAL 6 5.518 -1.422 10.503 45 HG23 VAL 6 HG23 VAL 6 5.338 -0.426 9.047 46 H ARG 7 HN ARG 7 4.000 2.993 9.082 47 HA ARG 7 HA ARG 7 5.717 2.058 6.992 48 HB2 ARG 7 HB2 ARG 7 4.753 3.546 5.259 49 HB3 ARG 7 HB1 ARG 7 3.810 2.146 5.726 50 HG2 ARG 7 HG2 ARG 7 2.926 4.222 7.354 51 HG3 ARG 7 HG1 ARG 7 3.047 4.874 5.716 52 HD2 ARG 7 HD2 ARG 7 1.645 3.165 4.839 53 HD3 ARG 7 HD1 ARG 7 1.724 2.247 6.342 54 HE ARG 7 HE ARG 7 0.658 4.802 6.875 55 HH11 ARG 7 HH11 ARG 7 -0.234 1.896 5.155 56 HH12 ARG 7 HH12 ARG 7 -1.914 2.026 5.546 57 HH21 ARG 7 HH21 ARG 7 -1.549 4.990 7.395 58 HH22 ARG 7 HH22 ARG 7 -2.667 3.785 6.841 59 H GLN 8 HN GLN 8 7.031 3.603 6.060 60 HA GLN 8 HA GLN 8 8.539 5.134 7.650 61 HB2 GLN 8 HB2 GLN 8 8.211 4.749 4.864 62 HB3 GLN 8 HB1 GLN 8 8.407 6.478 5.128 63 HG2 GLN 8 HG2 GLN 8 10.471 6.105 6.304 64 HG3 GLN 8 HG1 GLN 8 10.262 4.360 6.179 65 HE21 GLN 8 HE21 GLN 8 12.444 5.970 5.255 66 HE22 GLN 8 HE22 GLN 8 12.534 5.743 3.531 67 H GLY 9 HN GLY 9 7.938 6.622 9.048 68 HA2 GLY 9 HA3 GLY 9 6.055 8.719 8.363 69 HA3 GLY 9 HA2 GLY 9 6.972 8.569 9.859 70 H SER 10 HN SER 10 7.376 10.895 9.595 71 HA SER 10 HA SER 10 8.602 12.098 7.435 72 HB2 SER 10 HB2 SER 10 9.073 12.716 10.359 73 HB3 SER 10 HB1 SER 10 9.372 13.810 9.009 74 HG SER 10 HG SER 10 6.874 12.900 8.825 75 H LYS 11 HN LYS 11 10.248 11.275 6.393 76 HA LYS 11 HA LYS 11 12.147 10.167 5.865 77 HB2 LYS 11 HB2 LYS 11 14.150 11.238 6.548 78 HB3 LYS 11 HB1 LYS 11 12.948 12.482 6.320 79 HG2 LYS 11 HG2 LYS 11 12.600 12.514 8.749 80 HG3 LYS 11 HG1 LYS 11 13.886 11.340 8.944 81 HD2 LYS 11 HD2 LYS 11 15.435 12.962 7.875 82 HD3 LYS 11 HD1 LYS 11 14.124 14.144 7.869 83 HE2 LYS 11 HE2 LYS 11 13.965 13.952 10.314 84 HE3 LYS 11 HE1 LYS 11 15.306 12.810 10.302 85 HZ1 LYS 11 HZ1 LYS 11 16.018 15.051 10.863 86 HZ2 LYS 11 HZ2 LYS 11 15.444 15.630 9.385 87 HZ3 LYS 11 HZ3 LYS 11 16.733 14.534 9.420 88 H GLU 12 HN GLU 12 10.690 8.660 7.747 89 HA GLU 12 HA GLU 12 12.252 7.661 9.863 90 HB2 GLU 12 HB2 GLU 12 9.824 7.283 9.587 91 HB3 GLU 12 HB1 GLU 12 10.146 6.266 8.198 92 HG2 GLU 12 HG2 GLU 12 11.259 4.642 9.597 93 HG3 GLU 12 HG1 GLU 12 11.055 5.687 11.003 94 HA PRO 13 HA PRO 13 15.531 5.470 7.746 95 HB2 PRO 13 HB2 PRO 13 15.200 3.421 9.834 96 HB3 PRO 13 HB1 PRO 13 16.636 4.342 9.397 97 HG2 PRO 13 HG2 PRO 13 15.219 4.804 11.660 98 HG3 PRO 13 HG1 PRO 13 16.120 6.059 10.805 99 HD2 PRO 13 HD2 PRO 13 13.206 5.609 10.968 100 HD3 PRO 13 HD1 PRO 13 14.101 7.106 10.664 101 H TYR 14 HN TYR 14 15.315 4.129 6.066 102 HA TYR 14 HA TYR 14 12.724 3.125 5.651 103 HB2 TYR 14 HB2 TYR 14 14.021 4.144 3.840 104 HB3 TYR 14 HB1 TYR 14 15.140 2.787 3.881 105 HD1 TYR 14 HD1 TYR 14 14.015 0.453 3.681 106 HD2 TYR 14 HD2 TYR 14 12.265 4.057 2.315 107 HE1 TYR 14 HE1 TYR 14 12.589 -0.843 2.194 108 HE2 TYR 14 HE2 TYR 14 10.815 2.779 0.800 109 HH TYR 14 HH TYR 14 10.280 0.748 0.050 110 HA PRO 15 HA PRO 15 14.766 -1.302 5.434 111 HB2 PRO 15 HB2 PRO 15 16.955 -1.009 7.383 112 HB3 PRO 15 HB1 PRO 15 16.927 -1.876 5.851 113 HG2 PRO 15 HG2 PRO 15 18.253 0.431 6.170 114 HG3 PRO 15 HG1 PRO 15 17.519 -0.035 4.642 115 HD2 PRO 15 HD2 PRO 15 16.630 1.979 6.634 116 HD3 PRO 15 HD1 PRO 15 16.424 1.953 4.877 117 H ASP 16 HN ASP 16 14.518 0.859 7.980 118 HA ASP 16 HA ASP 16 13.839 -1.109 9.993 119 HB2 ASP 16 HB2 ASP 16 14.341 1.837 10.022 120 HB3 ASP 16 HB1 ASP 16 13.385 1.135 11.320 121 H PHE 17 HN PHE 17 12.342 1.530 8.190 122 HA PHE 17 HA PHE 17 9.785 1.433 9.294 123 HB2 PHE 17 HB2 PHE 17 9.505 3.100 7.755 124 HB3 PHE 17 HB1 PHE 17 11.063 2.676 7.064 125 HD1 PHE 17 HD1 PHE 17 7.523 1.459 6.940 126 HD2 PHE 17 HD2 PHE 17 11.148 2.169 4.854 127 HE1 PHE 17 HE1 PHE 17 6.449 0.773 4.828 128 HE2 PHE 17 HE2 PHE 17 10.075 1.485 2.764 129 HZ PHE 17 HZ PHE 17 7.719 0.813 2.751 130 H VAL 18 HN VAL 18 11.276 -0.410 6.705 131 HA VAL 18 HA VAL 18 8.908 -1.943 6.209 132 HB VAL 18 HB VAL 18 10.158 -1.604 4.272 133 HG11 VAL 18 HG11 VAL 18 12.567 -2.594 5.786 134 HG12 VAL 18 HG12 VAL 18 12.246 -0.916 5.337 135 HG13 VAL 18 HG13 VAL 18 12.537 -2.130 4.077 136 HG21 VAL 18 HG21 VAL 18 10.655 -4.326 5.409 137 HG22 VAL 18 HG22 VAL 18 11.101 -3.893 3.758 138 HG23 VAL 18 HG23 VAL 18 9.408 -3.825 4.259 139 H ALA 19 HN ALA 19 11.917 -2.449 7.997 140 HA ALA 19 HA ALA 19 11.659 -5.201 8.430 141 HB1 ALA 19 HB1 ALA 19 13.652 -3.889 9.082 142 HB2 ALA 19 HB2 ALA 19 13.061 -4.919 10.386 143 HB3 ALA 19 HB3 ALA 19 12.731 -3.187 10.411 144 H ARG 20 HN ARG 20 9.970 -2.530 10.016 145 HA ARG 20 HA ARG 20 8.711 -4.400 11.841 146 HB2 ARG 20 HB2 ARG 20 7.399 -2.470 12.637 147 HB3 ARG 20 HB1 ARG 20 9.127 -2.185 12.731 148 HG2 ARG 20 HG2 ARG 20 9.092 -0.604 11.055 149 HG3 ARG 20 HG1 ARG 20 7.589 -1.223 10.362 150 HD2 ARG 20 HD2 ARG 20 6.302 -0.341 12.146 151 HD3 ARG 20 HD1 ARG 20 7.737 0.024 13.087 152 HE ARG 20 HE ARG 20 8.149 1.587 10.997 153 HH11 ARG 20 HH11 ARG 20 5.225 1.019 12.828 154 HH12 ARG 20 HH12 ARG 20 4.563 2.586 12.502 155 HH21 ARG 20 HH21 ARG 20 7.314 3.669 10.611 156 HH22 ARG 20 HH22 ARG 20 5.747 4.090 11.242 157 H LEU 21 HN LEU 21 8.224 -2.837 8.825 158 HA LEU 21 HA LEU 21 5.543 -3.338 8.335 159 HB2 LEU 21 HB2 LEU 21 7.326 -2.114 6.931 160 HB3 LEU 21 HB1 LEU 21 7.729 -3.688 6.290 161 HG LEU 21 HG LEU 21 5.666 -3.864 5.162 162 HD11 LEU 21 HD11 LEU 21 4.150 -3.075 6.846 163 HD12 LEU 21 HD12 LEU 21 3.910 -2.119 5.381 164 HD13 LEU 21 HD13 LEU 21 4.819 -1.450 6.738 165 HD21 LEU 21 HD21 LEU 21 5.588 -1.675 3.907 166 HD22 LEU 21 HD22 LEU 21 7.132 -2.525 3.938 167 HD23 LEU 21 HD23 LEU 21 6.868 -1.137 4.991 168 H GLN 22 HN GLN 22 8.397 -5.358 7.884 169 HA GLN 22 HA GLN 22 7.006 -7.662 7.024 170 HB2 GLN 22 HB2 GLN 22 9.725 -7.620 8.310 171 HB3 GLN 22 HB1 GLN 22 9.052 -8.792 7.168 172 HG2 GLN 22 HG2 GLN 22 8.984 -6.862 5.546 173 HG3 GLN 22 HG1 GLN 22 9.989 -6.002 6.674 174 HE21 GLN 22 HE21 GLN 22 11.396 -5.908 4.871 175 HE22 GLN 22 HE22 GLN 22 12.489 -7.213 4.580 176 H ASP 23 HN ASP 23 8.395 -6.579 10.042 177 HA ASP 23 HA ASP 23 8.073 -8.838 11.582 178 HB2 ASP 23 HB2 ASP 23 9.072 -6.562 12.183 179 HB3 ASP 23 HB1 ASP 23 7.420 -6.111 12.605 180 H VAL 24 HN VAL 24 5.668 -6.269 11.039 181 HA VAL 24 HA VAL 24 3.797 -7.663 12.735 182 HB VAL 24 HB VAL 24 3.835 -5.223 12.825 183 HG11 VAL 24 HG11 VAL 24 4.549 -4.773 10.563 184 HG12 VAL 24 HG12 VAL 24 3.070 -3.884 10.923 185 HG13 VAL 24 HG13 VAL 24 3.005 -5.347 9.938 186 HG21 VAL 24 HG21 VAL 24 1.717 -6.235 13.363 187 HG22 VAL 24 HG22 VAL 24 1.286 -6.341 11.658 188 HG23 VAL 24 HG23 VAL 24 1.404 -4.761 12.438 189 H ALA 25 HN ALA 25 4.563 -7.375 9.395 190 HA ALA 25 HA ALA 25 2.114 -8.458 8.363 191 HB1 ALA 25 HB1 ALA 25 4.883 -8.432 7.147 192 HB2 ALA 25 HB2 ALA 25 3.645 -7.199 6.906 193 HB3 ALA 25 HB3 ALA 25 3.390 -8.836 6.300 194 H GLN 26 HN GLN 26 4.842 -9.529 9.992 195 HA GLN 26 HA GLN 26 4.533 -12.303 9.278 196 HB2 GLN 26 HB2 GLN 26 6.703 -12.122 9.728 197 HB3 GLN 26 HB1 GLN 26 6.453 -10.570 10.509 198 HG2 GLN 26 HG2 GLN 26 7.310 -11.742 12.225 199 HG3 GLN 26 HG1 GLN 26 5.600 -12.074 12.475 200 HE21 GLN 26 HE21 GLN 26 5.467 -13.839 10.168 201 HE22 GLN 26 HE22 GLN 26 6.214 -15.312 10.646 202 H LYS 27 HN LYS 27 3.916 -10.138 11.951 203 HA LYS 27 HA LYS 27 3.051 -12.022 13.850 204 HB2 LYS 27 HB2 LYS 27 2.188 -9.138 13.588 205 HB3 LYS 27 HB1 LYS 27 2.113 -10.129 15.049 206 HG2 LYS 27 HG2 LYS 27 4.602 -9.245 13.612 207 HG3 LYS 27 HG1 LYS 27 3.994 -8.615 15.143 208 HD2 LYS 27 HD2 LYS 27 4.595 -10.516 16.306 209 HD3 LYS 27 HD1 LYS 27 4.566 -11.533 14.864 210 HE2 LYS 27 HE2 LYS 27 6.593 -10.648 14.071 211 HE3 LYS 27 HE1 LYS 27 6.545 -9.316 15.218 212 HZ1 LYS 27 HZ1 LYS 27 6.941 -12.181 15.890 213 HZ2 LYS 27 HZ2 LYS 27 6.873 -10.923 17.012 214 HZ3 LYS 27 HZ3 LYS 27 8.139 -10.990 15.896 215 H SER 28 HN SER 28 1.235 -10.224 11.386 216 HA SER 28 HA SER 28 -1.242 -11.331 12.477 217 HB2 SER 28 HB2 SER 28 -0.826 -9.180 10.415 218 HB3 SER 28 HB1 SER 28 -2.369 -9.626 11.139 219 HG SER 28 HG SER 28 -0.786 -9.143 13.150 220 H ILE 29 HN ILE 29 1.025 -11.935 10.150 221 HA ILE 29 HA ILE 29 -0.940 -13.304 8.438 222 HB ILE 29 HB ILE 29 1.808 -12.286 7.758 223 HG12 ILE 29 HG12 ILE 29 -0.877 -11.473 6.652 224 HG13 ILE 29 HG11 ILE 29 0.067 -10.553 7.826 225 HG21 ILE 29 HG21 ILE 29 1.456 -14.355 6.611 226 HG22 ILE 29 HG22 ILE 29 1.377 -13.006 5.476 227 HG23 ILE 29 HG23 ILE 29 -0.111 -13.797 6.017 228 HD11 ILE 29 HD11 ILE 29 0.323 -9.744 5.508 229 HD12 ILE 29 HD12 ILE 29 1.037 -11.307 5.086 230 HD13 ILE 29 HD13 ILE 29 1.840 -10.252 6.255 231 H ALA 30 HN ALA 30 -0.917 -15.451 8.520 232 HA ALA 30 HA ALA 30 1.341 -16.836 9.734 233 HB1 ALA 30 HB1 ALA 30 -0.931 -17.467 10.392 234 HB2 ALA 30 HB2 ALA 30 -0.091 -18.816 9.628 235 HB3 ALA 30 HB3 ALA 30 -1.297 -17.901 8.723 236 H ASP 31 HN ASP 31 0.551 -15.715 6.749 237 HA ASP 31 HA ASP 31 1.650 -17.994 5.260 238 HB2 ASP 31 HB2 ASP 31 -0.547 -16.781 4.664 239 HB3 ASP 31 HB1 ASP 31 0.512 -15.496 4.090 240 H GLU 32 HN GLU 32 3.786 -17.921 4.924 241 HA GLU 32 HA GLU 32 5.395 -15.617 5.116 242 HB2 GLU 32 HB2 GLU 32 7.132 -16.980 4.031 243 HB3 GLU 32 HB1 GLU 32 6.310 -17.882 5.298 244 HG2 GLU 32 HG2 GLU 32 5.003 -19.075 3.662 245 HG3 GLU 32 HG1 GLU 32 5.698 -18.107 2.361 246 H LYS 33 HN LYS 33 3.399 -16.792 2.537 247 HA LYS 33 HA LYS 33 4.861 -15.486 0.436 248 HB2 LYS 33 HB2 LYS 33 2.035 -16.566 0.422 249 HB3 LYS 33 HB1 LYS 33 2.927 -16.030 -0.987 250 HG2 LYS 33 HG2 LYS 33 3.617 -18.095 -1.265 251 HG3 LYS 33 HG1 LYS 33 4.548 -17.941 0.228 252 HD2 LYS 33 HD2 LYS 33 2.701 -18.784 1.516 253 HD3 LYS 33 HD1 LYS 33 1.657 -18.787 0.091 254 HE2 LYS 33 HE2 LYS 33 3.201 -20.407 -0.964 255 HE3 LYS 33 HE1 LYS 33 4.104 -20.472 0.545 256 HZ1 LYS 33 HZ1 LYS 33 2.159 -21.322 1.662 257 HZ2 LYS 33 HZ2 LYS 33 2.523 -22.304 0.334 258 HZ3 LYS 33 HZ3 LYS 33 1.246 -21.199 0.245 259 H ALA 34 HN ALA 34 1.728 -14.929 2.035 260 HA ALA 34 HA ALA 34 1.359 -12.373 0.906 261 HB1 ALA 34 HB1 ALA 34 0.263 -13.481 3.496 262 HB2 ALA 34 HB2 ALA 34 -0.482 -13.624 1.904 263 HB3 ALA 34 HB3 ALA 34 -0.325 -12.041 2.666 264 H ARG 35 HN ARG 35 3.251 -13.491 3.601 265 HA ARG 35 HA ARG 35 3.605 -11.055 4.994 266 HB2 ARG 35 HB2 ARG 35 4.321 -13.555 5.537 267 HB3 ARG 35 HB1 ARG 35 5.828 -13.037 4.786 268 HG2 ARG 35 HG2 ARG 35 4.652 -11.326 6.938 269 HG3 ARG 35 HG1 ARG 35 5.420 -12.844 7.397 270 HD2 ARG 35 HD2 ARG 35 6.702 -10.582 5.859 271 HD3 ARG 35 HD1 ARG 35 6.973 -11.000 7.561 272 HE ARG 35 HE ARG 35 7.735 -13.250 6.532 273 HH11 ARG 35 HH11 ARG 35 8.289 -10.091 5.119 274 HH12 ARG 35 HH12 ARG 35 9.746 -10.572 4.312 275 HH21 ARG 35 HH21 ARG 35 9.635 -13.881 5.459 276 HH22 ARG 35 HH22 ARG 35 10.505 -12.724 4.496 277 H LYS 36 HN LYS 36 5.874 -12.704 2.783 278 HA LYS 36 HA LYS 36 7.665 -10.632 2.482 279 HB2 LYS 36 HB2 LYS 36 8.078 -11.685 0.216 280 HB3 LYS 36 HB1 LYS 36 8.306 -12.699 1.632 281 HG2 LYS 36 HG2 LYS 36 5.908 -13.296 1.248 282 HG3 LYS 36 HG1 LYS 36 6.145 -12.594 -0.358 283 HD2 LYS 36 HD2 LYS 36 7.823 -14.618 0.892 284 HD3 LYS 36 HD1 LYS 36 6.587 -15.021 -0.287 285 HE2 LYS 36 HE2 LYS 36 8.848 -13.099 -0.827 286 HE3 LYS 36 HE1 LYS 36 8.969 -14.824 -1.190 287 HZ1 LYS 36 HZ1 LYS 36 6.961 -14.526 -2.605 288 HZ2 LYS 36 HZ2 LYS 36 8.316 -13.685 -3.151 289 HZ3 LYS 36 HZ3 LYS 36 7.077 -12.857 -2.354 290 H VAL 37 HN VAL 37 5.085 -11.499 0.301 291 HA VAL 37 HA VAL 37 5.610 -9.539 -1.584 292 HB VAL 37 HB VAL 37 3.511 -10.003 -2.596 293 HG11 VAL 37 HG11 VAL 37 3.818 -12.672 -1.483 294 HG12 VAL 37 HG12 VAL 37 5.377 -11.919 -1.874 295 HG13 VAL 37 HG13 VAL 37 4.127 -12.093 -3.129 296 HG21 VAL 37 HG21 VAL 37 2.032 -9.736 -0.694 297 HG22 VAL 37 HG22 VAL 37 2.681 -11.195 0.051 298 HG23 VAL 37 HG23 VAL 37 1.753 -11.308 -1.444 299 H ILE 38 HN ILE 38 3.727 -9.260 1.386 300 HA ILE 38 HA ILE 38 2.784 -6.673 0.559 301 HB ILE 38 HB ILE 38 1.664 -8.441 2.263 302 HG12 ILE 38 HG12 ILE 38 0.919 -5.777 3.047 303 HG13 ILE 38 HG11 ILE 38 1.235 -5.842 1.318 304 HG21 ILE 38 HG21 ILE 38 1.758 -7.547 4.519 305 HG22 ILE 38 HG22 ILE 38 2.938 -6.338 4.007 306 HG23 ILE 38 HG23 ILE 38 3.370 -8.052 3.999 307 HD11 ILE 38 HD11 ILE 38 -0.377 -7.550 1.032 308 HD12 ILE 38 HD12 ILE 38 -1.101 -6.225 1.950 309 HD13 ILE 38 HD13 ILE 38 -0.596 -7.699 2.768 310 H VAL 39 HN VAL 39 5.359 -7.927 2.577 311 HA VAL 39 HA VAL 39 6.005 -5.365 3.618 312 HB VAL 39 HB VAL 39 7.938 -6.221 4.468 313 HG11 VAL 39 HG11 VAL 39 6.061 -8.560 4.233 314 HG12 VAL 39 HG12 VAL 39 6.032 -7.297 5.463 315 HG13 VAL 39 HG13 VAL 39 7.377 -8.443 5.397 316 HG21 VAL 39 HG21 VAL 39 9.128 -8.226 3.746 317 HG22 VAL 39 HG22 VAL 39 8.995 -7.057 2.431 318 HG23 VAL 39 HG23 VAL 39 7.941 -8.471 2.464 319 H GLU 40 HN GLU 40 7.215 -7.247 0.912 320 HA GLU 40 HA GLU 40 8.928 -5.314 -0.135 321 HB2 GLU 40 HB2 GLU 40 7.633 -7.779 -1.244 322 HB3 GLU 40 HB1 GLU 40 8.771 -6.819 -2.171 323 HG2 GLU 40 HG2 GLU 40 10.505 -7.214 -0.634 324 HG3 GLU 40 HG1 GLU 40 9.417 -7.872 0.553 325 H LEU 41 HN LEU 41 5.510 -5.743 -0.428 326 HA LEU 41 HA LEU 41 5.323 -3.935 -2.688 327 HB2 LEU 41 HB2 LEU 41 3.639 -5.851 -1.586 328 HB3 LEU 41 HB1 LEU 41 2.854 -4.327 -1.219 329 HG LEU 41 HG LEU 41 1.933 -4.979 -3.264 330 HD11 LEU 41 HD11 LEU 41 2.583 -3.316 -4.792 331 HD12 LEU 41 HD12 LEU 41 4.179 -3.186 -4.065 332 HD13 LEU 41 HD13 LEU 41 2.761 -2.656 -3.173 333 HD21 LEU 41 HD21 LEU 41 3.414 -6.778 -3.843 334 HD22 LEU 41 HD22 LEU 41 4.726 -5.644 -4.161 335 HD23 LEU 41 HD23 LEU 41 3.306 -5.663 -5.208 336 H MET 42 HN MET 42 4.306 -3.832 0.736 337 HA MET 42 HA MET 42 3.382 -1.161 0.675 338 HB2 MET 42 HB2 MET 42 4.332 -2.820 3.011 339 HB3 MET 42 HB1 MET 42 3.450 -1.289 3.154 340 HG2 MET 42 HG2 MET 42 2.504 -3.924 2.073 341 HG3 MET 42 HG1 MET 42 1.889 -3.010 3.441 342 HE1 MET 42 HE1 MET 42 -0.508 -3.486 2.531 343 HE2 MET 42 HE2 MET 42 0.128 -4.299 1.098 344 HE3 MET 42 HE3 MET 42 -1.070 -3.016 0.923 345 H ALA 43 HN ALA 43 6.444 -2.604 0.976 346 HA ALA 43 HA ALA 43 8.092 -0.746 2.024 347 HB1 ALA 43 HB1 ALA 43 8.897 -2.802 1.142 348 HB2 ALA 43 HB2 ALA 43 9.732 -1.483 0.314 349 HB3 ALA 43 HB3 ALA 43 8.421 -2.351 -0.493 350 H TYR 44 HN TYR 44 6.284 -0.589 -0.983 351 HA TYR 44 HA TYR 44 7.439 2.063 -1.594 352 HB2 TYR 44 HB2 TYR 44 7.543 0.560 -3.512 353 HB3 TYR 44 HB1 TYR 44 5.856 0.141 -3.294 354 HD1 TYR 44 HD1 TYR 44 8.149 2.338 -4.945 355 HD2 TYR 44 HD2 TYR 44 4.101 1.980 -3.732 356 HE1 TYR 44 HE1 TYR 44 7.517 4.027 -6.606 357 HE2 TYR 44 HE2 TYR 44 3.454 3.682 -5.374 358 HH TYR 44 HH TYR 44 4.628 5.634 -6.576 359 H GLU 45 HN GLU 45 4.367 0.361 -1.975 360 HA GLU 45 HA GLU 45 2.682 2.419 -2.268 361 HB2 GLU 45 HB2 GLU 45 1.844 0.164 -0.537 362 HB3 GLU 45 HB1 GLU 45 0.948 0.957 -1.824 363 HG2 GLU 45 HG2 GLU 45 3.291 -0.849 -2.158 364 HG3 GLU 45 HG1 GLU 45 1.625 -1.319 -2.402 365 H ASN 46 HN ASN 46 4.065 1.307 0.765 366 HA ASN 46 HA ASN 46 2.270 3.074 2.244 367 HB2 ASN 46 HB2 ASN 46 3.799 0.592 2.926 368 HB3 ASN 46 HB1 ASN 46 3.420 1.749 4.190 369 HD21 ASN 46 HD21 ASN 46 1.994 0.355 5.285 370 HD22 ASN 46 HD22 ASN 46 0.471 -0.101 4.611 371 H ALA 47 HN ALA 47 5.506 2.755 1.162 372 HA ALA 47 HA ALA 47 6.944 3.862 3.294 373 HB1 ALA 47 HB1 ALA 47 8.037 2.699 1.469 374 HB2 ALA 47 HB2 ALA 47 8.701 4.324 1.663 375 HB3 ALA 47 HB3 ALA 47 7.571 3.983 0.354 376 H ASN 48 HN ASN 48 8.343 5.865 2.814 377 HA ASN 48 HA ASN 48 6.758 8.178 2.960 378 HB2 ASN 48 HB2 ASN 48 9.649 7.548 2.761 379 HB3 ASN 48 HB1 ASN 48 9.171 9.161 2.239 380 HD21 ASN 48 HD21 ASN 48 10.752 8.264 4.572 381 HD22 ASN 48 HD22 ASN 48 9.918 8.907 5.949 382 HA PRO 49 HA PRO 49 5.587 8.944 -1.190 383 HB2 PRO 49 HB2 PRO 49 5.862 11.720 -1.136 384 HB3 PRO 49 HB1 PRO 49 4.427 10.814 -0.655 385 HG2 PRO 49 HG2 PRO 49 6.594 11.976 1.023 386 HG3 PRO 49 HG1 PRO 49 4.859 11.835 1.361 387 HD2 PRO 49 HD2 PRO 49 6.657 10.205 2.507 388 HD3 PRO 49 HD1 PRO 49 5.045 9.626 2.037 389 H GLU 50 HN GLU 50 8.583 10.185 0.039 390 HA GLU 50 HA GLU 50 9.728 10.697 -2.563 391 HB2 GLU 50 HB2 GLU 50 11.588 11.535 -1.378 392 HB3 GLU 50 HB1 GLU 50 10.193 11.985 -0.404 393 HG2 GLU 50 HG2 GLU 50 11.290 9.401 0.281 394 HG3 GLU 50 HG1 GLU 50 12.393 10.742 0.537 395 H CYS 51 HN CYS 51 9.596 8.226 -0.143 396 HA CYS 51 HA CYS 51 12.055 6.967 -0.942 397 HB2 CYS 51 HB2 CYS 51 9.978 6.253 1.139 398 HB3 CYS 51 HB1 CYS 51 11.464 5.344 0.859 399 HG CYS 51 HG CYS 51 11.193 8.550 2.021 400 H GLN 52 HN GLN 52 8.602 6.364 -1.169 401 HA GLN 52 HA GLN 52 8.915 3.920 -2.612 402 HB2 GLN 52 HB2 GLN 52 6.592 4.107 -3.142 403 HB3 GLN 52 HB1 GLN 52 6.788 4.601 -1.468 404 HG2 GLN 52 HG2 GLN 52 6.721 6.960 -2.220 405 HG3 GLN 52 HG1 GLN 52 6.380 6.391 -3.854 406 HE21 GLN 52 HE21 GLN 52 4.891 4.123 -2.747 407 HE22 GLN 52 HE22 GLN 52 3.367 4.724 -2.256 408 H SER 53 HN SER 53 8.882 7.262 -3.204 409 HA SER 53 HA SER 53 8.898 7.177 -6.026 410 HB2 SER 53 HB2 SER 53 9.502 9.197 -3.920 411 HB3 SER 53 HB1 SER 53 9.852 9.560 -5.618 412 HG SER 53 HG SER 53 7.500 9.605 -4.331 413 H ALA 54 HN ALA 54 11.293 6.718 -3.567 414 HA ALA 54 HA ALA 54 13.470 6.716 -5.445 415 HB1 ALA 54 HB1 ALA 54 14.690 5.568 -3.615 416 HB2 ALA 54 HB2 ALA 54 13.183 5.551 -2.689 417 HB3 ALA 54 HB3 ALA 54 13.937 7.083 -3.120 418 H ILE 55 HN ILE 55 10.981 4.615 -4.522 419 HA ILE 55 HA ILE 55 12.372 2.214 -5.284 420 HB ILE 55 HB ILE 55 9.712 2.747 -4.040 421 HG12 ILE 55 HG12 ILE 55 11.898 1.054 -2.943 422 HG13 ILE 55 HG11 ILE 55 12.086 2.812 -2.933 423 HG21 ILE 55 HG21 ILE 55 10.864 0.086 -4.844 424 HG22 ILE 55 HG22 ILE 55 9.409 0.836 -5.498 425 HG23 ILE 55 HG23 ILE 55 9.454 0.314 -3.814 426 HD11 ILE 55 HD11 ILE 55 10.179 3.085 -1.579 427 HD12 ILE 55 HD12 ILE 55 11.163 1.803 -0.859 428 HD13 ILE 55 HD13 ILE 55 9.703 1.392 -1.777 429 H LYS 56 HN LYS 56 9.741 4.190 -6.667 430 HA LYS 56 HA LYS 56 8.375 2.421 -8.156 431 HB2 LYS 56 HB2 LYS 56 8.932 4.490 -10.035 432 HB3 LYS 56 HB1 LYS 56 7.443 4.120 -9.189 433 HG2 LYS 56 HG2 LYS 56 7.771 6.275 -8.550 434 HG3 LYS 56 HG1 LYS 56 8.632 5.442 -7.251 435 HD2 LYS 56 HD2 LYS 56 10.651 6.038 -8.003 436 HD3 LYS 56 HD1 LYS 56 10.165 6.050 -9.700 437 HE2 LYS 56 HE2 LYS 56 9.788 8.207 -7.613 438 HE3 LYS 56 HE1 LYS 56 10.628 8.293 -9.159 439 HZ1 LYS 56 HZ1 LYS 56 8.508 9.422 -9.265 440 HZ2 LYS 56 HZ2 LYS 56 7.689 8.008 -8.834 441 HZ3 LYS 56 HZ3 LYS 56 8.516 8.091 -10.309 442 HA PRO 57 HA PRO 57 11.751 2.060 -11.705 443 HB2 PRO 57 HB2 PRO 57 14.294 1.993 -10.741 444 HB3 PRO 57 HB1 PRO 57 13.541 3.467 -11.369 445 HG2 PRO 57 HG2 PRO 57 13.698 2.502 -8.525 446 HG3 PRO 57 HG1 PRO 57 14.173 4.090 -9.173 447 HD2 PRO 57 HD2 PRO 57 11.825 3.798 -8.011 448 HD3 PRO 57 HD1 PRO 57 11.905 4.711 -9.526 449 H LEU 58 HN LEU 58 12.085 0.897 -8.417 450 HA LEU 58 HA LEU 58 12.946 -1.766 -9.301 451 HB2 LEU 58 HB2 LEU 58 12.474 -1.157 -6.446 452 HB3 LEU 58 HB1 LEU 58 13.736 -2.150 -7.163 453 HG LEU 58 HG LEU 58 13.668 0.876 -7.079 454 HD11 LEU 58 HD11 LEU 58 13.989 -0.033 -4.888 455 HD12 LEU 58 HD12 LEU 58 15.539 0.570 -5.480 456 HD13 LEU 58 HD13 LEU 58 15.204 -1.161 -5.484 457 HD21 LEU 58 HD21 LEU 58 14.853 0.042 -9.042 458 HD22 LEU 58 HD22 LEU 58 15.836 -1.004 -8.015 459 HD23 LEU 58 HD23 LEU 58 15.970 0.751 -7.877 460 H LYS 59 HN LYS 59 10.348 0.115 -8.378 461 HA LYS 59 HA LYS 59 8.682 -1.509 -6.932 462 HB2 LYS 59 HB2 LYS 59 8.088 0.754 -7.339 463 HB3 LYS 59 HB1 LYS 59 8.061 0.502 -9.076 464 HG2 LYS 59 HG2 LYS 59 5.829 0.500 -8.641 465 HG3 LYS 59 HG1 LYS 59 6.181 -1.211 -8.448 466 HD2 LYS 59 HD2 LYS 59 5.962 0.808 -6.245 467 HD3 LYS 59 HD1 LYS 59 4.760 -0.427 -6.634 468 HE2 LYS 59 HE2 LYS 59 6.933 -1.977 -6.320 469 HE3 LYS 59 HE1 LYS 59 7.363 -0.655 -5.231 470 HZ1 LYS 59 HZ1 LYS 59 5.056 -2.476 -5.125 471 HZ2 LYS 59 HZ2 LYS 59 4.988 -0.977 -4.345 472 HZ3 LYS 59 HZ3 LYS 59 6.170 -2.116 -3.900 473 H GLY 60 HN GLY 60 8.234 -3.548 -7.292 474 HA2 GLY 60 HA3 GLY 60 7.029 -5.263 -8.357 475 HA3 GLY 60 HA2 GLY 60 7.022 -4.314 -9.836 476 H LYS 61 HN LYS 61 10.026 -3.868 -9.307 477 HA LYS 61 HA LYS 61 10.832 -6.340 -10.680 478 HB2 LYS 61 HB2 LYS 61 12.617 -3.960 -10.520 479 HB3 LYS 61 HB1 LYS 61 12.353 -5.069 -11.857 480 HG2 LYS 61 HG2 LYS 61 10.414 -2.953 -10.985 481 HG3 LYS 61 HG1 LYS 61 11.564 -2.774 -12.299 482 HD2 LYS 61 HD2 LYS 61 9.454 -4.920 -12.181 483 HD3 LYS 61 HD1 LYS 61 9.247 -3.379 -13.017 484 HE2 LYS 61 HE2 LYS 61 11.103 -3.878 -14.475 485 HE3 LYS 61 HE1 LYS 61 11.434 -5.366 -13.593 486 HZ1 LYS 61 HZ1 LYS 61 10.216 -5.776 -15.649 487 HZ2 LYS 61 HZ2 LYS 61 8.944 -4.803 -15.106 488 HZ3 LYS 61 HZ3 LYS 61 9.313 -6.241 -14.298 489 H VAL 62 HN VAL 62 11.656 -7.747 -9.277 490 HA VAL 62 HA VAL 62 13.759 -6.771 -7.466 491 HB VAL 62 HB VAL 62 11.852 -7.592 -6.171 492 HG11 VAL 62 HG11 VAL 62 10.850 -9.112 -7.761 493 HG12 VAL 62 HG12 VAL 62 11.169 -9.947 -6.238 494 HG13 VAL 62 HG13 VAL 62 12.231 -10.202 -7.625 495 HG21 VAL 62 HG21 VAL 62 13.000 -9.366 -4.849 496 HG22 VAL 62 HG22 VAL 62 13.986 -7.939 -5.162 497 HG23 VAL 62 HG23 VAL 62 14.249 -9.413 -6.095 498 HA PRO 63 HA PRO 63 16.639 -9.700 -9.495 499 HB2 PRO 63 HB2 PRO 63 17.169 -10.233 -6.604 500 HB3 PRO 63 HB1 PRO 63 18.314 -10.068 -7.922 501 HG2 PRO 63 HG2 PRO 63 17.944 -8.048 -6.249 502 HG3 PRO 63 HG1 PRO 63 18.103 -7.745 -7.985 503 HD2 PRO 63 HD2 PRO 63 15.677 -7.672 -6.272 504 HD3 PRO 63 HD1 PRO 63 16.073 -6.716 -7.714 505 H ALA 64 HN ALA 64 16.409 -11.841 -9.955 506 HA ALA 64 HA ALA 64 13.925 -12.974 -9.386 507 HB1 ALA 64 HB1 ALA 64 15.165 -13.409 -11.445 508 HB2 ALA 64 HB2 ALA 64 14.692 -14.907 -10.643 509 HB3 ALA 64 HB3 ALA 64 16.357 -14.333 -10.530 510 H GLY 65 HN GLY 65 13.434 -13.465 -7.328 511 HA2 GLY 65 HA3 GLY 65 13.241 -15.257 -5.786 512 HA3 GLY 65 HA2 GLY 65 14.882 -15.743 -6.183 513 H SER 66 HN SER 66 15.281 -12.569 -5.885 514 HA SER 66 HA SER 66 16.208 -12.877 -3.125 515 HB2 SER 66 HB2 SER 66 16.654 -10.524 -4.944 516 HB3 SER 66 HB1 SER 66 17.610 -11.023 -3.549 517 HG SER 66 HG SER 66 17.634 -13.085 -5.124 518 H ASP 67 HN ASP 67 16.373 -10.372 -2.378 519 HA ASP 67 HA ASP 67 13.740 -9.939 -1.282 520 HB2 ASP 67 HB2 ASP 67 15.272 -8.226 0.041 521 HB3 ASP 67 HB1 ASP 67 15.358 -9.946 0.358 522 H VAL 68 HN VAL 68 12.375 -8.342 -2.056 523 HA VAL 68 HA VAL 68 13.550 -6.341 -3.784 524 HB VAL 68 HB VAL 68 11.528 -5.841 -4.561 525 HG11 VAL 68 HG11 VAL 68 9.789 -7.486 -4.336 526 HG12 VAL 68 HG12 VAL 68 10.557 -8.136 -2.888 527 HG13 VAL 68 HG13 VAL 68 11.361 -8.273 -4.448 528 HG21 VAL 68 HG21 VAL 68 11.010 -4.417 -2.699 529 HG22 VAL 68 HG22 VAL 68 10.477 -5.802 -1.740 530 HG23 VAL 68 HG23 VAL 68 9.569 -5.322 -3.177 531 H ILE 69 HN ILE 69 12.473 -6.655 -0.511 532 HA ILE 69 HA ILE 69 12.340 -3.987 0.228 533 HB ILE 69 HB ILE 69 13.159 -6.403 1.817 534 HG12 ILE 69 HG12 ILE 69 10.871 -6.529 1.271 535 HG13 ILE 69 HG11 ILE 69 10.909 -5.896 2.904 536 HG21 ILE 69 HG21 ILE 69 12.824 -4.950 3.848 537 HG22 ILE 69 HG22 ILE 69 12.818 -3.552 2.768 538 HG23 ILE 69 HG23 ILE 69 14.253 -4.567 2.887 539 HD11 ILE 69 HD11 ILE 69 10.487 -4.292 0.406 540 HD12 ILE 69 HD12 ILE 69 10.553 -3.631 2.041 541 HD13 ILE 69 HD13 ILE 69 9.255 -4.743 1.590 542 H SER 70 HN SER 70 15.079 -6.165 0.303 543 HA SER 70 HA SER 70 16.934 -4.424 1.379 544 HB2 SER 70 HB2 SER 70 17.285 -6.849 1.073 545 HB3 SER 70 HB1 SER 70 17.408 -6.609 -0.665 546 HG SER 70 HG SER 70 19.368 -5.819 -0.444 547 H GLU 71 HN GLU 71 15.641 -4.538 -1.864 548 HA GLU 71 HA GLU 71 17.618 -2.748 -2.980 549 HB2 GLU 71 HB2 GLU 71 15.000 -3.588 -4.198 550 HB3 GLU 71 HB1 GLU 71 16.461 -3.062 -5.025 551 HG2 GLU 71 HG2 GLU 71 16.792 -5.425 -3.345 552 HG3 GLU 71 HG1 GLU 71 15.695 -5.633 -4.703 553 H TYR 72 HN TYR 72 14.426 -2.720 -1.709 554 HA TYR 72 HA TYR 72 13.706 -0.136 -2.668 555 HB2 TYR 72 HB2 TYR 72 12.518 -2.102 -0.725 556 HB3 TYR 72 HB1 TYR 72 11.832 -0.494 -0.919 557 HD1 TYR 72 HD1 TYR 72 13.271 -2.027 -3.867 558 HD2 TYR 72 HD2 TYR 72 9.723 -1.608 -1.580 559 HE1 TYR 72 HE1 TYR 72 11.955 -2.847 -5.756 560 HE2 TYR 72 HE2 TYR 72 8.391 -2.442 -3.465 561 HH TYR 72 HH TYR 72 9.904 -3.804 -6.286 562 H VAL 73 HN VAL 73 14.953 -1.516 0.303 563 HA VAL 73 HA VAL 73 15.062 0.915 1.754 564 HB VAL 73 HB VAL 73 16.245 -0.115 3.419 565 HG11 VAL 73 HG11 VAL 73 14.916 -2.416 2.047 566 HG12 VAL 73 HG12 VAL 73 14.199 -1.310 3.213 567 HG13 VAL 73 HG13 VAL 73 15.472 -2.414 3.719 568 HG21 VAL 73 HG21 VAL 73 18.166 -0.698 1.869 569 HG22 VAL 73 HG22 VAL 73 17.385 -2.271 1.686 570 HG23 VAL 73 HG23 VAL 73 17.916 -1.721 3.284 571 H LYS 74 HN LYS 74 17.099 -0.771 -0.501 572 HA LYS 74 HA LYS 74 19.397 0.873 -0.353 573 HB2 LYS 74 HB2 LYS 74 18.575 -1.393 -1.757 574 HB3 LYS 74 HB1 LYS 74 18.796 -0.165 -2.997 575 HG2 LYS 74 HG2 LYS 74 20.890 -1.043 -2.970 576 HG3 LYS 74 HG1 LYS 74 21.087 0.206 -1.742 577 HD2 LYS 74 HD2 LYS 74 20.348 -2.650 -1.125 578 HD3 LYS 74 HD1 LYS 74 22.005 -2.045 -1.121 579 HE2 LYS 74 HE2 LYS 74 19.782 -0.915 0.565 580 HE3 LYS 74 HE1 LYS 74 20.926 -2.132 1.130 581 HZ1 LYS 74 HZ1 LYS 74 21.717 0.541 0.109 582 HZ2 LYS 74 HZ2 LYS 74 22.721 -0.610 0.832 583 HZ3 LYS 74 HZ3 LYS 74 21.531 0.167 1.747 584 H ALA 75 HN ALA 75 16.341 1.036 -2.002 585 HA ALA 75 HA ALA 75 16.879 3.183 -3.749 586 HB1 ALA 75 HB1 ALA 75 14.897 1.801 -3.958 587 HB2 ALA 75 HB2 ALA 75 14.439 3.494 -3.774 588 HB3 ALA 75 HB3 ALA 75 14.301 2.386 -2.407 589 H CYS 76 HN CYS 76 15.595 3.106 -0.451 590 HA CYS 76 HA CYS 76 15.849 6.006 -0.254 591 HB2 CYS 76 HB2 CYS 76 13.836 5.118 0.625 592 HB3 CYS 76 HB1 CYS 76 14.681 3.913 1.579 593 HG CYS 76 HG CYS 76 15.949 6.335 2.935 594 H ASP 77 HN ASP 77 18.003 3.666 -0.107 595 HA ASP 77 HA ASP 77 19.419 4.006 2.258 596 HB2 ASP 77 HB2 ASP 77 20.121 2.259 0.902 597 HB3 ASP 77 HB1 ASP 77 20.189 3.244 -0.548 598 H GLY 78 HN GLY 78 19.134 6.091 -0.516 599 HA2 GLY 78 HA3 GLY 78 21.139 7.931 0.534 600 HA3 GLY 78 HA2 GLY 78 20.223 8.126 -0.953 601 H ILE 79 HN ILE 79 17.711 7.450 0.674 602 HA ILE 79 HA ILE 79 17.090 10.197 1.247 603 HB ILE 79 HB ILE 79 15.382 7.737 1.493 604 HG12 ILE 79 HG12 ILE 79 15.429 9.825 -0.694 605 HG13 ILE 79 HG11 ILE 79 16.213 8.251 -0.814 606 HG21 ILE 79 HG21 ILE 79 14.510 10.615 1.383 607 HG22 ILE 79 HG22 ILE 79 14.628 9.667 2.864 608 HG23 ILE 79 HG23 ILE 79 13.485 9.199 1.606 609 HD11 ILE 79 HD11 ILE 79 13.283 8.581 -0.287 610 HD12 ILE 79 HD12 ILE 79 14.148 7.122 -0.782 611 HD13 ILE 79 HD13 ILE 79 13.968 8.474 -1.904 612 H GLY 80 HN GLY 80 16.336 10.989 3.216 613 HA2 GLY 80 HA3 GLY 80 15.731 10.135 5.575 614 HA3 GLY 80 HA2 GLY 80 17.399 9.583 5.544 615 H GLY 81 HN GLY 81 18.456 11.743 4.065 616 HA2 GLY 81 HA3 GLY 81 17.629 14.264 5.110 617 HA3 GLY 81 HA2 GLY 81 19.089 13.681 5.910 618 H ALA 82 HN ALA 82 18.699 15.987 4.146 619 HA ALA 82 HA ALA 82 19.820 17.107 2.530 620 HB1 ALA 82 HB1 ALA 82 21.710 14.763 2.567 621 HB2 ALA 82 HB2 ALA 82 21.816 16.193 3.592 622 HB3 ALA 82 HB3 ALA 82 22.021 16.342 1.848 623 H MET 83 HN MET 83 20.440 13.793 1.399 624 HA MET 83 HA MET 83 19.931 14.371 -1.296 625 HB2 MET 83 HB2 MET 83 19.746 11.700 0.110 626 HB3 MET 83 HB1 MET 83 19.876 11.938 -1.627 627 HG2 MET 83 HG2 MET 83 22.073 13.013 -1.272 628 HG3 MET 83 HG1 MET 83 21.940 12.642 0.444 629 HE1 MET 83 HE1 MET 83 24.429 11.770 -1.320 630 HE2 MET 83 HE2 MET 83 24.670 10.121 -0.745 631 HE3 MET 83 HE3 MET 83 24.261 11.400 0.397 632 H HIS 84 HN HIS 84 17.832 13.086 1.237 633 HA HIS 84 HA HIS 84 15.512 12.512 -0.169 634 HB2 HIS 84 HB2 HIS 84 15.516 12.079 2.175 635 HB3 HIS 84 HB1 HIS 84 15.980 13.725 2.569 636 HD1 HIS 84 HD1 HIS 84 14.058 14.292 4.094 637 HD2 HIS 84 HD2 HIS 84 12.788 12.859 0.407 638 HE1 HIS 84 HE1 HIS 84 11.591 14.717 4.021 639 HE2 HIS 84 HE2 HIS 84 10.812 13.666 1.872 640 H LYS 85 HN LYS 85 16.862 15.673 0.655 641 HA LYS 85 HA LYS 85 14.429 17.050 -0.069 642 HB2 LYS 85 HB2 LYS 85 17.149 18.205 0.557 643 HB3 LYS 85 HB1 LYS 85 15.620 19.074 0.527 644 HG2 LYS 85 HG2 LYS 85 16.461 16.941 2.483 645 HG3 LYS 85 HG1 LYS 85 16.215 18.658 2.807 646 HD2 LYS 85 HD2 LYS 85 13.831 18.388 2.248 647 HD3 LYS 85 HD1 LYS 85 14.107 16.666 1.984 648 HE2 LYS 85 HE2 LYS 85 13.186 16.961 4.175 649 HE3 LYS 85 HE1 LYS 85 14.873 16.477 4.327 650 HZ1 LYS 85 HZ1 LYS 85 15.484 18.732 4.799 651 HZ2 LYS 85 HZ2 LYS 85 14.234 18.286 5.847 652 HZ3 LYS 85 HZ3 LYS 85 13.909 19.278 4.518 653 H ALA 86 HN ALA 86 17.547 16.357 -1.510 654 HA ALA 86 HA ALA 86 17.161 18.018 -3.813 655 HB1 ALA 86 HB1 ALA 86 19.398 17.391 -3.081 656 HB2 ALA 86 HB2 ALA 86 19.101 16.824 -4.724 657 HB3 ALA 86 HB3 ALA 86 19.027 15.692 -3.372 658 H MET 87 HN MET 87 16.764 14.625 -3.072 659 HA MET 87 HA MET 87 15.904 13.897 -5.713 660 HB2 MET 87 HB2 MET 87 15.769 12.338 -3.119 661 HB3 MET 87 HB1 MET 87 15.622 11.673 -4.745 662 HG2 MET 87 HG2 MET 87 17.881 12.098 -5.234 663 HG3 MET 87 HG1 MET 87 18.060 13.163 -3.853 664 HE1 MET 87 HE1 MET 87 17.862 9.454 -5.090 665 HE2 MET 87 HE2 MET 87 16.416 9.550 -4.086 666 HE3 MET 87 HE3 MET 87 17.781 8.558 -3.574 667 H LEU 88 HN LEU 88 14.432 15.289 -3.029 668 HA LEU 88 HA LEU 88 11.882 14.301 -2.933 669 HB2 LEU 88 HB2 LEU 88 13.107 16.293 -1.719 670 HB3 LEU 88 HB1 LEU 88 12.300 17.254 -2.938 671 HG LEU 88 HG LEU 88 10.429 17.273 -1.735 672 HD11 LEU 88 HD11 LEU 88 10.612 14.271 -1.493 673 HD12 LEU 88 HD12 LEU 88 9.818 15.146 -2.806 674 HD13 LEU 88 HD13 LEU 88 9.195 15.265 -1.160 675 HD21 LEU 88 HD21 LEU 88 10.507 16.406 0.573 676 HD22 LEU 88 HD22 LEU 88 11.934 17.349 0.142 677 HD23 LEU 88 HD23 LEU 88 12.020 15.588 0.180 678 H MET 89 HN MET 89 13.047 16.915 -5.069 679 HA MET 89 HA MET 89 10.523 17.087 -6.428 680 HB2 MET 89 HB2 MET 89 11.992 19.051 -6.110 681 HB3 MET 89 HB1 MET 89 13.195 18.305 -7.149 682 HG2 MET 89 HG2 MET 89 11.937 19.991 -8.346 683 HG3 MET 89 HG1 MET 89 11.642 18.392 -9.024 684 HE1 MET 89 HE1 MET 89 8.209 20.188 -9.555 685 HE2 MET 89 HE2 MET 89 9.500 19.264 -10.322 686 HE3 MET 89 HE3 MET 89 9.824 20.880 -9.695 687 H ALA 90 HN ALA 90 13.230 15.081 -6.689 688 HA ALA 90 HA ALA 90 13.012 14.701 -9.560 689 HB1 ALA 90 HB1 ALA 90 15.208 14.756 -8.430 690 HB2 ALA 90 HB2 ALA 90 14.932 13.260 -9.325 691 HB3 ALA 90 HB3 ALA 90 14.770 13.281 -7.567 692 H GLN 91 HN GLN 91 11.856 13.217 -6.664 693 HA GLN 91 HA GLN 91 11.168 10.794 -8.181 694 HB2 GLN 91 HB2 GLN 91 11.788 10.949 -5.243 695 HB3 GLN 91 HB1 GLN 91 11.538 9.495 -6.206 696 HG2 GLN 91 HG2 GLN 91 13.507 10.002 -7.503 697 HG3 GLN 91 HG1 GLN 91 13.740 11.465 -6.558 698 HE21 GLN 91 HE21 GLN 91 13.079 10.437 -4.049 699 HE22 GLN 91 HE22 GLN 91 14.271 9.297 -3.585 700 H LEU 92 HN LEU 92 10.179 12.733 -5.345 701 HA LEU 92 HA LEU 92 7.873 11.545 -4.544 702 HB2 LEU 92 HB2 LEU 92 9.039 13.846 -3.931 703 HB3 LEU 92 HB1 LEU 92 7.804 14.503 -4.975 704 HG LEU 92 HG LEU 92 7.521 13.206 -2.293 705 HD11 LEU 92 HD11 LEU 92 6.337 15.674 -3.538 706 HD12 LEU 92 HD12 LEU 92 7.747 15.625 -2.484 707 HD13 LEU 92 HD13 LEU 92 6.164 15.165 -1.857 708 HD21 LEU 92 HD21 LEU 92 5.306 13.467 -4.327 709 HD22 LEU 92 HD22 LEU 92 5.077 13.119 -2.613 710 HD23 LEU 92 HD23 LEU 92 5.932 11.967 -3.640 711 H GLU 93 HN GLU 93 8.461 13.499 -7.333 712 HA GLU 93 HA GLU 93 7.115 14.478 -8.890 713 HB2 GLU 93 HB2 GLU 93 6.932 11.543 -9.037 714 HB3 GLU 93 HB1 GLU 93 6.250 12.537 -10.316 715 HG2 GLU 93 HG2 GLU 93 9.092 12.766 -9.378 716 HG3 GLU 93 HG1 GLU 93 8.602 11.649 -10.643 717 H2 PRO 1 HT1 PRO 1 5.421 -3.705 -13.413 718 H3 PRO 1 HT2 PRO 1 5.809 -2.189 -13.886 719 HA PRO 1 HA PRO 1 6.531 -2.145 -11.843 720 HB2 PRO 1 HB2 PRO 1 4.437 -1.161 -10.492 721 HB3 PRO 1 HB1 PRO 1 5.175 -0.262 -11.822 722 HG2 PRO 1 HG2 PRO 1 2.594 -1.648 -11.725 723 HG3 PRO 1 HG1 PRO 1 3.161 -0.412 -12.860 724 HD2 PRO 1 HD2 PRO 1 3.092 -3.309 -13.169 725 HD3 PRO 1 HD1 PRO 1 3.441 -2.066 -14.389 726 H SER 2 HN SER 2 4.829 -2.335 -9.429 727 HA SER 2 HA SER 2 4.558 -5.119 -8.956 728 HB2 SER 2 HB2 SER 2 3.096 -2.811 -7.658 729 HB3 SER 2 HB1 SER 2 3.194 -4.448 -7.031 730 HG SER 2 HG SER 2 5.635 -3.927 -7.306 731 H PHE 3 HN PHE 3 2.206 -5.940 -8.414 732 HA PHE 3 HA PHE 3 0.625 -5.615 -10.781 733 HB2 PHE 3 HB2 PHE 3 -0.998 -6.821 -8.927 734 HB3 PHE 3 HB1 PHE 3 0.082 -7.674 -10.026 735 HD1 PHE 3 HD1 PHE 3 -0.621 -6.669 -6.648 736 HD2 PHE 3 HD2 PHE 3 2.278 -8.483 -9.180 737 HE1 PHE 3 HE1 PHE 3 0.547 -7.554 -4.686 738 HE2 PHE 3 HE2 PHE 3 3.454 -9.375 -7.212 739 HZ PHE 3 HZ PHE 3 2.588 -8.909 -4.953 740 H ASN 4 HN ASN 4 0.285 -4.809 -7.385 741 HA ASN 4 HA ASN 4 -2.351 -3.749 -7.781 742 HB2 ASN 4 HB2 ASN 4 -2.302 -3.446 -5.350 743 HB3 ASN 4 HB1 ASN 4 -1.812 -5.075 -5.809 744 HD21 ASN 4 HD21 ASN 4 -0.565 -1.897 -4.925 745 HD22 ASN 4 HD22 ASN 4 0.909 -2.478 -4.224 746 H THR 5 HN THR 5 0.461 -2.356 -8.505 747 HA THR 5 HA THR 5 0.499 -0.006 -6.923 748 HB THR 5 HB THR 5 1.697 0.831 -9.140 749 HG1 THR 5 HG1 THR 5 1.390 -0.835 -10.507 750 HG21 THR 5 HG21 THR 5 3.760 -0.335 -8.269 751 HG22 THR 5 HG22 THR 5 2.702 -1.079 -7.068 752 HG23 THR 5 HG23 THR 5 2.878 0.674 -7.124 753 H VAL 6 HN VAL 6 -1.758 -1.010 -9.178 754 HA VAL 6 HA VAL 6 -2.418 1.582 -10.184 755 HB VAL 6 HB VAL 6 -4.194 0.584 -11.317 756 HG11 VAL 6 HG11 VAL 6 -2.089 -0.277 -12.144 757 HG12 VAL 6 HG12 VAL 6 -3.353 -1.497 -12.292 758 HG13 VAL 6 HG13 VAL 6 -2.166 -1.613 -10.995 759 HG21 VAL 6 HG21 VAL 6 -4.152 -1.793 -9.478 760 HG22 VAL 6 HG22 VAL 6 -5.379 -1.382 -10.689 761 HG23 VAL 6 HG23 VAL 6 -5.192 -0.388 -9.234 762 H ARG 7 HN ARG 7 -3.835 3.025 -9.267 763 HA ARG 7 HA ARG 7 -5.559 2.100 -7.176 764 HB2 ARG 7 HB2 ARG 7 -4.585 3.585 -5.446 765 HB3 ARG 7 HB1 ARG 7 -3.650 2.181 -5.913 766 HG2 ARG 7 HG2 ARG 7 -2.756 4.251 -7.545 767 HG3 ARG 7 HG1 ARG 7 -2.872 4.905 -5.907 768 HD2 ARG 7 HD2 ARG 7 -1.481 3.186 -5.029 769 HD3 ARG 7 HD1 ARG 7 -1.565 2.269 -6.533 770 HE ARG 7 HE ARG 7 -0.482 4.818 -7.066 771 HH11 ARG 7 HH11 ARG 7 0.385 1.908 -5.341 772 HH12 ARG 7 HH12 ARG 7 2.067 2.030 -5.717 773 HH21 ARG 7 HH21 ARG 7 1.725 4.995 -7.574 774 HH22 ARG 7 HH22 ARG 7 2.837 3.796 -7.004 775 H GLN 8 HN GLN 8 -6.859 3.658 -6.244 776 HA GLN 8 HA GLN 8 -8.366 5.188 -7.839 777 HB2 GLN 8 HB2 GLN 8 -8.040 4.805 -5.054 778 HB3 GLN 8 HB1 GLN 8 -8.223 6.536 -5.319 779 HG2 GLN 8 HG2 GLN 8 -10.289 6.178 -6.495 780 HG3 GLN 8 HG1 GLN 8 -10.092 4.432 -6.371 781 HE21 GLN 8 HE21 GLN 8 -12.264 6.053 -5.448 782 HE22 GLN 8 HE22 GLN 8 -12.357 5.828 -3.725 783 H GLY 9 HN GLY 9 -7.735 6.663 -9.251 784 HA2 GLY 9 HA3 GLY 9 -5.857 8.761 -8.556 785 HA3 GLY 9 HA2 GLY 9 -6.771 8.617 -10.054 786 H SER 10 HN SER 10 -7.169 10.941 -9.794 787 HA SER 10 HA SER 10 -8.387 12.150 -7.630 788 HB2 SER 10 HB2 SER 10 -8.837 12.773 -10.559 789 HB3 SER 10 HB1 SER 10 -9.161 13.862 -9.211 790 HG SER 10 HG SER 10 -6.643 12.916 -9.051 791 H LYS 11 HN LYS 11 -10.035 11.335 -6.591 792 HA LYS 11 HA LYS 11 -11.941 10.247 -6.061 793 HB2 LYS 11 HB2 LYS 11 -13.937 11.332 -6.742 794 HB3 LYS 11 HB1 LYS 11 -12.725 12.568 -6.516 795 HG2 LYS 11 HG2 LYS 11 -12.378 12.597 -8.944 796 HG3 LYS 11 HG1 LYS 11 -13.671 11.429 -9.141 797 HD2 LYS 11 HD2 LYS 11 -15.214 13.060 -8.077 798 HD3 LYS 11 HD1 LYS 11 -13.895 14.235 -8.064 799 HE2 LYS 11 HE2 LYS 11 -13.724 14.043 -10.509 800 HE3 LYS 11 HE1 LYS 11 -15.076 12.913 -10.502 801 HZ1 LYS 11 HZ1 LYS 11 -15.772 15.158 -11.067 802 HZ2 LYS 11 HZ2 LYS 11 -15.195 15.734 -9.587 803 HZ3 LYS 11 HZ3 LYS 11 -16.489 14.648 -9.625 804 H GLU 12 HN GLU 12 -10.492 8.734 -7.944 805 HA GLU 12 HA GLU 12 -12.059 7.739 -10.055 806 HB2 GLU 12 HB2 GLU 12 -9.636 7.348 -9.781 807 HB3 GLU 12 HB1 GLU 12 -9.961 6.339 -8.388 808 HG2 GLU 12 HG2 GLU 12 -11.088 4.716 -9.782 809 HG3 GLU 12 HG1 GLU 12 -10.871 5.753 -11.191 810 HA PRO 13 HA PRO 13 -15.350 5.572 -7.939 811 HB2 PRO 13 HB2 PRO 13 -15.033 3.518 -10.024 812 HB3 PRO 13 HB1 PRO 13 -16.462 4.450 -9.588 813 HG2 PRO 13 HG2 PRO 13 -15.040 4.897 -11.850 814 HG3 PRO 13 HG1 PRO 13 -15.936 6.158 -10.998 815 HD2 PRO 13 HD2 PRO 13 -13.027 5.697 -11.160 816 HD3 PRO 13 HD1 PRO 13 -13.916 7.198 -10.857 817 H TYR 14 HN TYR 14 -15.151 4.221 -6.262 818 HA TYR 14 HA TYR 14 -12.560 3.210 -5.841 819 HB2 TYR 14 HB2 TYR 14 -13.852 4.239 -4.032 820 HB3 TYR 14 HB1 TYR 14 -14.978 2.888 -4.071 821 HD1 TYR 14 HD1 TYR 14 -13.866 0.550 -3.868 822 HD2 TYR 14 HD2 TYR 14 -12.094 4.142 -2.504 823 HE1 TYR 14 HE1 TYR 14 -12.445 -0.755 -2.381 824 HE2 TYR 14 HE2 TYR 14 -10.651 2.857 -0.990 825 HH TYR 14 HH TYR 14 -10.124 0.820 -0.240 826 HA PRO 15 HA PRO 15 -14.629 -1.204 -5.616 827 HB2 PRO 15 HB2 PRO 15 -16.811 -0.900 -7.570 828 HB3 PRO 15 HB1 PRO 15 -16.792 -1.766 -6.036 829 HG2 PRO 15 HG2 PRO 15 -18.107 0.548 -6.361 830 HG3 PRO 15 HG1 PRO 15 -17.375 0.081 -4.831 831 HD2 PRO 15 HD2 PRO 15 -16.470 2.084 -6.827 832 HD3 PRO 15 HD1 PRO 15 -16.269 2.062 -5.070 833 H ASP 16 HN ASP 16 -14.367 0.948 -8.165 834 HA ASP 16 HA ASP 16 -13.702 -1.020 -10.178 835 HB2 ASP 16 HB2 ASP 16 -14.180 1.929 -10.197 836 HB3 ASP 16 HB1 ASP 16 -13.242 1.220 -11.503 837 H PHE 17 HN PHE 17 -12.188 1.612 -8.376 838 HA PHE 17 HA PHE 17 -9.632 1.499 -9.481 839 HB2 PHE 17 HB2 PHE 17 -9.341 3.165 -7.943 840 HB3 PHE 17 HB1 PHE 17 -10.902 2.751 -7.251 841 HD1 PHE 17 HD1 PHE 17 -7.368 1.513 -7.127 842 HD2 PHE 17 HD2 PHE 17 -10.989 2.244 -5.043 843 HE1 PHE 17 HE1 PHE 17 -6.299 0.823 -5.014 844 HE2 PHE 17 HE2 PHE 17 -9.920 1.557 -2.952 845 HZ PHE 17 HZ PHE 17 -7.569 0.872 -2.938 846 H VAL 18 HN VAL 18 -11.131 -0.337 -6.893 847 HA VAL 18 HA VAL 18 -8.772 -1.879 -6.394 848 HB VAL 18 HB VAL 18 -10.020 -1.533 -4.458 849 HG11 VAL 18 HG11 VAL 18 -12.435 -2.509 -5.971 850 HG12 VAL 18 HG12 VAL 18 -12.104 -0.833 -5.522 851 HG13 VAL 18 HG13 VAL 18 -12.403 -2.048 -4.262 852 HG21 VAL 18 HG21 VAL 18 -10.532 -4.252 -5.592 853 HG22 VAL 18 HG22 VAL 18 -10.978 -3.815 -3.942 854 HG23 VAL 18 HG23 VAL 18 -9.285 -3.758 -4.441 855 H ALA 19 HN ALA 19 -11.780 -2.371 -8.184 856 HA ALA 19 HA ALA 19 -11.539 -5.124 -8.615 857 HB1 ALA 19 HB1 ALA 19 -13.524 -3.802 -9.268 858 HB2 ALA 19 HB2 ALA 19 -12.939 -4.835 -10.573 859 HB3 ALA 19 HB3 ALA 19 -12.599 -3.105 -10.597 860 H ARG 20 HN ARG 20 -9.842 -2.461 -10.211 861 HA ARG 20 HA ARG 20 -8.587 -4.340 -12.027 862 HB2 ARG 20 HB2 ARG 20 -7.268 -2.418 -12.824 863 HB3 ARG 20 HB1 ARG 20 -8.993 -2.124 -12.917 864 HG2 ARG 20 HG2 ARG 20 -8.949 -0.542 -11.242 865 HG3 ARG 20 HG1 ARG 20 -7.449 -1.171 -10.549 866 HD2 ARG 20 HD2 ARG 20 -6.158 -0.298 -12.334 867 HD3 ARG 20 HD1 ARG 20 -7.591 0.082 -13.273 868 HE ARG 20 HE ARG 20 -7.986 1.642 -11.176 869 HH11 ARG 20 HH11 ARG 20 -5.066 1.058 -13.014 870 HH12 ARG 20 HH12 ARG 20 -4.400 2.626 -12.697 871 HH21 ARG 20 HH21 ARG 20 -7.143 3.724 -10.795 872 HH22 ARG 20 HH22 ARG 20 -5.583 4.146 -11.442 873 H LEU 21 HN LEU 21 -8.092 -2.778 -9.011 874 HA LEU 21 HA LEU 21 -5.417 -3.299 -8.520 875 HB2 LEU 21 HB2 LEU 21 -7.190 -2.060 -7.118 876 HB3 LEU 21 HB1 LEU 21 -7.605 -3.630 -6.475 877 HG LEU 21 HG LEU 21 -5.541 -3.819 -5.347 878 HD11 LEU 21 HD11 LEU 21 -4.021 -3.043 -7.031 879 HD12 LEU 21 HD12 LEU 21 -3.775 -2.085 -5.568 880 HD13 LEU 21 HD13 LEU 21 -4.680 -1.413 -6.926 881 HD21 LEU 21 HD21 LEU 21 -5.449 -1.630 -4.093 882 HD22 LEU 21 HD22 LEU 21 -6.999 -2.472 -4.123 883 HD23 LEU 21 HD23 LEU 21 -6.729 -1.085 -5.178 884 H GLN 22 HN GLN 22 -8.284 -5.302 -8.067 885 HA GLN 22 HA GLN 22 -6.903 -7.614 -7.206 886 HB2 GLN 22 HB2 GLN 22 -9.624 -7.555 -8.490 887 HB3 GLN 22 HB1 GLN 22 -8.959 -8.731 -7.346 888 HG2 GLN 22 HG2 GLN 22 -8.873 -6.795 -5.730 889 HG3 GLN 22 HG1 GLN 22 -9.879 -5.935 -6.855 890 HE21 GLN 22 HE21 GLN 22 -11.283 -5.823 -5.056 891 HE22 GLN 22 HE22 GLN 22 -12.381 -7.123 -4.757 892 H ASP 23 HN ASP 23 -8.294 -6.527 -10.226 893 HA ASP 23 HA ASP 23 -7.976 -8.787 -11.768 894 HB2 ASP 23 HB2 ASP 23 -8.960 -6.501 -12.368 895 HB3 ASP 23 HB1 ASP 23 -7.304 -6.064 -12.792 896 H VAL 24 HN VAL 24 -5.556 -6.229 -11.222 897 HA VAL 24 HA VAL 24 -3.690 -7.637 -12.914 898 HB VAL 24 HB VAL 24 -3.716 -5.197 -13.003 899 HG11 VAL 24 HG11 VAL 24 -4.429 -4.741 -10.743 900 HG12 VAL 24 HG12 VAL 24 -2.943 -3.861 -11.103 901 HG13 VAL 24 HG13 VAL 24 -2.887 -5.323 -10.117 902 HG21 VAL 24 HG21 VAL 24 -1.602 -6.221 -13.542 903 HG22 VAL 24 HG22 VAL 24 -1.171 -6.325 -11.838 904 HG23 VAL 24 HG23 VAL 24 -1.283 -4.747 -12.621 905 H ALA 25 HN ALA 25 -4.457 -7.337 -9.577 906 HA ALA 25 HA ALA 25 -2.017 -8.434 -8.543 907 HB1 ALA 25 HB1 ALA 25 -4.785 -8.394 -7.324 908 HB2 ALA 25 HB2 ALA 25 -3.541 -7.168 -7.085 909 HB3 ALA 25 HB3 ALA 25 -3.291 -8.806 -6.481 910 H GLN 26 HN GLN 26 -4.748 -9.491 -10.175 911 HA GLN 26 HA GLN 26 -4.457 -12.265 -9.454 912 HB2 GLN 26 HB2 GLN 26 -6.627 -12.072 -9.902 913 HB3 GLN 26 HB1 GLN 26 -6.366 -10.524 -10.688 914 HG2 GLN 26 HG2 GLN 26 -7.229 -11.696 -12.402 915 HG3 GLN 26 HG1 GLN 26 -5.522 -12.037 -12.652 916 HE21 GLN 26 HE21 GLN 26 -5.391 -13.799 -10.349 917 HE22 GLN 26 HE22 GLN 26 -6.155 -15.265 -10.815 918 H LYS 27 HN LYS 27 -3.826 -10.109 -12.131 919 HA LYS 27 HA LYS 27 -2.971 -12.003 -14.026 920 HB2 LYS 27 HB2 LYS 27 -2.092 -9.122 -13.770 921 HB3 LYS 27 HB1 LYS 27 -2.024 -10.114 -15.227 922 HG2 LYS 27 HG2 LYS 27 -4.508 -9.213 -13.790 923 HG3 LYS 27 HG1 LYS 27 -3.897 -8.591 -15.323 924 HD2 LYS 27 HD2 LYS 27 -4.506 -10.492 -16.480 925 HD3 LYS 27 HD1 LYS 27 -4.486 -11.506 -15.037 926 HE2 LYS 27 HE2 LYS 27 -6.508 -10.606 -14.250 927 HE3 LYS 27 HE1 LYS 27 -6.451 -9.277 -15.400 928 HZ1 LYS 27 HZ1 LYS 27 -6.865 -12.144 -16.059 929 HZ2 LYS 27 HZ2 LYS 27 -6.789 -10.889 -17.188 930 HZ3 LYS 27 HZ3 LYS 27 -8.058 -10.943 -16.073 931 H SER 28 HN SER 28 -1.139 -10.203 -11.567 932 HA SER 28 HA SER 28 1.325 -11.333 -12.658 933 HB2 SER 28 HB2 SER 28 0.921 -9.172 -10.604 934 HB3 SER 28 HB1 SER 28 2.467 -9.643 -11.305 935 HG SER 28 HG SER 28 0.840 -9.137 -13.317 936 H ILE 29 HN ILE 29 -0.942 -11.925 -10.332 937 HA ILE 29 HA ILE 29 1.013 -13.301 -8.613 938 HB ILE 29 HB ILE 29 -1.728 -12.264 -7.935 939 HG12 ILE 29 HG12 ILE 29 0.960 -11.466 -6.828 940 HG13 ILE 29 HG11 ILE 29 0.021 -10.542 -8.003 941 HG21 ILE 29 HG21 ILE 29 -1.392 -14.334 -6.785 942 HG22 ILE 29 HG22 ILE 29 -1.301 -12.985 -5.652 943 HG23 ILE 29 HG23 ILE 29 0.180 -13.788 -6.195 944 HD11 ILE 29 HD11 ILE 29 -0.232 -9.731 -5.688 945 HD12 ILE 29 HD12 ILE 29 -0.954 -11.290 -5.264 946 HD13 ILE 29 HD13 ILE 29 -1.751 -10.232 -6.435 947 H ALA 30 HN ALA 30 0.979 -15.445 -8.696 948 HA ALA 30 HA ALA 30 -1.286 -16.816 -9.909 949 HB1 ALA 30 HB1 ALA 30 0.980 -17.463 -10.563 950 HB2 ALA 30 HB2 ALA 30 0.129 -18.805 -9.801 951 HB3 ALA 30 HB3 ALA 30 1.340 -17.901 -8.894 952 H ASP 31 HN ASP 31 -0.508 -15.700 -6.928 953 HA ASP 31 HA ASP 31 -1.607 -17.975 -5.432 954 HB2 ASP 31 HB2 ASP 31 0.597 -16.775 -4.847 955 HB3 ASP 31 HB1 ASP 31 -0.453 -15.480 -4.273 956 H GLU 32 HN GLU 32 -3.743 -17.887 -5.089 957 HA GLU 32 HA GLU 32 -5.338 -15.573 -5.286 958 HB2 GLU 32 HB2 GLU 32 -7.081 -16.930 -4.201 959 HB3 GLU 32 HB1 GLU 32 -6.265 -17.834 -5.469 960 HG2 GLU 32 HG2 GLU 32 -4.961 -19.029 -3.830 961 HG3 GLU 32 HG1 GLU 32 -5.664 -18.064 -2.531 962 H LYS 33 HN LYS 33 -3.353 -16.759 -2.705 963 HA LYS 33 HA LYS 33 -4.803 -15.439 -0.605 964 HB2 LYS 33 HB2 LYS 33 -1.982 -16.536 -0.591 965 HB3 LYS 33 HB1 LYS 33 -2.870 -15.994 0.819 966 HG2 LYS 33 HG2 LYS 33 -3.574 -18.056 1.095 967 HG3 LYS 33 HG1 LYS 33 -4.504 -17.895 -0.396 968 HD2 LYS 33 HD2 LYS 33 -2.670 -18.759 -1.687 969 HD3 LYS 33 HD1 LYS 33 -1.621 -18.763 -0.266 970 HE2 LYS 33 HE2 LYS 33 -3.171 -20.369 0.802 971 HE3 LYS 33 HE1 LYS 33 -4.083 -20.430 -0.702 972 HZ1 LYS 33 HZ1 LYS 33 -2.150 -21.296 -1.826 973 HZ2 LYS 33 HZ2 LYS 33 -2.515 -22.274 -0.498 974 HZ3 LYS 33 HZ3 LYS 33 -1.230 -21.179 -0.412 975 H ALA 34 HN ALA 34 -1.669 -14.902 -2.206 976 HA ALA 34 HA ALA 34 -1.284 -12.346 -1.081 977 HB1 ALA 34 HB1 ALA 34 -0.197 -13.468 -3.670 978 HB2 ALA 34 HB2 ALA 34 0.547 -13.611 -2.078 979 HB3 ALA 34 HB3 ALA 34 0.401 -12.029 -2.844 980 H ARG 35 HN ARG 35 -3.184 -13.458 -3.773 981 HA ARG 35 HA ARG 35 -3.523 -11.021 -5.170 982 HB2 ARG 35 HB2 ARG 35 -4.253 -13.517 -5.711 983 HB3 ARG 35 HB1 ARG 35 -5.757 -12.989 -4.962 984 HG2 ARG 35 HG2 ARG 35 -4.569 -11.285 -7.112 985 HG3 ARG 35 HG1 ARG 35 -5.343 -12.799 -7.574 986 HD2 ARG 35 HD2 ARG 35 -6.613 -10.530 -6.035 987 HD3 ARG 35 HD1 ARG 35 -6.889 -10.950 -7.736 988 HE ARG 35 HE ARG 35 -7.654 -13.196 -6.697 989 HH11 ARG 35 HH11 ARG 35 -8.195 -10.027 -5.303 990 HH12 ARG 35 HH12 ARG 35 -9.657 -10.494 -4.497 991 HH21 ARG 35 HH21 ARG 35 -9.571 -13.808 -5.628 992 HH22 ARG 35 HH22 ARG 35 -10.429 -12.640 -4.669 993 H LYS 36 HN LYS 36 -5.798 -12.657 -2.958 994 HA LYS 36 HA LYS 36 -7.578 -10.576 -2.660 995 HB2 LYS 36 HB2 LYS 36 -7.997 -11.623 -0.393 996 HB3 LYS 36 HB1 LYS 36 -8.229 -12.637 -1.809 997 HG2 LYS 36 HG2 LYS 36 -5.836 -13.247 -1.424 998 HG3 LYS 36 HG1 LYS 36 -6.069 -12.544 0.182 999 HD2 LYS 36 HD2 LYS 36 -7.759 -14.557 -1.070 1000 HD3 LYS 36 HD1 LYS 36 -6.525 -14.970 0.108 1001 HE2 LYS 36 HE2 LYS 36 -8.769 -13.031 0.655 1002 HE3 LYS 36 HE1 LYS 36 -8.909 -14.757 1.007 1003 HZ1 LYS 36 HZ1 LYS 36 -6.896 -14.486 2.427 1004 HZ2 LYS 36 HZ2 LYS 36 -8.249 -13.640 2.974 1005 HZ3 LYS 36 HZ3 LYS 36 -7.005 -12.814 2.189 1006 H VAL 37 HN VAL 37 -5.005 -11.453 -0.475 1007 HA VAL 37 HA VAL 37 -5.519 -9.485 1.406 1008 HB VAL 37 HB VAL 37 -3.423 -9.962 2.418 1009 HG11 VAL 37 HG11 VAL 37 -3.748 -12.629 1.309 1010 HG12 VAL 37 HG12 VAL 37 -5.302 -11.864 1.699 1011 HG13 VAL 37 HG13 VAL 37 -4.052 -12.046 2.954 1012 HG21 VAL 37 HG21 VAL 37 -1.941 -9.706 0.519 1013 HG22 VAL 37 HG22 VAL 37 -2.600 -11.160 -0.227 1014 HG23 VAL 37 HG23 VAL 37 -1.674 -11.281 1.269 1015 H ILE 38 HN ILE 38 -3.635 -9.222 -1.564 1016 HA ILE 38 HA ILE 38 -2.676 -6.640 -0.741 1017 HB ILE 38 HB ILE 38 -1.566 -8.418 -2.442 1018 HG12 ILE 38 HG12 ILE 38 -0.803 -5.761 -3.230 1019 HG13 ILE 38 HG11 ILE 38 -1.122 -5.818 -1.500 1020 HG21 ILE 38 HG21 ILE 38 -1.654 -7.526 -4.700 1021 HG22 ILE 38 HG22 ILE 38 -2.828 -6.310 -4.188 1022 HG23 ILE 38 HG23 ILE 38 -3.269 -8.022 -4.178 1023 HD11 ILE 38 HD11 ILE 38 0.475 -7.543 -1.213 1024 HD12 ILE 38 HD12 ILE 38 1.211 -6.219 -2.122 1025 HD13 ILE 38 HD13 ILE 38 0.700 -7.687 -2.949 1026 H VAL 39 HN VAL 39 -5.259 -7.882 -2.756 1027 HA VAL 39 HA VAL 39 -5.888 -5.317 -3.801 1028 HB VAL 39 HB VAL 39 -7.827 -6.162 -4.649 1029 HG11 VAL 39 HG11 VAL 39 -5.964 -8.514 -4.413 1030 HG12 VAL 39 HG12 VAL 39 -5.926 -7.251 -5.643 1031 HG13 VAL 39 HG13 VAL 39 -7.277 -8.386 -5.578 1032 HG21 VAL 39 HG21 VAL 39 -9.027 -8.161 -3.926 1033 HG22 VAL 39 HG22 VAL 39 -8.889 -6.991 -2.613 1034 HG23 VAL 39 HG23 VAL 39 -7.841 -8.411 -2.643 1035 H GLU 40 HN GLU 40 -7.108 -7.189 -1.091 1036 HA GLU 40 HA GLU 40 -8.812 -5.245 -0.046 1037 HB2 GLU 40 HB2 GLU 40 -7.535 -7.719 1.064 1038 HB3 GLU 40 HB1 GLU 40 -8.669 -6.751 1.988 1039 HG2 GLU 40 HG2 GLU 40 -10.401 -7.130 0.447 1040 HG3 GLU 40 HG1 GLU 40 -9.314 -7.796 -0.737 1041 H LEU 41 HN LEU 41 -5.398 -5.697 0.249 1042 HA LEU 41 HA LEU 41 -5.200 -3.886 2.506 1043 HB2 LEU 41 HB2 LEU 41 -3.528 -5.813 1.405 1044 HB3 LEU 41 HB1 LEU 41 -2.733 -4.294 1.036 1045 HG LEU 41 HG LEU 41 -1.816 -4.951 3.080 1046 HD11 LEU 41 HD11 LEU 41 -2.453 -3.282 4.608 1047 HD12 LEU 41 HD12 LEU 41 -4.050 -3.144 3.884 1048 HD13 LEU 41 HD13 LEU 41 -2.630 -2.623 2.988 1049 HD21 LEU 41 HD21 LEU 41 -3.308 -6.742 3.661 1050 HD22 LEU 41 HD22 LEU 41 -4.611 -5.600 3.982 1051 HD23 LEU 41 HD23 LEU 41 -3.189 -5.628 5.025 1052 H MET 42 HN MET 42 -4.182 -3.792 -0.918 1053 HA MET 42 HA MET 42 -3.240 -1.126 -0.858 1054 HB2 MET 42 HB2 MET 42 -4.200 -2.780 -3.194 1055 HB3 MET 42 HB1 MET 42 -3.310 -1.256 -3.339 1056 HG2 MET 42 HG2 MET 42 -2.379 -3.896 -2.257 1057 HG3 MET 42 HG1 MET 42 -1.760 -2.986 -3.625 1058 HE1 MET 42 HE1 MET 42 0.636 -3.477 -2.713 1059 HE2 MET 42 HE2 MET 42 -0.004 -4.283 -1.280 1060 HE3 MET 42 HE3 MET 42 1.200 -3.006 -1.105 1061 H ALA 43 HN ALA 43 -6.312 -2.552 -1.161 1062 HA ALA 43 HA ALA 43 -7.950 -0.685 -2.209 1063 HB1 ALA 43 HB1 ALA 43 -8.766 -2.736 -1.325 1064 HB2 ALA 43 HB2 ALA 43 -9.593 -1.410 -0.499 1065 HB3 ALA 43 HB3 ALA 43 -8.287 -2.285 0.310 1066 H TYR 44 HN TYR 44 -6.142 -0.539 0.798 1067 HA TYR 44 HA TYR 44 -7.280 2.122 1.406 1068 HB2 TYR 44 HB2 TYR 44 -7.392 0.621 3.327 1069 HB3 TYR 44 HB1 TYR 44 -5.708 0.193 3.108 1070 HD1 TYR 44 HD1 TYR 44 -7.989 2.403 4.757 1071 HD2 TYR 44 HD2 TYR 44 -3.944 2.025 3.546 1072 HE1 TYR 44 HE1 TYR 44 -7.349 4.093 6.415 1073 HE2 TYR 44 HE2 TYR 44 -3.286 3.727 5.184 1074 HH TYR 44 HH TYR 44 -4.451 5.687 6.381 1075 H GLU 45 HN GLU 45 -4.218 0.403 1.791 1076 HA GLU 45 HA GLU 45 -2.522 2.450 2.081 1077 HB2 GLU 45 HB2 GLU 45 -1.699 0.190 0.350 1078 HB3 GLU 45 HB1 GLU 45 -0.797 0.980 1.636 1079 HG2 GLU 45 HG2 GLU 45 -3.151 -0.814 1.971 1080 HG3 GLU 45 HG1 GLU 45 -1.488 -1.294 2.213 1081 H ASN 46 HN ASN 46 -3.908 1.344 -0.953 1082 HA ASN 46 HA ASN 46 -2.104 3.102 -2.433 1083 HB2 ASN 46 HB2 ASN 46 -3.648 0.630 -3.110 1084 HB3 ASN 46 HB1 ASN 46 -3.263 1.784 -4.377 1085 HD21 ASN 46 HD21 ASN 46 -1.843 0.375 -5.471 1086 HD22 ASN 46 HD22 ASN 46 -0.322 -0.085 -4.797 1087 H ALA 47 HN ALA 47 -5.340 2.805 -1.350 1088 HA ALA 47 HA ALA 47 -6.772 3.913 -3.483 1089 HB1 ALA 47 HB1 ALA 47 -7.875 2.763 -1.658 1090 HB2 ALA 47 HB2 ALA 47 -8.527 4.393 -1.850 1091 HB3 ALA 47 HB3 ALA 47 -7.397 4.042 -0.544 1092 H ASN 48 HN ASN 48 -8.163 5.926 -3.004 1093 HA ASN 48 HA ASN 48 -6.561 8.229 -3.154 1094 HB2 ASN 48 HB2 ASN 48 -9.455 7.618 -2.955 1095 HB3 ASN 48 HB1 ASN 48 -8.970 9.228 -2.431 1096 HD21 ASN 48 HD21 ASN 48 -10.553 8.341 -4.762 1097 HD22 ASN 48 HD22 ASN 48 -9.717 8.974 -6.140 1098 HA PRO 49 HA PRO 49 -5.389 8.993 0.997 1099 HB2 PRO 49 HB2 PRO 49 -5.647 11.771 0.939 1100 HB3 PRO 49 HB1 PRO 49 -4.217 10.855 0.462 1101 HG2 PRO 49 HG2 PRO 49 -6.376 12.027 -1.221 1102 HG3 PRO 49 HG1 PRO 49 -4.643 11.875 -1.558 1103 HD2 PRO 49 HD2 PRO 49 -6.451 10.257 -2.701 1104 HD3 PRO 49 HD1 PRO 49 -4.841 9.669 -2.233 1105 H GLU 50 HN GLU 50 -8.379 10.246 -0.232 1106 HA GLU 50 HA GLU 50 -9.518 10.770 2.368 1107 HB2 GLU 50 HB2 GLU 50 -11.375 11.615 1.182 1108 HB3 GLU 50 HB1 GLU 50 -9.977 12.060 0.213 1109 HG2 GLU 50 HG2 GLU 50 -11.087 9.484 -0.478 1110 HG3 GLU 50 HG1 GLU 50 -12.177 10.833 -0.738 1111 H CYS 51 HN CYS 51 -9.403 8.297 -0.051 1112 HA CYS 51 HA CYS 51 -11.867 7.053 0.749 1113 HB2 CYS 51 HB2 CYS 51 -9.796 6.326 -1.332 1114 HB3 CYS 51 HB1 CYS 51 -11.287 5.426 -1.053 1115 HG CYS 51 HG CYS 51 -10.994 8.630 -2.213 1116 H GLN 52 HN GLN 52 -8.419 6.430 0.978 1117 HA GLN 52 HA GLN 52 -8.746 3.990 2.422 1118 HB2 GLN 52 HB2 GLN 52 -6.422 4.162 2.951 1119 HB3 GLN 52 HB1 GLN 52 -6.615 4.657 1.277 1120 HG2 GLN 52 HG2 GLN 52 -6.532 7.016 2.029 1121 HG3 GLN 52 HG1 GLN 52 -6.197 6.445 3.663 1122 HE21 GLN 52 HE21 GLN 52 -4.723 4.168 2.561 1123 HE22 GLN 52 HE22 GLN 52 -3.193 4.759 2.074 1124 H SER 53 HN SER 53 -8.701 7.332 3.011 1125 HA SER 53 HA SER 53 -8.713 7.247 5.834 1126 HB2 SER 53 HB2 SER 53 -9.305 9.272 3.728 1127 HB3 SER 53 HB1 SER 53 -9.652 9.635 5.428 1128 HG SER 53 HG SER 53 -7.302 9.674 4.142 1129 H ALA 54 HN ALA 54 -11.109 6.801 3.374 1130 HA ALA 54 HA ALA 54 -13.288 6.814 5.251 1131 HB1 ALA 54 HB1 ALA 54 -14.514 5.671 3.423 1132 HB2 ALA 54 HB2 ALA 54 -13.007 5.642 2.498 1133 HB3 ALA 54 HB3 ALA 54 -13.751 7.180 2.926 1134 H ILE 55 HN ILE 55 -10.809 4.697 4.331 1135 HA ILE 55 HA ILE 55 -12.212 2.306 5.096 1136 HB ILE 55 HB ILE 55 -9.550 2.823 3.850 1137 HG12 ILE 55 HG12 ILE 55 -11.745 1.140 2.755 1138 HG13 ILE 55 HG11 ILE 55 -11.924 2.899 2.744 1139 HG21 ILE 55 HG21 ILE 55 -10.717 0.169 4.658 1140 HG22 ILE 55 HG22 ILE 55 -9.256 0.911 5.310 1141 HG23 ILE 55 HG23 ILE 55 -9.306 0.388 3.626 1142 HD11 ILE 55 HD11 ILE 55 -10.014 3.161 1.389 1143 HD12 ILE 55 HD12 ILE 55 -11.004 1.883 0.670 1144 HD13 ILE 55 HD13 ILE 55 -9.546 1.467 1.589 1145 H LYS 56 HN LYS 56 -9.568 4.266 6.478 1146 HA LYS 56 HA LYS 56 -8.214 2.490 7.970 1147 HB2 LYS 56 HB2 LYS 56 -8.764 4.562 9.847 1148 HB3 LYS 56 HB1 LYS 56 -7.276 4.184 9.004 1149 HG2 LYS 56 HG2 LYS 56 -7.589 6.340 8.364 1150 HG3 LYS 56 HG1 LYS 56 -8.452 5.513 7.063 1151 HD2 LYS 56 HD2 LYS 56 -10.470 6.121 7.810 1152 HD3 LYS 56 HD1 LYS 56 -9.989 6.133 9.506 1153 HE2 LYS 56 HE2 LYS 56 -9.601 8.287 7.419 1154 HE3 LYS 56 HE1 LYS 56 -10.432 8.380 8.968 1155 HZ1 LYS 56 HZ1 LYS 56 -8.302 9.494 9.057 1156 HZ2 LYS 56 HZ2 LYS 56 -7.500 8.070 8.634 1157 HZ3 LYS 56 HZ3 LYS 56 -8.320 8.171 10.106 1158 HA PRO 57 HA PRO 57 -11.591 2.155 11.520 1159 HB2 PRO 57 HB2 PRO 57 -14.136 2.099 10.556 1160 HB3 PRO 57 HB1 PRO 57 -13.376 3.570 11.183 1161 HG2 PRO 57 HG2 PRO 57 -13.538 2.603 8.340 1162 HG3 PRO 57 HG1 PRO 57 -14.001 4.196 8.986 1163 HD2 PRO 57 HD2 PRO 57 -11.656 3.885 7.825 1164 HD3 PRO 57 HD1 PRO 57 -11.728 4.801 9.337 1165 H LEU 58 HN LEU 58 -11.936 0.991 8.231 1166 HA LEU 58 HA LEU 58 -12.810 -1.669 9.117 1167 HB2 LEU 58 HB2 LEU 58 -12.335 -1.063 6.262 1168 HB3 LEU 58 HB1 LEU 58 -13.602 -2.049 6.978 1169 HG LEU 58 HG LEU 58 -13.518 0.978 6.894 1170 HD11 LEU 58 HD11 LEU 58 -13.841 0.069 4.702 1171 HD12 LEU 58 HD12 LEU 58 -15.388 0.682 5.292 1172 HD13 LEU 58 HD13 LEU 58 -15.064 -1.051 5.299 1173 HD21 LEU 58 HD21 LEU 58 -14.709 0.152 8.855 1174 HD22 LEU 58 HD22 LEU 58 -15.696 -0.892 7.829 1175 HD23 LEU 58 HD23 LEU 58 -15.824 0.863 7.689 1176 H LYS 59 HN LYS 59 -10.201 0.197 8.192 1177 HA LYS 59 HA LYS 59 -8.546 -1.439 6.747 1178 HB2 LYS 59 HB2 LYS 59 -7.936 0.821 7.151 1179 HB3 LYS 59 HB1 LYS 59 -7.913 0.570 8.888 1180 HG2 LYS 59 HG2 LYS 59 -5.680 0.552 8.456 1181 HG3 LYS 59 HG1 LYS 59 -6.043 -1.156 8.262 1182 HD2 LYS 59 HD2 LYS 59 -5.814 0.862 6.059 1183 HD3 LYS 59 HD1 LYS 59 -4.618 -0.377 6.448 1184 HE2 LYS 59 HE2 LYS 59 -6.797 -1.917 6.138 1185 HE3 LYS 59 HE1 LYS 59 -7.220 -0.594 5.047 1186 HZ1 LYS 59 HZ1 LYS 59 -4.922 -2.426 4.945 1187 HZ2 LYS 59 HZ2 LYS 59 -4.846 -0.927 4.164 1188 HZ3 LYS 59 HZ3 LYS 59 -6.033 -2.062 3.718 1189 H GLY 60 HN GLY 60 -8.111 -3.478 7.108 1190 HA2 GLY 60 HA3 GLY 60 -6.916 -5.202 8.175 1191 HA3 GLY 60 HA2 GLY 60 -6.908 -4.251 9.654 1192 H LYS 61 HN LYS 61 -9.904 -3.783 9.131 1193 HA LYS 61 HA LYS 61 -10.725 -6.252 10.500 1194 HB2 LYS 61 HB2 LYS 61 -12.494 -3.860 10.338 1195 HB3 LYS 61 HB1 LYS 61 -12.237 -4.971 11.674 1196 HG2 LYS 61 HG2 LYS 61 -10.285 -2.865 10.802 1197 HG3 LYS 61 HG1 LYS 61 -11.433 -2.681 12.117 1198 HD2 LYS 61 HD2 LYS 61 -9.338 -4.842 11.998 1199 HD3 LYS 61 HD1 LYS 61 -9.117 -3.301 12.832 1200 HE2 LYS 61 HE2 LYS 61 -10.970 -3.782 14.294 1201 HE3 LYS 61 HE1 LYS 61 -11.324 -5.263 13.411 1202 HZ1 LYS 61 HZ1 LYS 61 -10.105 -5.698 15.457 1203 HZ2 LYS 61 HZ2 LYS 61 -8.826 -4.728 14.923 1204 HZ3 LYS 61 HZ3 LYS 61 -9.204 -6.161 14.103 1205 H VAL 62 HN VAL 62 -11.562 -7.656 9.099 1206 HA VAL 62 HA VAL 62 -13.653 -6.667 7.285 1207 HB VAL 62 HB VAL 62 -11.750 -7.503 5.992 1208 HG11 VAL 62 HG11 VAL 62 -10.759 -9.027 7.585 1209 HG12 VAL 62 HG12 VAL 62 -11.079 -9.860 6.062 1210 HG13 VAL 62 HG13 VAL 62 -12.144 -10.110 7.448 1211 HG21 VAL 62 HG21 VAL 62 -12.909 -9.270 4.672 1212 HG22 VAL 62 HG22 VAL 62 -13.886 -7.838 4.983 1213 HG23 VAL 62 HG23 VAL 62 -14.159 -9.311 5.915 1214 HA PRO 63 HA PRO 63 -16.555 -9.578 9.314 1215 HB2 PRO 63 HB2 PRO 63 -17.082 -10.115 6.425 1216 HB3 PRO 63 HB1 PRO 63 -18.229 -9.941 7.740 1217 HG2 PRO 63 HG2 PRO 63 -17.847 -7.927 6.061 1218 HG3 PRO 63 HG1 PRO 63 -18.008 -7.618 7.797 1219 HD2 PRO 63 HD2 PRO 63 -15.578 -7.559 6.089 1220 HD3 PRO 63 HD1 PRO 63 -15.971 -6.600 7.530 1221 H ALA 64 HN ALA 64 -16.328 -11.715 9.785 1222 HA ALA 64 HA ALA 64 -13.861 -12.872 9.216 1223 HB1 ALA 64 HB1 ALA 64 -15.107 -13.296 11.272 1224 HB2 ALA 64 HB2 ALA 64 -14.639 -14.797 10.474 1225 HB3 ALA 64 HB3 ALA 64 -16.299 -14.217 10.355 1226 H GLY 65 HN GLY 65 -13.366 -13.366 7.157 1227 HA2 GLY 65 HA3 GLY 65 -13.180 -15.162 5.619 1228 HA3 GLY 65 HA2 GLY 65 -14.824 -15.637 6.013 1229 H SER 66 HN SER 66 -15.205 -12.462 5.711 1230 HA SER 66 HA SER 66 -16.138 -12.768 2.952 1231 HB2 SER 66 HB2 SER 66 -16.565 -10.404 4.763 1232 HB3 SER 66 HB1 SER 66 -17.527 -10.904 3.373 1233 HG SER 66 HG SER 66 -17.595 -12.961 4.939 1234 H ASP 67 HN ASP 67 -16.289 -10.263 2.200 1235 HA ASP 67 HA ASP 67 -13.653 -9.843 1.106 1236 HB2 ASP 67 HB2 ASP 67 -15.174 -8.121 -0.220 1237 HB3 ASP 67 HB1 ASP 67 -15.268 -9.838 -0.537 1238 H VAL 68 HN VAL 68 -12.278 -8.252 1.876 1239 HA VAL 68 HA VAL 68 -13.439 -6.242 3.603 1240 HB VAL 68 HB VAL 68 -11.415 -5.753 4.378 1241 HG11 VAL 68 HG11 VAL 68 -9.686 -7.406 4.160 1242 HG12 VAL 68 HG12 VAL 68 -10.452 -8.053 2.710 1243 HG13 VAL 68 HG13 VAL 68 -11.264 -8.187 4.267 1244 HG21 VAL 68 HG21 VAL 68 -10.888 -4.335 2.516 1245 HG22 VAL 68 HG22 VAL 68 -10.363 -5.724 1.558 1246 HG23 VAL 68 HG23 VAL 68 -9.454 -5.247 2.994 1247 H ILE 69 HN ILE 69 -12.358 -6.565 0.331 1248 HA ILE 69 HA ILE 69 -12.215 -3.901 -0.411 1249 HB ILE 69 HB ILE 69 -13.047 -6.312 -1.997 1250 HG12 ILE 69 HG12 ILE 69 -10.758 -6.450 -1.453 1251 HG13 ILE 69 HG11 ILE 69 -10.794 -5.820 -3.085 1252 HG21 ILE 69 HG21 ILE 69 -12.705 -4.863 -4.029 1253 HG22 ILE 69 HG22 ILE 69 -12.689 -3.466 -2.949 1254 HG23 ILE 69 HG23 ILE 69 -14.131 -4.472 -3.067 1255 HD11 ILE 69 HD11 ILE 69 -10.363 -4.215 -0.589 1256 HD12 ILE 69 HD12 ILE 69 -10.427 -3.555 -2.225 1257 HD13 ILE 69 HD13 ILE 69 -9.133 -4.673 -1.773 1258 H SER 70 HN SER 70 -14.968 -6.062 -0.480 1259 HA SER 70 HA SER 70 -16.808 -4.308 -1.563 1260 HB2 SER 70 HB2 SER 70 -17.186 -6.728 -1.260 1261 HB3 SER 70 HB1 SER 70 -17.306 -6.491 0.479 1262 HG SER 70 HG SER 70 -19.264 -5.698 0.255 1263 H GLU 71 HN GLU 71 -15.520 -4.431 1.679 1264 HA GLU 71 HA GLU 71 -17.485 -2.627 2.794 1265 HB2 GLU 71 HB2 GLU 71 -14.875 -3.481 4.017 1266 HB3 GLU 71 HB1 GLU 71 -16.337 -2.951 4.841 1267 HG2 GLU 71 HG2 GLU 71 -16.663 -5.313 3.153 1268 HG3 GLU 71 HG1 GLU 71 -15.579 -5.524 4.521 1269 H TYR 72 HN TYR 72 -14.295 -2.618 1.521 1270 HA TYR 72 HA TYR 72 -13.559 -0.037 2.479 1271 HB2 TYR 72 HB2 TYR 72 -12.384 -2.012 0.538 1272 HB3 TYR 72 HB1 TYR 72 -11.688 -0.408 0.732 1273 HD1 TYR 72 HD1 TYR 72 -13.138 -1.932 3.680 1274 HD2 TYR 72 HD2 TYR 72 -9.588 -1.535 1.394 1275 HE1 TYR 72 HE1 TYR 72 -11.827 -2.757 5.570 1276 HE2 TYR 72 HE2 TYR 72 -8.260 -2.374 3.279 1277 HH TYR 72 HH TYR 72 -9.781 -3.722 6.106 1278 H VAL 73 HN VAL 73 -14.812 -1.414 -0.491 1279 HA VAL 73 HA VAL 73 -14.908 1.015 -1.944 1280 HB VAL 73 HB VAL 73 -16.098 -0.011 -3.608 1281 HG11 VAL 73 HG11 VAL 73 -14.780 -2.316 -2.233 1282 HG12 VAL 73 HG12 VAL 73 -14.057 -1.215 -3.402 1283 HG13 VAL 73 HG13 VAL 73 -15.338 -2.314 -3.904 1284 HG21 VAL 73 HG21 VAL 73 -18.019 -0.581 -2.051 1285 HG22 VAL 73 HG22 VAL 73 -17.247 -2.159 -1.873 1286 HG23 VAL 73 HG23 VAL 73 -17.778 -1.606 -3.469 1287 H LYS 74 HN LYS 74 -16.955 -0.656 0.313 1288 HA LYS 74 HA LYS 74 -19.246 1.000 0.163 1289 HB2 LYS 74 HB2 LYS 74 -18.437 -1.270 1.563 1290 HB3 LYS 74 HB1 LYS 74 -18.649 -0.041 2.803 1291 HG2 LYS 74 HG2 LYS 74 -20.749 -0.900 2.778 1292 HG3 LYS 74 HG1 LYS 74 -20.938 0.348 1.547 1293 HD2 LYS 74 HD2 LYS 74 -20.219 -2.517 0.939 1294 HD3 LYS 74 HD1 LYS 74 -21.873 -1.902 0.939 1295 HE2 LYS 74 HE2 LYS 74 -19.647 -0.792 -0.755 1296 HE3 LYS 74 HE1 LYS 74 -20.807 -1.996 -1.313 1297 HZ1 LYS 74 HZ1 LYS 74 -21.563 0.687 -0.292 1298 HZ2 LYS 74 HZ2 LYS 74 -22.584 -0.451 -1.013 1299 HZ3 LYS 74 HZ3 LYS 74 -21.385 0.310 -1.931 1300 H ALA 75 HN ALA 75 -16.188 1.147 1.816 1301 HA ALA 75 HA ALA 75 -16.716 3.296 3.562 1302 HB1 ALA 75 HB1 ALA 75 -14.737 1.909 3.768 1303 HB2 ALA 75 HB2 ALA 75 -14.272 3.600 3.581 1304 HB3 ALA 75 HB3 ALA 75 -14.143 2.490 2.214 1305 H CYS 76 HN CYS 76 -15.426 3.216 0.267 1306 HA CYS 76 HA CYS 76 -15.666 6.116 0.062 1307 HB2 CYS 76 HB2 CYS 76 -13.659 5.213 -0.817 1308 HB3 CYS 76 HB1 CYS 76 -14.515 4.013 -1.767 1309 HG CYS 76 HG CYS 76 -15.768 6.432 -3.132 1310 H ASP 77 HN ASP 77 -17.831 3.781 -0.085 1311 HA ASP 77 HA ASP 77 -19.243 4.131 -2.447 1312 HB2 ASP 77 HB2 ASP 77 -19.962 2.388 -1.098 1313 HB3 ASP 77 HB1 ASP 77 -20.019 3.371 0.356 1314 H GLY 78 HN GLY 78 -18.943 6.216 0.318 1315 HA2 GLY 78 HA3 GLY 78 -20.942 8.066 -0.726 1316 HA3 GLY 78 HA2 GLY 78 -20.027 8.256 0.761 1317 H ILE 79 HN ILE 79 -17.516 7.569 -0.863 1318 HA ILE 79 HA ILE 79 -16.883 10.313 -1.440 1319 HB ILE 79 HB ILE 79 -15.191 7.841 -1.685 1320 HG12 ILE 79 HG12 ILE 79 -15.223 9.931 0.501 1321 HG13 ILE 79 HG11 ILE 79 -16.017 8.361 0.622 1322 HG21 ILE 79 HG21 ILE 79 -14.300 10.714 -1.579 1323 HG22 ILE 79 HG22 ILE 79 -14.423 9.762 -3.057 1324 HG23 ILE 79 HG23 ILE 79 -13.284 9.290 -1.797 1325 HD11 ILE 79 HD11 ILE 79 -13.085 8.672 0.091 1326 HD12 ILE 79 HD12 ILE 79 -13.960 7.221 0.594 1327 HD13 ILE 79 HD13 ILE 79 -13.768 8.575 1.709 1328 H GLY 80 HN GLY 80 -16.123 11.098 -3.412 1329 HA2 GLY 80 HA3 GLY 80 -15.523 10.241 -5.768 1330 HA3 GLY 80 HA2 GLY 80 -17.191 9.690 -5.736 1331 H GLY 81 HN GLY 81 -18.243 11.855 -4.259 1332 HA2 GLY 81 HA3 GLY 81 -17.405 14.370 -5.308 1333 HA3 GLY 81 HA2 GLY 81 -18.869 13.793 -6.106 1334 H ALA 82 HN ALA 82 -18.463 16.103 -4.349 1335 HA ALA 82 HA ALA 82 -19.577 17.231 -2.733 1336 HB1 ALA 82 HB1 ALA 82 -21.484 14.899 -2.769 1337 HB2 ALA 82 HB2 ALA 82 -21.581 16.331 -3.794 1338 HB3 ALA 82 HB3 ALA 82 -21.785 16.480 -2.049 1339 H MET 83 HN MET 83 -20.211 13.921 -1.599 1340 HA MET 83 HA MET 83 -19.700 14.505 1.094 1341 HB2 MET 83 HB2 MET 83 -19.532 11.829 -0.305 1342 HB3 MET 83 HB1 MET 83 -19.655 12.070 1.433 1343 HG2 MET 83 HG2 MET 83 -21.846 13.160 1.080 1344 HG3 MET 83 HG1 MET 83 -21.721 12.781 -0.636 1345 HE1 MET 83 HE1 MET 83 -24.222 11.928 1.120 1346 HE2 MET 83 HE2 MET 83 -24.467 10.279 0.549 1347 HE3 MET 83 HE3 MET 83 -24.045 11.552 -0.594 1348 H HIS 84 HN HIS 84 -17.606 13.198 -1.434 1349 HA HIS 84 HA HIS 84 -15.291 12.617 -0.027 1350 HB2 HIS 84 HB2 HIS 84 -15.296 12.183 -2.372 1351 HB3 HIS 84 HB1 HIS 84 -15.750 13.831 -2.766 1352 HD1 HIS 84 HD1 HIS 84 -13.823 14.389 -4.286 1353 HD2 HIS 84 HD2 HIS 84 -12.567 12.945 -0.602 1354 HE1 HIS 84 HE1 HIS 84 -11.356 14.805 -4.206 1355 HE2 HIS 84 HE2 HIS 84 -10.587 13.732 -2.067 1356 H LYS 85 HN LYS 85 -16.626 15.784 -0.848 1357 HA LYS 85 HA LYS 85 -14.183 17.148 -0.134 1358 HB2 LYS 85 HB2 LYS 85 -16.896 18.321 -0.760 1359 HB3 LYS 85 HB1 LYS 85 -15.360 19.179 -0.730 1360 HG2 LYS 85 HG2 LYS 85 -16.218 17.053 -2.686 1361 HG3 LYS 85 HG1 LYS 85 -15.958 18.769 -3.011 1362 HD2 LYS 85 HD2 LYS 85 -13.577 18.482 -2.450 1363 HD3 LYS 85 HD1 LYS 85 -13.866 16.762 -2.185 1364 HE2 LYS 85 HE2 LYS 85 -12.942 17.047 -4.375 1365 HE3 LYS 85 HE1 LYS 85 -14.634 16.576 -4.528 1366 HZ1 LYS 85 HZ1 LYS 85 -15.225 18.837 -4.996 1367 HZ2 LYS 85 HZ2 LYS 85 -13.980 18.380 -6.047 1368 HZ3 LYS 85 HZ3 LYS 85 -13.644 19.368 -4.716 1369 H ALA 86 HN ALA 86 -17.302 16.473 1.311 1370 HA ALA 86 HA ALA 86 -16.908 18.137 3.612 1371 HB1 ALA 86 HB1 ALA 86 -19.145 17.523 2.874 1372 HB2 ALA 86 HB2 ALA 86 -18.855 16.953 4.518 1373 HB3 ALA 86 HB3 ALA 86 -18.786 15.822 3.167 1374 H MET 87 HN MET 87 -16.532 14.739 2.874 1375 HA MET 87 HA MET 87 -15.677 14.008 5.514 1376 HB2 MET 87 HB2 MET 87 -15.552 12.448 2.921 1377 HB3 MET 87 HB1 MET 87 -15.409 11.782 4.548 1378 HG2 MET 87 HG2 MET 87 -17.664 12.222 5.039 1379 HG3 MET 87 HG1 MET 87 -17.838 13.287 3.656 1380 HE1 MET 87 HE1 MET 87 -17.663 9.580 4.897 1381 HE2 MET 87 HE2 MET 87 -16.216 9.665 3.892 1382 HE3 MET 87 HE3 MET 87 -17.588 8.681 3.382 1383 H LEU 88 HN LEU 88 -14.195 15.392 2.832 1384 HA LEU 88 HA LEU 88 -11.651 14.385 2.736 1385 HB2 LEU 88 HB2 LEU 88 -12.865 16.385 1.521 1386 HB3 LEU 88 HB1 LEU 88 -12.052 17.341 2.741 1387 HG LEU 88 HG LEU 88 -10.182 17.351 1.536 1388 HD11 LEU 88 HD11 LEU 88 -10.383 14.350 1.294 1389 HD12 LEU 88 HD12 LEU 88 -9.584 15.219 2.606 1390 HD13 LEU 88 HD13 LEU 88 -8.960 15.336 0.960 1391 HD21 LEU 88 HD21 LEU 88 -10.265 16.484 -0.773 1392 HD22 LEU 88 HD22 LEU 88 -11.686 17.437 -0.340 1393 HD23 LEU 88 HD23 LEU 88 -11.784 15.676 -0.379 1394 H MET 89 HN MET 89 -12.800 17.014 4.859 1395 HA MET 89 HA MET 89 -10.283 17.171 6.227 1396 HB2 MET 89 HB2 MET 89 -11.742 19.142 5.905 1397 HB3 MET 89 HB1 MET 89 -12.950 18.404 6.944 1398 HG2 MET 89 HG2 MET 89 -11.681 20.084 8.141 1399 HG3 MET 89 HG1 MET 89 -11.399 18.482 8.819 1400 HE1 MET 89 HE1 MET 89 -7.946 20.249 9.353 1401 HE2 MET 89 HE2 MET 89 -9.246 19.337 10.119 1402 HE3 MET 89 HE3 MET 89 -9.555 20.956 9.495 1403 H ALA 90 HN ALA 90 -13.000 15.178 6.486 1404 HA ALA 90 HA ALA 90 -12.784 14.804 9.358 1405 HB1 ALA 90 HB1 ALA 90 -14.979 14.862 8.228 1406 HB2 ALA 90 HB2 ALA 90 -14.709 13.366 9.122 1407 HB3 ALA 90 HB3 ALA 90 -14.544 13.386 7.364 1408 H GLN 91 HN GLN 91 -11.632 13.308 6.462 1409 HA GLN 91 HA GLN 91 -10.960 10.885 7.988 1410 HB2 GLN 91 HB2 GLN 91 -11.576 11.034 5.047 1411 HB3 GLN 91 HB1 GLN 91 -11.337 9.582 6.015 1412 HG2 GLN 91 HG2 GLN 91 -13.304 10.105 7.307 1413 HG3 GLN 91 HG1 GLN 91 -13.526 11.568 6.360 1414 HE21 GLN 91 HE21 GLN 91 -12.870 10.530 3.852 1415 HE22 GLN 91 HE22 GLN 91 -14.070 9.398 3.390 1416 H LEU 92 HN LEU 92 -9.959 12.816 5.151 1417 HA LEU 92 HA LEU 92 -7.659 11.612 4.349 1418 HB2 LEU 92 HB2 LEU 92 -8.814 13.920 3.734 1419 HB3 LEU 92 HB1 LEU 92 -7.575 14.570 4.778 1420 HG LEU 92 HG LEU 92 -7.301 13.267 2.098 1421 HD11 LEU 92 HD11 LEU 92 -6.102 15.731 3.339 1422 HD12 LEU 92 HD12 LEU 92 -7.511 15.688 2.283 1423 HD13 LEU 92 HD13 LEU 92 -5.930 15.219 1.661 1424 HD21 LEU 92 HD21 LEU 92 -5.082 13.521 4.125 1425 HD22 LEU 92 HD22 LEU 92 -4.860 13.163 2.414 1426 HD23 LEU 92 HD23 LEU 92 -5.720 12.022 3.448 1427 H GLU 93 HN GLU 93 -8.238 13.572 7.136 1428 HA GLU 93 HA GLU 93 -6.879 14.542 8.693 1429 HB2 GLU 93 HB2 GLU 93 -6.724 11.603 8.841 1430 HB3 GLU 93 HB1 GLU 93 -6.036 12.592 10.121 1431 HG2 GLU 93 HG2 GLU 93 -8.877 12.842 9.181 1432 HG3 GLU 93 HG1 GLU 93 -8.396 11.726 10.452 Start of MODEL 11 1 H2 PRO 1 HT1 PRO 1 -5.258 -4.409 12.939 2 H3 PRO 1 HT2 PRO 1 -5.678 -2.936 13.512 3 HA PRO 1 HA PRO 1 -6.359 -2.752 11.463 4 HB2 PRO 1 HB2 PRO 1 -4.245 -1.641 10.239 5 HB3 PRO 1 HB1 PRO 1 -5.043 -0.851 11.599 6 HG2 PRO 1 HG2 PRO 1 -2.425 -2.146 11.493 7 HG3 PRO 1 HG1 PRO 1 -3.077 -1.037 12.711 8 HD2 PRO 1 HD2 PRO 1 -2.935 -3.954 12.742 9 HD3 PRO 1 HD1 PRO 1 -3.314 -2.840 14.070 10 H SER 2 HN SER 2 -4.627 -2.715 9.086 11 HA SER 2 HA SER 2 -4.241 -5.457 8.434 12 HB2 SER 2 HB2 SER 2 -2.914 -3.010 7.244 13 HB3 SER 2 HB1 SER 2 -2.985 -4.609 6.520 14 HG SER 2 HG SER 2 -5.416 -4.225 6.842 15 H PHE 3 HN PHE 3 -1.950 -6.281 7.964 16 HA PHE 3 HA PHE 3 -0.328 -6.057 10.260 17 HB2 PHE 3 HB2 PHE 3 1.305 -6.811 8.075 18 HB3 PHE 3 HB1 PHE 3 0.569 -7.880 9.276 19 HD1 PHE 3 HD1 PHE 3 0.771 -6.836 5.917 20 HD2 PHE 3 HD2 PHE 3 -1.777 -8.764 8.717 21 HE1 PHE 3 HE1 PHE 3 -0.476 -7.846 4.086 22 HE2 PHE 3 HE2 PHE 3 -3.055 -9.781 6.874 23 HZ PHE 3 HZ PHE 3 -2.403 -9.321 4.543 24 H ASN 4 HN ASN 4 -0.135 -4.715 7.048 25 HA ASN 4 HA ASN 4 2.541 -3.747 7.495 26 HB2 ASN 4 HB2 ASN 4 2.422 -3.269 5.093 27 HB3 ASN 4 HB1 ASN 4 1.926 -4.924 5.454 28 HD21 ASN 4 HD21 ASN 4 0.780 -1.704 4.661 29 HD22 ASN 4 HD22 ASN 4 -0.774 -2.208 4.080 30 H THR 5 HN THR 5 -0.291 -2.366 8.286 31 HA THR 5 HA THR 5 -0.333 0.050 6.814 32 HB THR 5 HB THR 5 -1.554 0.812 9.025 33 HG1 THR 5 HG1 THR 5 -1.177 -0.861 10.389 34 HG21 THR 5 HG21 THR 5 -2.537 -1.177 7.016 35 HG22 THR 5 HG22 THR 5 -2.684 0.580 6.961 36 HG23 THR 5 HG23 THR 5 -3.589 -0.348 8.161 37 H VAL 6 HN VAL 6 1.983 -0.981 8.937 38 HA VAL 6 HA VAL 6 2.694 1.541 9.984 39 HB VAL 6 HB VAL 6 4.700 0.558 10.684 40 HG11 VAL 6 HG11 VAL 6 2.691 -1.680 10.578 41 HG12 VAL 6 HG12 VAL 6 2.659 -0.332 11.719 42 HG13 VAL 6 HG13 VAL 6 3.992 -1.489 11.757 43 HG21 VAL 6 HG21 VAL 6 4.311 -1.712 8.733 44 HG22 VAL 6 HG22 VAL 6 5.664 -1.491 9.851 45 HG23 VAL 6 HG23 VAL 6 5.434 -0.361 8.511 46 H ARG 7 HN ARG 7 3.216 3.217 8.767 47 HA ARG 7 HA ARG 7 4.683 2.675 6.310 48 HB2 ARG 7 HB2 ARG 7 2.898 4.968 7.011 49 HB3 ARG 7 HB1 ARG 7 4.048 4.969 5.686 50 HG2 ARG 7 HG2 ARG 7 1.828 4.667 4.918 51 HG3 ARG 7 HG1 ARG 7 2.831 3.284 4.610 52 HD2 ARG 7 HD2 ARG 7 0.710 2.543 5.262 53 HD3 ARG 7 HD1 ARG 7 1.848 2.166 6.540 54 HE ARG 7 HE ARG 7 0.703 3.564 7.944 55 HH11 ARG 7 HH11 ARG 7 -0.310 4.244 4.653 56 HH12 ARG 7 HH12 ARG 7 -1.577 5.327 5.140 57 HH21 ARG 7 HH21 ARG 7 -0.969 4.968 8.573 58 HH22 ARG 7 HH22 ARG 7 -1.959 5.727 7.370 59 H GLN 8 HN GLN 8 6.318 4.096 5.732 60 HA GLN 8 HA GLN 8 8.108 5.072 7.592 61 HB2 GLN 8 HB2 GLN 8 7.892 4.792 4.822 62 HB3 GLN 8 HB1 GLN 8 8.190 6.507 5.061 63 HG2 GLN 8 HG2 GLN 8 10.175 5.959 6.390 64 HG3 GLN 8 HG1 GLN 8 9.891 4.247 6.087 65 HE21 GLN 8 HE21 GLN 8 12.189 5.838 5.412 66 HE22 GLN 8 HE22 GLN 8 12.352 5.746 3.681 67 H GLY 9 HN GLY 9 7.764 6.664 8.998 68 HA2 GLY 9 HA3 GLY 9 6.002 8.883 8.382 69 HA3 GLY 9 HA2 GLY 9 6.888 8.631 9.877 70 H SER 10 HN SER 10 7.479 10.876 9.811 71 HA SER 10 HA SER 10 8.737 12.228 7.775 72 HB2 SER 10 HB2 SER 10 9.361 12.464 10.727 73 HB3 SER 10 HB1 SER 10 9.644 13.696 9.498 74 HG SER 10 HG SER 10 7.556 13.582 10.907 75 H LYS 11 HN LYS 11 10.272 11.352 6.586 76 HA LYS 11 HA LYS 11 11.894 9.885 5.961 77 HB2 LYS 11 HB2 LYS 11 14.107 10.739 6.338 78 HB3 LYS 11 HB1 LYS 11 13.014 12.078 6.065 79 HG2 LYS 11 HG2 LYS 11 13.692 11.262 8.858 80 HG3 LYS 11 HG1 LYS 11 14.824 12.228 7.913 81 HD2 LYS 11 HD2 LYS 11 13.177 13.959 7.618 82 HD3 LYS 11 HD1 LYS 11 11.943 12.970 8.403 83 HE2 LYS 11 HE2 LYS 11 14.438 14.082 9.678 84 HE3 LYS 11 HE1 LYS 11 12.787 14.639 9.944 85 HZ1 LYS 11 HZ1 LYS 11 12.277 12.384 10.802 86 HZ2 LYS 11 HZ2 LYS 11 13.406 13.224 11.740 87 HZ3 LYS 11 HZ3 LYS 11 13.921 12.004 10.691 88 H GLU 12 HN GLU 12 10.540 8.498 7.763 89 HA GLU 12 HA GLU 12 11.979 7.522 9.970 90 HB2 GLU 12 HB2 GLU 12 9.567 7.171 9.661 91 HB3 GLU 12 HB1 GLU 12 9.866 6.155 8.259 92 HG2 GLU 12 HG2 GLU 12 10.912 4.488 9.636 93 HG3 GLU 12 HG1 GLU 12 10.790 5.530 11.055 94 HA PRO 13 HA PRO 13 15.315 5.250 8.084 95 HB2 PRO 13 HB2 PRO 13 14.787 3.244 10.193 96 HB3 PRO 13 HB1 PRO 13 16.290 4.077 9.797 97 HG2 PRO 13 HG2 PRO 13 14.834 4.688 11.976 98 HG3 PRO 13 HG1 PRO 13 15.774 5.890 11.086 99 HD2 PRO 13 HD2 PRO 13 12.847 5.473 11.178 100 HD3 PRO 13 HD1 PRO 13 13.767 6.955 10.881 101 H TYR 14 HN TYR 14 15.104 3.956 6.369 102 HA TYR 14 HA TYR 14 12.509 2.938 5.932 103 HB2 TYR 14 HB2 TYR 14 13.719 4.046 4.147 104 HB3 TYR 14 HB1 TYR 14 14.907 2.745 4.139 105 HD1 TYR 14 HD1 TYR 14 14.120 0.427 3.637 106 HD2 TYR 14 HD2 TYR 14 11.730 3.833 2.960 107 HE1 TYR 14 HE1 TYR 14 12.742 -0.886 2.109 108 HE2 TYR 14 HE2 TYR 14 10.328 2.572 1.404 109 HH TYR 14 HH TYR 14 10.222 0.625 0.217 110 HA PRO 15 HA PRO 15 14.715 -1.408 5.550 111 HB2 PRO 15 HB2 PRO 15 16.824 -1.043 7.588 112 HB3 PRO 15 HB1 PRO 15 16.877 -1.923 6.062 113 HG2 PRO 15 HG2 PRO 15 18.111 0.424 6.383 114 HG3 PRO 15 HG1 PRO 15 17.407 -0.059 4.845 115 HD2 PRO 15 HD2 PRO 15 16.428 1.910 6.844 116 HD3 PRO 15 HD1 PRO 15 16.242 1.893 5.084 117 H ASP 16 HN ASP 16 14.308 0.686 8.135 118 HA ASP 16 HA ASP 16 13.532 -1.344 10.048 119 HB2 ASP 16 HB2 ASP 16 14.151 1.555 10.189 120 HB3 ASP 16 HB1 ASP 16 12.976 0.945 11.347 121 H PHE 17 HN PHE 17 12.101 1.404 8.309 122 HA PHE 17 HA PHE 17 9.467 1.181 9.179 123 HB2 PHE 17 HB2 PHE 17 9.432 2.965 7.761 124 HB3 PHE 17 HB1 PHE 17 10.858 2.391 6.904 125 HD1 PHE 17 HD1 PHE 17 10.640 1.093 4.886 126 HD2 PHE 17 HD2 PHE 17 7.198 2.398 7.009 127 HE1 PHE 17 HE1 PHE 17 9.251 0.585 2.933 128 HE2 PHE 17 HE2 PHE 17 5.792 1.938 5.053 129 HZ PHE 17 HZ PHE 17 6.819 1.002 3.008 130 H VAL 18 HN VAL 18 11.228 -0.538 6.673 131 HA VAL 18 HA VAL 18 8.927 -2.091 5.973 132 HB VAL 18 HB VAL 18 10.276 -1.639 4.121 133 HG11 VAL 18 HG11 VAL 18 12.322 -1.000 5.182 134 HG12 VAL 18 HG12 VAL 18 12.664 -2.303 4.029 135 HG13 VAL 18 HG13 VAL 18 12.584 -2.646 5.768 136 HG21 VAL 18 HG21 VAL 18 9.496 -3.870 4.010 137 HG22 VAL 18 HG22 VAL 18 10.773 -4.432 5.099 138 HG23 VAL 18 HG23 VAL 18 11.178 -3.869 3.467 139 H ALA 19 HN ALA 19 11.904 -2.656 7.836 140 HA ALA 19 HA ALA 19 11.622 -5.424 8.151 141 HB1 ALA 19 HB1 ALA 19 12.680 -3.501 10.224 142 HB2 ALA 19 HB2 ALA 19 13.613 -4.172 8.888 143 HB3 ALA 19 HB3 ALA 19 12.983 -5.236 10.147 144 H ARG 20 HN ARG 20 9.919 -2.814 9.832 145 HA ARG 20 HA ARG 20 8.668 -4.749 11.593 146 HB2 ARG 20 HB2 ARG 20 7.336 -2.855 12.441 147 HB3 ARG 20 HB1 ARG 20 9.061 -2.550 12.540 148 HG2 ARG 20 HG2 ARG 20 8.999 -0.903 10.949 149 HG3 ARG 20 HG1 ARG 20 7.552 -1.554 10.176 150 HD2 ARG 20 HD2 ARG 20 6.162 -0.786 11.941 151 HD3 ARG 20 HD1 ARG 20 7.546 -0.391 12.941 152 HE ARG 20 HE ARG 20 7.860 1.195 10.757 153 HH11 ARG 20 HH11 ARG 20 5.266 0.668 13.051 154 HH12 ARG 20 HH12 ARG 20 4.643 2.283 12.908 155 HH21 ARG 20 HH21 ARG 20 7.066 3.330 10.593 156 HH22 ARG 20 HH22 ARG 20 5.659 3.790 11.513 157 H LEU 21 HN LEU 21 8.138 -3.035 8.659 158 HA LEU 21 HA LEU 21 5.499 -3.590 8.105 159 HB2 LEU 21 HB2 LEU 21 7.359 -2.322 6.792 160 HB3 LEU 21 HB1 LEU 21 7.679 -3.872 6.056 161 HG LEU 21 HG LEU 21 5.633 -3.871 4.906 162 HD11 LEU 21 HD11 LEU 21 3.919 -2.111 5.273 163 HD12 LEU 21 HD12 LEU 21 4.829 -1.591 6.695 164 HD13 LEU 21 HD13 LEU 21 4.118 -3.210 6.637 165 HD21 LEU 21 HD21 LEU 21 7.224 -2.399 3.904 166 HD22 LEU 21 HD22 LEU 21 6.763 -1.094 4.997 167 HD23 LEU 21 HD23 LEU 21 5.624 -1.662 3.779 168 H GLN 22 HN GLN 22 8.393 -5.543 7.519 169 HA GLN 22 HA GLN 22 7.076 -7.861 6.638 170 HB2 GLN 22 HB2 GLN 22 9.718 -7.900 8.029 171 HB3 GLN 22 HB1 GLN 22 9.138 -8.893 6.690 172 HG2 GLN 22 HG2 GLN 22 9.257 -6.895 5.279 173 HG3 GLN 22 HG1 GLN 22 9.950 -6.018 6.630 174 HE21 GLN 22 HE21 GLN 22 11.072 -6.456 4.136 175 HE22 GLN 22 HE22 GLN 22 12.534 -7.354 4.328 176 H ASP 23 HN ASP 23 8.449 -6.885 9.694 177 HA ASP 23 HA ASP 23 8.169 -9.146 11.199 178 HB2 ASP 23 HB2 ASP 23 9.022 -6.870 11.914 179 HB3 ASP 23 HB1 ASP 23 7.331 -6.455 12.199 180 H VAL 24 HN VAL 24 5.634 -6.694 10.753 181 HA VAL 24 HA VAL 24 3.832 -8.302 12.316 182 HB VAL 24 HB VAL 24 3.729 -5.898 12.611 183 HG11 VAL 24 HG11 VAL 24 3.045 -5.787 9.691 184 HG12 VAL 24 HG12 VAL 24 4.532 -5.217 10.448 185 HG13 VAL 24 HG13 VAL 24 3.000 -4.419 10.802 186 HG21 VAL 24 HG21 VAL 24 1.620 -7.003 12.958 187 HG22 VAL 24 HG22 VAL 24 1.277 -6.987 11.231 188 HG23 VAL 24 HG23 VAL 24 1.303 -5.471 12.135 189 H ALA 25 HN ALA 25 4.602 -7.752 9.004 190 HA ALA 25 HA ALA 25 2.199 -8.862 7.894 191 HB1 ALA 25 HB1 ALA 25 3.510 -9.080 5.825 192 HB2 ALA 25 HB2 ALA 25 4.974 -8.654 6.707 193 HB3 ALA 25 HB3 ALA 25 3.681 -7.469 6.521 194 H GLN 26 HN GLN 26 4.972 -9.925 9.467 195 HA GLN 26 HA GLN 26 4.793 -12.664 8.587 196 HB2 GLN 26 HB2 GLN 26 6.958 -12.360 9.029 197 HB3 GLN 26 HB1 GLN 26 6.618 -10.924 9.978 198 HG2 GLN 26 HG2 GLN 26 7.545 -12.223 11.563 199 HG3 GLN 26 HG1 GLN 26 5.862 -12.694 11.761 200 HE21 GLN 26 HE21 GLN 26 5.802 -14.201 9.295 201 HE22 GLN 26 HE22 GLN 26 6.656 -15.662 9.591 202 H LYS 27 HN LYS 27 4.089 -10.707 11.395 203 HA LYS 27 HA LYS 27 3.260 -12.774 13.119 204 HB2 LYS 27 HB2 LYS 27 2.354 -9.890 13.108 205 HB3 LYS 27 HB1 LYS 27 2.288 -11.004 14.475 206 HG2 LYS 27 HG2 LYS 27 4.762 -9.935 13.142 207 HG3 LYS 27 HG1 LYS 27 4.139 -9.482 14.727 208 HD2 LYS 27 HD2 LYS 27 4.791 -11.477 15.694 209 HD3 LYS 27 HD1 LYS 27 4.791 -12.341 14.155 210 HE2 LYS 27 HE2 LYS 27 6.795 -11.346 13.465 211 HE3 LYS 27 HE1 LYS 27 6.706 -10.111 14.715 212 HZ1 LYS 27 HZ1 LYS 27 8.354 -11.788 15.256 213 HZ2 LYS 27 HZ2 LYS 27 7.193 -13.009 15.155 214 HZ3 LYS 27 HZ3 LYS 27 7.089 -11.846 16.376 215 H SER 28 HN SER 28 1.512 -10.873 10.711 216 HA SER 28 HA SER 28 -1.014 -11.979 11.674 217 HB2 SER 28 HB2 SER 28 -0.412 -9.752 9.735 218 HB3 SER 28 HB1 SER 28 -2.035 -10.257 10.206 219 HG SER 28 HG SER 28 -0.484 -9.779 12.378 220 H ILE 29 HN ILE 29 1.336 -12.536 9.379 221 HA ILE 29 HA ILE 29 -0.600 -13.840 7.590 222 HB ILE 29 HB ILE 29 2.130 -12.749 6.954 223 HG12 ILE 29 HG12 ILE 29 -0.583 -11.889 5.947 224 HG13 ILE 29 HG11 ILE 29 0.399 -11.022 7.134 225 HG21 ILE 29 HG21 ILE 29 0.219 -14.181 5.129 226 HG22 ILE 29 HG22 ILE 29 1.793 -14.759 5.683 227 HG23 ILE 29 HG23 ILE 29 1.695 -13.344 4.632 228 HD11 ILE 29 HD11 ILE 29 1.330 -11.663 4.358 229 HD12 ILE 29 HD12 ILE 29 2.091 -10.595 5.548 230 HD13 ILE 29 HD13 ILE 29 0.549 -10.144 4.815 231 H ALA 30 HN ALA 30 -0.480 -15.994 7.417 232 HA ALA 30 HA ALA 30 1.753 -17.404 8.657 233 HB1 ALA 30 HB1 ALA 30 -0.495 -18.132 9.223 234 HB2 ALA 30 HB2 ALA 30 0.366 -19.404 8.355 235 HB3 ALA 30 HB3 ALA 30 -0.843 -18.429 7.521 236 H ASP 31 HN ASP 31 0.975 -16.163 5.735 237 HA ASP 31 HA ASP 31 2.243 -18.276 4.140 238 HB2 ASP 31 HB2 ASP 31 0.350 -16.049 3.590 239 HB3 ASP 31 HB1 ASP 31 1.441 -16.519 2.300 240 H GLU 32 HN GLU 32 4.427 -18.006 4.182 241 HA GLU 32 HA GLU 32 5.864 -15.640 4.406 242 HB2 GLU 32 HB2 GLU 32 7.727 -16.834 3.354 243 HB3 GLU 32 HB1 GLU 32 6.903 -17.869 4.510 244 HG2 GLU 32 HG2 GLU 32 5.748 -19.010 2.701 245 HG3 GLU 32 HG1 GLU 32 6.503 -17.932 1.529 246 H LYS 33 HN LYS 33 4.173 -16.952 1.686 247 HA LYS 33 HA LYS 33 5.434 -15.410 -0.347 248 HB2 LYS 33 HB2 LYS 33 2.710 -16.724 -0.300 249 HB3 LYS 33 HB1 LYS 33 3.466 -16.030 -1.726 250 HG2 LYS 33 HG2 LYS 33 4.063 -18.183 -2.060 251 HG3 LYS 33 HG1 LYS 33 5.405 -17.712 -1.017 252 HD2 LYS 33 HD2 LYS 33 4.551 -19.807 -0.240 253 HD3 LYS 33 HD1 LYS 33 4.113 -18.562 0.929 254 HE2 LYS 33 HE2 LYS 33 2.262 -20.102 0.518 255 HE3 LYS 33 HE1 LYS 33 1.864 -18.464 0.011 256 HZ1 LYS 33 HZ1 LYS 33 2.341 -19.100 -2.278 257 HZ2 LYS 33 HZ2 LYS 33 1.134 -20.080 -1.617 258 HZ3 LYS 33 HZ3 LYS 33 2.710 -20.677 -1.782 259 H ALA 34 HN ALA 34 2.338 -15.110 1.359 260 HA ALA 34 HA ALA 34 1.716 -12.577 0.272 261 HB1 ALA 34 HB1 ALA 34 0.015 -12.464 2.049 262 HB2 ALA 34 HB2 ALA 34 0.719 -13.898 2.794 263 HB3 ALA 34 HB3 ALA 34 -0.015 -14.007 1.196 264 H ARG 35 HN ARG 35 3.770 -13.642 2.815 265 HA ARG 35 HA ARG 35 3.858 -11.234 4.334 266 HB2 ARG 35 HB2 ARG 35 4.671 -13.701 4.885 267 HB3 ARG 35 HB1 ARG 35 6.179 -13.120 4.197 268 HG2 ARG 35 HG2 ARG 35 4.851 -11.522 6.346 269 HG3 ARG 35 HG1 ARG 35 5.736 -12.984 6.772 270 HD2 ARG 35 HD2 ARG 35 6.807 -10.531 5.384 271 HD3 ARG 35 HD1 ARG 35 7.187 -11.109 7.012 272 HE ARG 35 HE ARG 35 7.827 -12.915 4.821 273 HH11 ARG 35 HH11 ARG 35 8.965 -10.583 7.166 274 HH12 ARG 35 HH12 ARG 35 10.640 -10.949 6.912 275 HH21 ARG 35 HH21 ARG 35 10.035 -13.420 4.501 276 HH22 ARG 35 HH22 ARG 35 11.248 -12.555 5.393 277 H LYS 36 HN LYS 36 6.143 -12.727 2.039 278 HA LYS 36 HA LYS 36 7.881 -10.585 1.691 279 HB2 LYS 36 HB2 LYS 36 6.891 -12.424 -0.477 280 HB3 LYS 36 HB1 LYS 36 8.373 -11.480 -0.503 281 HG2 LYS 36 HG2 LYS 36 9.482 -12.923 0.798 282 HG3 LYS 36 HG1 LYS 36 8.031 -13.369 1.722 283 HD2 LYS 36 HD2 LYS 36 8.844 -15.194 0.242 284 HD3 LYS 36 HD1 LYS 36 7.187 -14.645 -0.103 285 HE2 LYS 36 HE2 LYS 36 7.923 -13.373 -1.983 286 HE3 LYS 36 HE1 LYS 36 9.623 -13.617 -1.584 287 HZ1 LYS 36 HZ1 LYS 36 8.909 -15.046 -3.396 288 HZ2 LYS 36 HZ2 LYS 36 7.711 -15.736 -2.426 289 HZ3 LYS 36 HZ3 LYS 36 9.342 -15.977 -2.054 290 H VAL 37 HN VAL 37 5.126 -11.489 -0.344 291 HA VAL 37 HA VAL 37 5.444 -9.479 -2.197 292 HB VAL 37 HB VAL 37 3.142 -9.776 -2.912 293 HG11 VAL 37 HG11 VAL 37 3.142 -12.250 -3.207 294 HG12 VAL 37 HG12 VAL 37 4.467 -12.363 -2.040 295 HG13 VAL 37 HG13 VAL 37 4.699 -11.507 -3.571 296 HG21 VAL 37 HG21 VAL 37 1.670 -11.363 -1.626 297 HG22 VAL 37 HG22 VAL 37 1.922 -9.780 -0.892 298 HG23 VAL 37 HG23 VAL 37 2.793 -11.184 -0.278 299 H ILE 38 HN ILE 38 3.843 -9.367 0.904 300 HA ILE 38 HA ILE 38 2.704 -6.786 0.335 301 HB ILE 38 HB ILE 38 2.177 -8.863 2.196 302 HG12 ILE 38 HG12 ILE 38 0.857 -6.878 0.735 303 HG13 ILE 38 HG11 ILE 38 0.128 -8.174 1.677 304 HG21 ILE 38 HG21 ILE 38 1.857 -7.675 4.262 305 HG22 ILE 38 HG22 ILE 38 2.521 -6.205 3.546 306 HG23 ILE 38 HG23 ILE 38 3.556 -7.619 3.782 307 HD11 ILE 38 HD11 ILE 38 0.356 -5.345 2.254 308 HD12 ILE 38 HD12 ILE 38 0.608 -6.447 3.600 309 HD13 ILE 38 HD13 ILE 38 -0.896 -6.525 2.672 310 H VAL 39 HN VAL 39 5.463 -8.038 2.168 311 HA VAL 39 HA VAL 39 6.000 -5.479 3.324 312 HB VAL 39 HB VAL 39 7.979 -6.326 4.195 313 HG11 VAL 39 HG11 VAL 39 6.071 -8.624 3.906 314 HG12 VAL 39 HG12 VAL 39 6.094 -7.403 5.178 315 HG13 VAL 39 HG13 VAL 39 7.411 -8.577 5.047 316 HG21 VAL 39 HG21 VAL 39 9.162 -8.322 3.447 317 HG22 VAL 39 HG22 VAL 39 9.043 -7.134 2.148 318 HG23 VAL 39 HG23 VAL 39 7.983 -8.544 2.153 319 H GLU 40 HN GLU 40 7.381 -7.294 0.628 320 HA GLU 40 HA GLU 40 8.956 -5.337 -0.510 321 HB2 GLU 40 HB2 GLU 40 7.428 -7.638 -1.687 322 HB3 GLU 40 HB1 GLU 40 8.585 -6.697 -2.593 323 HG2 GLU 40 HG2 GLU 40 10.366 -7.446 -1.358 324 HG3 GLU 40 HG1 GLU 40 9.382 -7.906 0.007 325 H LEU 41 HN LEU 41 5.500 -5.747 -0.535 326 HA LEU 41 HA LEU 41 5.090 -3.910 -2.708 327 HB2 LEU 41 HB2 LEU 41 3.527 -5.794 -1.449 328 HB3 LEU 41 HB1 LEU 41 2.800 -4.261 -0.999 329 HG LEU 41 HG LEU 41 1.686 -4.792 -2.943 330 HD11 LEU 41 HD11 LEU 41 3.991 -3.268 -4.077 331 HD12 LEU 41 HD12 LEU 41 2.820 -2.552 -2.977 332 HD13 LEU 41 HD13 LEU 41 2.291 -3.191 -4.528 333 HD21 LEU 41 HD21 LEU 41 3.010 -6.732 -3.530 334 HD22 LEU 41 HD22 LEU 41 4.289 -5.682 -4.138 335 HD23 LEU 41 HD23 LEU 41 2.715 -5.708 -4.933 336 H MET 42 HN MET 42 4.180 -3.809 0.718 337 HA MET 42 HA MET 42 3.389 -1.101 0.727 338 HB2 MET 42 HB2 MET 42 4.306 -2.835 3.005 339 HB3 MET 42 HB1 MET 42 3.429 -1.307 3.175 340 HG2 MET 42 HG2 MET 42 2.472 -3.872 1.946 341 HG3 MET 42 HG1 MET 42 1.860 -3.052 3.376 342 HE1 MET 42 HE1 MET 42 -0.547 -3.366 2.387 343 HE2 MET 42 HE2 MET 42 0.094 -4.094 0.907 344 HE3 MET 42 HE3 MET 42 -1.056 -2.762 0.809 345 H ALA 43 HN ALA 43 6.430 -2.639 1.013 346 HA ALA 43 HA ALA 43 8.092 -0.737 1.998 347 HB1 ALA 43 HB1 ALA 43 8.898 -2.836 1.205 348 HB2 ALA 43 HB2 ALA 43 9.721 -1.554 0.313 349 HB3 ALA 43 HB3 ALA 43 8.405 -2.461 -0.443 350 H TYR 44 HN TYR 44 6.158 -0.631 -0.902 351 HA TYR 44 HA TYR 44 7.351 1.978 -1.601 352 HB2 TYR 44 HB2 TYR 44 7.411 0.507 -3.501 353 HB3 TYR 44 HB1 TYR 44 5.746 0.022 -3.236 354 HD1 TYR 44 HD1 TYR 44 7.949 2.390 -4.789 355 HD2 TYR 44 HD2 TYR 44 3.900 1.678 -3.773 356 HE1 TYR 44 HE1 TYR 44 7.249 4.048 -6.447 357 HE2 TYR 44 HE2 TYR 44 3.179 3.354 -5.418 358 HH TYR 44 HH TYR 44 4.180 5.369 -6.558 359 H GLU 45 HN GLU 45 4.188 0.361 -1.875 360 HA GLU 45 HA GLU 45 2.610 2.516 -2.018 361 HB2 GLU 45 HB2 GLU 45 1.719 0.244 -0.337 362 HB3 GLU 45 HB1 GLU 45 0.810 1.149 -1.540 363 HG2 GLU 45 HG2 GLU 45 2.977 -0.838 -2.008 364 HG3 GLU 45 HG1 GLU 45 1.278 -1.064 -2.351 365 H ASN 46 HN ASN 46 4.078 1.279 0.909 366 HA ASN 46 HA ASN 46 2.568 3.171 2.542 367 HB2 ASN 46 HB2 ASN 46 3.980 0.594 3.150 368 HB3 ASN 46 HB1 ASN 46 3.588 1.744 4.432 369 HD21 ASN 46 HD21 ASN 46 2.025 0.363 5.412 370 HD22 ASN 46 HD22 ASN 46 0.519 0.037 4.666 371 H ALA 47 HN ALA 47 5.566 2.652 1.146 372 HA ALA 47 HA ALA 47 7.286 3.789 3.053 373 HB1 ALA 47 HB1 ALA 47 8.790 4.282 1.193 374 HB2 ALA 47 HB2 ALA 47 7.502 3.888 0.057 375 HB3 ALA 47 HB3 ALA 47 8.159 2.636 1.110 376 H ASN 48 HN ASN 48 8.387 5.865 2.746 377 HA ASN 48 HA ASN 48 6.667 8.052 2.936 378 HB2 ASN 48 HB2 ASN 48 9.575 7.592 2.700 379 HB3 ASN 48 HB1 ASN 48 9.025 9.184 2.182 380 HD21 ASN 48 HD21 ASN 48 10.540 8.073 4.575 381 HD22 ASN 48 HD22 ASN 48 9.727 8.779 5.933 382 HA PRO 49 HA PRO 49 5.439 8.935 -1.196 383 HB2 PRO 49 HB2 PRO 49 5.572 11.712 -1.065 384 HB3 PRO 49 HB1 PRO 49 4.189 10.728 -0.584 385 HG2 PRO 49 HG2 PRO 49 6.331 11.949 1.090 386 HG3 PRO 49 HG1 PRO 49 4.607 11.738 1.447 387 HD2 PRO 49 HD2 PRO 49 6.482 10.152 2.534 388 HD3 PRO 49 HD1 PRO 49 4.884 9.526 2.079 389 H GLU 50 HN GLU 50 8.384 10.149 0.120 390 HA GLU 50 HA GLU 50 9.527 10.822 -2.448 391 HB2 GLU 50 HB2 GLU 50 11.321 11.712 -1.238 392 HB3 GLU 50 HB1 GLU 50 9.927 12.025 -0.212 393 HG2 GLU 50 HG2 GLU 50 11.123 9.470 0.333 394 HG3 GLU 50 HG1 GLU 50 12.229 10.808 0.580 395 H CYS 51 HN CYS 51 9.470 8.249 -0.104 396 HA CYS 51 HA CYS 51 11.899 7.103 -1.096 397 HB2 CYS 51 HB2 CYS 51 11.587 7.004 1.240 398 HB3 CYS 51 HB1 CYS 51 10.006 6.231 1.085 399 HG CYS 51 HG CYS 51 11.624 4.206 -0.568 400 H GLN 52 HN GLN 52 8.454 6.387 -1.140 401 HA GLN 52 HA GLN 52 8.771 3.972 -2.619 402 HB2 GLN 52 HB2 GLN 52 6.446 4.128 -3.129 403 HB3 GLN 52 HB1 GLN 52 6.640 4.646 -1.462 404 HG2 GLN 52 HG2 GLN 52 6.546 6.991 -2.240 405 HG3 GLN 52 HG1 GLN 52 6.219 6.400 -3.869 406 HE21 GLN 52 HE21 GLN 52 4.772 4.121 -2.739 407 HE22 GLN 52 HE22 GLN 52 3.238 4.705 -2.258 408 H SER 53 HN SER 53 8.786 7.290 -3.162 409 HA SER 53 HA SER 53 8.756 7.270 -5.985 410 HB2 SER 53 HB2 SER 53 9.436 9.180 -3.815 411 HB3 SER 53 HB1 SER 53 9.793 9.611 -5.503 412 HG SER 53 HG SER 53 7.476 9.764 -4.246 413 H ALA 54 HN ALA 54 11.175 6.805 -3.543 414 HA ALA 54 HA ALA 54 13.337 6.766 -5.442 415 HB1 ALA 54 HB1 ALA 54 14.588 5.692 -3.598 416 HB2 ALA 54 HB2 ALA 54 13.091 5.632 -2.661 417 HB3 ALA 54 HB3 ALA 54 13.792 7.186 -3.106 418 H ILE 55 HN ILE 55 10.824 4.687 -4.498 419 HA ILE 55 HA ILE 55 12.220 2.295 -5.256 420 HB ILE 55 HB ILE 55 9.574 2.794 -3.967 421 HG12 ILE 55 HG12 ILE 55 11.827 1.167 -2.890 422 HG13 ILE 55 HG11 ILE 55 11.963 2.927 -2.896 423 HG21 ILE 55 HG21 ILE 55 9.311 0.858 -5.412 424 HG22 ILE 55 HG22 ILE 55 9.362 0.365 -3.718 425 HG23 ILE 55 HG23 ILE 55 10.781 0.150 -4.743 426 HD11 ILE 55 HD11 ILE 55 11.131 1.994 -0.785 427 HD12 ILE 55 HD12 ILE 55 9.700 1.395 -1.647 428 HD13 ILE 55 HD13 ILE 55 10.018 3.136 -1.547 429 H LYS 56 HN LYS 56 9.534 4.247 -6.613 430 HA LYS 56 HA LYS 56 8.240 2.434 -8.134 431 HB2 LYS 56 HB2 LYS 56 8.766 4.610 -9.948 432 HB3 LYS 56 HB1 LYS 56 7.259 4.069 -9.248 433 HG2 LYS 56 HG2 LYS 56 7.299 6.192 -8.468 434 HG3 LYS 56 HG1 LYS 56 8.197 5.415 -7.163 435 HD2 LYS 56 HD2 LYS 56 10.128 6.340 -7.737 436 HD3 LYS 56 HD1 LYS 56 9.798 6.251 -9.466 437 HE2 LYS 56 HE2 LYS 56 8.685 8.348 -7.547 438 HE3 LYS 56 HE1 LYS 56 9.964 8.569 -8.743 439 HZ1 LYS 56 HZ1 LYS 56 7.947 9.413 -9.631 440 HZ2 LYS 56 HZ2 LYS 56 7.112 7.979 -9.296 441 HZ3 LYS 56 HZ3 LYS 56 8.320 7.996 -10.480 442 HA PRO 57 HA PRO 57 11.693 2.341 -11.648 443 HB2 PRO 57 HB2 PRO 57 14.215 2.415 -10.627 444 HB3 PRO 57 HB1 PRO 57 13.385 3.851 -11.249 445 HG2 PRO 57 HG2 PRO 57 13.513 2.841 -8.417 446 HG3 PRO 57 HG1 PRO 57 13.929 4.466 -9.021 447 HD2 PRO 57 HD2 PRO 57 11.568 4.060 -7.947 448 HD3 PRO 57 HD1 PRO 57 11.650 4.961 -9.471 449 H LEU 58 HN LEU 58 11.906 1.114 -8.388 450 HA LEU 58 HA LEU 58 12.981 -1.466 -9.300 451 HB2 LEU 58 HB2 LEU 58 12.479 -0.949 -6.433 452 HB3 LEU 58 HB1 LEU 58 13.796 -1.845 -7.181 453 HG LEU 58 HG LEU 58 13.549 1.165 -7.000 454 HD11 LEU 58 HD11 LEU 58 13.950 0.119 -4.845 455 HD12 LEU 58 HD12 LEU 58 15.399 0.963 -5.402 456 HD13 LEU 58 HD13 LEU 58 15.299 -0.794 -5.521 457 HD21 LEU 58 HD21 LEU 58 15.852 1.195 -7.828 458 HD22 LEU 58 HD22 LEU 58 14.747 0.487 -9.005 459 HD23 LEU 58 HD23 LEU 58 15.797 -0.555 -8.043 460 H LYS 59 HN LYS 59 10.274 0.255 -8.329 461 HA LYS 59 HA LYS 59 8.689 -1.508 -6.950 462 HB2 LYS 59 HB2 LYS 59 7.975 0.731 -7.335 463 HB3 LYS 59 HB1 LYS 59 7.974 0.494 -9.073 464 HG2 LYS 59 HG2 LYS 59 5.751 0.328 -8.696 465 HG3 LYS 59 HG1 LYS 59 6.202 -1.348 -8.434 466 HD2 LYS 59 HD2 LYS 59 5.857 0.722 -6.294 467 HD3 LYS 59 HD1 LYS 59 4.692 -0.545 -6.681 468 HE2 LYS 59 HE2 LYS 59 6.880 -2.045 -6.287 469 HE3 LYS 59 HE1 LYS 59 7.272 -0.686 -5.227 470 HZ1 LYS 59 HZ1 LYS 59 4.867 -1.031 -4.383 471 HZ2 LYS 59 HZ2 LYS 59 6.079 -2.101 -3.858 472 HZ3 LYS 59 HZ3 LYS 59 5.013 -2.567 -5.086 473 H GLY 60 HN GLY 60 8.389 -3.568 -7.363 474 HA2 GLY 60 HA3 GLY 60 7.328 -5.344 -8.475 475 HA3 GLY 60 HA2 GLY 60 7.250 -4.359 -9.927 476 H LYS 61 HN LYS 61 10.229 -3.730 -9.355 477 HA LYS 61 HA LYS 61 11.209 -6.089 -10.809 478 HB2 LYS 61 HB2 LYS 61 12.828 -3.605 -10.527 479 HB3 LYS 61 HB1 LYS 61 12.670 -4.681 -11.903 480 HG2 LYS 61 HG2 LYS 61 10.572 -2.733 -11.005 481 HG3 LYS 61 HG1 LYS 61 11.724 -2.443 -12.298 482 HD2 LYS 61 HD2 LYS 61 9.751 -4.722 -12.252 483 HD3 LYS 61 HD1 LYS 61 9.480 -3.187 -13.083 484 HE2 LYS 61 HE2 LYS 61 11.396 -3.565 -14.491 485 HE3 LYS 61 HE1 LYS 61 11.795 -5.036 -13.609 486 HZ1 LYS 61 HZ1 LYS 61 9.792 -6.059 -14.395 487 HZ2 LYS 61 HZ2 LYS 61 10.645 -5.457 -15.726 488 HZ3 LYS 61 HZ3 LYS 61 9.290 -4.628 -15.143 489 H VAL 62 HN VAL 62 12.161 -7.507 -9.489 490 HA VAL 62 HA VAL 62 14.131 -6.449 -7.581 491 HB VAL 62 HB VAL 62 12.287 -7.501 -6.375 492 HG11 VAL 62 HG11 VAL 62 11.821 -9.901 -6.572 493 HG12 VAL 62 HG12 VAL 62 12.923 -9.991 -7.947 494 HG13 VAL 62 HG13 VAL 62 11.453 -9.023 -8.057 495 HG21 VAL 62 HG21 VAL 62 13.564 -9.191 -5.096 496 HG22 VAL 62 HG22 VAL 62 14.454 -7.694 -5.373 497 HG23 VAL 62 HG23 VAL 62 14.819 -9.129 -6.333 498 HA PRO 63 HA PRO 63 17.316 -8.827 -9.794 499 HB2 PRO 63 HB2 PRO 63 18.109 -9.355 -6.967 500 HB3 PRO 63 HB1 PRO 63 19.110 -8.888 -8.328 501 HG2 PRO 63 HG2 PRO 63 18.445 -7.098 -6.496 502 HG3 PRO 63 HG1 PRO 63 18.468 -6.658 -8.213 503 HD2 PRO 63 HD2 PRO 63 16.147 -7.172 -6.421 504 HD3 PRO 63 HD1 PRO 63 16.291 -6.055 -7.793 505 H ALA 64 HN ALA 64 17.486 -10.953 -10.318 506 HA ALA 64 HA ALA 64 15.401 -12.677 -9.565 507 HB1 ALA 64 HB1 ALA 64 17.964 -13.362 -10.996 508 HB2 ALA 64 HB2 ALA 64 16.489 -12.762 -11.755 509 HB3 ALA 64 HB3 ALA 64 16.496 -14.338 -10.963 510 H GLY 65 HN GLY 65 15.273 -13.307 -7.486 511 HA2 GLY 65 HA3 GLY 65 15.796 -15.176 -6.056 512 HA3 GLY 65 HA2 GLY 65 17.485 -14.985 -6.501 513 H SER 66 HN SER 66 16.894 -11.941 -6.170 514 HA SER 66 HA SER 66 17.768 -11.918 -3.398 515 HB2 SER 66 HB2 SER 66 17.469 -9.599 -5.314 516 HB3 SER 66 HB1 SER 66 18.402 -9.633 -3.816 517 HG SER 66 HG SER 66 19.337 -11.624 -5.160 518 H ASP 67 HN ASP 67 16.935 -10.017 -2.062 519 HA ASP 67 HA ASP 67 14.033 -10.147 -1.902 520 HB2 ASP 67 HB2 ASP 67 15.978 -9.988 -0.004 521 HB3 ASP 67 HB1 ASP 67 15.573 -8.291 -0.178 522 H VAL 68 HN VAL 68 12.625 -8.344 -2.287 523 HA VAL 68 HA VAL 68 13.831 -6.308 -3.946 524 HB VAL 68 HB VAL 68 11.809 -5.799 -4.733 525 HG11 VAL 68 HG11 VAL 68 11.708 -8.236 -4.704 526 HG12 VAL 68 HG12 VAL 68 10.114 -7.497 -4.592 527 HG13 VAL 68 HG13 VAL 68 10.875 -8.177 -3.153 528 HG21 VAL 68 HG21 VAL 68 9.773 -5.516 -3.259 529 HG22 VAL 68 HG22 VAL 68 11.121 -4.413 -2.971 530 HG23 VAL 68 HG23 VAL 68 10.855 -5.776 -1.888 531 H ILE 69 HN ILE 69 12.844 -6.734 -0.687 532 HA ILE 69 HA ILE 69 12.550 -4.072 0.081 533 HB ILE 69 HB ILE 69 13.384 -6.503 1.622 534 HG12 ILE 69 HG12 ILE 69 11.129 -6.730 1.043 535 HG13 ILE 69 HG11 ILE 69 11.055 -5.997 2.638 536 HG21 ILE 69 HG21 ILE 69 12.955 -3.691 2.634 537 HG22 ILE 69 HG22 ILE 69 14.390 -4.702 2.801 538 HG23 ILE 69 HG23 ILE 69 12.916 -5.114 3.680 539 HD11 ILE 69 HD11 ILE 69 10.701 -4.615 0.008 540 HD12 ILE 69 HD12 ILE 69 10.767 -3.798 1.568 541 HD13 ILE 69 HD13 ILE 69 9.466 -4.944 1.228 542 H SER 70 HN SER 70 15.328 -6.174 0.124 543 HA SER 70 HA SER 70 17.263 -4.560 1.170 544 HB2 SER 70 HB2 SER 70 17.678 -6.873 0.560 545 HB3 SER 70 HB1 SER 70 17.476 -6.502 -1.148 546 HG SER 70 HG SER 70 19.510 -6.023 -1.183 547 H GLU 71 HN GLU 71 15.860 -4.386 -2.049 548 HA GLU 71 HA GLU 71 17.689 -2.373 -3.007 549 HB2 GLU 71 HB2 GLU 71 15.139 -3.299 -4.293 550 HB3 GLU 71 HB1 GLU 71 16.582 -2.656 -5.071 551 HG2 GLU 71 HG2 GLU 71 16.918 -5.110 -3.488 552 HG3 GLU 71 HG1 GLU 71 15.993 -5.250 -4.975 553 H TYR 72 HN TYR 72 14.508 -2.623 -1.697 554 HA TYR 72 HA TYR 72 13.642 -0.041 -2.550 555 HB2 TYR 72 HB2 TYR 72 12.549 -2.151 -0.705 556 HB3 TYR 72 HB1 TYR 72 11.793 -0.568 -0.823 557 HD1 TYR 72 HD1 TYR 72 13.308 -1.910 -3.827 558 HD2 TYR 72 HD2 TYR 72 9.729 -1.706 -1.559 559 HE1 TYR 72 HE1 TYR 72 12.032 -2.682 -5.766 560 HE2 TYR 72 HE2 TYR 72 8.441 -2.495 -3.493 561 HH TYR 72 HH TYR 72 10.044 -3.618 -6.398 562 H VAL 73 HN VAL 73 15.027 -1.497 0.304 563 HA VAL 73 HA VAL 73 14.935 0.865 1.889 564 HB VAL 73 HB VAL 73 16.205 -0.137 3.521 565 HG11 VAL 73 HG11 VAL 73 14.204 -1.377 3.345 566 HG12 VAL 73 HG12 VAL 73 15.511 -2.486 3.748 567 HG13 VAL 73 HG13 VAL 73 14.891 -2.413 2.098 568 HG21 VAL 73 HG21 VAL 73 18.080 -0.685 1.812 569 HG22 VAL 73 HG22 VAL 73 17.377 -2.305 1.860 570 HG23 VAL 73 HG23 VAL 73 17.977 -1.552 3.347 571 H LYS 74 HN LYS 74 17.078 -0.637 -0.373 572 HA LYS 74 HA LYS 74 19.302 1.070 -0.210 573 HB2 LYS 74 HB2 LYS 74 19.033 -1.186 -1.361 574 HB3 LYS 74 HB1 LYS 74 18.257 -0.313 -2.663 575 HG2 LYS 74 HG2 LYS 74 20.191 0.329 -3.525 576 HG3 LYS 74 HG1 LYS 74 20.803 0.864 -1.958 577 HD2 LYS 74 HD2 LYS 74 20.741 -1.995 -2.922 578 HD3 LYS 74 HD1 LYS 74 22.164 -0.949 -2.933 579 HE2 LYS 74 HE2 LYS 74 20.598 -1.601 -0.442 580 HE3 LYS 74 HE1 LYS 74 22.000 -2.533 -0.980 581 HZ1 LYS 74 HZ1 LYS 74 22.016 0.371 -0.354 582 HZ2 LYS 74 HZ2 LYS 74 23.353 -0.557 -0.807 583 HZ3 LYS 74 HZ3 LYS 74 22.584 -0.851 0.670 584 H ALA 75 HN ALA 75 16.241 1.223 -1.844 585 HA ALA 75 HA ALA 75 16.701 3.428 -3.524 586 HB1 ALA 75 HB1 ALA 75 14.255 3.691 -3.490 587 HB2 ALA 75 HB2 ALA 75 14.166 2.553 -2.144 588 HB3 ALA 75 HB3 ALA 75 14.738 2.010 -3.720 589 H CYS 76 HN CYS 76 15.499 3.215 -0.200 590 HA CYS 76 HA CYS 76 15.742 6.116 0.093 591 HB2 CYS 76 HB2 CYS 76 13.767 5.126 0.990 592 HB3 CYS 76 HB1 CYS 76 14.688 3.972 1.930 593 HG CYS 76 HG CYS 76 15.870 6.498 3.210 594 H ASP 77 HN ASP 77 17.900 3.757 0.108 595 HA ASP 77 HA ASP 77 19.380 4.207 2.460 596 HB2 ASP 77 HB2 ASP 77 19.860 2.282 1.146 597 HB3 ASP 77 HB1 ASP 77 20.189 3.233 -0.293 598 H GLY 78 HN GLY 78 18.821 6.099 -0.315 599 HA2 GLY 78 HA3 GLY 78 20.866 8.027 0.560 600 HA3 GLY 78 HA2 GLY 78 20.099 8.016 -1.021 601 H ILE 79 HN ILE 79 17.722 7.391 1.256 602 HA ILE 79 HA ILE 79 16.957 10.212 1.267 603 HB ILE 79 HB ILE 79 15.273 7.768 1.618 604 HG12 ILE 79 HG12 ILE 79 15.266 9.833 -0.588 605 HG13 ILE 79 HG11 ILE 79 16.030 8.245 -0.702 606 HG21 ILE 79 HG21 ILE 79 13.343 9.246 1.679 607 HG22 ILE 79 HG22 ILE 79 14.410 10.649 1.600 608 HG23 ILE 79 HG23 ILE 79 14.448 9.589 3.010 609 HD11 ILE 79 HD11 ILE 79 13.942 7.151 -0.588 610 HD12 ILE 79 HD12 ILE 79 13.779 8.461 -1.761 611 HD13 ILE 79 HD13 ILE 79 13.114 8.641 -0.139 612 H GLY 80 HN GLY 80 17.000 11.283 3.068 613 HA2 GLY 80 HA3 GLY 80 15.737 10.473 5.412 614 HA3 GLY 80 HA2 GLY 80 17.467 10.251 5.633 615 H GLY 81 HN GLY 81 18.537 12.253 4.268 616 HA2 GLY 81 HA3 GLY 81 17.284 14.776 4.983 617 HA3 GLY 81 HA2 GLY 81 18.740 14.382 5.896 618 H ALA 82 HN ALA 82 18.454 16.614 4.173 619 HA ALA 82 HA ALA 82 19.506 17.738 2.517 620 HB1 ALA 82 HB1 ALA 82 21.466 15.453 2.582 621 HB2 ALA 82 HB2 ALA 82 21.536 16.904 3.581 622 HB3 ALA 82 HB3 ALA 82 21.729 17.028 1.832 623 H MET 83 HN MET 83 20.350 14.502 1.323 624 HA MET 83 HA MET 83 19.602 15.080 -1.324 625 HB2 MET 83 HB2 MET 83 19.904 12.397 0.035 626 HB3 MET 83 HB1 MET 83 19.770 12.633 -1.702 627 HG2 MET 83 HG2 MET 83 21.829 14.003 -1.625 628 HG3 MET 83 HG1 MET 83 21.979 13.613 0.085 629 HE1 MET 83 HE1 MET 83 21.940 12.211 -3.560 630 HE2 MET 83 HE2 MET 83 20.725 11.187 -2.794 631 HE3 MET 83 HE3 MET 83 22.261 10.495 -3.308 632 H HIS 84 HN HIS 84 17.878 13.500 1.307 633 HA HIS 84 HA HIS 84 15.536 12.701 0.089 634 HB2 HIS 84 HB2 HIS 84 15.805 12.231 2.396 635 HB3 HIS 84 HB1 HIS 84 16.121 13.909 2.792 636 HD1 HIS 84 HD1 HIS 84 14.338 13.908 4.633 637 HD2 HIS 84 HD2 HIS 84 12.829 12.990 0.868 638 HE1 HIS 84 HE1 HIS 84 11.840 14.051 4.854 639 HE2 HIS 84 HE2 HIS 84 10.954 13.276 2.633 640 H LYS 85 HN LYS 85 16.433 15.977 1.100 641 HA LYS 85 HA LYS 85 13.843 16.957 0.271 642 HB2 LYS 85 HB2 LYS 85 16.153 18.250 1.681 643 HB3 LYS 85 HB1 LYS 85 14.675 19.113 1.227 644 HG2 LYS 85 HG2 LYS 85 13.336 17.783 2.576 645 HG3 LYS 85 HG1 LYS 85 14.563 16.531 2.717 646 HD2 LYS 85 HD2 LYS 85 15.929 18.206 4.017 647 HD3 LYS 85 HD1 LYS 85 14.460 19.201 4.076 648 HE2 LYS 85 HE2 LYS 85 13.231 17.305 5.005 649 HE3 LYS 85 HE1 LYS 85 14.708 16.339 4.986 650 HZ1 LYS 85 HZ1 LYS 85 14.285 18.833 6.566 651 HZ2 LYS 85 HZ2 LYS 85 15.695 17.900 6.560 652 HZ3 LYS 85 HZ3 LYS 85 14.260 17.259 7.188 653 H ALA 86 HN ALA 86 16.967 16.685 -1.073 654 HA ALA 86 HA ALA 86 16.546 18.666 -3.121 655 HB1 ALA 86 HB1 ALA 86 18.516 16.389 -3.025 656 HB2 ALA 86 HB2 ALA 86 18.815 18.021 -2.426 657 HB3 ALA 86 HB3 ALA 86 18.551 17.749 -4.148 658 H MET 87 HN MET 87 16.171 15.270 -2.682 659 HA MET 87 HA MET 87 15.336 14.761 -5.394 660 HB2 MET 87 HB2 MET 87 15.594 13.016 -2.943 661 HB3 MET 87 HB1 MET 87 15.123 12.424 -4.540 662 HG2 MET 87 HG2 MET 87 17.546 14.044 -4.535 663 HG3 MET 87 HG1 MET 87 17.677 12.563 -3.606 664 HE1 MET 87 HE1 MET 87 19.653 11.819 -5.274 665 HE2 MET 87 HE2 MET 87 19.442 13.302 -6.203 666 HE3 MET 87 HE3 MET 87 19.466 11.744 -7.026 667 H LEU 88 HN LEU 88 13.869 15.813 -2.575 668 HA LEU 88 HA LEU 88 11.431 14.510 -2.503 669 HB2 LEU 88 HB2 LEU 88 12.559 16.418 -1.044 670 HB3 LEU 88 HB1 LEU 88 11.508 17.435 -2.004 671 HG LEU 88 HG LEU 88 9.761 16.947 -0.705 672 HD11 LEU 88 HD11 LEU 88 10.449 14.010 -0.866 673 HD12 LEU 88 HD12 LEU 88 9.441 14.868 -2.033 674 HD13 LEU 88 HD13 LEU 88 8.913 14.709 -0.358 675 HD21 LEU 88 HD21 LEU 88 11.426 17.051 1.042 676 HD22 LEU 88 HD22 LEU 88 11.805 15.345 0.815 677 HD23 LEU 88 HD23 LEU 88 10.227 15.821 1.447 678 H MET 89 HN MET 89 12.521 17.110 -4.624 679 HA MET 89 HA MET 89 9.921 17.355 -5.873 680 HB2 MET 89 HB2 MET 89 11.447 19.288 -5.738 681 HB3 MET 89 HB1 MET 89 12.619 18.434 -6.726 682 HG2 MET 89 HG2 MET 89 9.854 19.046 -7.713 683 HG3 MET 89 HG1 MET 89 11.173 20.201 -7.849 684 HE1 MET 89 HE1 MET 89 13.672 18.225 -8.446 685 HE2 MET 89 HE2 MET 89 13.375 19.766 -9.248 686 HE3 MET 89 HE3 MET 89 13.673 18.318 -10.207 687 H ALA 90 HN ALA 90 13.009 15.845 -6.523 688 HA ALA 90 HA ALA 90 12.566 15.160 -9.211 689 HB1 ALA 90 HB1 ALA 90 14.393 13.800 -7.231 690 HB2 ALA 90 HB2 ALA 90 14.783 15.277 -8.118 691 HB3 ALA 90 HB3 ALA 90 14.524 13.767 -8.991 692 H GLN 91 HN GLN 91 12.459 13.080 -6.311 693 HA GLN 91 HA GLN 91 11.626 10.859 -7.972 694 HB2 GLN 91 HB2 GLN 91 11.902 10.872 -4.985 695 HB3 GLN 91 HB1 GLN 91 11.961 9.488 -6.075 696 HG2 GLN 91 HG2 GLN 91 14.025 10.158 -6.958 697 HG3 GLN 91 HG1 GLN 91 13.876 11.733 -6.183 698 HE21 GLN 91 HE21 GLN 91 12.941 10.716 -3.699 699 HE22 GLN 91 HE22 GLN 91 14.268 9.951 -2.917 700 H LEU 92 HN LEU 92 10.275 12.848 -5.387 701 HA LEU 92 HA LEU 92 8.172 11.470 -4.445 702 HB2 LEU 92 HB2 LEU 92 8.893 13.993 -4.204 703 HB3 LEU 92 HB1 LEU 92 7.613 14.257 -5.373 704 HG LEU 92 HG LEU 92 7.341 13.117 -2.589 705 HD11 LEU 92 HD11 LEU 92 5.939 15.101 -2.247 706 HD12 LEU 92 HD12 LEU 92 6.333 15.638 -3.882 707 HD13 LEU 92 HD13 LEU 92 7.603 15.509 -2.666 708 HD21 LEU 92 HD21 LEU 92 5.188 13.497 -4.670 709 HD22 LEU 92 HD22 LEU 92 4.936 13.027 -2.989 710 HD23 LEU 92 HD23 LEU 92 5.795 11.948 -4.087 711 H GLU 93 HN GLU 93 8.343 13.110 -7.546 712 HA GLU 93 HA GLU 93 6.556 11.129 -8.610 713 HB2 GLU 93 HB2 GLU 93 6.005 14.046 -8.898 714 HB3 GLU 93 HB1 GLU 93 5.219 12.806 -9.868 715 HG2 GLU 93 HG2 GLU 93 4.769 11.797 -7.471 716 HG3 GLU 93 HG1 GLU 93 4.887 13.494 -7.016 717 H2 PRO 1 HT1 PRO 1 5.371 -4.439 -13.119 718 H3 PRO 1 HT2 PRO 1 5.807 -2.976 -13.706 719 HA PRO 1 HA PRO 1 6.487 -2.779 -11.656 720 HB2 PRO 1 HB2 PRO 1 4.379 -1.654 -10.434 721 HB3 PRO 1 HB1 PRO 1 5.182 -0.872 -11.798 722 HG2 PRO 1 HG2 PRO 1 2.557 -2.156 -11.685 723 HG3 PRO 1 HG1 PRO 1 3.213 -1.052 -12.904 724 HD2 PRO 1 HD2 PRO 1 3.055 -3.964 -12.939 725 HD3 PRO 1 HD1 PRO 1 3.448 -2.853 -14.266 726 H SER 2 HN SER 2 4.755 -2.726 -9.275 727 HA SER 2 HA SER 2 4.361 -5.468 -8.624 728 HB2 SER 2 HB2 SER 2 3.044 -3.017 -7.435 729 HB3 SER 2 HB1 SER 2 3.110 -4.616 -6.709 730 HG SER 2 HG SER 2 5.540 -4.249 -7.031 731 H PHE 3 HN PHE 3 2.062 -6.282 -8.149 732 HA PHE 3 HA PHE 3 0.440 -6.049 -10.445 733 HB2 PHE 3 HB2 PHE 3 -1.197 -6.793 -8.261 734 HB3 PHE 3 HB1 PHE 3 -0.464 -7.867 -9.460 735 HD1 PHE 3 HD1 PHE 3 -0.661 -6.815 -6.101 736 HD2 PHE 3 HD2 PHE 3 1.876 -8.765 -8.898 737 HE1 PHE 3 HE1 PHE 3 0.581 -7.828 -4.270 738 HE2 PHE 3 HE2 PHE 3 3.147 -9.785 -7.053 739 HZ PHE 3 HZ PHE 3 2.499 -9.316 -4.724 740 H ASN 4 HN ASN 4 0.258 -4.701 -7.236 741 HA ASN 4 HA ASN 4 -2.414 -3.716 -7.682 742 HB2 ASN 4 HB2 ASN 4 -2.289 -3.236 -5.281 743 HB3 ASN 4 HB1 ASN 4 -1.804 -4.896 -5.640 744 HD21 ASN 4 HD21 ASN 4 -0.635 -1.682 -4.854 745 HD22 ASN 4 HD22 ASN 4 0.916 -2.197 -4.274 746 H THR 5 HN THR 5 0.422 -2.353 -8.481 747 HA THR 5 HA THR 5 0.484 0.064 -7.009 748 HB THR 5 HB THR 5 1.704 0.822 -9.218 749 HG1 THR 5 HG1 THR 5 1.350 -0.816 -10.605 750 HG21 THR 5 HG21 THR 5 2.681 -1.182 -7.219 751 HG22 THR 5 HG22 THR 5 2.839 0.573 -7.159 752 HG23 THR 5 HG23 THR 5 3.735 -0.357 -8.364 753 H VAL 6 HN VAL 6 -1.841 -0.956 -9.126 754 HA VAL 6 HA VAL 6 -2.537 1.569 -10.179 755 HB VAL 6 HB VAL 6 -4.549 0.595 -10.878 756 HG11 VAL 6 HG11 VAL 6 -2.549 -1.653 -10.772 757 HG12 VAL 6 HG12 VAL 6 -2.514 -0.309 -11.918 758 HG13 VAL 6 HG13 VAL 6 -3.853 -1.458 -11.949 759 HG21 VAL 6 HG21 VAL 6 -4.169 -1.673 -8.925 760 HG22 VAL 6 HG22 VAL 6 -5.521 -1.449 -10.044 761 HG23 VAL 6 HG23 VAL 6 -5.287 -0.318 -8.705 762 H ARG 7 HN ARG 7 -3.041 3.250 -8.955 763 HA ARG 7 HA ARG 7 -4.520 2.720 -6.507 764 HB2 ARG 7 HB2 ARG 7 -2.721 5.003 -7.203 765 HB3 ARG 7 HB1 ARG 7 -3.871 5.008 -5.878 766 HG2 ARG 7 HG2 ARG 7 -1.650 4.694 -5.112 767 HG3 ARG 7 HG1 ARG 7 -2.660 3.316 -4.804 768 HD2 ARG 7 HD2 ARG 7 -0.543 2.564 -5.459 769 HD3 ARG 7 HD1 ARG 7 -1.684 2.194 -6.736 770 HE ARG 7 HE ARG 7 -0.539 3.593 -8.141 771 HH11 ARG 7 HH11 ARG 7 0.487 4.260 -4.854 772 HH12 ARG 7 HH12 ARG 7 1.749 5.345 -5.336 773 HH21 ARG 7 HH21 ARG 7 1.148 4.986 -8.773 774 HH22 ARG 7 HH22 ARG 7 2.139 5.746 -7.571 775 H GLN 8 HN GLN 8 -6.143 4.146 -5.931 776 HA GLN 8 HA GLN 8 -7.929 5.132 -7.790 777 HB2 GLN 8 HB2 GLN 8 -7.712 4.853 -5.018 778 HB3 GLN 8 HB1 GLN 8 -8.001 6.569 -5.259 779 HG2 GLN 8 HG2 GLN 8 -9.992 6.031 -6.585 780 HG3 GLN 8 HG1 GLN 8 -9.717 4.317 -6.281 781 HE21 GLN 8 HE21 GLN 8 -12.006 5.922 -5.601 782 HE22 GLN 8 HE22 GLN 8 -12.167 5.831 -3.871 783 H GLY 9 HN GLY 9 -7.576 6.719 -9.195 784 HA2 GLY 9 HA3 GLY 9 -5.805 8.930 -8.585 785 HA3 GLY 9 HA2 GLY 9 -6.698 8.679 -10.076 786 H SER 10 HN SER 10 -7.263 10.929 -10.009 787 HA SER 10 HA SER 10 -8.518 12.290 -7.978 788 HB2 SER 10 HB2 SER 10 -9.141 12.524 -10.929 789 HB3 SER 10 HB1 SER 10 -9.429 13.756 -9.703 790 HG SER 10 HG SER 10 -7.328 13.609 -11.119 791 H LYS 11 HN LYS 11 -10.062 11.430 -6.790 792 HA LYS 11 HA LYS 11 -11.688 9.966 -6.163 793 HB2 LYS 11 HB2 LYS 11 -13.894 10.833 -6.537 794 HB3 LYS 11 HB1 LYS 11 -12.794 12.168 -6.270 795 HG2 LYS 11 HG2 LYS 11 -13.481 11.346 -9.058 796 HG3 LYS 11 HG1 LYS 11 -14.605 12.323 -8.115 797 HD2 LYS 11 HD2 LYS 11 -12.944 14.040 -7.831 798 HD3 LYS 11 HD1 LYS 11 -11.721 13.043 -8.617 799 HE2 LYS 11 HE2 LYS 11 -14.211 14.174 -9.886 800 HE3 LYS 11 HE1 LYS 11 -12.557 14.713 -10.159 801 HZ1 LYS 11 HZ1 LYS 11 -12.075 12.458 -11.028 802 HZ2 LYS 11 HZ2 LYS 11 -13.208 13.306 -11.952 803 HZ3 LYS 11 HZ3 LYS 11 -13.721 12.088 -10.902 804 H GLU 12 HN GLU 12 -10.342 8.564 -7.955 805 HA GLU 12 HA GLU 12 -11.788 7.598 -10.165 806 HB2 GLU 12 HB2 GLU 12 -9.378 7.230 -9.859 807 HB3 GLU 12 HB1 GLU 12 -9.681 6.220 -8.453 808 HG2 GLU 12 HG2 GLU 12 -10.741 4.556 -9.824 809 HG3 GLU 12 HG1 GLU 12 -10.614 5.593 -11.245 810 HA PRO 13 HA PRO 13 -15.138 5.349 -8.275 811 HB2 PRO 13 HB2 PRO 13 -14.626 3.337 -10.381 812 HB3 PRO 13 HB1 PRO 13 -16.122 4.180 -9.986 813 HG2 PRO 13 HG2 PRO 13 -14.663 4.777 -12.168 814 HG3 PRO 13 HG1 PRO 13 -15.596 5.987 -11.280 815 HD2 PRO 13 HD2 PRO 13 -12.670 5.553 -11.369 816 HD3 PRO 13 HD1 PRO 13 -13.581 7.041 -11.074 817 H TYR 14 HN TYR 14 -14.935 4.055 -6.559 818 HA TYR 14 HA TYR 14 -12.343 3.025 -6.122 819 HB2 TYR 14 HB2 TYR 14 -13.545 4.142 -4.336 820 HB3 TYR 14 HB1 TYR 14 -14.740 2.848 -4.325 821 HD1 TYR 14 HD1 TYR 14 -13.965 0.526 -3.821 822 HD2 TYR 14 HD2 TYR 14 -11.557 3.920 -3.149 823 HE1 TYR 14 HE1 TYR 14 -12.592 -0.794 -2.293 824 HE2 TYR 14 HE2 TYR 14 -10.161 2.653 -1.592 825 HH TYR 14 HH TYR 14 -10.064 0.706 -0.404 826 HA PRO 15 HA PRO 15 -14.574 -1.306 -5.728 827 HB2 PRO 15 HB2 PRO 15 -16.682 -0.929 -7.764 828 HB3 PRO 15 HB1 PRO 15 -16.740 -1.808 -6.240 829 HG2 PRO 15 HG2 PRO 15 -17.960 0.546 -6.561 830 HG3 PRO 15 HG1 PRO 15 -17.260 0.059 -5.022 831 HD2 PRO 15 HD2 PRO 15 -16.269 2.025 -7.016 832 HD3 PRO 15 HD1 PRO 15 -16.082 2.002 -5.257 833 H ASP 16 HN ASP 16 -14.167 0.781 -8.320 834 HA ASP 16 HA ASP 16 -13.396 -1.257 -10.227 835 HB2 ASP 16 HB2 ASP 16 -14.005 1.643 -10.375 836 HB3 ASP 16 HB1 ASP 16 -12.830 1.028 -11.531 837 H PHE 17 HN PHE 17 -11.950 1.482 -8.489 838 HA PHE 17 HA PHE 17 -9.318 1.246 -9.368 839 HB2 PHE 17 HB2 PHE 17 -9.266 3.030 -7.952 840 HB3 PHE 17 HB1 PHE 17 -10.695 2.467 -7.092 841 HD1 PHE 17 HD1 PHE 17 -10.483 1.167 -5.074 842 HD2 PHE 17 HD2 PHE 17 -7.036 2.453 -7.202 843 HE1 PHE 17 HE1 PHE 17 -9.096 0.656 -3.123 844 HE2 PHE 17 HE2 PHE 17 -5.633 1.988 -5.246 845 HZ PHE 17 HZ PHE 17 -6.663 1.061 -3.201 846 H VAL 18 HN VAL 18 -11.080 -0.459 -6.854 847 HA VAL 18 HA VAL 18 -8.787 -2.025 -6.157 848 HB VAL 18 HB VAL 18 -10.134 -1.561 -4.302 849 HG11 VAL 18 HG11 VAL 18 -12.176 -0.913 -5.365 850 HG12 VAL 18 HG12 VAL 18 -12.527 -2.214 -4.212 851 HG13 VAL 18 HG13 VAL 18 -12.447 -2.556 -5.952 852 HG21 VAL 18 HG21 VAL 18 -9.367 -3.799 -4.196 853 HG22 VAL 18 HG22 VAL 18 -10.649 -4.351 -5.283 854 HG23 VAL 18 HG23 VAL 18 -11.049 -3.788 -3.650 855 H ALA 19 HN ALA 19 -11.773 -2.578 -8.016 856 HA ALA 19 HA ALA 19 -11.503 -5.346 -8.331 857 HB1 ALA 19 HB1 ALA 19 -12.549 -3.418 -10.402 858 HB2 ALA 19 HB2 ALA 19 -13.485 -4.083 -9.066 859 HB3 ALA 19 HB3 ALA 19 -12.863 -5.150 -10.325 860 H ARG 20 HN ARG 20 -9.785 -2.749 -10.012 861 HA ARG 20 HA ARG 20 -8.549 -4.692 -11.774 862 HB2 ARG 20 HB2 ARG 20 -7.206 -2.809 -12.623 863 HB3 ARG 20 HB1 ARG 20 -8.929 -2.492 -12.722 864 HG2 ARG 20 HG2 ARG 20 -8.856 -0.843 -11.131 865 HG3 ARG 20 HG1 ARG 20 -7.410 -1.501 -10.360 866 HD2 ARG 20 HD2 ARG 20 -6.019 -0.740 -12.130 867 HD3 ARG 20 HD1 ARG 20 -7.404 -0.338 -13.126 868 HE ARG 20 HE ARG 20 -7.705 1.247 -10.940 869 HH11 ARG 20 HH11 ARG 20 -5.120 0.712 -13.240 870 HH12 ARG 20 HH12 ARG 20 -4.498 2.323 -13.106 871 HH21 ARG 20 HH21 ARG 20 -6.906 3.382 -10.782 872 HH22 ARG 20 HH22 ARG 20 -5.507 3.836 -11.711 873 H LEU 21 HN LEU 21 -8.007 -2.978 -8.843 874 HA LEU 21 HA LEU 21 -5.369 -3.546 -8.290 875 HB2 LEU 21 HB2 LEU 21 -7.221 -2.265 -6.978 876 HB3 LEU 21 HB1 LEU 21 -7.550 -3.813 -6.241 877 HG LEU 21 HG LEU 21 -5.503 -3.823 -5.090 878 HD11 LEU 21 HD11 LEU 21 -3.781 -2.072 -5.459 879 HD12 LEU 21 HD12 LEU 21 -4.688 -1.548 -6.881 880 HD13 LEU 21 HD13 LEU 21 -3.987 -3.171 -6.823 881 HD21 LEU 21 HD21 LEU 21 -7.084 -2.343 -4.090 882 HD22 LEU 21 HD22 LEU 21 -6.619 -1.040 -5.184 883 HD23 LEU 21 HD23 LEU 21 -5.481 -1.612 -3.967 884 H GLN 22 HN GLN 22 -8.275 -5.481 -7.706 885 HA GLN 22 HA GLN 22 -6.969 -7.804 -6.817 886 HB2 GLN 22 HB2 GLN 22 -9.611 -7.829 -8.206 887 HB3 GLN 22 HB1 GLN 22 -9.038 -8.826 -6.868 888 HG2 GLN 22 HG2 GLN 22 -9.146 -6.825 -5.457 889 HG3 GLN 22 HG1 GLN 22 -9.831 -5.945 -6.810 890 HE21 GLN 22 HE21 GLN 22 -10.956 -6.379 -4.317 891 HE22 GLN 22 HE22 GLN 22 -12.420 -7.270 -4.512 892 H ASP 23 HN ASP 23 -8.341 -6.827 -9.873 893 HA ASP 23 HA ASP 23 -8.075 -9.095 -11.370 894 HB2 ASP 23 HB2 ASP 23 -8.917 -6.818 -12.097 895 HB3 ASP 23 HB1 ASP 23 -7.225 -6.411 -12.380 896 H VAL 24 HN VAL 24 -5.528 -6.654 -10.936 897 HA VAL 24 HA VAL 24 -3.736 -8.275 -12.497 898 HB VAL 24 HB VAL 24 -3.622 -5.872 -12.800 899 HG11 VAL 24 HG11 VAL 24 -2.934 -5.761 -9.879 900 HG12 VAL 24 HG12 VAL 24 -4.416 -5.180 -10.637 901 HG13 VAL 24 HG13 VAL 24 -2.878 -4.396 -10.992 902 HG21 VAL 24 HG21 VAL 24 -1.520 -6.987 -13.151 903 HG22 VAL 24 HG22 VAL 24 -1.174 -6.977 -11.423 904 HG23 VAL 24 HG23 VAL 24 -1.191 -5.459 -12.324 905 H ALA 25 HN ALA 25 -4.498 -7.712 -9.186 906 HA ALA 25 HA ALA 25 -2.102 -8.836 -8.077 907 HB1 ALA 25 HB1 ALA 25 -3.408 -9.042 -6.005 908 HB2 ALA 25 HB2 ALA 25 -4.874 -8.611 -6.884 909 HB3 ALA 25 HB3 ALA 25 -3.574 -7.433 -6.703 910 H GLN 26 HN GLN 26 -4.884 -9.888 -9.646 911 HA GLN 26 HA GLN 26 -4.717 -12.625 -8.761 912 HB2 GLN 26 HB2 GLN 26 -6.881 -12.311 -9.203 913 HB3 GLN 26 HB1 GLN 26 -6.533 -10.878 -10.153 914 HG2 GLN 26 HG2 GLN 26 -7.471 -12.172 -11.737 915 HG3 GLN 26 HG1 GLN 26 -5.790 -12.655 -11.937 916 HE21 GLN 26 HE21 GLN 26 -5.737 -14.157 -9.472 917 HE22 GLN 26 HE22 GLN 26 -6.603 -15.612 -9.761 918 H LYS 27 HN LYS 27 -4.005 -10.681 -11.573 919 HA LYS 27 HA LYS 27 -3.187 -12.752 -13.296 920 HB2 LYS 27 HB2 LYS 27 -2.265 -9.874 -13.285 921 HB3 LYS 27 HB1 LYS 27 -2.206 -10.989 -14.653 922 HG2 LYS 27 HG2 LYS 27 -4.672 -9.907 -13.316 923 HG3 LYS 27 HG1 LYS 27 -4.050 -9.460 -14.903 924 HD2 LYS 27 HD2 LYS 27 -4.712 -11.452 -15.864 925 HD3 LYS 27 HD1 LYS 27 -4.716 -12.314 -14.323 926 HE2 LYS 27 HE2 LYS 27 -6.715 -11.307 -13.635 927 HE3 LYS 27 HE1 LYS 27 -6.617 -10.071 -14.882 928 HZ1 LYS 27 HZ1 LYS 27 -8.277 -11.726 -15.431 929 HZ2 LYS 27 HZ2 LYS 27 -7.131 -12.963 -15.323 930 HZ3 LYS 27 HZ3 LYS 27 -7.008 -11.805 -16.544 931 H SER 28 HN SER 28 -1.434 -10.860 -10.887 932 HA SER 28 HA SER 28 1.092 -11.972 -11.851 933 HB2 SER 28 HB2 SER 28 0.505 -9.743 -9.904 934 HB3 SER 28 HB1 SER 28 2.123 -10.242 -10.405 935 HG SER 28 HG SER 28 0.595 -9.796 -12.568 936 H ILE 29 HN ILE 29 -1.261 -12.520 -9.557 937 HA ILE 29 HA ILE 29 0.673 -13.830 -7.766 938 HB ILE 29 HB ILE 29 -2.055 -12.726 -7.132 939 HG12 ILE 29 HG12 ILE 29 0.664 -11.879 -6.126 940 HG13 ILE 29 HG11 ILE 29 -0.316 -11.007 -7.315 941 HG21 ILE 29 HG21 ILE 29 -0.151 -14.162 -5.301 942 HG22 ILE 29 HG22 ILE 29 -1.727 -14.735 -5.854 943 HG23 ILE 29 HG23 ILE 29 -1.624 -13.318 -4.807 944 HD11 ILE 29 HD11 ILE 29 -1.249 -11.638 -4.535 945 HD12 ILE 29 HD12 ILE 29 -2.002 -10.567 -5.727 946 HD13 ILE 29 HD13 ILE 29 -0.456 -10.125 -4.994 947 H ALA 30 HN ALA 30 0.531 -15.989 -7.568 948 HA ALA 30 HA ALA 30 -1.714 -17.382 -8.822 949 HB1 ALA 30 HB1 ALA 30 0.532 -18.124 -9.397 950 HB2 ALA 30 HB2 ALA 30 -0.333 -19.394 -8.532 951 HB3 ALA 30 HB3 ALA 30 0.882 -18.427 -7.696 952 H ASP 31 HN ASP 31 -0.914 -16.145 -5.904 953 HA ASP 31 HA ASP 31 -2.198 -18.239 -4.304 954 HB2 ASP 31 HB2 ASP 31 -0.300 -16.018 -3.754 955 HB3 ASP 31 HB1 ASP 31 -1.390 -16.490 -2.465 956 H GLU 32 HN GLU 32 -4.381 -17.959 -4.358 957 HA GLU 32 HA GLU 32 -5.803 -15.587 -4.574 958 HB2 GLU 32 HB2 GLU 32 -7.673 -16.768 -3.523 959 HB3 GLU 32 HB1 GLU 32 -6.854 -17.810 -4.678 960 HG2 GLU 32 HG2 GLU 32 -5.701 -18.951 -2.864 961 HG3 GLU 32 HG1 GLU 32 -6.461 -17.873 -1.696 962 H LYS 33 HN LYS 33 -4.113 -16.905 -1.859 963 HA LYS 33 HA LYS 33 -5.366 -15.356 0.178 964 HB2 LYS 33 HB2 LYS 33 -2.649 -16.686 0.125 965 HB3 LYS 33 HB1 LYS 33 -3.396 -15.985 1.552 966 HG2 LYS 33 HG2 LYS 33 -4.009 -18.134 1.892 967 HG3 LYS 33 HG1 LYS 33 -5.349 -17.658 0.849 968 HD2 LYS 33 HD2 LYS 33 -4.507 -19.760 0.078 969 HD3 LYS 33 HD1 LYS 33 -4.065 -18.521 -1.095 970 HE2 LYS 33 HE2 LYS 33 -2.221 -20.069 -0.686 971 HE3 LYS 33 HE1 LYS 33 -1.811 -18.433 -0.180 972 HZ1 LYS 33 HZ1 LYS 33 -2.286 -19.069 2.111 973 HZ2 LYS 33 HZ2 LYS 33 -1.088 -20.056 1.445 974 HZ3 LYS 33 HZ3 LYS 33 -2.667 -20.644 1.613 975 H ALA 34 HN ALA 34 -2.268 -15.075 -1.530 976 HA ALA 34 HA ALA 34 -1.633 -12.545 -0.447 977 HB1 ALA 34 HB1 ALA 34 0.068 -12.443 -2.224 978 HB2 ALA 34 HB2 ALA 34 -0.643 -13.872 -2.970 979 HB3 ALA 34 HB3 ALA 34 0.091 -13.984 -1.371 980 H ARG 35 HN ARG 35 -3.695 -13.600 -2.989 981 HA ARG 35 HA ARG 35 -3.771 -11.194 -4.510 982 HB2 ARG 35 HB2 ARG 35 -4.598 -13.658 -5.057 983 HB3 ARG 35 HB1 ARG 35 -6.103 -13.066 -4.371 984 HG2 ARG 35 HG2 ARG 35 -4.765 -11.478 -6.521 985 HG3 ARG 35 HG1 ARG 35 -5.657 -12.937 -6.945 986 HD2 ARG 35 HD2 ARG 35 -6.714 -10.473 -5.563 987 HD3 ARG 35 HD1 ARG 35 -7.101 -11.057 -7.187 988 HE ARG 35 HE ARG 35 -7.744 -12.844 -4.983 989 HH11 ARG 35 HH11 ARG 35 -8.879 -10.518 -7.336 990 HH12 ARG 35 HH12 ARG 35 -10.553 -10.882 -7.073 991 HH21 ARG 35 HH21 ARG 35 -9.948 -13.336 -4.651 992 HH22 ARG 35 HH22 ARG 35 -11.157 -12.481 -5.554 993 H LYS 36 HN LYS 36 -6.064 -12.669 -2.211 994 HA LYS 36 HA LYS 36 -7.787 -10.515 -1.864 995 HB2 LYS 36 HB2 LYS 36 -6.809 -12.355 0.306 996 HB3 LYS 36 HB1 LYS 36 -8.285 -11.402 0.329 997 HG2 LYS 36 HG2 LYS 36 -9.402 -12.847 -0.964 998 HG3 LYS 36 HG1 LYS 36 -7.953 -13.300 -1.891 999 HD2 LYS 36 HD2 LYS 36 -8.769 -15.115 -0.405 1000 HD3 LYS 36 HD1 LYS 36 -7.110 -14.572 -0.062 1001 HE2 LYS 36 HE2 LYS 36 -7.843 -13.292 1.816 1002 HE3 LYS 36 HE1 LYS 36 -9.544 -13.531 1.416 1003 HZ1 LYS 36 HZ1 LYS 36 -8.841 -14.956 3.235 1004 HZ2 LYS 36 HZ2 LYS 36 -7.644 -15.655 2.271 1005 HZ3 LYS 36 HZ3 LYS 36 -9.277 -15.887 1.894 1006 H VAL 37 HN VAL 37 -5.032 -11.435 0.169 1007 HA VAL 37 HA VAL 37 -5.340 -9.422 2.021 1008 HB VAL 37 HB VAL 37 -3.042 -9.735 2.736 1009 HG11 VAL 37 HG11 VAL 37 -3.059 -12.209 3.035 1010 HG12 VAL 37 HG12 VAL 37 -4.384 -12.314 1.866 1011 HG13 VAL 37 HG13 VAL 37 -4.614 -11.457 3.397 1012 HG21 VAL 37 HG21 VAL 37 -1.579 -11.328 1.449 1013 HG22 VAL 37 HG22 VAL 37 -1.826 -9.745 0.713 1014 HG23 VAL 37 HG23 VAL 37 -2.704 -11.146 0.103 1015 H ILE 38 HN ILE 38 -3.743 -9.323 -1.082 1016 HA ILE 38 HA ILE 38 -2.589 -6.747 -0.519 1017 HB ILE 38 HB ILE 38 -2.077 -8.831 -2.377 1018 HG12 ILE 38 HG12 ILE 38 -0.746 -6.851 -0.920 1019 HG13 ILE 38 HG11 ILE 38 -0.026 -8.156 -1.858 1020 HG21 ILE 38 HG21 ILE 38 -1.750 -7.648 -4.444 1021 HG22 ILE 38 HG22 ILE 38 -2.404 -6.173 -3.730 1022 HG23 ILE 38 HG23 ILE 38 -3.448 -7.579 -3.964 1023 HD11 ILE 38 HD11 ILE 38 -0.224 -5.326 -2.440 1024 HD12 ILE 38 HD12 ILE 38 -0.495 -6.426 -3.785 1025 HD13 ILE 38 HD13 ILE 38 1.011 -6.524 -2.861 1026 H VAL 39 HN VAL 39 -5.357 -7.988 -2.347 1027 HA VAL 39 HA VAL 39 -5.881 -5.428 -3.508 1028 HB VAL 39 HB VAL 39 -7.866 -6.266 -4.375 1029 HG11 VAL 39 HG11 VAL 39 -5.969 -8.572 -4.084 1030 HG12 VAL 39 HG12 VAL 39 -5.987 -7.352 -5.357 1031 HG13 VAL 39 HG13 VAL 39 -7.308 -8.520 -5.225 1032 HG21 VAL 39 HG21 VAL 39 -9.057 -8.256 -3.619 1033 HG22 VAL 39 HG22 VAL 39 -8.930 -7.063 -2.325 1034 HG23 VAL 39 HG23 VAL 39 -7.877 -8.478 -2.327 1035 H GLU 40 HN GLU 40 -7.270 -7.231 -0.808 1036 HA GLU 40 HA GLU 40 -8.832 -5.260 0.329 1037 HB2 GLU 40 HB2 GLU 40 -7.318 -7.570 1.505 1038 HB3 GLU 40 HB1 GLU 40 -8.468 -6.622 2.412 1039 HG2 GLU 40 HG2 GLU 40 -10.256 -7.360 1.178 1040 HG3 GLU 40 HG1 GLU 40 -9.275 -7.827 -0.188 1041 H LEU 41 HN LEU 41 -5.379 -5.689 0.350 1042 HA LEU 41 HA LEU 41 -4.955 -3.854 2.523 1043 HB2 LEU 41 HB2 LEU 41 -3.407 -5.749 1.262 1044 HB3 LEU 41 HB1 LEU 41 -2.669 -4.221 0.813 1045 HG LEU 41 HG LEU 41 -1.559 -4.763 2.757 1046 HD11 LEU 41 HD11 LEU 41 -3.852 -3.218 3.888 1047 HD12 LEU 41 HD12 LEU 41 -2.675 -2.513 2.788 1048 HD13 LEU 41 HD13 LEU 41 -2.152 -3.152 4.340 1049 HD21 LEU 41 HD21 LEU 41 -2.897 -6.690 3.347 1050 HD22 LEU 41 HD22 LEU 41 -4.167 -5.629 3.955 1051 HD23 LEU 41 HD23 LEU 41 -2.593 -5.665 4.748 1052 H MET 42 HN MET 42 -4.047 -3.761 -0.905 1053 HA MET 42 HA MET 42 -3.240 -1.059 -0.918 1054 HB2 MET 42 HB2 MET 42 -4.169 -2.790 -3.193 1055 HB3 MET 42 HB1 MET 42 -3.282 -1.268 -3.366 1056 HG2 MET 42 HG2 MET 42 -2.342 -3.839 -2.133 1057 HG3 MET 42 HG1 MET 42 -1.724 -3.025 -3.565 1058 HE1 MET 42 HE1 MET 42 0.683 -3.355 -2.580 1059 HE2 MET 42 HE2 MET 42 0.040 -4.074 -1.096 1060 HE3 MET 42 HE3 MET 42 1.199 -2.750 -1.004 1061 H ALA 43 HN ALA 43 -6.290 -2.581 -1.200 1062 HA ALA 43 HA ALA 43 -7.942 -0.669 -2.187 1063 HB1 ALA 43 HB1 ALA 43 -8.762 -2.764 -1.388 1064 HB2 ALA 43 HB2 ALA 43 -9.577 -1.473 -0.496 1065 HB3 ALA 43 HB3 ALA 43 -8.264 -2.386 0.260 1066 H TYR 44 HN TYR 44 -6.008 -0.572 0.713 1067 HA TYR 44 HA TYR 44 -7.184 2.045 1.409 1068 HB2 TYR 44 HB2 TYR 44 -7.252 0.578 3.312 1069 HB3 TYR 44 HB1 TYR 44 -5.590 0.081 3.046 1070 HD1 TYR 44 HD1 TYR 44 -7.777 2.466 4.600 1071 HD2 TYR 44 HD2 TYR 44 -3.732 1.729 3.580 1072 HE1 TYR 44 HE1 TYR 44 -7.064 4.123 6.253 1073 HE2 TYR 44 HE2 TYR 44 -3.000 3.403 5.220 1074 HH TYR 44 HH TYR 44 -3.986 5.425 6.355 1075 H GLU 45 HN GLU 45 -4.030 0.412 1.683 1076 HA GLU 45 HA GLU 45 -2.439 2.556 1.823 1077 HB2 GLU 45 HB2 GLU 45 -1.565 0.278 0.141 1078 HB3 GLU 45 HB1 GLU 45 -0.648 1.178 1.343 1079 HG2 GLU 45 HG2 GLU 45 -2.824 -0.797 1.816 1080 HG3 GLU 45 HG1 GLU 45 -1.127 -1.031 2.156 1081 H ASN 46 HN ASN 46 -3.914 1.321 -1.102 1082 HA ASN 46 HA ASN 46 -2.396 3.204 -2.739 1083 HB2 ASN 46 HB2 ASN 46 -3.824 0.635 -3.346 1084 HB3 ASN 46 HB1 ASN 46 -3.425 1.783 -4.626 1085 HD21 ASN 46 HD21 ASN 46 -1.870 0.391 -5.607 1086 HD22 ASN 46 HD22 ASN 46 -0.365 0.056 -4.860 1087 H ALA 47 HN ALA 47 -5.398 2.705 -1.341 1088 HA ALA 47 HA ALA 47 -7.111 3.849 -3.249 1089 HB1 ALA 47 HB1 ALA 47 -8.611 4.356 -1.390 1090 HB2 ALA 47 HB2 ALA 47 -7.326 3.954 -0.252 1091 HB3 ALA 47 HB3 ALA 47 -7.991 2.706 -1.304 1092 H ASN 48 HN ASN 48 -8.199 5.933 -2.943 1093 HA ASN 48 HA ASN 48 -6.470 8.113 -3.138 1094 HB2 ASN 48 HB2 ASN 48 -9.378 7.663 -2.897 1095 HB3 ASN 48 HB1 ASN 48 -8.823 9.253 -2.380 1096 HD21 ASN 48 HD21 ASN 48 -10.345 8.146 -4.770 1097 HD22 ASN 48 HD22 ASN 48 -9.530 8.845 -6.132 1098 HA PRO 49 HA PRO 49 -5.232 8.990 0.991 1099 HB2 PRO 49 HB2 PRO 49 -5.346 11.767 0.858 1100 HB3 PRO 49 HB1 PRO 49 -3.970 10.774 0.379 1101 HG2 PRO 49 HG2 PRO 49 -6.101 12.007 -1.295 1102 HG3 PRO 49 HG1 PRO 49 -4.380 11.782 -1.653 1103 HD2 PRO 49 HD2 PRO 49 -6.267 10.210 -2.738 1104 HD3 PRO 49 HD1 PRO 49 -4.673 9.570 -2.282 1105 H GLU 50 HN GLU 50 -8.169 10.224 -0.322 1106 HA GLU 50 HA GLU 50 -9.308 10.906 2.245 1107 HB2 GLU 50 HB2 GLU 50 -11.098 11.801 1.029 1108 HB3 GLU 50 HB1 GLU 50 -9.701 12.108 0.007 1109 HG2 GLU 50 HG2 GLU 50 -10.903 9.559 -0.545 1110 HG3 GLU 50 HG1 GLU 50 -12.005 10.901 -0.791 1111 H CYS 51 HN CYS 51 -9.267 8.326 -0.095 1112 HA CYS 51 HA CYS 51 -11.704 7.196 0.901 1113 HB2 CYS 51 HB2 CYS 51 -11.392 7.092 -1.437 1114 HB3 CYS 51 HB1 CYS 51 -9.817 6.308 -1.279 1115 HG CYS 51 HG CYS 51 -11.444 4.295 0.376 1116 H GLN 52 HN GLN 52 -8.262 6.460 0.941 1117 HA GLN 52 HA GLN 52 -8.590 4.049 2.424 1118 HB2 GLN 52 HB2 GLN 52 -6.266 4.192 2.932 1119 HB3 GLN 52 HB1 GLN 52 -6.456 4.712 1.266 1120 HG2 GLN 52 HG2 GLN 52 -6.348 7.055 2.044 1121 HG3 GLN 52 HG1 GLN 52 -6.026 6.463 3.674 1122 HE21 GLN 52 HE21 GLN 52 -4.593 4.173 2.543 1123 HE22 GLN 52 HE22 GLN 52 -3.055 4.749 2.066 1124 H SER 53 HN SER 53 -8.592 7.370 2.965 1125 HA SER 53 HA SER 53 -8.556 7.351 5.788 1126 HB2 SER 53 HB2 SER 53 -9.226 9.265 3.619 1127 HB3 SER 53 HB1 SER 53 -9.581 9.697 5.306 1128 HG SER 53 HG SER 53 -7.257 9.814 4.041 1129 H ALA 54 HN ALA 54 -10.981 6.897 3.350 1130 HA ALA 54 HA ALA 54 -13.142 6.874 5.248 1131 HB1 ALA 54 HB1 ALA 54 -14.401 5.808 3.406 1132 HB2 ALA 54 HB2 ALA 54 -12.903 5.730 2.470 1133 HB3 ALA 54 HB3 ALA 54 -13.590 7.291 2.909 1134 H ILE 55 HN ILE 55 -10.639 4.780 4.306 1135 HA ILE 55 HA ILE 55 -12.048 2.396 5.069 1136 HB ILE 55 HB ILE 55 -9.401 2.879 3.776 1137 HG12 ILE 55 HG12 ILE 55 -11.665 1.262 2.704 1138 HG13 ILE 55 HG11 ILE 55 -11.790 3.025 2.707 1139 HG21 ILE 55 HG21 ILE 55 -9.147 0.943 5.224 1140 HG22 ILE 55 HG22 ILE 55 -9.201 0.449 3.531 1141 HG23 ILE 55 HG23 ILE 55 -10.621 0.242 4.556 1142 HD11 ILE 55 HD11 ILE 55 -10.966 2.082 0.597 1143 HD12 ILE 55 HD12 ILE 55 -9.536 1.475 1.459 1144 HD13 ILE 55 HD13 ILE 55 -9.845 3.219 1.357 1145 H LYS 56 HN LYS 56 -9.349 4.332 6.418 1146 HA LYS 56 HA LYS 56 -8.064 2.514 7.942 1147 HB2 LYS 56 HB2 LYS 56 -8.578 4.694 9.753 1148 HB3 LYS 56 HB1 LYS 56 -7.075 4.146 9.050 1149 HG2 LYS 56 HG2 LYS 56 -7.104 6.268 8.269 1150 HG3 LYS 56 HG1 LYS 56 -8.008 5.497 6.966 1151 HD2 LYS 56 HD2 LYS 56 -9.936 6.431 7.543 1152 HD3 LYS 56 HD1 LYS 56 -9.603 6.342 9.271 1153 HE2 LYS 56 HE2 LYS 56 -8.477 8.433 7.349 1154 HE3 LYS 56 HE1 LYS 56 -9.759 8.662 8.541 1155 HZ1 LYS 56 HZ1 LYS 56 -7.745 9.497 9.437 1156 HZ2 LYS 56 HZ2 LYS 56 -6.913 8.063 9.098 1157 HZ3 LYS 56 HZ3 LYS 56 -8.121 8.078 10.280 1158 HA PRO 57 HA PRO 57 -11.515 2.447 11.456 1159 HB2 PRO 57 HB2 PRO 57 -14.037 2.536 10.438 1160 HB3 PRO 57 HB1 PRO 57 -13.196 3.968 11.056 1161 HG2 PRO 57 HG2 PRO 57 -13.337 2.952 8.225 1162 HG3 PRO 57 HG1 PRO 57 -13.744 4.581 8.828 1163 HD2 PRO 57 HD2 PRO 57 -11.385 4.162 7.753 1164 HD3 PRO 57 HD1 PRO 57 -11.460 5.063 9.278 1165 H LEU 58 HN LEU 58 -11.738 1.217 8.202 1166 HA LEU 58 HA LEU 58 -12.826 -1.353 9.118 1167 HB2 LEU 58 HB2 LEU 58 -12.326 -0.844 6.251 1168 HB3 LEU 58 HB1 LEU 58 -13.646 -1.735 7.001 1169 HG LEU 58 HG LEU 58 -13.388 1.274 6.818 1170 HD11 LEU 58 HD11 LEU 58 -13.790 0.231 4.663 1171 HD12 LEU 58 HD12 LEU 58 -15.235 1.081 5.217 1172 HD13 LEU 58 HD13 LEU 58 -15.143 -0.676 5.338 1173 HD21 LEU 58 HD21 LEU 58 -15.690 1.317 7.642 1174 HD22 LEU 58 HD22 LEU 58 -14.592 0.601 8.821 1175 HD23 LEU 58 HD23 LEU 58 -15.649 -0.434 7.856 1176 H LYS 59 HN LYS 59 -10.111 0.349 8.141 1177 HA LYS 59 HA LYS 59 -8.536 -1.425 6.766 1178 HB2 LYS 59 HB2 LYS 59 -7.811 0.809 7.147 1179 HB3 LYS 59 HB1 LYS 59 -7.808 0.575 8.885 1180 HG2 LYS 59 HG2 LYS 59 -5.587 0.399 8.503 1181 HG3 LYS 59 HG1 LYS 59 -6.047 -1.278 8.247 1182 HD2 LYS 59 HD2 LYS 59 -5.694 0.787 6.102 1183 HD3 LYS 59 HD1 LYS 59 -4.537 -0.488 6.489 1184 HE2 LYS 59 HE2 LYS 59 -6.733 -1.975 6.100 1185 HE3 LYS 59 HE1 LYS 59 -7.117 -0.615 5.040 1186 HZ1 LYS 59 HZ1 LYS 59 -4.714 -0.972 4.195 1187 HZ2 LYS 59 HZ2 LYS 59 -5.932 -2.035 3.672 1188 HZ3 LYS 59 HZ3 LYS 59 -4.868 -2.508 4.900 1189 H GLY 60 HN GLY 60 -8.248 -3.485 7.181 1190 HA2 GLY 60 HA3 GLY 60 -7.195 -5.263 8.294 1191 HA3 GLY 60 HA2 GLY 60 -7.119 -4.282 9.748 1192 H LYS 61 HN LYS 61 -10.085 -3.634 9.180 1193 HA LYS 61 HA LYS 61 -11.077 -5.991 10.628 1194 HB2 LYS 61 HB2 LYS 61 -12.683 -3.497 10.349 1195 HB3 LYS 61 HB1 LYS 61 -12.527 -4.574 11.726 1196 HG2 LYS 61 HG2 LYS 61 -10.423 -2.636 10.822 1197 HG3 LYS 61 HG1 LYS 61 -11.570 -2.338 12.117 1198 HD2 LYS 61 HD2 LYS 61 -9.610 -4.626 12.076 1199 HD3 LYS 61 HD1 LYS 61 -9.329 -3.090 12.901 1200 HE2 LYS 61 HE2 LYS 61 -11.239 -3.452 14.315 1201 HE3 LYS 61 HE1 LYS 61 -11.658 -4.916 13.433 1202 HZ1 LYS 61 HZ1 LYS 61 -9.662 -5.964 14.209 1203 HZ2 LYS 61 HZ2 LYS 61 -10.508 -5.359 15.542 1204 HZ3 LYS 61 HZ3 LYS 61 -9.146 -4.541 14.965 1205 H VAL 62 HN VAL 62 -12.038 -7.401 9.309 1206 HA VAL 62 HA VAL 62 -14.005 -6.333 7.401 1207 HB VAL 62 HB VAL 62 -12.167 -7.403 6.197 1208 HG11 VAL 62 HG11 VAL 62 -11.719 -9.805 6.397 1209 HG12 VAL 62 HG12 VAL 62 -12.821 -9.885 7.774 1210 HG13 VAL 62 HG13 VAL 62 -11.342 -8.928 7.882 1211 HG21 VAL 62 HG21 VAL 62 -13.461 -9.085 4.922 1212 HG22 VAL 62 HG22 VAL 62 -14.340 -7.582 5.200 1213 HG23 VAL 62 HG23 VAL 62 -14.712 -9.012 6.164 1214 HA PRO 63 HA PRO 63 -17.196 -8.690 9.626 1215 HB2 PRO 63 HB2 PRO 63 -18.002 -9.220 6.805 1216 HB3 PRO 63 HB1 PRO 63 -18.995 -8.742 8.167 1217 HG2 PRO 63 HG2 PRO 63 -18.324 -6.964 6.326 1218 HG3 PRO 63 HG1 PRO 63 -18.340 -6.518 8.041 1219 HD2 PRO 63 HD2 PRO 63 -16.027 -7.050 6.247 1220 HD3 PRO 63 HD1 PRO 63 -16.162 -5.929 7.615 1221 H ALA 64 HN ALA 64 -17.376 -10.813 10.157 1222 HA ALA 64 HA ALA 64 -15.310 -12.555 9.402 1223 HB1 ALA 64 HB1 ALA 64 -17.874 -13.218 10.837 1224 HB2 ALA 64 HB2 ALA 64 -16.394 -12.629 11.593 1225 HB3 ALA 64 HB3 ALA 64 -16.414 -14.206 10.804 1226 H GLY 65 HN GLY 65 -15.186 -13.191 7.329 1227 HA2 GLY 65 HA3 GLY 65 -15.727 -15.055 5.899 1228 HA3 GLY 65 HA2 GLY 65 -17.413 -14.853 6.348 1229 H SER 66 HN SER 66 -16.805 -11.809 6.012 1230 HA SER 66 HA SER 66 -17.672 -11.790 3.234 1231 HB2 SER 66 HB2 SER 66 -17.374 -9.471 5.152 1232 HB3 SER 66 HB1 SER 66 -18.262 -9.479 3.629 1233 HG SER 66 HG SER 66 -19.202 -11.484 5.048 1234 H ASP 67 HN ASP 67 -16.826 -9.891 1.898 1235 HA ASP 67 HA ASP 67 -13.926 -10.042 1.727 1236 HB2 ASP 67 HB2 ASP 67 -15.873 -9.875 -0.166 1237 HB3 ASP 67 HB1 ASP 67 -15.465 -8.178 0.009 1238 H VAL 68 HN VAL 68 -12.510 -8.244 2.115 1239 HA VAL 68 HA VAL 68 -13.707 -6.202 3.769 1240 HB VAL 68 HB VAL 68 -11.683 -5.700 4.556 1241 HG11 VAL 68 HG11 VAL 68 -11.597 -8.136 4.531 1242 HG12 VAL 68 HG12 VAL 68 -9.997 -7.410 4.417 1243 HG13 VAL 68 HG13 VAL 68 -10.763 -8.086 2.981 1244 HG21 VAL 68 HG21 VAL 68 -9.645 -5.432 3.079 1245 HG22 VAL 68 HG22 VAL 68 -10.988 -4.320 2.793 1246 HG23 VAL 68 HG23 VAL 68 -10.731 -5.687 1.711 1247 H ILE 69 HN ILE 69 -12.731 -6.638 0.512 1248 HA ILE 69 HA ILE 69 -12.420 -3.980 -0.260 1249 HB ILE 69 HB ILE 69 -13.269 -6.408 -1.801 1250 HG12 ILE 69 HG12 ILE 69 -11.014 -6.645 -1.221 1251 HG13 ILE 69 HG11 ILE 69 -10.937 -5.916 -2.817 1252 HG21 ILE 69 HG21 ILE 69 -12.823 -3.600 -2.818 1253 HG22 ILE 69 HG22 ILE 69 -14.266 -4.600 -2.980 1254 HG23 ILE 69 HG23 ILE 69 -12.798 -5.025 -3.860 1255 HD11 ILE 69 HD11 ILE 69 -10.574 -4.533 -0.190 1256 HD12 ILE 69 HD12 ILE 69 -10.639 -3.715 -1.750 1257 HD13 ILE 69 HD13 ILE 69 -9.342 -4.869 -1.410 1258 H SER 70 HN SER 70 -15.211 -6.062 -0.289 1259 HA SER 70 HA SER 70 -17.133 -4.436 -1.343 1260 HB2 SER 70 HB2 SER 70 -17.562 -6.749 -0.728 1261 HB3 SER 70 HB1 SER 70 -17.369 -6.373 0.980 1262 HG SER 70 HG SER 70 -19.411 -5.916 0.988 1263 H GLU 71 HN GLU 71 -15.731 -4.271 1.877 1264 HA GLU 71 HA GLU 71 -17.545 -2.245 2.830 1265 HB2 GLU 71 HB2 GLU 71 -15.004 -3.193 4.118 1266 HB3 GLU 71 HB1 GLU 71 -16.438 -2.529 4.896 1267 HG2 GLU 71 HG2 GLU 71 -16.800 -4.986 3.320 1268 HG3 GLU 71 HG1 GLU 71 -15.885 -5.130 4.813 1269 H TYR 72 HN TYR 72 -14.367 -2.516 1.519 1270 HA TYR 72 HA TYR 72 -13.485 0.063 2.364 1271 HB2 TYR 72 HB2 TYR 72 -12.408 -2.055 0.522 1272 HB3 TYR 72 HB1 TYR 72 -11.642 -0.476 0.637 1273 HD1 TYR 72 HD1 TYR 72 -13.161 -1.805 3.645 1274 HD2 TYR 72 HD2 TYR 72 -9.585 -1.625 1.373 1275 HE1 TYR 72 HE1 TYR 72 -11.888 -2.580 5.584 1276 HE2 TYR 72 HE2 TYR 72 -8.298 -2.418 3.308 1277 HH TYR 72 HH TYR 72 -9.904 -3.529 6.213 1278 H VAL 73 HN VAL 73 -14.878 -1.389 -0.486 1279 HA VAL 73 HA VAL 73 -14.775 0.969 -2.074 1280 HB VAL 73 HB VAL 73 -16.053 -0.027 -3.702 1281 HG11 VAL 73 HG11 VAL 73 -14.061 -1.279 -3.530 1282 HG12 VAL 73 HG12 VAL 73 -15.376 -2.381 -3.928 1283 HG13 VAL 73 HG13 VAL 73 -14.751 -2.310 -2.279 1284 HG21 VAL 73 HG21 VAL 73 -17.930 -0.562 -1.992 1285 HG22 VAL 73 HG22 VAL 73 -17.236 -2.187 -2.037 1286 HG23 VAL 73 HG23 VAL 73 -17.833 -1.432 -3.526 1287 H LYS 74 HN LYS 74 -16.931 -0.522 0.183 1288 HA LYS 74 HA LYS 74 -19.141 1.201 0.029 1289 HB2 LYS 74 HB2 LYS 74 -18.882 -1.057 1.181 1290 HB3 LYS 74 HB1 LYS 74 -18.099 -0.187 2.481 1291 HG2 LYS 74 HG2 LYS 74 -20.028 0.466 3.344 1292 HG3 LYS 74 HG1 LYS 74 -20.636 1.003 1.777 1293 HD2 LYS 74 HD2 LYS 74 -20.593 -1.854 2.743 1294 HD3 LYS 74 HD1 LYS 74 -22.009 -0.798 2.759 1295 HE2 LYS 74 HE2 LYS 74 -20.455 -1.462 0.264 1296 HE3 LYS 74 HE1 LYS 74 -21.862 -2.384 0.806 1297 HZ1 LYS 74 HZ1 LYS 74 -21.862 0.520 0.180 1298 HZ2 LYS 74 HZ2 LYS 74 -23.203 -0.396 0.637 1299 HZ3 LYS 74 HZ3 LYS 74 -22.440 -0.697 -0.838 1300 H ALA 75 HN ALA 75 -16.075 1.339 1.656 1301 HA ALA 75 HA ALA 75 -16.521 3.549 3.332 1302 HB1 ALA 75 HB1 ALA 75 -14.075 3.800 3.299 1303 HB2 ALA 75 HB2 ALA 75 -13.991 2.657 1.957 1304 HB3 ALA 75 HB3 ALA 75 -14.566 2.123 3.534 1305 H CYS 76 HN CYS 76 -15.330 3.325 0.006 1306 HA CYS 76 HA CYS 76 -15.552 6.228 -0.285 1307 HB2 CYS 76 HB2 CYS 76 -13.583 5.227 -1.181 1308 HB3 CYS 76 HB1 CYS 76 -14.510 4.076 -2.118 1309 HG CYS 76 HG CYS 76 -15.673 6.633 -3.383 1310 H ASP 77 HN ASP 77 -17.718 3.878 -0.302 1311 HA ASP 77 HA ASP 77 -19.195 4.326 -2.654 1312 HB2 ASP 77 HB2 ASP 77 -19.688 2.409 -1.338 1313 HB3 ASP 77 HB1 ASP 77 -19.995 3.362 0.104 1314 H GLY 78 HN GLY 78 -18.623 6.220 0.115 1315 HA2 GLY 78 HA3 GLY 78 -20.663 8.154 -0.750 1316 HA3 GLY 78 HA2 GLY 78 -19.906 8.132 0.835 1317 H ILE 79 HN ILE 79 -17.528 7.512 -1.456 1318 HA ILE 79 HA ILE 79 -16.750 10.332 -1.459 1319 HB ILE 79 HB ILE 79 -15.077 7.877 -1.808 1320 HG12 ILE 79 HG12 ILE 79 -15.058 9.945 0.396 1321 HG13 ILE 79 HG11 ILE 79 -15.830 8.360 0.512 1322 HG21 ILE 79 HG21 ILE 79 -13.138 9.343 -1.875 1323 HG22 ILE 79 HG22 ILE 79 -14.197 10.753 -1.798 1324 HG23 ILE 79 HG23 ILE 79 -14.242 9.690 -3.205 1325 HD11 ILE 79 HD11 ILE 79 -13.748 7.254 0.396 1326 HD12 ILE 79 HD12 ILE 79 -13.574 8.567 1.564 1327 HD13 ILE 79 HD13 ILE 79 -12.913 8.741 -0.059 1328 H GLY 80 HN GLY 80 -16.792 11.403 -3.268 1329 HA2 GLY 80 HA3 GLY 80 -15.529 10.579 -5.610 1330 HA3 GLY 80 HA2 GLY 80 -17.259 10.363 -5.831 1331 H GLY 81 HN GLY 81 -18.305 12.393 -4.448 1332 HA2 GLY 81 HA3 GLY 81 -17.046 14.904 -5.185 1333 HA3 GLY 81 HA2 GLY 81 -18.494 14.512 -6.109 1334 H ALA 82 HN ALA 82 -18.193 16.750 -4.368 1335 HA ALA 82 HA ALA 82 -19.253 17.879 -2.715 1336 HB1 ALA 82 HB1 ALA 82 -21.220 15.598 -2.776 1337 HB2 ALA 82 HB2 ALA 82 -21.290 17.048 -3.775 1338 HB3 ALA 82 HB3 ALA 82 -21.477 17.173 -2.027 1339 H MET 83 HN MET 83 -20.109 14.639 -1.527 1340 HA MET 83 HA MET 83 -19.360 15.220 1.119 1341 HB2 MET 83 HB2 MET 83 -19.678 12.532 -0.224 1342 HB3 MET 83 HB1 MET 83 -19.541 12.778 1.510 1343 HG2 MET 83 HG2 MET 83 -21.593 14.153 1.431 1344 HG3 MET 83 HG1 MET 83 -21.745 13.763 -0.280 1345 HE1 MET 83 HE1 MET 83 -21.718 12.364 3.364 1346 HE2 MET 83 HE2 MET 83 -20.506 11.331 2.605 1347 HE3 MET 83 HE3 MET 83 -22.049 10.650 3.117 1348 H HIS 84 HN HIS 84 -17.647 13.616 -1.504 1349 HA HIS 84 HA HIS 84 -15.306 12.814 -0.288 1350 HB2 HIS 84 HB2 HIS 84 -15.585 12.342 -2.593 1351 HB3 HIS 84 HB1 HIS 84 -15.889 14.023 -2.993 1352 HD1 HIS 84 HD1 HIS 84 -14.109 14.011 -4.836 1353 HD2 HIS 84 HD2 HIS 84 -12.605 13.085 -1.070 1354 HE1 HIS 84 HE1 HIS 84 -11.611 14.132 -5.055 1355 HE2 HIS 84 HE2 HIS 84 -10.734 13.341 -2.837 1356 H LYS 85 HN LYS 85 -16.186 16.093 -1.309 1357 HA LYS 85 HA LYS 85 -13.591 17.058 -0.481 1358 HB2 LYS 85 HB2 LYS 85 -15.893 18.364 -1.891 1359 HB3 LYS 85 HB1 LYS 85 -14.410 19.219 -1.438 1360 HG2 LYS 85 HG2 LYS 85 -13.077 17.878 -2.786 1361 HG3 LYS 85 HG1 LYS 85 -14.312 16.633 -2.925 1362 HD2 LYS 85 HD2 LYS 85 -15.666 18.315 -4.225 1363 HD3 LYS 85 HD1 LYS 85 -14.192 19.300 -4.286 1364 HE2 LYS 85 HE2 LYS 85 -12.975 17.392 -5.213 1365 HE3 LYS 85 HE1 LYS 85 -14.462 16.440 -5.194 1366 HZ1 LYS 85 HZ1 LYS 85 -14.019 18.928 -6.778 1367 HZ2 LYS 85 HZ2 LYS 85 -15.435 18.004 -6.771 1368 HZ3 LYS 85 HZ3 LYS 85 -14.006 17.354 -7.395 1369 H ALA 86 HN ALA 86 -16.716 16.808 0.865 1370 HA ALA 86 HA ALA 86 -16.278 18.786 2.913 1371 HB1 ALA 86 HB1 ALA 86 -18.262 16.526 2.822 1372 HB2 ALA 86 HB2 ALA 86 -18.550 18.159 2.219 1373 HB3 ALA 86 HB3 ALA 86 -18.287 17.889 3.941 1374 H MET 87 HN MET 87 -15.926 15.387 2.474 1375 HA MET 87 HA MET 87 -15.094 14.877 5.189 1376 HB2 MET 87 HB2 MET 87 -15.364 13.129 2.741 1377 HB3 MET 87 HB1 MET 87 -14.891 12.538 4.338 1378 HG2 MET 87 HG2 MET 87 -17.305 14.171 4.330 1379 HG3 MET 87 HG1 MET 87 -17.446 12.685 3.410 1380 HE1 MET 87 HE1 MET 87 -19.418 11.953 5.078 1381 HE2 MET 87 HE2 MET 87 -19.208 13.438 6.006 1382 HE3 MET 87 HE3 MET 87 -19.235 11.880 6.831 1383 H LEU 88 HN LEU 88 -13.623 15.916 2.366 1384 HA LEU 88 HA LEU 88 -11.190 14.603 2.299 1385 HB2 LEU 88 HB2 LEU 88 -12.312 16.511 0.835 1386 HB3 LEU 88 HB1 LEU 88 -11.257 17.527 1.791 1387 HG LEU 88 HG LEU 88 -9.511 17.027 0.492 1388 HD11 LEU 88 HD11 LEU 88 -10.216 14.095 0.655 1389 HD12 LEU 88 HD12 LEU 88 -9.202 14.947 1.820 1390 HD13 LEU 88 HD13 LEU 88 -8.676 14.786 0.144 1391 HD21 LEU 88 HD21 LEU 88 -11.175 17.139 -1.255 1392 HD22 LEU 88 HD22 LEU 88 -11.563 15.435 -1.026 1393 HD23 LEU 88 HD23 LEU 88 -9.984 15.901 -1.658 1394 H MET 89 HN MET 89 -12.272 17.212 4.419 1395 HA MET 89 HA MET 89 -9.667 17.448 5.657 1396 HB2 MET 89 HB2 MET 89 -11.184 19.389 5.526 1397 HB3 MET 89 HB1 MET 89 -12.357 18.541 6.518 1398 HG2 MET 89 HG2 MET 89 -9.584 19.139 7.492 1399 HG3 MET 89 HG1 MET 89 -10.897 20.302 7.633 1400 HE1 MET 89 HE1 MET 89 -13.403 18.342 8.241 1401 HE2 MET 89 HE2 MET 89 -13.093 19.880 9.045 1402 HE3 MET 89 HE3 MET 89 -13.397 18.430 10.001 1403 H ALA 90 HN ALA 90 -12.759 15.953 6.317 1404 HA ALA 90 HA ALA 90 -12.320 15.270 9.005 1405 HB1 ALA 90 HB1 ALA 90 -14.148 13.908 7.030 1406 HB2 ALA 90 HB2 ALA 90 -14.533 15.391 7.907 1407 HB3 ALA 90 HB3 ALA 90 -14.282 13.886 8.791 1408 H GLN 91 HN GLN 91 -12.225 13.181 6.113 1409 HA GLN 91 HA GLN 91 -11.406 10.957 7.774 1410 HB2 GLN 91 HB2 GLN 91 -11.678 10.973 4.786 1411 HB3 GLN 91 HB1 GLN 91 -11.749 9.589 5.875 1412 HG2 GLN 91 HG2 GLN 91 -13.810 10.273 6.754 1413 HG3 GLN 91 HG1 GLN 91 -13.647 11.846 5.980 1414 HE21 GLN 91 HE21 GLN 91 -12.715 10.821 3.497 1415 HE22 GLN 91 HE22 GLN 91 -14.046 10.067 2.713 1416 H LEU 92 HN LEU 92 -10.046 12.935 5.184 1417 HA LEU 92 HA LEU 92 -7.952 11.545 4.241 1418 HB2 LEU 92 HB2 LEU 92 -8.658 14.073 3.999 1419 HB3 LEU 92 HB1 LEU 92 -7.376 14.332 5.167 1420 HG LEU 92 HG LEU 92 -7.113 13.187 2.383 1421 HD11 LEU 92 HD11 LEU 92 -5.704 15.166 2.035 1422 HD12 LEU 92 HD12 LEU 92 -6.092 15.707 3.670 1423 HD13 LEU 92 HD13 LEU 92 -7.364 15.582 2.458 1424 HD21 LEU 92 HD21 LEU 92 -4.953 13.558 4.460 1425 HD22 LEU 92 HD22 LEU 92 -4.705 13.086 2.778 1426 HD23 LEU 92 HD23 LEU 92 -5.569 12.011 3.878 1427 H GLU 93 HN GLU 93 -8.111 13.192 7.341 1428 HA GLU 93 HA GLU 93 -6.325 11.205 8.397 1429 HB2 GLU 93 HB2 GLU 93 -5.774 14.122 8.688 1430 HB3 GLU 93 HB1 GLU 93 -4.986 12.880 9.655 1431 HG2 GLU 93 HG2 GLU 93 -4.545 11.871 7.259 1432 HG3 GLU 93 HG1 GLU 93 -4.660 13.568 6.801 Start of MODEL 12 1 H2 PRO 1 HT1 PRO 1 -5.127 -4.367 13.474 2 H3 PRO 1 HT2 PRO 1 -5.492 -2.865 14.014 3 HA PRO 1 HA PRO 1 -6.273 -2.766 11.987 4 HB2 PRO 1 HB2 PRO 1 -4.247 -1.662 10.647 5 HB3 PRO 1 HB1 PRO 1 -4.935 -0.860 12.062 6 HG2 PRO 1 HG2 PRO 1 -2.355 -2.233 11.770 7 HG3 PRO 1 HG1 PRO 1 -2.870 -1.054 12.992 8 HD2 PRO 1 HD2 PRO 1 -2.808 -3.965 13.148 9 HD3 PRO 1 HD1 PRO 1 -3.099 -2.788 14.445 10 H SER 2 HN SER 2 -4.538 -2.808 9.564 11 HA SER 2 HA SER 2 -4.253 -5.585 9.005 12 HB2 SER 2 HB2 SER 2 -2.993 -3.178 7.680 13 HB3 SER 2 HB1 SER 2 -2.962 -4.812 7.044 14 HG SER 2 HG SER 2 -5.253 -4.763 6.980 15 H PHE 3 HN PHE 3 -1.920 -6.268 8.249 16 HA PHE 3 HA PHE 3 -0.204 -6.031 10.520 17 HB2 PHE 3 HB2 PHE 3 1.336 -7.043 8.472 18 HB3 PHE 3 HB1 PHE 3 0.403 -8.000 9.617 19 HD1 PHE 3 HD1 PHE 3 0.890 -7.010 6.231 20 HD2 PHE 3 HD2 PHE 3 -1.927 -8.729 8.916 21 HE1 PHE 3 HE1 PHE 3 -0.339 -7.972 4.347 22 HE2 PHE 3 HE2 PHE 3 -3.178 -9.670 7.021 23 HZ PHE 3 HZ PHE 3 -2.382 -9.290 4.723 24 H ASN 4 HN ASN 4 -0.158 -4.887 7.201 25 HA ASN 4 HA ASN 4 2.524 -3.884 7.534 26 HB2 ASN 4 HB2 ASN 4 2.379 -3.490 5.125 27 HB3 ASN 4 HB1 ASN 4 1.914 -5.137 5.541 28 HD21 ASN 4 HD21 ASN 4 0.680 -1.954 4.707 29 HD22 ASN 4 HD22 ASN 4 -0.847 -2.509 4.105 30 H THR 5 HN THR 5 -0.321 -2.502 8.313 31 HA THR 5 HA THR 5 -0.370 -0.098 6.814 32 HB THR 5 HB THR 5 -1.637 0.715 8.929 33 HG1 THR 5 HG1 THR 5 -1.201 -0.690 10.510 34 HG21 THR 5 HG21 THR 5 -2.460 -1.507 7.112 35 HG22 THR 5 HG22 THR 5 -2.917 0.195 7.060 36 HG23 THR 5 HG23 THR 5 -3.571 -0.861 8.317 37 H VAL 6 HN VAL 6 1.958 -1.144 8.982 38 HA VAL 6 HA VAL 6 2.552 1.348 10.210 39 HB VAL 6 HB VAL 6 4.436 0.314 11.163 40 HG11 VAL 6 HG11 VAL 6 3.549 -1.746 12.099 41 HG12 VAL 6 HG12 VAL 6 2.358 -1.824 10.799 42 HG13 VAL 6 HG13 VAL 6 2.295 -0.509 11.975 43 HG21 VAL 6 HG21 VAL 6 5.493 -1.702 10.419 44 HG22 VAL 6 HG22 VAL 6 5.352 -0.613 9.030 45 HG23 VAL 6 HG23 VAL 6 4.232 -1.969 9.208 46 H ARG 7 HN ARG 7 3.505 3.023 9.264 47 HA ARG 7 HA ARG 7 5.118 2.450 6.901 48 HB2 ARG 7 HB2 ARG 7 2.953 4.521 6.983 49 HB3 ARG 7 HB1 ARG 7 3.859 3.933 5.588 50 HG2 ARG 7 HG2 ARG 7 2.832 1.783 5.881 51 HG3 ARG 7 HG1 ARG 7 2.043 2.340 7.339 52 HD2 ARG 7 HD2 ARG 7 1.528 3.142 4.538 53 HD3 ARG 7 HD1 ARG 7 0.481 2.402 5.705 54 HE ARG 7 HE ARG 7 1.318 4.925 6.641 55 HH11 ARG 7 HH11 ARG 7 -0.960 3.423 4.427 56 HH12 ARG 7 HH12 ARG 7 -1.997 4.817 4.388 57 HH21 ARG 7 HH21 ARG 7 -0.068 6.725 6.591 58 HH22 ARG 7 HH22 ARG 7 -1.502 6.683 5.612 59 H GLN 8 HN GLN 8 6.573 3.808 6.322 60 HA GLN 8 HA GLN 8 8.193 5.198 7.906 61 HB2 GLN 8 HB2 GLN 8 7.735 4.850 5.132 62 HB3 GLN 8 HB1 GLN 8 8.148 6.545 5.392 63 HG2 GLN 8 HG2 GLN 8 10.170 5.882 6.576 64 HG3 GLN 8 HG1 GLN 8 9.766 4.189 6.329 65 HE21 GLN 8 HE21 GLN 8 12.094 5.699 5.510 66 HE22 GLN 8 HE22 GLN 8 12.168 5.578 3.774 67 H GLY 9 HN GLY 9 7.920 6.852 9.223 68 HA2 GLY 9 HA3 GLY 9 6.172 9.079 8.528 69 HA3 GLY 9 HA2 GLY 9 7.109 8.902 10.006 70 H SER 10 HN SER 10 7.763 11.141 9.686 71 HA SER 10 HA SER 10 8.989 12.244 7.497 72 HB2 SER 10 HB2 SER 10 8.412 13.447 9.610 73 HB3 SER 10 HB1 SER 10 9.832 12.727 10.365 74 HG SER 10 HG SER 10 9.717 14.581 8.231 75 H LYS 11 HN LYS 11 10.436 11.226 6.306 76 HA LYS 11 HA LYS 11 12.055 9.741 5.692 77 HB2 LYS 11 HB2 LYS 11 14.283 10.593 6.039 78 HB3 LYS 11 HB1 LYS 11 13.204 11.938 5.749 79 HG2 LYS 11 HG2 LYS 11 13.307 12.642 7.941 80 HG3 LYS 11 HG1 LYS 11 13.910 11.100 8.531 81 HD2 LYS 11 HD2 LYS 11 16.007 11.521 7.253 82 HD3 LYS 11 HD1 LYS 11 15.393 13.128 6.869 83 HE2 LYS 11 HE2 LYS 11 15.293 13.675 9.236 84 HE3 LYS 11 HE1 LYS 11 15.846 12.054 9.648 85 HZ1 LYS 11 HZ1 LYS 11 17.672 13.586 9.738 86 HZ2 LYS 11 HZ2 LYS 11 17.382 14.109 8.161 87 HZ3 LYS 11 HZ3 LYS 11 17.912 12.526 8.441 88 H GLU 12 HN GLU 12 10.673 8.567 7.787 89 HA GLU 12 HA GLU 12 12.210 7.633 9.926 90 HB2 GLU 12 HB2 GLU 12 9.815 7.315 9.832 91 HB3 GLU 12 HB1 GLU 12 9.945 6.346 8.380 92 HG2 GLU 12 HG2 GLU 12 11.099 4.601 9.660 93 HG3 GLU 12 HG1 GLU 12 10.930 5.584 11.113 94 HA PRO 13 HA PRO 13 15.447 5.247 8.061 95 HB2 PRO 13 HB2 PRO 13 14.820 3.263 10.176 96 HB3 PRO 13 HB1 PRO 13 16.372 3.985 9.755 97 HG2 PRO 13 HG2 PRO 13 15.016 4.730 11.942 98 HG3 PRO 13 HG1 PRO 13 15.969 5.877 10.993 99 HD2 PRO 13 HD2 PRO 13 13.031 5.564 11.180 100 HD3 PRO 13 HD1 PRO 13 13.992 7.008 10.823 101 H TYR 14 HN TYR 14 15.189 4.016 6.306 102 HA TYR 14 HA TYR 14 12.587 3.023 5.869 103 HB2 TYR 14 HB2 TYR 14 13.817 4.148 4.094 104 HB3 TYR 14 HB1 TYR 14 14.987 2.832 4.063 105 HD1 TYR 14 HD1 TYR 14 14.033 0.490 3.688 106 HD2 TYR 14 HD2 TYR 14 11.959 4.040 2.685 107 HE1 TYR 14 HE1 TYR 14 12.645 -0.797 2.156 108 HE2 TYR 14 HE2 TYR 14 10.543 2.776 1.130 109 HH TYR 14 HH TYR 14 10.268 0.789 0.114 110 HA PRO 15 HA PRO 15 14.745 -1.347 5.464 111 HB2 PRO 15 HB2 PRO 15 16.868 -1.032 7.489 112 HB3 PRO 15 HB1 PRO 15 16.908 -1.880 5.946 113 HG2 PRO 15 HG2 PRO 15 18.164 0.454 6.325 114 HG3 PRO 15 HG1 PRO 15 17.475 -0.002 4.772 115 HD2 PRO 15 HD2 PRO 15 16.491 1.951 6.780 116 HD3 PRO 15 HD1 PRO 15 16.314 1.949 5.019 117 H ASP 16 HN ASP 16 14.380 0.738 8.066 118 HA ASP 16 HA ASP 16 13.657 -1.309 9.987 119 HB2 ASP 16 HB2 ASP 16 14.331 1.568 10.135 120 HB3 ASP 16 HB1 ASP 16 13.145 1.000 11.305 121 H PHE 17 HN PHE 17 12.188 1.425 8.277 122 HA PHE 17 HA PHE 17 9.593 1.231 9.269 123 HB2 PHE 17 HB2 PHE 17 9.436 2.990 7.830 124 HB3 PHE 17 HB1 PHE 17 10.903 2.485 6.996 125 HD1 PHE 17 HD1 PHE 17 10.809 1.410 4.904 126 HD2 PHE 17 HD2 PHE 17 7.230 2.083 7.101 127 HE1 PHE 17 HE1 PHE 17 9.490 0.792 2.932 128 HE2 PHE 17 HE2 PHE 17 5.899 1.474 5.125 129 HZ PHE 17 HZ PHE 17 7.027 0.827 3.038 130 H VAL 18 HN VAL 18 11.225 -0.502 6.689 131 HA VAL 18 HA VAL 18 8.899 -2.057 6.072 132 HB VAL 18 HB VAL 18 10.242 -1.562 4.196 133 HG11 VAL 18 HG11 VAL 18 12.548 -2.822 5.672 134 HG12 VAL 18 HG12 VAL 18 12.337 -1.090 5.392 135 HG13 VAL 18 HG13 VAL 18 12.586 -2.187 4.021 136 HG21 VAL 18 HG21 VAL 18 11.031 -3.825 3.493 137 HG22 VAL 18 HG22 VAL 18 9.359 -3.746 4.054 138 HG23 VAL 18 HG23 VAL 18 10.622 -4.384 5.118 139 H ALA 19 HN ALA 19 11.901 -2.585 7.872 140 HA ALA 19 HA ALA 19 11.668 -5.344 8.248 141 HB1 ALA 19 HB1 ALA 19 13.643 -4.045 8.939 142 HB2 ALA 19 HB2 ALA 19 13.044 -5.090 10.225 143 HB3 ALA 19 HB3 ALA 19 12.711 -3.359 10.269 144 H ARG 20 HN ARG 20 9.967 -2.722 9.924 145 HA ARG 20 HA ARG 20 8.753 -4.630 11.731 146 HB2 ARG 20 HB2 ARG 20 7.391 -2.728 12.535 147 HB3 ARG 20 HB1 ARG 20 9.113 -2.409 12.630 148 HG2 ARG 20 HG2 ARG 20 9.046 -0.828 10.945 149 HG3 ARG 20 HG1 ARG 20 7.538 -1.459 10.276 150 HD2 ARG 20 HD2 ARG 20 6.272 -0.594 12.084 151 HD3 ARG 20 HD1 ARG 20 7.718 -0.224 13.006 152 HE ARG 20 HE ARG 20 8.052 1.338 10.866 153 HH11 ARG 20 HH11 ARG 20 5.291 0.815 12.948 154 HH12 ARG 20 HH12 ARG 20 4.649 2.410 12.714 155 HH21 ARG 20 HH21 ARG 20 7.241 3.462 10.593 156 HH22 ARG 20 HH22 ARG 20 5.747 3.910 11.373 157 H LEU 21 HN LEU 21 8.190 -3.025 8.752 158 HA LEU 21 HA LEU 21 5.538 -3.592 8.254 159 HB2 LEU 21 HB2 LEU 21 7.359 -2.329 6.898 160 HB3 LEU 21 HB1 LEU 21 7.693 -3.882 6.176 161 HG LEU 21 HG LEU 21 5.644 -3.923 5.044 162 HD11 LEU 21 HD11 LEU 21 4.144 -3.296 6.803 163 HD12 LEU 21 HD12 LEU 21 3.882 -2.216 5.432 164 HD13 LEU 21 HD13 LEU 21 4.801 -1.660 6.835 165 HD21 LEU 21 HD21 LEU 21 5.572 -1.746 3.887 166 HD22 LEU 21 HD22 LEU 21 7.196 -2.417 4.029 167 HD23 LEU 21 HD23 LEU 21 6.684 -1.109 5.097 168 H GLN 22 HN GLN 22 8.432 -5.537 7.679 169 HA GLN 22 HA GLN 22 7.098 -7.825 6.717 170 HB2 GLN 22 HB2 GLN 22 9.808 -7.762 8.014 171 HB3 GLN 22 HB1 GLN 22 9.170 -8.923 6.841 172 HG2 GLN 22 HG2 GLN 22 9.045 -6.971 5.260 173 HG3 GLN 22 HG1 GLN 22 10.002 -6.088 6.415 174 HE21 GLN 22 HE21 GLN 22 11.440 -5.903 4.646 175 HE22 GLN 22 HE22 GLN 22 12.588 -7.163 4.348 176 H ASP 23 HN ASP 23 8.463 -6.895 9.790 177 HA ASP 23 HA ASP 23 8.229 -9.236 11.203 178 HB2 ASP 23 HB2 ASP 23 8.855 -6.709 11.862 179 HB3 ASP 23 HB1 ASP 23 7.236 -6.830 12.567 180 H VAL 24 HN VAL 24 5.719 -6.698 11.089 181 HA VAL 24 HA VAL 24 3.924 -8.403 12.562 182 HB VAL 24 HB VAL 24 3.810 -6.016 12.968 183 HG11 VAL 24 HG11 VAL 24 3.117 -4.419 11.241 184 HG12 VAL 24 HG12 VAL 24 3.144 -5.713 10.042 185 HG13 VAL 24 HG13 VAL 24 4.638 -5.212 10.835 186 HG21 VAL 24 HG21 VAL 24 1.390 -7.059 11.513 187 HG22 VAL 24 HG22 VAL 24 1.386 -5.557 12.442 188 HG23 VAL 24 HG23 VAL 24 1.702 -7.098 13.247 189 H ALA 25 HN ALA 25 4.666 -7.775 9.257 190 HA ALA 25 HA ALA 25 2.273 -8.729 8.072 191 HB1 ALA 25 HB1 ALA 25 4.045 -7.592 6.763 192 HB2 ALA 25 HB2 ALA 25 3.661 -9.178 6.097 193 HB3 ALA 25 HB3 ALA 25 5.119 -8.961 7.069 194 H GLN 26 HN GLN 26 5.084 -10.039 9.496 195 HA GLN 26 HA GLN 26 4.716 -12.731 8.638 196 HB2 GLN 26 HB2 GLN 26 6.886 -12.631 9.133 197 HB3 GLN 26 HB1 GLN 26 6.641 -11.079 9.910 198 HG2 GLN 26 HG2 GLN 26 7.518 -12.252 11.632 199 HG3 GLN 26 HG1 GLN 26 5.811 -12.602 11.887 200 HE21 GLN 26 HE21 GLN 26 5.643 -14.349 9.612 201 HE22 GLN 26 HE22 GLN 26 6.418 -15.821 10.043 202 H LYS 27 HN LYS 27 4.008 -10.831 11.472 203 HA LYS 27 HA LYS 27 3.142 -12.844 13.191 204 HB2 LYS 27 HB2 LYS 27 2.566 -9.922 13.007 205 HB3 LYS 27 HB1 LYS 27 1.738 -10.933 14.186 206 HG2 LYS 27 HG2 LYS 27 3.598 -10.195 15.380 207 HG3 LYS 27 HG1 LYS 27 4.008 -11.761 14.776 208 HD2 LYS 27 HD2 LYS 27 5.041 -10.551 12.835 209 HD3 LYS 27 HD1 LYS 27 5.073 -9.179 13.950 210 HE2 LYS 27 HE2 LYS 27 5.977 -11.805 14.894 211 HE3 LYS 27 HE1 LYS 27 7.055 -10.919 13.818 212 HZ1 LYS 27 HZ1 LYS 27 7.131 -9.128 15.370 213 HZ2 LYS 27 HZ2 LYS 27 7.421 -10.548 16.247 214 HZ3 LYS 27 HZ3 LYS 27 5.905 -9.806 16.326 215 H SER 28 HN SER 28 1.496 -10.946 10.802 216 HA SER 28 HA SER 28 -1.060 -11.979 11.703 217 HB2 SER 28 HB2 SER 28 -0.419 -9.776 9.759 218 HB3 SER 28 HB1 SER 28 -2.025 -10.160 10.385 219 HG SER 28 HG SER 28 0.212 -9.080 11.738 220 H ILE 29 HN ILE 29 1.276 -12.608 9.447 221 HA ILE 29 HA ILE 29 -0.664 -13.790 7.581 222 HB ILE 29 HB ILE 29 2.114 -12.758 7.055 223 HG12 ILE 29 HG12 ILE 29 -0.543 -11.887 5.916 224 HG13 ILE 29 HG11 ILE 29 0.365 -11.039 7.173 225 HG21 ILE 29 HG21 ILE 29 0.272 -14.209 5.177 226 HG22 ILE 29 HG22 ILE 29 1.850 -14.745 5.763 227 HG23 ILE 29 HG23 ILE 29 1.735 -13.339 4.702 228 HD11 ILE 29 HD11 ILE 29 0.641 -10.114 4.879 229 HD12 ILE 29 HD12 ILE 29 1.461 -11.622 4.442 230 HD13 ILE 29 HD13 ILE 29 2.140 -10.570 5.690 231 H ALA 30 HN ALA 30 -0.652 -15.953 7.431 232 HA ALA 30 HA ALA 30 1.527 -17.466 8.646 233 HB1 ALA 30 HB1 ALA 30 0.075 -19.403 8.347 234 HB2 ALA 30 HB2 ALA 30 -1.078 -18.410 7.455 235 HB3 ALA 30 HB3 ALA 30 -0.780 -18.096 9.165 236 H ASP 31 HN ASP 31 0.929 -16.103 5.770 237 HA ASP 31 HA ASP 31 2.129 -18.241 4.145 238 HB2 ASP 31 HB2 ASP 31 0.289 -15.970 3.590 239 HB3 ASP 31 HB1 ASP 31 1.404 -16.436 2.318 240 H GLU 32 HN GLU 32 4.325 -17.989 4.321 241 HA GLU 32 HA GLU 32 5.764 -15.622 4.595 242 HB2 GLU 32 HB2 GLU 32 7.674 -16.849 3.703 243 HB3 GLU 32 HB1 GLU 32 6.746 -17.889 4.776 244 HG2 GLU 32 HG2 GLU 32 5.686 -18.935 2.828 245 HG3 GLU 32 HG1 GLU 32 6.657 -17.914 1.768 246 H LYS 33 HN LYS 33 4.195 -16.944 1.805 247 HA LYS 33 HA LYS 33 5.524 -15.404 -0.186 248 HB2 LYS 33 HB2 LYS 33 2.767 -16.653 -0.212 249 HB3 LYS 33 HB1 LYS 33 3.578 -15.976 -1.616 250 HG2 LYS 33 HG2 LYS 33 4.096 -18.154 -1.934 251 HG3 LYS 33 HG1 LYS 33 5.447 -17.711 -0.892 252 HD2 LYS 33 HD2 LYS 33 4.532 -19.778 -0.101 253 HD3 LYS 33 HD1 LYS 33 4.131 -18.514 1.056 254 HE2 LYS 33 HE2 LYS 33 2.233 -20.002 0.660 255 HE3 LYS 33 HE1 LYS 33 1.883 -18.357 0.141 256 HZ1 LYS 33 HZ1 LYS 33 2.310 -19.016 -2.140 257 HZ2 LYS 33 HZ2 LYS 33 1.108 -19.990 -1.460 258 HZ3 LYS 33 HZ3 LYS 33 2.677 -20.593 -1.646 259 H ALA 34 HN ALA 34 2.366 -15.084 1.399 260 HA ALA 34 HA ALA 34 1.809 -12.530 0.344 261 HB1 ALA 34 HB1 ALA 34 0.047 -12.421 2.040 262 HB2 ALA 34 HB2 ALA 34 0.729 -13.838 2.839 263 HB3 ALA 34 HB3 ALA 34 0.054 -13.980 1.216 264 H ARG 35 HN ARG 35 3.826 -13.629 2.896 265 HA ARG 35 HA ARG 35 3.840 -11.238 4.471 266 HB2 ARG 35 HB2 ARG 35 4.594 -13.674 5.096 267 HB3 ARG 35 HB1 ARG 35 6.125 -13.184 4.381 268 HG2 ARG 35 HG2 ARG 35 4.888 -11.448 6.483 269 HG3 ARG 35 HG1 ARG 35 5.707 -12.936 6.955 270 HD2 ARG 35 HD2 ARG 35 6.886 -10.627 5.423 271 HD3 ARG 35 HD1 ARG 35 7.232 -11.090 7.098 272 HE ARG 35 HE ARG 35 7.961 -13.304 5.873 273 HH11 ARG 35 HH11 ARG 35 8.560 -10.007 4.877 274 HH12 ARG 35 HH12 ARG 35 10.053 -10.377 4.079 275 HH21 ARG 35 HH21 ARG 35 9.912 -13.809 4.806 276 HH22 ARG 35 HH22 ARG 35 10.815 -12.549 4.024 277 H LYS 36 HN LYS 36 6.148 -12.687 2.170 278 HA LYS 36 HA LYS 36 7.877 -10.502 1.940 279 HB2 LYS 36 HB2 LYS 36 7.047 -12.329 -0.302 280 HB3 LYS 36 HB1 LYS 36 8.527 -11.384 -0.199 281 HG2 LYS 36 HG2 LYS 36 9.540 -12.858 1.134 282 HG3 LYS 36 HG1 LYS 36 8.034 -13.306 1.971 283 HD2 LYS 36 HD2 LYS 36 8.789 -15.156 0.607 284 HD3 LYS 36 HD1 LYS 36 7.295 -14.460 -0.060 285 HE2 LYS 36 HE2 LYS 36 8.867 -13.032 -1.526 286 HE3 LYS 36 HE1 LYS 36 10.130 -14.163 -1.044 287 HZ1 LYS 36 HZ1 LYS 36 9.137 -14.799 -3.150 288 HZ2 LYS 36 HZ2 LYS 36 7.615 -14.914 -2.428 289 HZ3 LYS 36 HZ3 LYS 36 8.846 -15.978 -1.973 290 H VAL 37 HN VAL 37 5.138 -11.412 -0.127 291 HA VAL 37 HA VAL 37 5.542 -9.439 -2.011 292 HB VAL 37 HB VAL 37 3.283 -9.789 -2.816 293 HG11 VAL 37 HG11 VAL 37 3.339 -12.261 -3.061 294 HG12 VAL 37 HG12 VAL 37 4.616 -12.324 -1.840 295 HG13 VAL 37 HG13 VAL 37 4.895 -11.493 -3.376 296 HG21 VAL 37 HG21 VAL 37 1.790 -11.384 -1.549 297 HG22 VAL 37 HG22 VAL 37 1.962 -9.766 -0.870 298 HG23 VAL 37 HG23 VAL 37 2.844 -11.116 -0.159 299 H ILE 38 HN ILE 38 3.787 -9.234 1.045 300 HA ILE 38 HA ILE 38 2.828 -6.622 0.290 301 HB ILE 38 HB ILE 38 1.683 -8.473 1.903 302 HG12 ILE 38 HG12 ILE 38 1.253 -5.515 2.214 303 HG13 ILE 38 HG11 ILE 38 0.794 -6.373 0.753 304 HG21 ILE 38 HG21 ILE 38 1.730 -7.719 4.185 305 HG22 ILE 38 HG22 ILE 38 2.770 -6.360 3.756 306 HG23 ILE 38 HG23 ILE 38 3.395 -8.010 3.668 307 HD11 ILE 38 HD11 ILE 38 -0.572 -7.840 2.380 308 HD12 ILE 38 HD12 ILE 38 -1.151 -6.229 1.959 309 HD13 ILE 38 HD13 ILE 38 -0.343 -6.487 3.493 310 H VAL 39 HN VAL 39 5.413 -7.937 2.292 311 HA VAL 39 HA VAL 39 6.056 -5.384 3.369 312 HB VAL 39 HB VAL 39 8.030 -6.218 4.169 313 HG11 VAL 39 HG11 VAL 39 6.113 -8.522 3.979 314 HG12 VAL 39 HG12 VAL 39 6.178 -7.281 5.230 315 HG13 VAL 39 HG13 VAL 39 7.485 -8.461 5.080 316 HG21 VAL 39 HG21 VAL 39 9.213 -8.208 3.423 317 HG22 VAL 39 HG22 VAL 39 9.028 -7.057 2.099 318 HG23 VAL 39 HG23 VAL 39 7.989 -8.479 2.178 319 H GLU 40 HN GLU 40 7.341 -7.206 0.617 320 HA GLU 40 HA GLU 40 8.990 -5.256 -0.426 321 HB2 GLU 40 HB2 GLU 40 7.525 -7.545 -1.696 322 HB3 GLU 40 HB1 GLU 40 8.707 -6.579 -2.548 323 HG2 GLU 40 HG2 GLU 40 10.446 -7.288 -1.204 324 HG3 GLU 40 HG1 GLU 40 9.389 -7.859 0.057 325 H LEU 41 HN LEU 41 5.531 -5.631 -0.686 326 HA LEU 41 HA LEU 41 5.363 -3.660 -2.800 327 HB2 LEU 41 HB2 LEU 41 3.686 -5.673 -1.891 328 HB3 LEU 41 HB1 LEU 41 2.865 -4.189 -1.445 329 HG LEU 41 HG LEU 41 2.009 -4.630 -3.547 330 HD11 LEU 41 HD11 LEU 41 4.375 -2.979 -4.357 331 HD12 LEU 41 HD12 LEU 41 3.116 -2.355 -3.297 332 HD13 LEU 41 HD13 LEU 41 2.708 -2.885 -4.923 333 HD21 LEU 41 HD21 LEU 41 4.776 -5.378 -4.471 334 HD22 LEU 41 HD22 LEU 41 3.305 -5.418 -5.444 335 HD23 LEU 41 HD23 LEU 41 3.479 -6.503 -4.067 336 H MET 42 HN MET 42 4.338 -3.814 0.622 337 HA MET 42 HA MET 42 3.378 -1.146 0.698 338 HB2 MET 42 HB2 MET 42 4.291 -2.914 2.965 339 HB3 MET 42 HB1 MET 42 3.395 -1.402 3.159 340 HG2 MET 42 HG2 MET 42 2.473 -3.959 1.887 341 HG3 MET 42 HG1 MET 42 1.863 -3.180 3.338 342 HE1 MET 42 HE1 MET 42 -0.613 -3.364 2.537 343 HE2 MET 42 HE2 MET 42 -0.023 -4.229 1.113 344 HE3 MET 42 HE3 MET 42 -1.150 -2.883 0.923 345 H ALA 43 HN ALA 43 6.462 -2.592 0.962 346 HA ALA 43 HA ALA 43 8.041 -0.683 2.096 347 HB1 ALA 43 HB1 ALA 43 8.971 -2.703 1.271 348 HB2 ALA 43 HB2 ALA 43 9.742 -1.379 0.390 349 HB3 ALA 43 HB3 ALA 43 8.471 -2.338 -0.377 350 H TYR 44 HN TYR 44 6.283 -0.566 -0.923 351 HA TYR 44 HA TYR 44 7.393 2.096 -1.539 352 HB2 TYR 44 HB2 TYR 44 7.493 0.584 -3.419 353 HB3 TYR 44 HB1 TYR 44 5.824 0.112 -3.166 354 HD1 TYR 44 HD1 TYR 44 8.051 2.513 -4.706 355 HD2 TYR 44 HD2 TYR 44 3.989 1.680 -3.806 356 HE1 TYR 44 HE1 TYR 44 7.353 4.164 -6.370 357 HE2 TYR 44 HE2 TYR 44 3.275 3.337 -5.472 358 HH TYR 44 HH TYR 44 5.282 4.582 -7.807 359 H GLU 45 HN GLU 45 4.297 0.432 -1.957 360 HA GLU 45 HA GLU 45 2.630 2.543 -2.085 361 HB2 GLU 45 HB2 GLU 45 2.018 -0.055 -0.709 362 HB3 GLU 45 HB1 GLU 45 0.869 0.998 -1.522 363 HG2 GLU 45 HG2 GLU 45 3.147 -0.422 -2.889 364 HG3 GLU 45 HG1 GLU 45 1.501 -1.030 -2.823 365 H ASN 46 HN ASN 46 4.076 1.271 0.830 366 HA ASN 46 HA ASN 46 2.312 2.929 2.471 367 HB2 ASN 46 HB2 ASN 46 3.784 0.388 2.925 368 HB3 ASN 46 HB1 ASN 46 3.531 1.457 4.296 369 HD21 ASN 46 HD21 ASN 46 2.028 0.140 5.363 370 HD22 ASN 46 HD22 ASN 46 0.454 -0.131 4.750 371 H ALA 47 HN ALA 47 5.465 2.711 1.261 372 HA ALA 47 HA ALA 47 6.917 3.789 3.422 373 HB1 ALA 47 HB1 ALA 47 8.010 2.676 1.547 374 HB2 ALA 47 HB2 ALA 47 8.646 4.305 1.791 375 HB3 ALA 47 HB3 ALA 47 7.512 3.988 0.478 376 H ASN 48 HN ASN 48 8.169 5.883 3.014 377 HA ASN 48 HA ASN 48 6.494 8.120 3.066 378 HB2 ASN 48 HB2 ASN 48 9.406 7.618 2.743 379 HB3 ASN 48 HB1 ASN 48 8.808 9.211 2.290 380 HD21 ASN 48 HD21 ASN 48 10.485 8.099 4.531 381 HD22 ASN 48 HD22 ASN 48 9.757 8.771 5.953 382 HA PRO 49 HA PRO 49 5.324 8.782 -1.127 383 HB2 PRO 49 HB2 PRO 49 5.597 11.554 -1.153 384 HB3 PRO 49 HB1 PRO 49 4.163 10.670 -0.636 385 HG2 PRO 49 HG2 PRO 49 6.346 11.878 0.993 386 HG3 PRO 49 HG1 PRO 49 4.610 11.770 1.340 387 HD2 PRO 49 HD2 PRO 49 6.398 10.158 2.539 388 HD3 PRO 49 HD1 PRO 49 4.773 9.583 2.097 389 H GLU 50 HN GLU 50 8.218 10.259 0.114 390 HA GLU 50 HA GLU 50 9.519 10.596 -2.426 391 HB2 GLU 50 HB2 GLU 50 11.254 11.596 -1.169 392 HB3 GLU 50 HB1 GLU 50 9.774 12.022 -0.318 393 HG2 GLU 50 HG2 GLU 50 10.894 9.536 0.564 394 HG3 GLU 50 HG1 GLU 50 11.955 10.916 0.838 395 H CYS 51 HN CYS 51 9.336 8.240 0.118 396 HA CYS 51 HA CYS 51 11.810 6.983 -0.604 397 HB2 CYS 51 HB2 CYS 51 9.634 6.197 1.340 398 HB3 CYS 51 HB1 CYS 51 11.101 5.254 1.056 399 HG CYS 51 HG CYS 51 11.578 8.505 1.784 400 H GLN 52 HN GLN 52 8.388 6.438 -1.047 401 HA GLN 52 HA GLN 52 8.768 4.103 -2.651 402 HB2 GLN 52 HB2 GLN 52 6.440 4.355 -3.239 403 HB3 GLN 52 HB1 GLN 52 6.628 4.600 -1.509 404 HG2 GLN 52 HG2 GLN 52 6.597 7.061 -1.947 405 HG3 GLN 52 HG1 GLN 52 6.180 6.691 -3.623 406 HE21 GLN 52 HE21 GLN 52 4.723 4.314 -2.745 407 HE22 GLN 52 HE22 GLN 52 3.241 4.867 -2.095 408 H SER 53 HN SER 53 8.746 7.493 -3.010 409 HA SER 53 HA SER 53 8.750 7.647 -5.826 410 HB2 SER 53 HB2 SER 53 8.911 9.900 -5.445 411 HB3 SER 53 HB1 SER 53 8.630 9.441 -3.754 412 HG SER 53 HG SER 53 11.017 9.273 -3.666 413 H ALA 54 HN ALA 54 11.110 6.882 -3.436 414 HA ALA 54 HA ALA 54 13.295 6.933 -5.326 415 HB1 ALA 54 HB1 ALA 54 14.501 5.787 -3.431 416 HB2 ALA 54 HB2 ALA 54 13.004 5.954 -2.502 417 HB3 ALA 54 HB3 ALA 54 13.856 7.388 -3.074 418 H ILE 55 HN ILE 55 10.829 4.821 -4.344 419 HA ILE 55 HA ILE 55 12.253 2.453 -5.132 420 HB ILE 55 HB ILE 55 9.607 2.908 -3.837 421 HG12 ILE 55 HG12 ILE 55 11.853 1.260 -2.798 422 HG13 ILE 55 HG11 ILE 55 11.998 3.025 -2.778 423 HG21 ILE 55 HG21 ILE 55 10.806 0.291 -4.711 424 HG22 ILE 55 HG22 ILE 55 9.312 1.011 -5.307 425 HG23 ILE 55 HG23 ILE 55 9.422 0.463 -3.634 426 HD11 ILE 55 HD11 ILE 55 9.736 1.464 -1.557 427 HD12 ILE 55 HD12 ILE 55 10.015 3.211 -1.458 428 HD13 ILE 55 HD13 ILE 55 11.150 2.088 -0.687 429 H LYS 56 HN LYS 56 9.573 4.403 -6.496 430 HA LYS 56 HA LYS 56 8.362 2.498 -8.016 431 HB2 LYS 56 HB2 LYS 56 7.719 4.116 -9.720 432 HB3 LYS 56 HB1 LYS 56 7.416 4.659 -8.090 433 HG2 LYS 56 HG2 LYS 56 9.929 5.390 -9.342 434 HG3 LYS 56 HG1 LYS 56 8.481 6.223 -9.873 435 HD2 LYS 56 HD2 LYS 56 8.161 6.371 -7.262 436 HD3 LYS 56 HD1 LYS 56 9.922 6.340 -7.345 437 HE2 LYS 56 HE2 LYS 56 9.186 8.607 -7.468 438 HE3 LYS 56 HE1 LYS 56 9.845 8.145 -9.019 439 HZ1 LYS 56 HZ1 LYS 56 6.945 8.130 -8.401 440 HZ2 LYS 56 HZ2 LYS 56 7.673 7.955 -9.919 441 HZ3 LYS 56 HZ3 LYS 56 7.734 9.439 -9.114 442 HA PRO 57 HA PRO 57 11.854 2.667 -11.495 443 HB2 PRO 57 HB2 PRO 57 14.316 2.618 -10.306 444 HB3 PRO 57 HB1 PRO 57 13.571 4.093 -10.940 445 HG2 PRO 57 HG2 PRO 57 13.483 3.004 -8.134 446 HG3 PRO 57 HG1 PRO 57 13.973 4.634 -8.666 447 HD2 PRO 57 HD2 PRO 57 11.530 4.291 -7.769 448 HD3 PRO 57 HD1 PRO 57 11.742 5.176 -9.289 449 H LEU 58 HN LEU 58 12.030 1.282 -8.272 450 HA LEU 58 HA LEU 58 13.056 -1.264 -9.319 451 HB2 LEU 58 HB2 LEU 58 12.555 -0.897 -6.433 452 HB3 LEU 58 HB1 LEU 58 13.877 -1.739 -7.225 453 HG LEU 58 HG LEU 58 13.607 1.261 -6.946 454 HD11 LEU 58 HD11 LEU 58 13.944 0.234 -4.797 455 HD12 LEU 58 HD12 LEU 58 15.445 1.007 -5.314 456 HD13 LEU 58 HD13 LEU 58 15.266 -0.744 -5.432 457 HD21 LEU 58 HD21 LEU 58 14.877 0.621 -8.919 458 HD22 LEU 58 HD22 LEU 58 15.904 -0.427 -7.939 459 HD23 LEU 58 HD23 LEU 58 15.933 1.321 -7.693 460 H LYS 59 HN LYS 59 10.309 0.384 -8.273 461 HA LYS 59 HA LYS 59 8.762 -1.550 -7.050 462 HB2 LYS 59 HB2 LYS 59 7.991 0.731 -7.252 463 HB3 LYS 59 HB1 LYS 59 7.897 0.573 -8.998 464 HG2 LYS 59 HG2 LYS 59 5.724 0.175 -8.599 465 HG3 LYS 59 HG1 LYS 59 6.307 -1.443 -8.243 466 HD2 LYS 59 HD2 LYS 59 5.869 0.731 -6.231 467 HD3 LYS 59 HD1 LYS 59 4.777 -0.634 -6.504 468 HE2 LYS 59 HE2 LYS 59 7.646 -0.775 -5.553 469 HE3 LYS 59 HE1 LYS 59 6.214 -1.012 -4.563 470 HZ1 LYS 59 HZ1 LYS 59 7.078 -2.734 -6.809 471 HZ2 LYS 59 HZ2 LYS 59 5.664 -2.955 -5.919 472 HZ3 LYS 59 HZ3 LYS 59 7.175 -3.119 -5.168 473 H GLY 60 HN GLY 60 8.499 -3.564 -7.677 474 HA2 GLY 60 HA3 GLY 60 7.403 -5.177 -9.017 475 HA3 GLY 60 HA2 GLY 60 7.497 -4.068 -10.380 476 H LYS 61 HN LYS 61 10.390 -3.516 -9.617 477 HA LYS 61 HA LYS 61 11.450 -5.876 -11.014 478 HB2 LYS 61 HB2 LYS 61 13.114 -3.447 -10.621 479 HB3 LYS 61 HB1 LYS 61 12.959 -4.480 -12.033 480 HG2 LYS 61 HG2 LYS 61 10.909 -2.472 -11.159 481 HG3 LYS 61 HG1 LYS 61 12.136 -2.176 -12.377 482 HD2 LYS 61 HD2 LYS 61 10.053 -4.349 -12.539 483 HD3 LYS 61 HD1 LYS 61 9.911 -2.770 -13.312 484 HE2 LYS 61 HE2 LYS 61 12.007 -3.240 -14.536 485 HE3 LYS 61 HE1 LYS 61 12.015 -4.855 -13.837 486 HZ1 LYS 61 HZ1 LYS 61 9.889 -5.283 -14.914 487 HZ2 LYS 61 HZ2 LYS 61 11.070 -4.873 -16.050 488 HZ3 LYS 61 HZ3 LYS 61 9.904 -3.736 -15.598 489 H VAL 62 HN VAL 62 12.172 -7.303 -9.567 490 HA VAL 62 HA VAL 62 14.176 -6.329 -7.650 491 HB VAL 62 HB VAL 62 12.270 -7.231 -6.420 492 HG11 VAL 62 HG11 VAL 62 11.581 -9.570 -6.606 493 HG12 VAL 62 HG12 VAL 62 12.687 -9.785 -7.965 494 HG13 VAL 62 HG13 VAL 62 11.314 -8.687 -8.113 495 HG21 VAL 62 HG21 VAL 62 14.393 -7.613 -5.404 496 HG22 VAL 62 HG22 VAL 62 14.665 -9.051 -6.388 497 HG23 VAL 62 HG23 VAL 62 13.401 -9.050 -5.159 498 HA PRO 63 HA PRO 63 17.220 -8.968 -9.784 499 HB2 PRO 63 HB2 PRO 63 17.781 -9.695 -6.943 500 HB3 PRO 63 HB1 PRO 63 18.910 -9.323 -8.233 501 HG2 PRO 63 HG2 PRO 63 18.366 -7.514 -6.373 502 HG3 PRO 63 HG1 PRO 63 18.552 -7.032 -8.067 503 HD2 PRO 63 HD2 PRO 63 16.088 -7.256 -6.429 504 HD3 PRO 63 HD1 PRO 63 16.448 -6.173 -7.787 505 H ALA 64 HN ALA 64 17.233 -11.112 -10.354 506 HA ALA 64 HA ALA 64 14.859 -12.529 -9.927 507 HB1 ALA 64 HB1 ALA 64 16.223 -12.726 -11.954 508 HB2 ALA 64 HB2 ALA 64 15.865 -14.298 -11.243 509 HB3 ALA 64 HB3 ALA 64 17.459 -13.576 -11.028 510 H GLY 65 HN GLY 65 14.421 -13.059 -7.841 511 HA2 GLY 65 HA3 GLY 65 14.353 -14.956 -6.400 512 HA3 GLY 65 HA2 GLY 65 16.040 -15.262 -6.777 513 H SER 66 HN SER 66 16.049 -12.057 -6.326 514 HA SER 66 HA SER 66 16.994 -12.401 -3.589 515 HB2 SER 66 HB2 SER 66 17.147 -9.934 -5.318 516 HB3 SER 66 HB1 SER 66 18.097 -10.298 -3.880 517 HG SER 66 HG SER 66 18.513 -12.318 -5.445 518 H ASP 67 HN ASP 67 16.730 -10.187 -2.345 519 HA ASP 67 HA ASP 67 13.922 -9.982 -1.677 520 HB2 ASP 67 HB2 ASP 67 15.931 -10.061 -0.064 521 HB3 ASP 67 HB1 ASP 67 16.231 -8.410 -0.555 522 H VAL 68 HN VAL 68 12.578 -8.243 -2.271 523 HA VAL 68 HA VAL 68 13.805 -6.211 -3.925 524 HB VAL 68 HB VAL 68 11.805 -5.690 -4.745 525 HG11 VAL 68 HG11 VAL 68 10.848 -8.066 -3.182 526 HG12 VAL 68 HG12 VAL 68 11.645 -8.103 -4.753 527 HG13 VAL 68 HG13 VAL 68 10.058 -7.355 -4.589 528 HG21 VAL 68 HG21 VAL 68 10.734 -5.685 -1.936 529 HG22 VAL 68 HG22 VAL 68 9.765 -5.312 -3.360 530 HG23 VAL 68 HG23 VAL 68 11.150 -4.298 -2.946 531 H ILE 69 HN ILE 69 12.720 -6.607 -0.681 532 HA ILE 69 HA ILE 69 12.485 -3.951 0.104 533 HB ILE 69 HB ILE 69 13.329 -6.384 1.652 534 HG12 ILE 69 HG12 ILE 69 11.072 -6.614 1.053 535 HG13 ILE 69 HG11 ILE 69 11.005 -5.922 2.667 536 HG21 ILE 69 HG21 ILE 69 12.840 -3.580 2.664 537 HG22 ILE 69 HG22 ILE 69 14.313 -4.539 2.809 538 HG23 ILE 69 HG23 ILE 69 12.866 -5.006 3.704 539 HD11 ILE 69 HD11 ILE 69 10.713 -3.696 1.648 540 HD12 ILE 69 HD12 ILE 69 9.404 -4.832 1.306 541 HD13 ILE 69 HD13 ILE 69 10.624 -4.482 0.073 542 H SER 70 HN SER 70 15.220 -6.109 0.204 543 HA SER 70 HA SER 70 17.232 -4.548 1.134 544 HB2 SER 70 HB2 SER 70 17.545 -6.877 0.503 545 HB3 SER 70 HB1 SER 70 17.316 -6.490 -1.197 546 HG SER 70 HG SER 70 19.386 -5.351 0.375 547 H GLU 71 HN GLU 71 15.764 -4.336 -2.064 548 HA GLU 71 HA GLU 71 17.649 -2.380 -3.047 549 HB2 GLU 71 HB2 GLU 71 15.037 -3.147 -4.313 550 HB3 GLU 71 HB1 GLU 71 16.521 -2.618 -5.098 551 HG2 GLU 71 HG2 GLU 71 16.682 -5.104 -3.537 552 HG3 GLU 71 HG1 GLU 71 15.717 -5.160 -5.005 553 H TYR 72 HN TYR 72 14.488 -2.536 -1.698 554 HA TYR 72 HA TYR 72 13.668 0.061 -2.544 555 HB2 TYR 72 HB2 TYR 72 12.541 -2.030 -0.697 556 HB3 TYR 72 HB1 TYR 72 11.804 -0.441 -0.836 557 HD1 TYR 72 HD1 TYR 72 13.327 -1.811 -3.819 558 HD2 TYR 72 HD2 TYR 72 9.737 -1.582 -1.569 559 HE1 TYR 72 HE1 TYR 72 12.056 -2.571 -5.768 560 HE2 TYR 72 HE2 TYR 72 8.455 -2.359 -3.514 561 HH TYR 72 HH TYR 72 10.010 -3.610 -6.333 562 H VAL 73 HN VAL 73 14.992 -1.419 0.335 563 HA VAL 73 HA VAL 73 14.997 0.957 1.895 564 HB VAL 73 HB VAL 73 16.206 -0.096 3.531 565 HG11 VAL 73 HG11 VAL 73 14.177 -1.304 3.295 566 HG12 VAL 73 HG12 VAL 73 15.460 -2.420 3.750 567 HG13 VAL 73 HG13 VAL 73 14.894 -2.360 2.082 568 HG21 VAL 73 HG21 VAL 73 17.933 -1.603 3.359 569 HG22 VAL 73 HG22 VAL 73 18.111 -0.642 1.882 570 HG23 VAL 73 HG23 VAL 73 17.361 -2.239 1.810 571 H LYS 74 HN LYS 74 17.083 -0.584 -0.405 572 HA LYS 74 HA LYS 74 19.359 1.075 -0.173 573 HB2 LYS 74 HB2 LYS 74 18.598 -1.124 -1.676 574 HB3 LYS 74 HB1 LYS 74 18.700 0.166 -2.866 575 HG2 LYS 74 HG2 LYS 74 20.835 -0.543 -2.990 576 HG3 LYS 74 HG1 LYS 74 21.025 0.577 -1.642 577 HD2 LYS 74 HD2 LYS 74 20.434 -2.357 -1.300 578 HD3 LYS 74 HD1 LYS 74 22.067 -1.692 -1.319 579 HE2 LYS 74 HE2 LYS 74 19.909 -0.807 0.585 580 HE3 LYS 74 HE1 LYS 74 21.092 -2.058 0.961 581 HZ1 LYS 74 HZ1 LYS 74 21.777 0.740 0.230 582 HZ2 LYS 74 HZ2 LYS 74 22.853 -0.466 0.717 583 HZ3 LYS 74 HZ3 LYS 74 21.720 0.142 1.813 584 H ALA 75 HN ALA 75 16.305 1.290 -1.814 585 HA ALA 75 HA ALA 75 16.788 3.527 -3.448 586 HB1 ALA 75 HB1 ALA 75 14.351 3.777 -3.476 587 HB2 ALA 75 HB2 ALA 75 14.225 2.639 -2.133 588 HB3 ALA 75 HB3 ALA 75 14.836 2.096 -3.695 589 H CYS 76 HN CYS 76 15.500 3.290 -0.140 590 HA CYS 76 HA CYS 76 15.641 6.198 0.117 591 HB2 CYS 76 HB2 CYS 76 13.678 5.297 1.009 592 HB3 CYS 76 HB1 CYS 76 14.522 4.037 1.891 593 HG CYS 76 HG CYS 76 15.771 6.149 3.536 594 H ASP 77 HN ASP 77 17.821 3.876 0.274 595 HA ASP 77 HA ASP 77 19.238 4.315 2.635 596 HB2 ASP 77 HB2 ASP 77 19.840 2.457 1.321 597 HB3 ASP 77 HB1 ASP 77 20.055 3.418 -0.133 598 H GLY 78 HN GLY 78 18.698 6.355 -0.041 599 HA2 GLY 78 HA3 GLY 78 20.683 8.251 1.041 600 HA3 GLY 78 HA2 GLY 78 20.235 8.193 -0.655 601 H ILE 79 HN ILE 79 17.638 7.755 1.624 602 HA ILE 79 HA ILE 79 16.683 10.441 1.003 603 HB ILE 79 HB ILE 79 15.368 7.940 1.959 604 HG12 ILE 79 HG12 ILE 79 15.073 9.677 -0.496 605 HG13 ILE 79 HG11 ILE 79 15.846 8.101 -0.415 606 HG21 ILE 79 HG21 ILE 79 14.332 9.796 3.173 607 HG22 ILE 79 HG22 ILE 79 13.226 9.077 2.003 608 HG23 ILE 79 HG23 ILE 79 14.017 10.614 1.641 609 HD11 ILE 79 HD11 ILE 79 12.948 8.588 0.167 610 HD12 ILE 79 HD12 ILE 79 13.764 7.033 0.005 611 HD13 ILE 79 HD13 ILE 79 13.582 8.085 -1.395 612 H GLY 80 HN GLY 80 18.252 8.934 3.542 613 HA2 GLY 80 HA3 GLY 80 16.570 9.727 5.690 614 HA3 GLY 80 HA2 GLY 80 18.181 9.086 5.824 615 H GLY 81 HN GLY 81 18.135 11.886 3.859 616 HA2 GLY 81 HA3 GLY 81 17.528 14.095 4.959 617 HA3 GLY 81 HA2 GLY 81 18.633 13.586 6.226 618 H ALA 82 HN ALA 82 18.505 14.175 2.739 619 HA ALA 82 HA ALA 82 20.435 16.197 2.774 620 HB1 ALA 82 HB1 ALA 82 22.020 14.406 3.228 621 HB2 ALA 82 HB2 ALA 82 22.301 15.103 1.632 622 HB3 ALA 82 HB3 ALA 82 21.480 13.550 1.787 623 H MET 83 HN MET 83 20.583 13.770 0.255 624 HA MET 83 HA MET 83 19.674 15.542 -1.765 625 HB2 MET 83 HB2 MET 83 19.912 12.527 -1.800 626 HB3 MET 83 HB1 MET 83 19.633 13.529 -3.216 627 HG2 MET 83 HG2 MET 83 21.792 14.658 -2.782 628 HG3 MET 83 HG1 MET 83 22.074 13.527 -1.460 629 HE1 MET 83 HE1 MET 83 22.249 10.864 -1.832 630 HE2 MET 83 HE2 MET 83 22.199 10.102 -3.421 631 HE3 MET 83 HE3 MET 83 20.750 10.858 -2.761 632 H HIS 84 HN HIS 84 18.084 13.543 0.467 633 HA HIS 84 HA HIS 84 15.640 12.938 -0.631 634 HB2 HIS 84 HB2 HIS 84 16.107 12.231 1.576 635 HB3 HIS 84 HB1 HIS 84 16.465 13.861 2.119 636 HD1 HIS 84 HD1 HIS 84 14.804 14.193 3.931 637 HD2 HIS 84 HD2 HIS 84 13.075 12.607 0.506 638 HE1 HIS 84 HE1 HIS 84 12.347 14.108 4.398 639 HE2 HIS 84 HE2 HIS 84 11.393 12.825 2.465 640 H LYS 85 HN LYS 85 16.835 16.108 0.350 641 HA LYS 85 HA LYS 85 14.199 17.292 0.159 642 HB2 LYS 85 HB2 LYS 85 16.884 18.628 0.541 643 HB3 LYS 85 HB1 LYS 85 15.306 19.365 0.793 644 HG2 LYS 85 HG2 LYS 85 16.522 17.112 2.387 645 HG3 LYS 85 HG1 LYS 85 16.248 18.773 2.922 646 HD2 LYS 85 HD2 LYS 85 13.844 18.460 2.707 647 HD3 LYS 85 HD1 LYS 85 14.098 16.818 2.115 648 HE2 LYS 85 HE2 LYS 85 13.508 16.710 4.433 649 HE3 LYS 85 HE1 LYS 85 15.206 16.266 4.256 650 HZ1 LYS 85 HZ1 LYS 85 14.243 18.961 5.061 651 HZ2 LYS 85 HZ2 LYS 85 15.853 18.447 4.995 652 HZ3 LYS 85 HZ3 LYS 85 14.798 17.777 6.132 653 H ALA 86 HN ALA 86 16.925 16.797 -1.869 654 HA ALA 86 HA ALA 86 16.102 18.729 -3.868 655 HB1 ALA 86 HB1 ALA 86 17.966 17.686 -5.184 656 HB2 ALA 86 HB2 ALA 86 18.263 16.625 -3.802 657 HB3 ALA 86 HB3 ALA 86 18.453 18.371 -3.634 658 H MET 87 HN MET 87 16.048 15.294 -3.313 659 HA MET 87 HA MET 87 14.942 14.664 -5.912 660 HB2 MET 87 HB2 MET 87 15.540 12.940 -3.490 661 HB3 MET 87 HB1 MET 87 15.073 12.335 -5.081 662 HG2 MET 87 HG2 MET 87 17.083 13.139 -6.062 663 HG3 MET 87 HG1 MET 87 17.500 14.032 -4.609 664 HE1 MET 87 HE1 MET 87 17.102 10.443 -6.195 665 HE2 MET 87 HE2 MET 87 16.033 10.374 -4.795 666 HE3 MET 87 HE3 MET 87 17.512 9.413 -4.825 667 H LEU 88 HN LEU 88 13.733 15.519 -2.876 668 HA LEU 88 HA LEU 88 11.453 14.049 -2.555 669 HB2 LEU 88 HB2 LEU 88 12.468 16.034 -1.211 670 HB3 LEU 88 HB1 LEU 88 11.452 17.035 -2.218 671 HG LEU 88 HG LEU 88 9.751 16.721 -0.822 672 HD11 LEU 88 HD11 LEU 88 9.147 14.758 -2.165 673 HD12 LEU 88 HD12 LEU 88 8.722 14.546 -0.466 674 HD13 LEU 88 HD13 LEU 88 10.149 13.749 -1.123 675 HD21 LEU 88 HD21 LEU 88 10.142 15.491 1.290 676 HD22 LEU 88 HD22 LEU 88 11.425 16.634 0.891 677 HD23 LEU 88 HD23 LEU 88 11.667 14.909 0.620 678 H MET 89 HN MET 89 11.737 17.087 -4.419 679 HA MET 89 HA MET 89 9.012 16.967 -5.257 680 HB2 MET 89 HB2 MET 89 10.192 19.096 -4.963 681 HB3 MET 89 HB1 MET 89 11.301 18.672 -6.258 682 HG2 MET 89 HG2 MET 89 9.443 18.687 -7.847 683 HG3 MET 89 HG1 MET 89 8.337 19.123 -6.546 684 HE1 MET 89 HE1 MET 89 9.563 22.695 -5.561 685 HE2 MET 89 HE2 MET 89 10.130 21.188 -4.845 686 HE3 MET 89 HE3 MET 89 8.422 21.390 -5.232 687 H ALA 90 HN ALA 90 11.938 15.592 -6.452 688 HA ALA 90 HA ALA 90 11.044 15.649 -9.218 689 HB1 ALA 90 HB1 ALA 90 13.534 14.433 -8.029 690 HB2 ALA 90 HB2 ALA 90 13.392 16.104 -8.574 691 HB3 ALA 90 HB3 ALA 90 13.235 14.783 -9.735 692 H GLN 91 HN GLN 91 10.561 13.559 -6.627 693 HA GLN 91 HA GLN 91 9.963 11.410 -8.542 694 HB2 GLN 91 HB2 GLN 91 10.816 10.638 -5.822 695 HB3 GLN 91 HB1 GLN 91 10.978 9.775 -7.342 696 HG2 GLN 91 HG2 GLN 91 12.821 11.086 -7.982 697 HG3 GLN 91 HG1 GLN 91 12.550 12.209 -6.649 698 HE21 GLN 91 HE21 GLN 91 12.971 11.566 -4.556 699 HE22 GLN 91 HE22 GLN 91 13.995 10.236 -4.201 700 H LEU 92 HN LEU 92 9.328 12.788 -5.323 701 HA LEU 92 HA LEU 92 7.036 11.494 -4.527 702 HB2 LEU 92 HB2 LEU 92 8.329 13.634 -3.627 703 HB3 LEU 92 HB1 LEU 92 7.089 14.491 -4.511 704 HG LEU 92 HG LEU 92 6.847 12.827 -2.038 705 HD11 LEU 92 HD11 LEU 92 5.822 15.525 -2.885 706 HD12 LEU 92 HD12 LEU 92 7.173 15.197 -1.800 707 HD13 LEU 92 HD13 LEU 92 5.531 14.773 -1.315 708 HD21 LEU 92 HD21 LEU 92 4.395 12.883 -2.255 709 HD22 LEU 92 HD22 LEU 92 5.148 11.879 -3.494 710 HD23 LEU 92 HD23 LEU 92 4.566 13.492 -3.901 711 H GLU 93 HN GLU 93 7.683 13.743 -7.030 712 HA GLU 93 HA GLU 93 5.738 15.198 -7.811 713 HB2 GLU 93 HB2 GLU 93 6.216 14.661 -10.210 714 HB3 GLU 93 HB1 GLU 93 7.651 14.950 -9.223 715 HG2 GLU 93 HG2 GLU 93 8.223 12.684 -9.199 716 HG3 GLU 93 HG1 GLU 93 6.629 12.177 -9.755 717 H2 PRO 1 HT1 PRO 1 5.216 -4.449 -13.695 718 H3 PRO 1 HT2 PRO 1 5.587 -2.948 -14.237 719 HA PRO 1 HA PRO 1 6.380 -2.857 -12.211 720 HB2 PRO 1 HB2 PRO 1 4.365 -1.736 -10.864 721 HB3 PRO 1 HB1 PRO 1 5.055 -0.940 -12.280 722 HG2 PRO 1 HG2 PRO 1 2.465 -2.289 -11.984 723 HG3 PRO 1 HG1 PRO 1 2.990 -1.118 -13.209 724 HD2 PRO 1 HD2 PRO 1 2.901 -4.029 -13.356 725 HD3 PRO 1 HD1 PRO 1 3.195 -2.859 -14.657 726 H SER 2 HN SER 2 4.663 -2.879 -9.781 727 HA SER 2 HA SER 2 4.348 -5.648 -9.215 728 HB2 SER 2 HB2 SER 2 3.113 -3.228 -7.889 729 HB3 SER 2 HB1 SER 2 3.068 -4.862 -7.253 730 HG SER 2 HG SER 2 5.365 -4.831 -7.198 731 H PHE 3 HN PHE 3 2.010 -6.315 -8.460 732 HA PHE 3 HA PHE 3 0.293 -6.063 -10.725 733 HB2 PHE 3 HB2 PHE 3 -1.253 -7.062 -8.674 734 HB3 PHE 3 HB1 PHE 3 -0.328 -8.026 -9.820 735 HD1 PHE 3 HD1 PHE 3 -0.801 -7.029 -6.434 736 HD2 PHE 3 HD2 PHE 3 1.995 -8.776 -9.122 737 HE1 PHE 3 HE1 PHE 3 0.426 -8.000 -4.550 738 HE2 PHE 3 HE2 PHE 3 3.244 -9.724 -7.229 739 HZ PHE 3 HZ PHE 3 2.456 -9.336 -4.929 740 H ASN 4 HN ASN 4 0.262 -4.919 -7.406 741 HA ASN 4 HA ASN 4 -2.411 -3.892 -7.734 742 HB2 ASN 4 HB2 ASN 4 -2.258 -3.495 -5.326 743 HB3 ASN 4 HB1 ASN 4 -1.806 -5.146 -5.742 744 HD21 ASN 4 HD21 ASN 4 -0.545 -1.970 -4.914 745 HD22 ASN 4 HD22 ASN 4 0.979 -2.537 -4.313 746 H THR 5 HN THR 5 0.446 -2.533 -8.519 747 HA THR 5 HA THR 5 0.512 -0.124 -7.028 748 HB THR 5 HB THR 5 1.788 0.680 -9.139 749 HG1 THR 5 HG1 THR 5 1.329 -0.715 -10.725 750 HG21 THR 5 HG21 THR 5 2.593 -1.555 -7.328 751 HG22 THR 5 HG22 THR 5 3.068 0.142 -7.277 752 HG23 THR 5 HG23 THR 5 3.708 -0.918 -8.535 753 H VAL 6 HN VAL 6 -1.827 -1.161 -9.186 754 HA VAL 6 HA VAL 6 -2.407 1.332 -10.418 755 HB VAL 6 HB VAL 6 -4.301 0.312 -11.363 756 HG11 VAL 6 HG11 VAL 6 -3.437 -1.759 -12.297 757 HG12 VAL 6 HG12 VAL 6 -2.238 -1.841 -11.004 758 HG13 VAL 6 HG13 VAL 6 -2.174 -0.530 -12.185 759 HG21 VAL 6 HG21 VAL 6 -5.372 -1.691 -10.614 760 HG22 VAL 6 HG22 VAL 6 -5.217 -0.602 -9.227 761 HG23 VAL 6 HG23 VAL 6 -4.110 -1.970 -9.407 762 H ARG 7 HN ARG 7 -3.341 3.016 -9.472 763 HA ARG 7 HA ARG 7 -4.952 2.462 -7.105 764 HB2 ARG 7 HB2 ARG 7 -2.772 4.519 -7.198 765 HB3 ARG 7 HB1 ARG 7 -3.679 3.942 -5.798 766 HG2 ARG 7 HG2 ARG 7 -2.672 1.782 -6.090 767 HG3 ARG 7 HG1 ARG 7 -1.881 2.328 -7.549 768 HD2 ARG 7 HD2 ARG 7 -1.352 3.126 -4.749 769 HD3 ARG 7 HD1 ARG 7 -0.313 2.380 -5.920 770 HE ARG 7 HE ARG 7 -1.130 4.911 -6.848 771 HH11 ARG 7 HH11 ARG 7 1.124 3.380 -4.629 772 HH12 ARG 7 HH12 ARG 7 2.182 4.758 -4.593 773 HH21 ARG 7 HH21 ARG 7 0.274 6.701 -6.792 774 HH22 ARG 7 HH22 ARG 7 1.700 6.644 -5.814 775 H GLN 8 HN GLN 8 -6.387 3.839 -6.513 776 HA GLN 8 HA GLN 8 -8.006 5.233 -8.102 777 HB2 GLN 8 HB2 GLN 8 -7.547 4.889 -5.328 778 HB3 GLN 8 HB1 GLN 8 -7.947 6.587 -5.592 779 HG2 GLN 8 HG2 GLN 8 -9.976 5.937 -6.769 780 HG3 GLN 8 HG1 GLN 8 -9.585 4.240 -6.522 781 HE21 GLN 8 HE21 GLN 8 -11.900 5.768 -5.700 782 HE22 GLN 8 HE22 GLN 8 -11.971 5.651 -3.964 783 H GLY 9 HN GLY 9 -7.729 6.886 -9.420 784 HA2 GLY 9 HA3 GLY 9 -5.954 9.096 -8.735 785 HA3 GLY 9 HA2 GLY 9 -6.900 8.927 -10.208 786 H SER 10 HN SER 10 -7.556 11.157 -9.913 787 HA SER 10 HA SER 10 -8.747 12.285 -7.702 788 HB2 SER 10 HB2 SER 10 -8.157 13.481 -9.816 789 HB3 SER 10 HB1 SER 10 -9.585 12.777 -10.572 790 HG SER 10 HG SER 10 -9.483 14.587 -8.387 791 H LYS 11 HN LYS 11 -10.206 11.284 -6.511 792 HA LYS 11 HA LYS 11 -11.830 9.810 -5.891 793 HB2 LYS 11 HB2 LYS 11 -14.050 10.683 -6.229 794 HB3 LYS 11 HB1 LYS 11 -12.957 12.016 -5.944 795 HG2 LYS 11 HG2 LYS 11 -13.058 12.714 -8.140 796 HG3 LYS 11 HG1 LYS 11 -13.685 11.180 -8.723 797 HD2 LYS 11 HD2 LYS 11 -15.768 11.637 -7.434 798 HD3 LYS 11 HD1 LYS 11 -15.125 13.236 -7.058 799 HE2 LYS 11 HE2 LYS 11 -15.037 13.783 -9.421 800 HE3 LYS 11 HE1 LYS 11 -15.600 12.165 -9.836 801 HZ1 LYS 11 HZ1 LYS 11 -17.419 13.704 -9.925 802 HZ2 LYS 11 HZ2 LYS 11 -17.122 14.231 -8.348 803 HZ3 LYS 11 HZ3 LYS 11 -17.663 12.652 -8.622 804 H GLU 12 HN GLU 12 -10.463 8.627 -7.986 805 HA GLU 12 HA GLU 12 -12.010 7.697 -10.116 806 HB2 GLU 12 HB2 GLU 12 -9.616 7.357 -10.026 807 HB3 GLU 12 HB1 GLU 12 -9.754 6.392 -8.573 808 HG2 GLU 12 HG2 GLU 12 -10.926 4.652 -9.845 809 HG3 GLU 12 HG1 GLU 12 -10.759 5.633 -11.301 810 HA PRO 13 HA PRO 13 -15.266 5.342 -8.248 811 HB2 PRO 13 HB2 PRO 13 -14.653 3.350 -10.358 812 HB3 PRO 13 HB1 PRO 13 -16.199 4.083 -9.938 813 HG2 PRO 13 HG2 PRO 13 -14.840 4.815 -12.125 814 HG3 PRO 13 HG1 PRO 13 -15.785 5.968 -11.177 815 HD2 PRO 13 HD2 PRO 13 -12.849 5.638 -11.364 816 HD3 PRO 13 HD1 PRO 13 -13.802 7.087 -11.010 817 H TYR 14 HN TYR 14 -15.019 4.106 -6.489 818 HA TYR 14 HA TYR 14 -12.418 3.099 -6.056 819 HB2 TYR 14 HB2 TYR 14 -13.633 4.236 -4.278 820 HB3 TYR 14 HB1 TYR 14 -14.815 2.929 -4.240 821 HD1 TYR 14 HD1 TYR 14 -13.877 0.581 -3.866 822 HD2 TYR 14 HD2 TYR 14 -11.771 4.115 -2.870 823 HE1 TYR 14 HE1 TYR 14 -12.493 -0.717 -2.335 824 HE2 TYR 14 HE2 TYR 14 -10.360 2.841 -1.318 825 HH TYR 14 HH TYR 14 -10.100 0.854 -0.301 826 HA PRO 15 HA PRO 15 -14.608 -1.252 -5.637 827 HB2 PRO 15 HB2 PRO 15 -16.733 -0.924 -7.658 828 HB3 PRO 15 HB1 PRO 15 -16.777 -1.771 -6.114 829 HG2 PRO 15 HG2 PRO 15 -18.014 0.574 -6.493 830 HG3 PRO 15 HG1 PRO 15 -17.324 0.115 -4.942 831 HD2 PRO 15 HD2 PRO 15 -16.331 2.057 -6.955 832 HD3 PRO 15 HD1 PRO 15 -16.148 2.057 -5.195 833 H ASP 16 HN ASP 16 -14.232 0.820 -8.245 834 HA ASP 16 HA ASP 16 -13.525 -1.231 -10.167 835 HB2 ASP 16 HB2 ASP 16 -14.176 1.652 -10.311 836 HB3 ASP 16 HB1 ASP 16 -13.012 1.069 -11.493 837 H PHE 17 HN PHE 17 -12.036 1.489 -8.454 838 HA PHE 17 HA PHE 17 -9.444 1.279 -9.458 839 HB2 PHE 17 HB2 PHE 17 -9.271 3.036 -8.020 840 HB3 PHE 17 HB1 PHE 17 -10.739 2.542 -7.181 841 HD1 PHE 17 HD1 PHE 17 -10.648 1.471 -5.090 842 HD2 PHE 17 HD2 PHE 17 -7.069 2.113 -7.297 843 HE1 PHE 17 HE1 PHE 17 -9.329 0.846 -3.121 844 HE2 PHE 17 HE2 PHE 17 -5.738 1.497 -5.324 845 HZ PHE 17 HZ PHE 17 -6.867 0.862 -3.233 846 H VAL 18 HN VAL 18 -11.087 -0.442 -6.877 847 HA VAL 18 HA VAL 18 -8.771 -2.012 -6.258 848 HB VAL 18 HB VAL 18 -10.106 -1.503 -4.382 849 HG11 VAL 18 HG11 VAL 18 -12.426 -2.746 -5.851 850 HG12 VAL 18 HG12 VAL 18 -12.199 -1.017 -5.573 851 HG13 VAL 18 HG13 VAL 18 -12.455 -2.109 -4.199 852 HG21 VAL 18 HG21 VAL 18 -10.907 -3.759 -3.672 853 HG22 VAL 18 HG22 VAL 18 -9.237 -3.693 -4.241 854 HG23 VAL 18 HG23 VAL 18 -10.510 -4.324 -5.298 855 H ALA 19 HN ALA 19 -11.782 -2.521 -8.051 856 HA ALA 19 HA ALA 19 -11.565 -5.283 -8.423 857 HB1 ALA 19 HB1 ALA 19 -13.538 -3.974 -9.107 858 HB2 ALA 19 HB2 ALA 19 -12.949 -5.025 -10.395 859 HB3 ALA 19 HB3 ALA 19 -12.606 -3.297 -10.443 860 H ARG 20 HN ARG 20 -9.850 -2.673 -10.099 861 HA ARG 20 HA ARG 20 -8.659 -4.588 -11.916 862 HB2 ARG 20 HB2 ARG 20 -7.286 -2.697 -12.724 863 HB3 ARG 20 HB1 ARG 20 -9.005 -2.364 -12.812 864 HG2 ARG 20 HG2 ARG 20 -8.917 -0.784 -11.128 865 HG3 ARG 20 HG1 ARG 20 -7.412 -1.427 -10.464 866 HD2 ARG 20 HD2 ARG 20 -6.143 -0.571 -12.273 867 HD3 ARG 20 HD1 ARG 20 -7.585 -0.192 -13.193 868 HE ARG 20 HE ARG 20 -7.904 1.377 -11.052 869 HH11 ARG 20 HH11 ARG 20 -5.146 0.829 -13.136 870 HH12 ARG 20 HH12 ARG 20 -4.496 2.420 -12.908 871 HH21 ARG 20 HH21 ARG 20 -7.083 3.491 -10.784 872 HH22 ARG 20 HH22 ARG 20 -5.592 3.932 -11.567 873 H LEU 21 HN LEU 21 -8.073 -2.991 -8.939 874 HA LEU 21 HA LEU 21 -5.425 -3.578 -8.447 875 HB2 LEU 21 HB2 LEU 21 -7.235 -2.297 -7.090 876 HB3 LEU 21 HB1 LEU 21 -7.578 -3.847 -6.364 877 HG LEU 21 HG LEU 21 -5.525 -3.903 -5.238 878 HD11 LEU 21 HD11 LEU 21 -4.024 -3.287 -7.000 879 HD12 LEU 21 HD12 LEU 21 -3.752 -2.208 -5.630 880 HD13 LEU 21 HD13 LEU 21 -4.670 -1.647 -7.031 881 HD21 LEU 21 HD21 LEU 21 -5.434 -1.727 -4.080 882 HD22 LEU 21 HD22 LEU 21 -7.065 -2.383 -4.219 883 HD23 LEU 21 HD23 LEU 21 -6.543 -1.081 -5.288 884 H GLN 22 HN GLN 22 -8.332 -5.499 -7.858 885 HA GLN 22 HA GLN 22 -7.018 -7.796 -6.898 886 HB2 GLN 22 HB2 GLN 22 -9.727 -7.712 -8.191 887 HB3 GLN 22 HB1 GLN 22 -9.098 -8.878 -7.017 888 HG2 GLN 22 HG2 GLN 22 -8.957 -6.922 -5.441 889 HG3 GLN 22 HG1 GLN 22 -9.909 -6.034 -6.595 890 HE21 GLN 22 HE21 GLN 22 -11.343 -5.835 -4.821 891 HE22 GLN 22 HE22 GLN 22 -12.493 -7.091 -4.516 892 H ASP 23 HN ASP 23 -8.387 -6.864 -9.967 893 HA ASP 23 HA ASP 23 -8.167 -9.205 -11.377 894 HB2 ASP 23 HB2 ASP 23 -8.771 -6.674 -12.041 895 HB3 ASP 23 HB1 ASP 23 -7.158 -6.815 -12.756 896 H VAL 24 HN VAL 24 -5.637 -6.688 -11.270 897 HA VAL 24 HA VAL 24 -3.862 -8.406 -12.752 898 HB VAL 24 HB VAL 24 -3.728 -6.021 -13.159 899 HG11 VAL 24 HG11 VAL 24 -3.021 -4.427 -11.436 900 HG12 VAL 24 HG12 VAL 24 -3.052 -5.720 -10.237 901 HG13 VAL 24 HG13 VAL 24 -4.546 -5.210 -11.025 902 HG21 VAL 24 HG21 VAL 24 -1.312 -7.080 -11.708 903 HG22 VAL 24 HG22 VAL 24 -1.300 -5.580 -12.643 904 HG23 VAL 24 HG23 VAL 24 -1.630 -7.122 -13.442 905 H ALA 25 HN ALA 25 -4.592 -7.772 -9.448 906 HA ALA 25 HA ALA 25 -2.203 -8.740 -8.265 907 HB1 ALA 25 HB1 ALA 25 -3.960 -7.589 -6.952 908 HB2 ALA 25 HB2 ALA 25 -3.590 -9.179 -6.286 909 HB3 ALA 25 HB3 ALA 25 -5.048 -8.946 -7.255 910 H GLN 26 HN GLN 26 -5.028 -10.029 -9.677 911 HA GLN 26 HA GLN 26 -4.680 -12.724 -8.821 912 HB2 GLN 26 HB2 GLN 26 -6.849 -12.604 -9.310 913 HB3 GLN 26 HB1 GLN 26 -6.594 -11.057 -10.092 914 HG2 GLN 26 HG2 GLN 26 -7.483 -12.225 -11.809 915 HG3 GLN 26 HG1 GLN 26 -5.781 -12.592 -12.066 916 HE21 GLN 26 HE21 GLN 26 -5.618 -14.339 -9.791 917 HE22 GLN 26 HE22 GLN 26 -6.412 -15.801 -10.218 918 H LYS 27 HN LYS 27 -3.964 -10.834 -11.660 919 HA LYS 27 HA LYS 27 -3.119 -12.855 -13.379 920 HB2 LYS 27 HB2 LYS 27 -2.517 -9.939 -13.199 921 HB3 LYS 27 HB1 LYS 27 -1.701 -10.957 -14.376 922 HG2 LYS 27 HG2 LYS 27 -3.555 -10.203 -15.568 923 HG3 LYS 27 HG1 LYS 27 -3.977 -11.767 -14.965 924 HD2 LYS 27 HD2 LYS 27 -4.999 -10.549 -13.020 925 HD3 LYS 27 HD1 LYS 27 -5.022 -9.177 -14.136 926 HE2 LYS 27 HE2 LYS 27 -5.944 -11.795 -15.087 927 HE3 LYS 27 HE1 LYS 27 -7.016 -10.909 -14.001 928 HZ1 LYS 27 HZ1 LYS 27 -7.082 -9.105 -15.544 929 HZ2 LYS 27 HZ2 LYS 27 -7.391 -10.519 -16.424 930 HZ3 LYS 27 HZ3 LYS 27 -5.867 -9.791 -16.507 931 H SER 28 HN SER 28 -1.449 -10.967 -10.996 932 HA SER 28 HA SER 28 1.097 -12.030 -11.900 933 HB2 SER 28 HB2 SER 28 0.475 -9.811 -9.966 934 HB3 SER 28 HB1 SER 28 2.078 -10.212 -10.589 935 HG SER 28 HG SER 28 -0.144 -9.101 -11.937 936 H ILE 29 HN ILE 29 -1.238 -12.631 -9.635 937 HA ILE 29 HA ILE 29 0.700 -13.825 -7.774 938 HB ILE 29 HB ILE 29 -2.070 -12.773 -7.244 939 HG12 ILE 29 HG12 ILE 29 0.594 -11.917 -6.111 940 HG13 ILE 29 HG11 ILE 29 -0.310 -11.065 -7.368 941 HG21 ILE 29 HG21 ILE 29 -0.236 -14.234 -5.369 942 HG22 ILE 29 HG22 ILE 29 -1.818 -14.759 -5.952 943 HG23 ILE 29 HG23 ILE 29 -1.693 -13.355 -4.892 944 HD11 ILE 29 HD11 ILE 29 -0.576 -10.136 -5.076 945 HD12 ILE 29 HD12 ILE 29 -1.406 -11.636 -4.634 946 HD13 ILE 29 HD13 ILE 29 -2.080 -10.581 -5.882 947 H ALA 30 HN ALA 30 0.666 -15.994 -7.609 948 HA ALA 30 HA ALA 30 -1.530 -17.482 -8.831 949 HB1 ALA 30 HB1 ALA 30 -0.097 -19.435 -8.535 950 HB2 ALA 30 HB2 ALA 30 1.069 -18.454 -7.648 951 HB3 ALA 30 HB3 ALA 30 0.769 -18.136 -9.357 952 H ASP 31 HN ASP 31 -0.908 -16.128 -5.956 953 HA ASP 31 HA ASP 31 -2.128 -18.248 -4.329 954 HB2 ASP 31 HB2 ASP 31 -0.268 -15.995 -3.780 955 HB3 ASP 31 HB1 ASP 31 -1.381 -16.455 -2.504 956 H GLU 32 HN GLU 32 -4.318 -17.985 -4.480 957 HA GLU 32 HA GLU 32 -5.736 -15.599 -4.769 958 HB2 GLU 32 HB2 GLU 32 -7.657 -16.808 -3.878 959 HB3 GLU 32 HB1 GLU 32 -6.741 -17.860 -4.948 960 HG2 GLU 32 HG2 GLU 32 -5.696 -18.916 -2.997 961 HG3 GLU 32 HG1 GLU 32 -6.652 -17.878 -1.940 962 H LYS 33 HN LYS 33 -4.171 -16.932 -1.984 963 HA LYS 33 HA LYS 33 -5.488 -15.385 0.009 964 HB2 LYS 33 HB2 LYS 33 -2.740 -16.653 0.028 965 HB3 LYS 33 HB1 LYS 33 -3.538 -15.965 1.433 966 HG2 LYS 33 HG2 LYS 33 -4.072 -18.138 1.763 967 HG3 LYS 33 HG1 LYS 33 -5.425 -17.689 0.724 968 HD2 LYS 33 HD2 LYS 33 -4.527 -19.769 -0.061 969 HD3 LYS 33 HD1 LYS 33 -4.127 -18.510 -1.228 970 HE2 LYS 33 HE2 LYS 33 -2.233 -20.005 -0.839 971 HE3 LYS 33 HE1 LYS 33 -1.872 -18.359 -0.327 972 HZ1 LYS 33 HZ1 LYS 33 -2.288 -19.009 1.959 973 HZ2 LYS 33 HZ2 LYS 33 -1.092 -19.987 1.278 974 HZ3 LYS 33 HZ3 LYS 33 -2.660 -20.587 1.472 975 H ALA 34 HN ALA 34 -2.334 -15.085 -1.589 976 HA ALA 34 HA ALA 34 -1.752 -12.537 -0.533 977 HB1 ALA 34 HB1 ALA 34 0.006 -12.443 -2.237 978 HB2 ALA 34 HB2 ALA 34 -0.687 -13.857 -3.029 979 HB3 ALA 34 HB3 ALA 34 -0.008 -13.999 -1.409 980 H ARG 35 HN ARG 35 -3.782 -13.623 -3.080 981 HA ARG 35 HA ARG 35 -3.781 -11.234 -4.659 982 HB2 ARG 35 HB2 ARG 35 -4.555 -13.664 -5.277 983 HB3 ARG 35 HB1 ARG 35 -6.080 -13.162 -4.560 984 HG2 ARG 35 HG2 ARG 35 -4.836 -11.440 -6.669 985 HG3 ARG 35 HG1 ARG 35 -5.667 -12.924 -7.134 986 HD2 ARG 35 HD2 ARG 35 -6.825 -10.600 -5.604 987 HD3 ARG 35 HD1 ARG 35 -7.178 -11.066 -7.277 988 HE ARG 35 HE ARG 35 -7.923 -13.272 -6.038 989 HH11 ARG 35 HH11 ARG 35 -8.493 -9.964 -5.059 990 HH12 ARG 35 HH12 ARG 35 -9.999 -10.321 -4.279 991 HH21 ARG 35 HH21 ARG 35 -9.880 -13.749 -4.980 992 HH22 ARG 35 HH22 ARG 35 -10.774 -12.478 -4.210 993 H LYS 36 HN LYS 36 -6.095 -12.661 -2.348 994 HA LYS 36 HA LYS 36 -7.808 -10.461 -2.116 995 HB2 LYS 36 HB2 LYS 36 -6.985 -12.292 0.126 996 HB3 LYS 36 HB1 LYS 36 -8.457 -11.338 0.028 997 HG2 LYS 36 HG2 LYS 36 -9.484 -12.804 -1.305 998 HG3 LYS 36 HG1 LYS 36 -7.985 -13.265 -2.143 999 HD2 LYS 36 HD2 LYS 36 -8.752 -15.110 -0.776 1000 HD3 LYS 36 HD1 LYS 36 -7.252 -14.422 -0.111 1001 HE2 LYS 36 HE2 LYS 36 -8.815 -12.980 1.354 1002 HE3 LYS 36 HE1 LYS 36 -10.085 -14.103 0.875 1003 HZ1 LYS 36 HZ1 LYS 36 -9.104 -14.743 2.981 1004 HZ2 LYS 36 HZ2 LYS 36 -7.578 -14.863 2.268 1005 HZ3 LYS 36 HZ3 LYS 36 -8.810 -15.924 1.808 1006 H VAL 37 HN VAL 37 -5.065 -11.389 -0.061 1007 HA VAL 37 HA VAL 37 -5.452 -9.412 1.827 1008 HB VAL 37 HB VAL 37 -3.192 -9.780 2.627 1009 HG11 VAL 37 HG11 VAL 37 -3.269 -12.254 2.876 1010 HG12 VAL 37 HG12 VAL 37 -4.550 -12.309 1.659 1011 HG13 VAL 37 HG13 VAL 37 -4.819 -11.473 3.194 1012 HG21 VAL 37 HG21 VAL 37 -1.717 -11.389 1.356 1013 HG22 VAL 37 HG22 VAL 37 -1.881 -9.771 0.674 1014 HG23 VAL 37 HG23 VAL 37 -2.776 -11.116 -0.029 1015 H ILE 38 HN ILE 38 -3.702 -9.225 -1.233 1016 HA ILE 38 HA ILE 38 -2.722 -6.617 -0.486 1017 HB ILE 38 HB ILE 38 -1.597 -8.482 -2.099 1018 HG12 ILE 38 HG12 ILE 38 -1.143 -5.525 -2.412 1019 HG13 ILE 38 HG11 ILE 38 -0.686 -6.390 -0.953 1020 HG21 ILE 38 HG21 ILE 38 -1.642 -7.729 -4.382 1021 HG22 ILE 38 HG22 ILE 38 -2.670 -6.362 -3.954 1022 HG23 ILE 38 HG23 ILE 38 -3.308 -8.006 -3.860 1023 HD11 ILE 38 HD11 ILE 38 0.665 -7.865 -2.582 1024 HD12 ILE 38 HD12 ILE 38 1.258 -6.258 -2.166 1025 HD13 ILE 38 HD13 ILE 38 0.443 -6.513 -3.697 1026 H VAL 39 HN VAL 39 -5.320 -7.918 -2.483 1027 HA VAL 39 HA VAL 39 -5.947 -5.360 -3.559 1028 HB VAL 39 HB VAL 39 -7.932 -6.178 -4.351 1029 HG11 VAL 39 HG11 VAL 39 -6.035 -8.500 -4.164 1030 HG12 VAL 39 HG12 VAL 39 -6.090 -7.258 -5.415 1031 HG13 VAL 39 HG13 VAL 39 -7.409 -8.425 -5.262 1032 HG21 VAL 39 HG21 VAL 39 -9.129 -8.158 -3.597 1033 HG22 VAL 39 HG22 VAL 39 -8.929 -7.008 -2.275 1034 HG23 VAL 39 HG23 VAL 39 -7.903 -8.440 -2.359 1035 H GLU 40 HN GLU 40 -7.241 -7.168 -0.802 1036 HA GLU 40 HA GLU 40 -8.872 -5.202 0.243 1037 HB2 GLU 40 HB2 GLU 40 -7.417 -7.499 1.512 1038 HB3 GLU 40 HB1 GLU 40 -8.590 -6.522 2.367 1039 HG2 GLU 40 HG2 GLU 40 -10.340 -7.228 1.037 1040 HG3 GLU 40 HG1 GLU 40 -9.293 -7.801 -0.233 1041 H LEU 41 HN LEU 41 -5.415 -5.602 0.492 1042 HA LEU 41 HA LEU 41 -5.227 -3.631 2.604 1043 HB2 LEU 41 HB2 LEU 41 -3.566 -5.659 1.698 1044 HB3 LEU 41 HB1 LEU 41 -2.735 -4.183 1.245 1045 HG LEU 41 HG LEU 41 -1.875 -4.624 3.343 1046 HD11 LEU 41 HD11 LEU 41 -4.227 -2.956 4.158 1047 HD12 LEU 41 HD12 LEU 41 -2.966 -2.343 3.093 1048 HD13 LEU 41 HD13 LEU 41 -2.558 -2.873 4.719 1049 HD21 LEU 41 HD21 LEU 41 -4.640 -5.345 4.284 1050 HD22 LEU 41 HD22 LEU 41 -3.163 -5.398 5.245 1051 HD23 LEU 41 HD23 LEU 41 -3.358 -6.484 3.871 1052 H MET 42 HN MET 42 -4.210 -3.798 -0.818 1053 HA MET 42 HA MET 42 -3.230 -1.137 -0.901 1054 HB2 MET 42 HB2 MET 42 -4.161 -2.904 -3.163 1055 HB3 MET 42 HB1 MET 42 -3.251 -1.401 -3.361 1056 HG2 MET 42 HG2 MET 42 -2.349 -3.964 -2.086 1057 HG3 MET 42 HG1 MET 42 -1.734 -3.191 -3.539 1058 HE1 MET 42 HE1 MET 42 0.738 -3.389 -2.743 1059 HE2 MET 42 HE2 MET 42 0.147 -4.251 -1.318 1060 HE3 MET 42 HE3 MET 42 1.284 -2.912 -1.131 1061 H ALA 43 HN ALA 43 -6.326 -2.560 -1.153 1062 HA ALA 43 HA ALA 43 -7.892 -0.642 -2.287 1063 HB1 ALA 43 HB1 ALA 43 -8.836 -2.653 -1.457 1064 HB2 ALA 43 HB2 ALA 43 -9.594 -1.322 -0.577 1065 HB3 ALA 43 HB3 ALA 43 -8.329 -2.288 0.191 1066 H TYR 44 HN TYR 44 -6.125 -0.535 0.727 1067 HA TYR 44 HA TYR 44 -7.213 2.136 1.342 1068 HB2 TYR 44 HB2 TYR 44 -7.320 0.628 3.224 1069 HB3 TYR 44 HB1 TYR 44 -5.655 0.141 2.965 1070 HD1 TYR 44 HD1 TYR 44 -7.858 2.564 4.511 1071 HD2 TYR 44 HD2 TYR 44 -3.804 1.693 3.603 1072 HE1 TYR 44 HE1 TYR 44 -7.140 4.208 6.174 1073 HE2 TYR 44 HE2 TYR 44 -3.071 3.341 5.269 1074 HH TYR 44 HH TYR 44 -5.065 4.604 7.610 1075 H GLU 45 HN GLU 45 -4.131 0.448 1.748 1076 HA GLU 45 HA GLU 45 -2.447 2.547 1.873 1077 HB2 GLU 45 HB2 GLU 45 -1.858 -0.060 0.501 1078 HB3 GLU 45 HB1 GLU 45 -0.699 0.986 1.308 1079 HG2 GLU 45 HG2 GLU 45 -2.983 -0.409 2.687 1080 HG3 GLU 45 HG1 GLU 45 -1.345 -1.035 2.614 1081 H ASN 46 HN ASN 46 -3.907 1.287 -1.038 1082 HA ASN 46 HA ASN 46 -2.129 2.925 -2.684 1083 HB2 ASN 46 HB2 ASN 46 -3.628 0.397 -3.129 1084 HB3 ASN 46 HB1 ASN 46 -3.368 1.459 -4.504 1085 HD21 ASN 46 HD21 ASN 46 -1.873 0.134 -5.572 1086 HD22 ASN 46 HD22 ASN 46 -0.303 -0.153 -4.961 1087 H ALA 47 HN ALA 47 -5.277 2.741 -1.463 1088 HA ALA 47 HA ALA 47 -6.730 3.823 -3.622 1089 HB1 ALA 47 HB1 ALA 47 -7.828 2.722 -1.743 1090 HB2 ALA 47 HB2 ALA 47 -8.450 4.355 -1.988 1091 HB3 ALA 47 HB3 ALA 47 -7.317 4.031 -0.678 1092 H ASN 48 HN ASN 48 -7.965 5.925 -3.212 1093 HA ASN 48 HA ASN 48 -6.276 8.150 -3.271 1094 HB2 ASN 48 HB2 ASN 48 -9.191 7.675 -2.938 1095 HB3 ASN 48 HB1 ASN 48 -8.575 9.262 -2.491 1096 HD21 ASN 48 HD21 ASN 48 -10.269 8.160 -4.730 1097 HD22 ASN 48 HD22 ASN 48 -9.538 8.825 -6.153 1098 HA PRO 49 HA PRO 49 -5.088 8.805 0.920 1099 HB2 PRO 49 HB2 PRO 49 -5.334 11.579 0.945 1100 HB3 PRO 49 HB1 PRO 49 -3.911 10.681 0.420 1101 HG2 PRO 49 HG2 PRO 49 -6.091 11.906 -1.199 1102 HG3 PRO 49 HG1 PRO 49 -4.359 11.786 -1.553 1103 HD2 PRO 49 HD2 PRO 49 -6.160 10.187 -2.745 1104 HD3 PRO 49 HD1 PRO 49 -4.540 9.599 -2.307 1105 H GLU 50 HN GLU 50 -7.971 10.309 -0.315 1106 HA GLU 50 HA GLU 50 -9.265 10.656 2.225 1107 HB2 GLU 50 HB2 GLU 50 -10.995 11.668 0.970 1108 HB3 GLU 50 HB1 GLU 50 -9.513 12.083 0.117 1109 HG2 GLU 50 HG2 GLU 50 -10.651 9.604 -0.762 1110 HG3 GLU 50 HG1 GLU 50 -11.706 10.992 -1.034 1111 H CYS 51 HN CYS 51 -9.108 8.296 -0.317 1112 HA CYS 51 HA CYS 51 -11.589 7.059 0.414 1113 HB2 CYS 51 HB2 CYS 51 -9.426 6.253 -1.536 1114 HB3 CYS 51 HB1 CYS 51 -10.899 5.323 -1.246 1115 HG CYS 51 HG CYS 51 -11.352 8.577 -1.978 1116 H GLN 52 HN GLN 52 -8.170 6.485 0.847 1117 HA GLN 52 HA GLN 52 -8.564 4.158 2.459 1118 HB2 GLN 52 HB2 GLN 52 -6.233 4.393 3.041 1119 HB3 GLN 52 HB1 GLN 52 -6.422 4.638 1.311 1120 HG2 GLN 52 HG2 GLN 52 -6.375 7.100 1.747 1121 HG3 GLN 52 HG1 GLN 52 -5.955 6.728 3.421 1122 HE21 GLN 52 HE21 GLN 52 -4.515 4.342 2.534 1123 HE22 GLN 52 HE22 GLN 52 -3.031 4.885 1.879 1124 H SER 53 HN SER 53 -8.520 7.547 2.809 1125 HA SER 53 HA SER 53 -8.513 7.705 5.625 1126 HB2 SER 53 HB2 SER 53 -8.651 9.960 5.241 1127 HB3 SER 53 HB1 SER 53 -8.381 9.494 3.550 1128 HG SER 53 HG SER 53 -10.773 9.346 3.475 1129 H ALA 54 HN ALA 54 -10.883 6.956 3.244 1130 HA ALA 54 HA ALA 54 -13.064 7.024 5.139 1131 HB1 ALA 54 HB1 ALA 54 -14.283 5.890 3.247 1132 HB2 ALA 54 HB2 ALA 54 -12.786 6.046 2.315 1133 HB3 ALA 54 HB3 ALA 54 -13.625 7.486 2.890 1134 H ILE 55 HN ILE 55 -10.615 4.895 4.153 1135 HA ILE 55 HA ILE 55 -12.057 2.540 4.946 1136 HB ILE 55 HB ILE 55 -9.410 2.970 3.645 1137 HG12 ILE 55 HG12 ILE 55 -11.676 1.343 2.613 1138 HG13 ILE 55 HG11 ILE 55 -11.802 3.109 2.590 1139 HG21 ILE 55 HG21 ILE 55 -10.634 0.366 4.522 1140 HG22 ILE 55 HG22 ILE 55 -9.132 1.071 5.117 1141 HG23 ILE 55 HG23 ILE 55 -9.249 0.523 3.444 1142 HD11 ILE 55 HD11 ILE 55 -9.559 1.525 1.366 1143 HD12 ILE 55 HD12 ILE 55 -9.821 3.276 1.266 1144 HD13 ILE 55 HD13 ILE 55 -10.968 2.162 0.499 1145 H LYS 56 HN LYS 56 -9.358 4.469 6.301 1146 HA LYS 56 HA LYS 56 -8.159 2.559 7.823 1147 HB2 LYS 56 HB2 LYS 56 -7.503 4.174 9.521 1148 HB3 LYS 56 HB1 LYS 56 -7.196 4.713 7.890 1149 HG2 LYS 56 HG2 LYS 56 -9.703 5.464 9.143 1150 HG3 LYS 56 HG1 LYS 56 -8.246 6.285 9.675 1151 HD2 LYS 56 HD2 LYS 56 -7.923 6.431 7.064 1152 HD3 LYS 56 HD1 LYS 56 -9.686 6.415 7.146 1153 HE2 LYS 56 HE2 LYS 56 -8.936 8.674 7.273 1154 HE3 LYS 56 HE1 LYS 56 -9.585 8.214 8.831 1155 HZ1 LYS 56 HZ1 LYS 56 -6.690 8.183 8.182 1156 HZ2 LYS 56 HZ2 LYS 56 -7.403 7.997 9.705 1157 HZ3 LYS 56 HZ3 LYS 56 -7.469 9.491 8.919 1158 HA PRO 57 HA PRO 57 -11.641 2.767 11.310 1159 HB2 PRO 57 HB2 PRO 57 -14.106 2.724 10.123 1160 HB3 PRO 57 HB1 PRO 57 -13.351 4.197 10.752 1161 HG2 PRO 57 HG2 PRO 57 -13.274 3.103 7.950 1162 HG3 PRO 57 HG1 PRO 57 -13.753 4.736 8.478 1163 HD2 PRO 57 HD2 PRO 57 -11.312 4.375 7.580 1164 HD3 PRO 57 HD1 PRO 57 -11.517 5.264 9.098 1165 H LEU 58 HN LEU 58 -11.848 1.374 8.087 1166 HA LEU 58 HA LEU 58 -12.884 -1.162 9.143 1167 HB2 LEU 58 HB2 LEU 58 -12.386 -0.807 6.256 1168 HB3 LEU 58 HB1 LEU 58 -13.713 -1.636 7.051 1169 HG LEU 58 HG LEU 58 -13.418 1.360 6.767 1170 HD11 LEU 58 HD11 LEU 58 -13.766 0.332 4.621 1171 HD12 LEU 58 HD12 LEU 58 -15.258 1.121 5.138 1172 HD13 LEU 58 HD13 LEU 58 -15.097 -0.630 5.260 1173 HD21 LEU 58 HD21 LEU 58 -14.690 0.735 8.745 1174 HD22 LEU 58 HD22 LEU 58 -15.728 -0.306 7.767 1175 HD23 LEU 58 HD23 LEU 58 -15.742 1.441 7.519 1176 H LYS 59 HN LYS 59 -10.126 0.458 8.079 1177 HA LYS 59 HA LYS 59 -8.597 -1.490 6.859 1178 HB2 LYS 59 HB2 LYS 59 -7.810 0.786 7.059 1179 HB3 LYS 59 HB1 LYS 59 -7.712 0.627 8.805 1180 HG2 LYS 59 HG2 LYS 59 -5.544 0.213 8.401 1181 HG3 LYS 59 HG1 LYS 59 -6.139 -1.401 8.046 1182 HD2 LYS 59 HD2 LYS 59 -5.689 0.770 6.033 1183 HD3 LYS 59 HD1 LYS 59 -4.610 -0.606 6.303 1184 HE2 LYS 59 HE2 LYS 59 -7.481 -0.720 5.360 1185 HE3 LYS 59 HE1 LYS 59 -6.054 -0.970 4.367 1186 HZ1 LYS 59 HZ1 LYS 59 -6.931 -2.681 6.614 1187 HZ2 LYS 59 HZ2 LYS 59 -5.522 -2.917 5.721 1188 HZ3 LYS 59 HZ3 LYS 59 -7.035 -3.065 4.974 1189 H GLY 60 HN GLY 60 -8.346 -3.505 7.490 1190 HA2 GLY 60 HA3 GLY 60 -7.259 -5.121 8.829 1191 HA3 GLY 60 HA2 GLY 60 -7.338 -4.009 10.190 1192 H LYS 61 HN LYS 61 -10.234 -3.446 9.433 1193 HA LYS 61 HA LYS 61 -11.309 -5.790 10.843 1194 HB2 LYS 61 HB2 LYS 61 -12.952 -3.347 10.444 1195 HB3 LYS 61 HB1 LYS 61 -12.804 -4.378 11.859 1196 HG2 LYS 61 HG2 LYS 61 -10.739 -2.389 10.976 1197 HG3 LYS 61 HG1 LYS 61 -11.962 -2.081 12.195 1198 HD2 LYS 61 HD2 LYS 61 -9.895 -4.269 12.360 1199 HD3 LYS 61 HD1 LYS 61 -9.742 -2.689 13.132 1200 HE2 LYS 61 HE2 LYS 61 -11.840 -3.141 14.359 1201 HE3 LYS 61 HE1 LYS 61 -11.864 -4.757 13.657 1202 HZ1 LYS 61 HZ1 LYS 61 -9.732 -5.202 14.727 1203 HZ2 LYS 61 HZ2 LYS 61 -10.918 -4.800 15.861 1204 HZ3 LYS 61 HZ3 LYS 61 -9.746 -3.660 15.427 1205 H VAL 62 HN VAL 62 -12.053 -7.215 9.400 1206 HA VAL 62 HA VAL 62 -14.047 -6.225 7.482 1207 HB VAL 62 HB VAL 62 -12.152 -7.140 6.248 1208 HG11 VAL 62 HG11 VAL 62 -11.475 -9.478 6.436 1209 HG12 VAL 62 HG12 VAL 62 -12.587 -9.690 7.791 1210 HG13 VAL 62 HG13 VAL 62 -11.208 -8.601 7.945 1211 HG21 VAL 62 HG21 VAL 62 -14.280 -7.509 5.236 1212 HG22 VAL 62 HG22 VAL 62 -14.560 -8.942 6.224 1213 HG23 VAL 62 HG23 VAL 62 -13.299 -8.954 4.992 1214 HA PRO 63 HA PRO 63 -17.106 -8.833 9.622 1215 HB2 PRO 63 HB2 PRO 63 -17.690 -9.557 6.786 1216 HB3 PRO 63 HB1 PRO 63 -18.808 -9.174 8.081 1217 HG2 PRO 63 HG2 PRO 63 -18.252 -7.371 6.218 1218 HG3 PRO 63 HG1 PRO 63 -18.427 -6.887 7.912 1219 HD2 PRO 63 HD2 PRO 63 -15.972 -7.133 6.265 1220 HD3 PRO 63 HD1 PRO 63 -16.317 -6.048 7.626 1221 H ALA 64 HN ALA 64 -17.127 -10.970 10.205 1222 HA ALA 64 HA ALA 64 -14.778 -12.419 9.764 1223 HB1 ALA 64 HB1 ALA 64 -16.140 -12.593 11.797 1224 HB2 ALA 64 HB2 ALA 64 -15.796 -14.172 11.090 1225 HB3 ALA 64 HB3 ALA 64 -17.385 -13.437 10.878 1226 H GLY 65 HN GLY 65 -14.352 -12.960 7.683 1227 HA2 GLY 65 HA3 GLY 65 -14.300 -14.854 6.246 1228 HA3 GLY 65 HA2 GLY 65 -15.992 -15.143 6.616 1229 H SER 66 HN SER 66 -15.968 -11.939 6.171 1230 HA SER 66 HA SER 66 -16.922 -12.277 3.438 1231 HB2 SER 66 HB2 SER 66 -17.055 -9.810 5.164 1232 HB3 SER 66 HB1 SER 66 -18.020 -10.174 3.737 1233 HG SER 66 HG SER 66 -18.441 -12.194 5.275 1234 H ASP 67 HN ASP 67 -16.652 -10.058 2.196 1235 HA ASP 67 HA ASP 67 -13.842 -9.882 1.514 1236 HB2 ASP 67 HB2 ASP 67 -15.857 -9.947 -0.090 1237 HB3 ASP 67 HB1 ASP 67 -16.143 -8.295 0.399 1238 H VAL 68 HN VAL 68 -12.479 -8.159 2.103 1239 HA VAL 68 HA VAL 68 -13.683 -6.112 3.754 1240 HB VAL 68 HB VAL 68 -11.679 -5.609 4.570 1241 HG11 VAL 68 HG11 VAL 68 -10.748 -7.994 3.006 1242 HG12 VAL 68 HG12 VAL 68 -11.538 -8.021 4.580 1243 HG13 VAL 68 HG13 VAL 68 -9.944 -7.288 4.407 1244 HG21 VAL 68 HG21 VAL 68 -10.612 -5.617 1.758 1245 HG22 VAL 68 HG22 VAL 68 -9.639 -5.248 3.182 1246 HG23 VAL 68 HG23 VAL 68 -11.018 -4.225 2.765 1247 H ILE 69 HN ILE 69 -12.613 -6.523 0.508 1248 HA ILE 69 HA ILE 69 -12.356 -3.872 -0.280 1249 HB ILE 69 HB ILE 69 -13.224 -6.299 -1.821 1250 HG12 ILE 69 HG12 ILE 69 -10.966 -6.546 -1.230 1251 HG13 ILE 69 HG11 ILE 69 -10.900 -5.856 -2.844 1252 HG21 ILE 69 HG21 ILE 69 -12.716 -3.500 -2.840 1253 HG22 ILE 69 HG22 ILE 69 -14.196 -4.449 -2.978 1254 HG23 ILE 69 HG23 ILE 69 -12.755 -4.928 -3.875 1255 HD11 ILE 69 HD11 ILE 69 -10.585 -3.632 -1.829 1256 HD12 ILE 69 HD12 ILE 69 -9.286 -4.778 -1.487 1257 HD13 ILE 69 HD13 ILE 69 -10.500 -4.417 -0.253 1258 H SER 70 HN SER 70 -15.108 -6.003 -0.363 1259 HA SER 70 HA SER 70 -17.106 -4.428 -1.294 1260 HB2 SER 70 HB2 SER 70 -17.442 -6.753 -0.661 1261 HB3 SER 70 HB1 SER 70 -17.200 -6.367 1.038 1262 HG SER 70 HG SER 70 -19.273 -5.234 -0.544 1263 H GLU 71 HN GLU 71 -15.630 -4.223 1.898 1264 HA GLU 71 HA GLU 71 -17.499 -2.251 2.885 1265 HB2 GLU 71 HB2 GLU 71 -14.891 -3.037 4.145 1266 HB3 GLU 71 HB1 GLU 71 -16.371 -2.500 4.932 1267 HG2 GLU 71 HG2 GLU 71 -16.539 -4.982 3.366 1268 HG3 GLU 71 HG1 GLU 71 -15.590 -5.044 4.844 1269 H TYR 72 HN TYR 72 -14.344 -2.436 1.524 1270 HA TYR 72 HA TYR 72 -13.501 0.156 2.366 1271 HB2 TYR 72 HB2 TYR 72 -12.393 -1.947 0.519 1272 HB3 TYR 72 HB1 TYR 72 -11.644 -0.362 0.655 1273 HD1 TYR 72 HD1 TYR 72 -13.170 -1.716 3.644 1274 HD2 TYR 72 HD2 TYR 72 -9.583 -1.519 1.385 1275 HE1 TYR 72 HE1 TYR 72 -11.900 -2.486 5.590 1276 HE2 TYR 72 HE2 TYR 72 -8.303 -2.308 3.329 1277 HH TYR 72 HH TYR 72 -9.863 -3.549 6.147 1278 H VAL 73 HN VAL 73 -14.842 -1.315 -0.511 1279 HA VAL 73 HA VAL 73 -14.831 1.059 -2.070 1280 HB VAL 73 HB VAL 73 -16.053 0.012 -3.703 1281 HG11 VAL 73 HG11 VAL 73 -14.032 -1.210 -3.471 1282 HG12 VAL 73 HG12 VAL 73 -15.327 -2.316 -3.920 1283 HG13 VAL 73 HG13 VAL 73 -14.754 -2.258 -2.253 1284 HG21 VAL 73 HG21 VAL 73 -17.790 -1.481 -3.523 1285 HG22 VAL 73 HG22 VAL 73 -17.958 -0.515 -2.049 1286 HG23 VAL 73 HG23 VAL 73 -17.220 -2.117 -1.974 1287 H LYS 74 HN LYS 74 -16.929 -0.463 0.232 1288 HA LYS 74 HA LYS 74 -19.191 1.216 0.008 1289 HB2 LYS 74 HB2 LYS 74 -18.443 -0.988 1.514 1290 HB3 LYS 74 HB1 LYS 74 -18.535 0.306 2.701 1291 HG2 LYS 74 HG2 LYS 74 -20.676 -0.389 2.829 1292 HG3 LYS 74 HG1 LYS 74 -20.862 0.731 1.479 1293 HD2 LYS 74 HD2 LYS 74 -20.287 -2.208 1.141 1294 HD3 LYS 74 HD1 LYS 74 -21.916 -1.534 1.162 1295 HE2 LYS 74 HE2 LYS 74 -19.758 -0.668 -0.750 1296 HE3 LYS 74 HE1 LYS 74 -20.956 -1.907 -1.121 1297 HZ1 LYS 74 HZ1 LYS 74 -21.608 0.895 -0.383 1298 HZ2 LYS 74 HZ2 LYS 74 -22.700 -0.300 -0.873 1299 HZ3 LYS 74 HZ3 LYS 74 -21.563 0.304 -1.966 1300 H ALA 75 HN ALA 75 -16.125 1.407 1.631 1301 HA ALA 75 HA ALA 75 -16.591 3.648 3.270 1302 HB1 ALA 75 HB1 ALA 75 -14.151 3.883 3.290 1303 HB2 ALA 75 HB2 ALA 75 -14.036 2.738 1.951 1304 HB3 ALA 75 HB3 ALA 75 -14.647 2.207 3.516 1305 H CYS 76 HN CYS 76 -15.309 3.397 -0.038 1306 HA CYS 76 HA CYS 76 -15.429 6.305 -0.299 1307 HB2 CYS 76 HB2 CYS 76 -13.476 5.387 -1.196 1308 HB3 CYS 76 HB1 CYS 76 -14.332 4.130 -2.067 1309 HG CYS 76 HG CYS 76 -15.575 6.262 -3.704 1310 H ASP 77 HN ASP 77 -17.630 4.009 -0.439 1311 HA ASP 77 HA ASP 77 -19.045 4.447 -2.801 1312 HB2 ASP 77 HB2 ASP 77 -19.654 2.598 -1.476 1313 HB3 ASP 77 HB1 ASP 77 -19.869 3.570 -0.029 1314 H GLY 78 HN GLY 78 -18.491 6.489 -0.134 1315 HA2 GLY 78 HA3 GLY 78 -20.456 8.402 -1.225 1316 HA3 GLY 78 HA2 GLY 78 -20.011 8.341 0.473 1317 H ILE 79 HN ILE 79 -17.418 7.879 -1.804 1318 HA ILE 79 HA ILE 79 -16.438 10.555 -1.185 1319 HB ILE 79 HB ILE 79 -15.147 8.043 -2.140 1320 HG12 ILE 79 HG12 ILE 79 -14.829 9.781 0.309 1321 HG13 ILE 79 HG11 ILE 79 -15.617 8.212 0.235 1322 HG21 ILE 79 HG21 ILE 79 -14.097 9.885 -3.360 1323 HG22 ILE 79 HG22 ILE 79 -12.994 9.163 -2.189 1324 HG23 ILE 79 HG23 ILE 79 -13.775 10.706 -1.833 1325 HD11 ILE 79 HD11 ILE 79 -12.718 8.673 -0.359 1326 HD12 ILE 79 HD12 ILE 79 -13.545 7.125 -0.192 1327 HD13 ILE 79 HD13 ILE 79 -13.350 8.177 1.206 1328 H GLY 80 HN GLY 80 -18.024 9.062 -3.716 1329 HA2 GLY 80 HA3 GLY 80 -16.342 9.830 -5.874 1330 HA3 GLY 80 HA2 GLY 80 -17.959 9.206 -5.999 1331 H GLY 81 HN GLY 81 -17.886 12.009 -4.043 1332 HA2 GLY 81 HA3 GLY 81 -17.266 14.213 -5.141 1333 HA3 GLY 81 HA2 GLY 81 -18.374 13.714 -6.409 1334 H ALA 82 HN ALA 82 -18.238 14.295 -2.922 1335 HA ALA 82 HA ALA 82 -20.151 16.337 -2.954 1336 HB1 ALA 82 HB1 ALA 82 -21.749 14.551 -3.399 1337 HB2 ALA 82 HB2 ALA 82 -22.021 15.259 -1.806 1338 HB3 ALA 82 HB3 ALA 82 -21.212 13.699 -1.953 1339 H MET 83 HN MET 83 -20.306 13.918 -0.432 1340 HA MET 83 HA MET 83 -19.380 15.691 1.580 1341 HB2 MET 83 HB2 MET 83 -19.642 12.677 1.618 1342 HB3 MET 83 HB1 MET 83 -19.354 13.678 3.033 1343 HG2 MET 83 HG2 MET 83 -21.505 14.824 2.599 1344 HG3 MET 83 HG1 MET 83 -21.796 13.694 1.277 1345 HE1 MET 83 HE1 MET 83 -21.992 11.035 1.648 1346 HE2 MET 83 HE2 MET 83 -21.949 10.271 3.236 1347 HE3 MET 83 HE3 MET 83 -20.493 11.015 2.577 1348 H HIS 84 HN HIS 84 -17.808 13.676 -0.652 1349 HA HIS 84 HA HIS 84 -15.371 13.046 0.445 1350 HB2 HIS 84 HB2 HIS 84 -15.846 12.340 -1.759 1351 HB3 HIS 84 HB1 HIS 84 -16.194 13.971 -2.305 1352 HD1 HIS 84 HD1 HIS 84 -14.542 14.288 -4.119 1353 HD2 HIS 84 HD2 HIS 84 -12.807 12.693 -0.701 1354 HE1 HIS 84 HE1 HIS 84 -12.087 14.193 -4.595 1355 HE2 HIS 84 HE2 HIS 84 -11.130 12.901 -2.667 1356 H LYS 85 HN LYS 85 -16.536 16.223 -0.550 1357 HA LYS 85 HA LYS 85 -13.893 17.386 -0.357 1358 HB2 LYS 85 HB2 LYS 85 -16.567 18.746 -0.735 1359 HB3 LYS 85 HB1 LYS 85 -14.983 19.468 -0.991 1360 HG2 LYS 85 HG2 LYS 85 -16.225 17.226 -2.582 1361 HG3 LYS 85 HG1 LYS 85 -15.934 18.883 -3.118 1362 HD2 LYS 85 HD2 LYS 85 -13.533 18.545 -2.921 1363 HD3 LYS 85 HD1 LYS 85 -13.799 16.909 -2.318 1364 HE2 LYS 85 HE2 LYS 85 -13.224 16.774 -4.641 1365 HE3 LYS 85 HE1 LYS 85 -14.929 16.355 -4.455 1366 HZ1 LYS 85 HZ1 LYS 85 -13.929 19.030 -5.280 1367 HZ2 LYS 85 HZ2 LYS 85 -15.547 18.542 -5.201 1368 HZ3 LYS 85 HZ3 LYS 85 -14.510 17.849 -6.340 1369 H ALA 86 HN ALA 86 -16.624 16.920 1.675 1370 HA ALA 86 HA ALA 86 -15.781 18.842 3.672 1371 HB1 ALA 86 HB1 ALA 86 -17.648 17.817 4.993 1372 HB2 ALA 86 HB2 ALA 86 -17.957 16.755 3.615 1373 HB3 ALA 86 HB3 ALA 86 -18.135 18.501 3.444 1374 H MET 87 HN MET 87 -15.754 15.405 3.121 1375 HA MET 87 HA MET 87 -14.645 14.775 5.717 1376 HB2 MET 87 HB2 MET 87 -15.263 13.049 3.301 1377 HB3 MET 87 HB1 MET 87 -14.797 12.445 4.893 1378 HG2 MET 87 HG2 MET 87 -16.797 13.265 5.880 1379 HG3 MET 87 HG1 MET 87 -17.214 14.158 4.426 1380 HE1 MET 87 HE1 MET 87 -16.834 10.576 6.023 1381 HE2 MET 87 HE2 MET 87 -15.775 10.488 4.614 1382 HE3 MET 87 HE3 MET 87 -17.263 9.542 4.661 1383 H LEU 88 HN LEU 88 -13.440 15.609 2.676 1384 HA LEU 88 HA LEU 88 -11.170 14.125 2.352 1385 HB2 LEU 88 HB2 LEU 88 -12.173 16.117 1.009 1386 HB3 LEU 88 HB1 LEU 88 -11.147 17.112 2.014 1387 HG LEU 88 HG LEU 88 -9.452 16.783 0.612 1388 HD11 LEU 88 HD11 LEU 88 -8.859 14.818 1.958 1389 HD12 LEU 88 HD12 LEU 88 -8.440 14.600 0.257 1390 HD13 LEU 88 HD13 LEU 88 -9.871 13.814 0.920 1391 HD21 LEU 88 HD21 LEU 88 -9.858 15.552 -1.497 1392 HD22 LEU 88 HD22 LEU 88 -11.132 16.706 -1.095 1393 HD23 LEU 88 HD23 LEU 88 -11.386 14.983 -0.819 1394 H MET 89 HN MET 89 -11.426 17.162 4.215 1395 HA MET 89 HA MET 89 -8.701 17.028 5.040 1396 HB2 MET 89 HB2 MET 89 -9.863 19.165 4.743 1397 HB3 MET 89 HB1 MET 89 -10.974 18.753 6.040 1398 HG2 MET 89 HG2 MET 89 -9.116 18.748 7.628 1399 HG3 MET 89 HG1 MET 89 -8.009 19.176 6.325 1400 HE1 MET 89 HE1 MET 89 -9.200 22.755 5.347 1401 HE2 MET 89 HE2 MET 89 -9.783 21.255 4.630 1402 HE3 MET 89 HE3 MET 89 -8.073 21.439 5.016 1403 H ALA 90 HN ALA 90 -11.632 15.679 6.248 1404 HA ALA 90 HA ALA 90 -10.731 15.734 9.011 1405 HB1 ALA 90 HB1 ALA 90 -13.229 14.534 7.827 1406 HB2 ALA 90 HB2 ALA 90 -13.075 16.204 8.372 1407 HB3 ALA 90 HB3 ALA 90 -12.923 14.881 9.532 1408 H GLN 91 HN GLN 91 -10.270 13.634 6.421 1409 HA GLN 91 HA GLN 91 -9.685 11.486 8.339 1410 HB2 GLN 91 HB2 GLN 91 -10.550 10.712 5.624 1411 HB3 GLN 91 HB1 GLN 91 -10.717 9.855 7.147 1412 HG2 GLN 91 HG2 GLN 91 -12.548 11.186 7.783 1413 HG3 GLN 91 HG1 GLN 91 -12.271 12.300 6.446 1414 HE21 GLN 91 HE21 GLN 91 -12.702 11.661 4.360 1415 HE22 GLN 91 HE22 GLN 91 -13.736 10.337 4.006 1416 H LEU 92 HN LEU 92 -9.050 12.852 5.119 1417 HA LEU 92 HA LEU 92 -6.770 11.538 4.321 1418 HB2 LEU 92 HB2 LEU 92 -8.048 13.685 3.417 1419 HB3 LEU 92 HB1 LEU 92 -6.800 14.533 4.295 1420 HG LEU 92 HG LEU 92 -6.575 12.864 1.827 1421 HD11 LEU 92 HD11 LEU 92 -5.524 15.551 2.667 1422 HD12 LEU 92 HD12 LEU 92 -6.882 15.237 1.589 1423 HD13 LEU 92 HD13 LEU 92 -5.247 14.798 1.097 1424 HD21 LEU 92 HD21 LEU 92 -4.123 12.900 2.038 1425 HD22 LEU 92 HD22 LEU 92 -4.882 11.903 3.279 1426 HD23 LEU 92 HD23 LEU 92 -4.285 13.513 3.683 1427 H GLU 93 HN GLU 93 -7.395 13.795 6.826 1428 HA GLU 93 HA GLU 93 -5.423 15.229 7.600 1429 HB2 GLU 93 HB2 GLU 93 -5.910 14.707 9.999 1430 HB3 GLU 93 HB1 GLU 93 -7.344 15.006 9.014 1431 HG2 GLU 93 HG2 GLU 93 -7.940 12.746 8.999 1432 HG3 GLU 93 HG1 GLU 93 -6.353 12.225 9.560 Start of MODEL 13 1 H2 PRO 1 HT1 PRO 1 -5.114 -4.144 13.459 2 H3 PRO 1 HT2 PRO 1 -5.594 -2.664 13.968 3 HA PRO 1 HA PRO 1 -6.326 -2.624 11.928 4 HB2 PRO 1 HB2 PRO 1 -4.315 -1.465 10.593 5 HB3 PRO 1 HB1 PRO 1 -5.096 -0.654 11.959 6 HG2 PRO 1 HG2 PRO 1 -2.435 -1.876 11.795 7 HG3 PRO 1 HG1 PRO 1 -3.062 -0.702 12.964 8 HD2 PRO 1 HD2 PRO 1 -2.814 -3.597 13.216 9 HD3 PRO 1 HD1 PRO 1 -3.231 -2.404 14.464 10 H SER 2 HN SER 2 -4.749 -2.636 9.489 11 HA SER 2 HA SER 2 -4.206 -5.352 8.918 12 HB2 SER 2 HB2 SER 2 -3.010 -2.884 7.646 13 HB3 SER 2 HB1 SER 2 -3.010 -4.502 6.970 14 HG SER 2 HG SER 2 -5.355 -4.396 7.058 15 H PHE 3 HN PHE 3 -1.929 -6.083 8.375 16 HA PHE 3 HA PHE 3 -0.274 -5.684 10.647 17 HB2 PHE 3 HB2 PHE 3 1.325 -6.818 8.715 18 HB3 PHE 3 HB1 PHE 3 0.332 -7.706 9.868 19 HD1 PHE 3 HD1 PHE 3 0.977 -6.889 6.468 20 HD2 PHE 3 HD2 PHE 3 -1.987 -8.434 9.098 21 HE1 PHE 3 HE1 PHE 3 -0.180 -7.891 4.576 22 HE2 PHE 3 HE2 PHE 3 -3.171 -9.434 7.187 23 HZ PHE 3 HZ PHE 3 -2.266 -9.162 4.911 24 H ASN 4 HN ASN 4 0.017 -4.780 7.245 25 HA ASN 4 HA ASN 4 2.658 -3.689 7.715 26 HB2 ASN 4 HB2 ASN 4 2.801 -3.572 5.321 27 HB3 ASN 4 HB1 ASN 4 2.039 -5.112 5.732 28 HD21 ASN 4 HD21 ASN 4 -0.020 -5.466 5.170 29 HD22 ASN 4 HD22 ASN 4 -0.968 -4.336 4.274 30 H THR 5 HN THR 5 -0.396 -2.413 7.938 31 HA THR 5 HA THR 5 -0.209 -0.145 6.310 32 HB THR 5 HB THR 5 -2.331 -0.911 7.040 33 HG1 THR 5 HG1 THR 5 -2.138 1.363 6.683 34 HG21 THR 5 HG21 THR 5 -1.181 -0.338 9.713 35 HG22 THR 5 HG22 THR 5 -1.776 -1.871 9.066 36 HG23 THR 5 HG23 THR 5 -2.912 -0.570 9.454 37 H VAL 6 HN VAL 6 1.605 -0.922 8.957 38 HA VAL 6 HA VAL 6 2.129 1.695 9.959 39 HB VAL 6 HB VAL 6 3.866 0.754 11.207 40 HG11 VAL 6 HG11 VAL 6 1.928 -1.502 10.761 41 HG12 VAL 6 HG12 VAL 6 1.745 -0.170 11.904 42 HG13 VAL 6 HG13 VAL 6 3.032 -1.356 12.129 43 HG21 VAL 6 HG21 VAL 6 5.143 -1.202 10.670 44 HG22 VAL 6 HG22 VAL 6 5.059 -0.200 9.212 45 HG23 VAL 6 HG23 VAL 6 4.030 -1.628 9.363 46 H ARG 7 HN ARG 7 3.637 3.198 9.133 47 HA ARG 7 HA ARG 7 5.428 2.254 7.116 48 HB2 ARG 7 HB2 ARG 7 4.484 3.793 5.359 49 HB3 ARG 7 HB1 ARG 7 3.702 2.271 5.711 50 HG2 ARG 7 HG2 ARG 7 2.429 4.106 7.343 51 HG3 ARG 7 HG1 ARG 7 2.637 4.902 5.780 52 HD2 ARG 7 HD2 ARG 7 1.663 2.949 4.663 53 HD3 ARG 7 HD1 ARG 7 1.387 2.187 6.239 54 HE ARG 7 HE ARG 7 -0.060 4.186 6.713 55 HH11 ARG 7 HH11 ARG 7 0.443 3.001 3.468 56 HH12 ARG 7 HH12 ARG 7 -0.928 3.821 2.813 57 HH21 ARG 7 HH21 ARG 7 -1.877 5.284 5.861 58 HH22 ARG 7 HH22 ARG 7 -2.259 5.120 4.178 59 H GLN 8 HN GLN 8 6.727 3.753 6.126 60 HA GLN 8 HA GLN 8 8.307 5.239 7.664 61 HB2 GLN 8 HB2 GLN 8 8.024 4.735 4.936 62 HB3 GLN 8 HB1 GLN 8 8.126 6.488 5.048 63 HG2 GLN 8 HG2 GLN 8 10.206 6.284 6.303 64 HG3 GLN 8 HG1 GLN 8 10.101 4.526 6.195 65 HE21 GLN 8 HE21 GLN 8 12.192 6.240 5.248 66 HE22 GLN 8 HE22 GLN 8 12.286 6.014 3.524 67 H GLY 9 HN GLY 9 7.774 6.761 9.053 68 HA2 GLY 9 HA3 GLY 9 5.880 8.859 8.412 69 HA3 GLY 9 HA2 GLY 9 6.820 8.698 9.888 70 H SER 10 HN SER 10 7.382 10.904 9.863 71 HA SER 10 HA SER 10 8.471 12.324 7.747 72 HB2 SER 10 HB2 SER 10 7.750 13.310 9.919 73 HB3 SER 10 HB1 SER 10 9.193 12.631 10.672 74 HG SER 10 HG SER 10 8.981 14.683 8.752 75 H LYS 11 HN LYS 11 9.985 11.422 6.527 76 HA LYS 11 HA LYS 11 11.762 10.176 5.859 77 HB2 LYS 11 HB2 LYS 11 13.877 11.196 6.337 78 HB3 LYS 11 HB1 LYS 11 12.689 12.447 6.072 79 HG2 LYS 11 HG2 LYS 11 12.609 12.963 8.358 80 HG3 LYS 11 HG1 LYS 11 13.498 11.520 8.814 81 HD2 LYS 11 HD2 LYS 11 15.472 12.430 7.613 82 HD3 LYS 11 HD1 LYS 11 14.561 13.911 7.313 83 HE2 LYS 11 HE2 LYS 11 14.348 14.295 9.701 84 HE3 LYS 11 HE1 LYS 11 15.174 12.776 10.040 85 HZ1 LYS 11 HZ1 LYS 11 16.377 15.108 8.646 86 HZ2 LYS 11 HZ2 LYS 11 17.165 13.657 9.014 87 HZ3 LYS 11 HZ3 LYS 11 16.651 14.678 10.258 88 H GLU 12 HN GLU 12 10.486 8.715 7.794 89 HA GLU 12 HA GLU 12 12.106 7.739 9.863 90 HB2 GLU 12 HB2 GLU 12 9.703 7.275 9.664 91 HB3 GLU 12 HB1 GLU 12 9.988 6.329 8.220 92 HG2 GLU 12 HG2 GLU 12 11.236 4.689 9.536 93 HG3 GLU 12 HG1 GLU 12 10.957 5.654 10.988 94 HA PRO 13 HA PRO 13 15.360 5.560 7.703 95 HB2 PRO 13 HB2 PRO 13 15.085 3.475 9.758 96 HB3 PRO 13 HB1 PRO 13 16.496 4.438 9.334 97 HG2 PRO 13 HG2 PRO 13 15.081 4.813 11.615 98 HG3 PRO 13 HG1 PRO 13 15.960 6.103 10.789 99 HD2 PRO 13 HD2 PRO 13 13.054 5.599 10.938 100 HD3 PRO 13 HD1 PRO 13 13.925 7.120 10.692 101 H TYR 14 HN TYR 14 15.071 4.276 5.995 102 HA TYR 14 HA TYR 14 12.498 3.195 5.650 103 HB2 TYR 14 HB2 TYR 14 13.681 4.258 3.806 104 HB3 TYR 14 HB1 TYR 14 14.878 2.970 3.819 105 HD1 TYR 14 HD1 TYR 14 13.897 0.571 3.628 106 HD2 TYR 14 HD2 TYR 14 11.888 4.065 2.334 107 HE1 TYR 14 HE1 TYR 14 12.537 -0.808 2.146 108 HE2 TYR 14 HE2 TYR 14 10.500 2.709 0.828 109 HH TYR 14 HH TYR 14 10.116 0.662 0.044 110 HA PRO 15 HA PRO 15 14.712 -1.152 5.350 111 HB2 PRO 15 HB2 PRO 15 16.885 -0.757 7.305 112 HB3 PRO 15 HB1 PRO 15 16.893 -1.644 5.782 113 HG2 PRO 15 HG2 PRO 15 18.122 0.715 6.065 114 HG3 PRO 15 HG1 PRO 15 17.393 0.214 4.545 115 HD2 PRO 15 HD2 PRO 15 16.444 2.199 6.539 116 HD3 PRO 15 HD1 PRO 15 16.219 2.158 4.785 117 H ASP 16 HN ASP 16 14.395 0.974 7.913 118 HA ASP 16 HA ASP 16 13.742 -1.019 9.909 119 HB2 ASP 16 HB2 ASP 16 14.115 1.955 9.978 120 HB3 ASP 16 HB1 ASP 16 13.301 1.138 11.303 121 H PHE 17 HN PHE 17 12.213 1.632 8.137 122 HA PHE 17 HA PHE 17 9.636 1.451 9.178 123 HB2 PHE 17 HB2 PHE 17 9.437 3.165 7.695 124 HB3 PHE 17 HB1 PHE 17 10.905 2.662 6.870 125 HD1 PHE 17 HD1 PHE 17 10.817 1.687 4.747 126 HD2 PHE 17 HD2 PHE 17 7.264 2.046 7.046 127 HE1 PHE 17 HE1 PHE 17 9.493 0.973 2.806 128 HE2 PHE 17 HE2 PHE 17 5.928 1.343 5.107 129 HZ PHE 17 HZ PHE 17 7.042 0.805 2.983 130 H VAL 18 HN VAL 18 11.192 -0.287 6.552 131 HA VAL 18 HA VAL 18 8.884 -1.878 5.999 132 HB VAL 18 HB VAL 18 10.235 -1.502 4.123 133 HG11 VAL 18 HG11 VAL 18 12.535 -2.425 5.821 134 HG12 VAL 18 HG12 VAL 18 12.290 -0.827 5.105 135 HG13 VAL 18 HG13 VAL 18 12.621 -2.223 4.066 136 HG21 VAL 18 HG21 VAL 18 11.137 -3.758 3.566 137 HG22 VAL 18 HG22 VAL 18 9.449 -3.722 4.082 138 HG23 VAL 18 HG23 VAL 18 10.707 -4.257 5.211 139 H ALA 19 HN ALA 19 11.892 -2.342 7.818 140 HA ALA 19 HA ALA 19 11.660 -5.073 8.318 141 HB1 ALA 19 HB1 ALA 19 13.604 -3.714 9.008 142 HB2 ALA 19 HB2 ALA 19 12.980 -4.712 10.323 143 HB3 ALA 19 HB3 ALA 19 12.624 -2.985 10.281 144 H ARG 20 HN ARG 20 9.941 -2.373 9.890 145 HA ARG 20 HA ARG 20 8.737 -4.216 11.763 146 HB2 ARG 20 HB2 ARG 20 7.400 -2.312 12.549 147 HB3 ARG 20 HB1 ARG 20 9.115 -1.947 12.563 148 HG2 ARG 20 HG2 ARG 20 8.936 -0.436 10.810 149 HG3 ARG 20 HG1 ARG 20 7.397 -1.107 10.260 150 HD2 ARG 20 HD2 ARG 20 6.229 -0.182 12.098 151 HD3 ARG 20 HD1 ARG 20 7.716 0.213 12.938 152 HE ARG 20 HE ARG 20 8.006 1.780 10.855 153 HH11 ARG 20 HH11 ARG 20 5.088 1.119 12.680 154 HH12 ARG 20 HH12 ARG 20 4.376 2.666 12.343 155 HH21 ARG 20 HH21 ARG 20 7.086 3.839 10.455 156 HH22 ARG 20 HH22 ARG 20 5.505 4.201 11.085 157 H LEU 21 HN LEU 21 8.136 -2.713 8.742 158 HA LEU 21 HA LEU 21 5.495 -3.282 8.240 159 HB2 LEU 21 HB2 LEU 21 7.317 -2.129 6.823 160 HB3 LEU 21 HB1 LEU 21 7.707 -3.729 6.248 161 HG LEU 21 HG LEU 21 5.582 -3.930 5.163 162 HD11 LEU 21 HD11 LEU 21 4.949 -1.264 6.379 163 HD12 LEU 21 HD12 LEU 21 4.166 -2.804 6.740 164 HD13 LEU 21 HD13 LEU 21 3.985 -2.078 5.144 165 HD21 LEU 21 HD21 LEU 21 7.288 -2.832 3.907 166 HD22 LEU 21 HD22 LEU 21 6.933 -1.294 4.691 167 HD23 LEU 21 HD23 LEU 21 5.754 -2.017 3.600 168 H GLN 22 HN GLN 22 8.360 -5.262 7.745 169 HA GLN 22 HA GLN 22 7.091 -7.629 6.943 170 HB2 GLN 22 HB2 GLN 22 9.678 -7.513 8.432 171 HB3 GLN 22 HB1 GLN 22 9.162 -8.648 7.164 172 HG2 GLN 22 HG2 GLN 22 9.204 -6.663 5.641 173 HG3 GLN 22 HG1 GLN 22 9.989 -5.784 6.929 174 HE21 GLN 22 HE21 GLN 22 10.994 -6.312 4.379 175 HE22 GLN 22 HE22 GLN 22 12.435 -7.247 4.551 176 H ASP 23 HN ASP 23 8.594 -6.685 9.945 177 HA ASP 23 HA ASP 23 8.229 -8.918 11.468 178 HB2 ASP 23 HB2 ASP 23 7.985 -6.036 12.140 179 HB3 ASP 23 HB1 ASP 23 7.870 -7.263 13.385 180 H VAL 24 HN VAL 24 5.860 -6.298 11.014 181 HA VAL 24 HA VAL 24 4.061 -7.644 12.774 182 HB VAL 24 HB VAL 24 4.033 -5.209 12.783 183 HG11 VAL 24 HG11 VAL 24 4.677 -4.828 10.482 184 HG12 VAL 24 HG12 VAL 24 3.186 -3.962 10.853 185 HG13 VAL 24 HG13 VAL 24 3.130 -5.463 9.929 186 HG21 VAL 24 HG21 VAL 24 1.505 -6.448 11.704 187 HG22 VAL 24 HG22 VAL 24 1.579 -4.832 12.413 188 HG23 VAL 24 HG23 VAL 24 1.955 -6.251 13.397 189 H ALA 25 HN ALA 25 4.677 -7.464 9.394 190 HA ALA 25 HA ALA 25 2.167 -8.458 8.473 191 HB1 ALA 25 HB1 ALA 25 3.377 -8.995 6.394 192 HB2 ALA 25 HB2 ALA 25 4.907 -8.652 7.199 193 HB3 ALA 25 HB3 ALA 25 3.742 -7.357 6.934 194 H GLN 26 HN GLN 26 5.052 -9.667 9.807 195 HA GLN 26 HA GLN 26 4.677 -12.405 9.129 196 HB2 GLN 26 HB2 GLN 26 6.843 -12.289 9.620 197 HB3 GLN 26 HB1 GLN 26 6.612 -10.697 10.324 198 HG2 GLN 26 HG2 GLN 26 7.438 -11.754 12.119 199 HG3 GLN 26 HG1 GLN 26 5.733 -12.134 12.359 200 HE21 GLN 26 HE21 GLN 26 5.723 -14.005 10.110 201 HE22 GLN 26 HE22 GLN 26 6.508 -15.426 10.677 202 H LYS 27 HN LYS 27 3.964 -10.313 11.805 203 HA LYS 27 HA LYS 27 3.121 -12.229 13.691 204 HB2 LYS 27 HB2 LYS 27 2.233 -9.352 13.410 205 HB3 LYS 27 HB1 LYS 27 2.128 -10.340 14.867 206 HG2 LYS 27 HG2 LYS 27 4.650 -9.456 13.493 207 HG3 LYS 27 HG1 LYS 27 3.991 -8.799 14.992 208 HD2 LYS 27 HD2 LYS 27 4.544 -10.691 16.205 209 HD3 LYS 27 HD1 LYS 27 4.587 -11.721 14.774 210 HE2 LYS 27 HE2 LYS 27 6.648 -10.883 14.086 211 HE3 LYS 27 HE1 LYS 27 6.524 -9.478 15.135 212 HZ1 LYS 27 HZ1 LYS 27 8.104 -11.119 15.973 213 HZ2 LYS 27 HZ2 LYS 27 6.879 -12.280 16.050 214 HZ3 LYS 27 HZ3 LYS 27 6.816 -10.917 17.046 215 H SER 28 HN SER 28 1.396 -10.507 11.131 216 HA SER 28 HA SER 28 -1.125 -11.584 12.154 217 HB2 SER 28 HB2 SER 28 -0.618 -9.428 10.110 218 HB3 SER 28 HB1 SER 28 -2.195 -9.885 10.751 219 HG SER 28 HG SER 28 -0.537 -9.372 12.785 220 H ILE 29 HN ILE 29 1.222 -12.159 9.878 221 HA ILE 29 HA ILE 29 -0.684 -13.530 8.102 222 HB ILE 29 HB ILE 29 2.102 -12.527 7.579 223 HG12 ILE 29 HG12 ILE 29 -0.526 -11.803 6.287 224 HG13 ILE 29 HG11 ILE 29 0.323 -10.838 7.499 225 HG21 ILE 29 HG21 ILE 29 0.344 -14.173 5.790 226 HG22 ILE 29 HG22 ILE 29 1.932 -14.600 6.439 227 HG23 ILE 29 HG23 ILE 29 1.784 -13.291 5.262 228 HD11 ILE 29 HD11 ILE 29 0.665 -10.107 5.151 229 HD12 ILE 29 HD12 ILE 29 1.529 -11.630 4.873 230 HD13 ILE 29 HD13 ILE 29 2.137 -10.463 6.053 231 H ALA 30 HN ALA 30 -0.634 -15.692 7.995 232 HA ALA 30 HA ALA 30 1.309 -17.096 9.640 233 HB1 ALA 30 HB1 ALA 30 -0.113 -19.049 9.297 234 HB2 ALA 30 HB2 ALA 30 -1.103 -18.136 8.159 235 HB3 ALA 30 HB3 ALA 30 -1.055 -17.668 9.858 236 H ASP 31 HN ASP 31 1.234 -16.039 6.526 237 HA ASP 31 HA ASP 31 2.726 -18.380 5.539 238 HB2 ASP 31 HB2 ASP 31 0.462 -17.614 4.437 239 HB3 ASP 31 HB1 ASP 31 1.511 -16.429 3.664 240 H GLU 32 HN GLU 32 4.652 -18.115 4.653 241 HA GLU 32 HA GLU 32 6.126 -15.708 5.020 242 HB2 GLU 32 HB2 GLU 32 7.908 -16.925 3.863 243 HB3 GLU 32 HB1 GLU 32 7.131 -17.972 5.046 244 HG2 GLU 32 HG2 GLU 32 5.707 -18.846 3.114 245 HG3 GLU 32 HG1 GLU 32 6.850 -18.008 2.059 246 H LYS 33 HN LYS 33 4.264 -17.079 2.386 247 HA LYS 33 HA LYS 33 5.488 -15.573 0.287 248 HB2 LYS 33 HB2 LYS 33 2.694 -16.717 0.325 249 HB3 LYS 33 HB1 LYS 33 3.666 -16.347 -1.079 250 HG2 LYS 33 HG2 LYS 33 4.742 -18.256 -1.006 251 HG3 LYS 33 HG1 LYS 33 4.898 -18.221 0.748 252 HD2 LYS 33 HD2 LYS 33 2.469 -18.800 0.861 253 HD3 LYS 33 HD1 LYS 33 2.527 -19.080 -0.882 254 HE2 LYS 33 HE2 LYS 33 2.782 -21.141 0.344 255 HE3 LYS 33 HE1 LYS 33 4.254 -20.750 -0.543 256 HZ1 LYS 33 HZ1 LYS 33 4.518 -21.540 1.834 257 HZ2 LYS 33 HZ2 LYS 33 3.903 -20.029 2.304 258 HZ3 LYS 33 HZ3 LYS 33 5.338 -20.126 1.407 259 H ALA 34 HN ALA 34 2.425 -15.283 2.026 260 HA ALA 34 HA ALA 34 1.695 -12.803 0.924 261 HB1 ALA 34 HB1 ALA 34 0.088 -12.688 2.803 262 HB2 ALA 34 HB2 ALA 34 0.864 -14.102 3.520 263 HB3 ALA 34 HB3 ALA 34 0.052 -14.236 1.961 264 H ARG 35 HN ARG 35 3.883 -13.695 3.468 265 HA ARG 35 HA ARG 35 3.911 -11.186 4.840 266 HB2 ARG 35 HB2 ARG 35 4.844 -13.583 5.525 267 HB3 ARG 35 HB1 ARG 35 6.316 -12.957 4.798 268 HG2 ARG 35 HG2 ARG 35 4.939 -11.238 6.792 269 HG3 ARG 35 HG1 ARG 35 5.766 -12.678 7.380 270 HD2 ARG 35 HD2 ARG 35 6.968 -10.404 5.802 271 HD3 ARG 35 HD1 ARG 35 7.253 -10.807 7.505 272 HE ARG 35 HE ARG 35 8.071 -13.044 6.385 273 HH11 ARG 35 HH11 ARG 35 8.668 -9.773 5.278 274 HH12 ARG 35 HH12 ARG 35 10.195 -10.164 4.556 275 HH21 ARG 35 HH21 ARG 35 10.070 -13.552 5.430 276 HH22 ARG 35 HH22 ARG 35 10.993 -12.305 4.647 277 H LYS 36 HN LYS 36 6.188 -12.742 2.586 278 HA LYS 36 HA LYS 36 7.855 -10.581 2.071 279 HB2 LYS 36 HB2 LYS 36 6.864 -12.581 0.053 280 HB3 LYS 36 HB1 LYS 36 8.316 -11.600 -0.078 281 HG2 LYS 36 HG2 LYS 36 9.496 -12.909 1.309 282 HG3 LYS 36 HG1 LYS 36 8.071 -13.362 2.270 283 HD2 LYS 36 HD2 LYS 36 8.916 -15.239 0.902 284 HD3 LYS 36 HD1 LYS 36 7.256 -14.739 0.492 285 HE2 LYS 36 HE2 LYS 36 7.999 -13.582 -1.450 286 HE3 LYS 36 HE1 LYS 36 9.697 -13.724 -0.991 287 HZ1 LYS 36 HZ1 LYS 36 9.081 -15.290 -2.740 288 HZ2 LYS 36 HZ2 LYS 36 7.916 -15.987 -1.737 289 HZ3 LYS 36 HZ3 LYS 36 9.554 -16.109 -1.338 290 H VAL 37 HN VAL 37 5.069 -11.664 0.165 291 HA VAL 37 HA VAL 37 5.333 -9.795 -1.834 292 HB VAL 37 HB VAL 37 3.039 -10.198 -2.503 293 HG11 VAL 37 HG11 VAL 37 4.408 -12.676 -1.443 294 HG12 VAL 37 HG12 VAL 37 4.617 -11.942 -3.038 295 HG13 VAL 37 HG13 VAL 37 3.073 -12.679 -2.601 296 HG21 VAL 37 HG21 VAL 37 1.583 -11.672 -1.093 297 HG22 VAL 37 HG22 VAL 37 1.845 -10.047 -0.461 298 HG23 VAL 37 HG23 VAL 37 2.722 -11.411 0.230 299 H ILE 38 HN ILE 38 3.740 -9.425 1.289 300 HA ILE 38 HA ILE 38 2.775 -6.840 0.449 301 HB ILE 38 HB ILE 38 1.687 -8.617 2.193 302 HG12 ILE 38 HG12 ILE 38 1.185 -5.665 2.370 303 HG13 ILE 38 HG11 ILE 38 0.821 -6.552 0.896 304 HG21 ILE 38 HG21 ILE 38 2.768 -6.362 3.879 305 HG22 ILE 38 HG22 ILE 38 3.424 -8.000 3.891 306 HG23 ILE 38 HG23 ILE 38 1.765 -7.710 4.419 307 HD11 ILE 38 HD11 ILE 38 -0.512 -8.062 2.598 308 HD12 ILE 38 HD12 ILE 38 -1.189 -6.589 1.910 309 HD13 ILE 38 HD13 ILE 38 -0.506 -6.559 3.526 310 H VAL 39 HN VAL 39 5.355 -8.064 2.563 311 HA VAL 39 HA VAL 39 5.966 -5.474 3.544 312 HB VAL 39 HB VAL 39 7.969 -6.296 4.408 313 HG11 VAL 39 HG11 VAL 39 7.401 -8.473 5.403 314 HG12 VAL 39 HG12 VAL 39 6.067 -8.622 4.264 315 HG13 VAL 39 HG13 VAL 39 6.063 -7.320 5.456 316 HG21 VAL 39 HG21 VAL 39 8.985 -7.196 2.385 317 HG22 VAL 39 HG22 VAL 39 7.897 -8.581 2.443 318 HG23 VAL 39 HG23 VAL 39 9.099 -8.351 3.714 319 H GLU 40 HN GLU 40 7.264 -7.353 0.853 320 HA GLU 40 HA GLU 40 8.964 -5.481 -0.242 321 HB2 GLU 40 HB2 GLU 40 7.415 -7.761 -1.412 322 HB3 GLU 40 HB1 GLU 40 8.582 -6.844 -2.338 323 HG2 GLU 40 HG2 GLU 40 10.358 -7.584 -1.103 324 HG3 GLU 40 HG1 GLU 40 9.377 -7.980 0.291 325 H LEU 41 HN LEU 41 5.499 -5.794 -0.541 326 HA LEU 41 HA LEU 41 5.356 -3.912 -2.749 327 HB2 LEU 41 HB2 LEU 41 3.698 -5.886 -1.676 328 HB3 LEU 41 HB1 LEU 41 2.870 -4.382 -1.334 329 HG LEU 41 HG LEU 41 2.001 -5.104 -3.372 330 HD11 LEU 41 HD11 LEU 41 2.715 -2.740 -3.297 331 HD12 LEU 41 HD12 LEU 41 2.567 -3.419 -4.911 332 HD13 LEU 41 HD13 LEU 41 4.161 -3.205 -4.190 333 HD21 LEU 41 HD21 LEU 41 3.563 -6.839 -3.920 334 HD22 LEU 41 HD22 LEU 41 4.824 -5.654 -4.247 335 HD23 LEU 41 HD23 LEU 41 3.412 -5.750 -5.301 336 H MET 42 HN MET 42 4.311 -3.922 0.665 337 HA MET 42 HA MET 42 3.320 -1.269 0.671 338 HB2 MET 42 HB2 MET 42 4.258 -2.969 2.975 339 HB3 MET 42 HB1 MET 42 3.247 -1.523 3.127 340 HG2 MET 42 HG2 MET 42 2.552 -4.107 1.770 341 HG3 MET 42 HG1 MET 42 1.886 -3.449 3.260 342 HE1 MET 42 HE1 MET 42 -0.023 -4.460 1.059 343 HE2 MET 42 HE2 MET 42 -1.189 -3.139 0.982 344 HE3 MET 42 HE3 MET 42 -0.556 -3.670 2.546 345 H ALA 43 HN ALA 43 6.408 -2.682 1.012 346 HA ALA 43 HA ALA 43 7.963 -0.752 2.139 347 HB1 ALA 43 HB1 ALA 43 8.439 -2.465 -0.283 348 HB2 ALA 43 HB2 ALA 43 8.921 -2.782 1.384 349 HB3 ALA 43 HB3 ALA 43 9.695 -1.481 0.472 350 H TYR 44 HN TYR 44 6.291 -0.732 -0.918 351 HA TYR 44 HA TYR 44 7.365 1.939 -1.549 352 HB2 TYR 44 HB2 TYR 44 7.478 0.409 -3.431 353 HB3 TYR 44 HB1 TYR 44 5.809 -0.071 -3.160 354 HD1 TYR 44 HD1 TYR 44 7.975 2.162 -4.947 355 HD2 TYR 44 HD2 TYR 44 3.980 1.681 -3.604 356 HE1 TYR 44 HE1 TYR 44 7.222 3.774 -6.621 357 HE2 TYR 44 HE2 TYR 44 3.218 3.304 -5.275 358 HH TYR 44 HH TYR 44 5.024 4.244 -7.869 359 H GLU 45 HN GLU 45 4.323 0.153 -1.801 360 HA GLU 45 HA GLU 45 2.648 2.247 -2.199 361 HB2 GLU 45 HB2 GLU 45 1.883 -0.148 -0.595 362 HB3 GLU 45 HB1 GLU 45 0.870 0.788 -1.685 363 HG2 GLU 45 HG2 GLU 45 3.153 -0.995 -2.412 364 HG3 GLU 45 HG1 GLU 45 1.456 -1.330 -2.686 365 H ASN 46 HN ASN 46 4.025 1.199 0.843 366 HA ASN 46 HA ASN 46 2.208 2.952 2.298 367 HB2 ASN 46 HB2 ASN 46 3.824 0.526 3.004 368 HB3 ASN 46 HB1 ASN 46 3.360 1.669 4.252 369 HD21 ASN 46 HD21 ASN 46 1.917 0.299 5.329 370 HD22 ASN 46 HD22 ASN 46 0.470 -0.244 4.583 371 H ALA 47 HN ALA 47 5.456 2.668 1.210 372 HA ALA 47 HA ALA 47 6.856 3.888 3.312 373 HB1 ALA 47 HB1 ALA 47 8.622 4.329 1.681 374 HB2 ALA 47 HB2 ALA 47 7.514 3.905 0.376 375 HB3 ALA 47 HB3 ALA 47 8.002 2.681 1.550 376 H ASN 48 HN ASN 48 8.205 5.918 2.796 377 HA ASN 48 HA ASN 48 6.542 8.186 2.759 378 HB2 ASN 48 HB2 ASN 48 9.467 7.680 2.708 379 HB3 ASN 48 HB1 ASN 48 8.929 9.249 2.114 380 HD21 ASN 48 HD21 ASN 48 10.383 8.302 4.607 381 HD22 ASN 48 HD22 ASN 48 9.485 9.036 5.892 382 HA PRO 49 HA PRO 49 5.382 8.856 -1.401 383 HB2 PRO 49 HB2 PRO 49 6.536 11.574 -0.971 384 HB3 PRO 49 HB1 PRO 49 4.963 11.115 -1.626 385 HG2 PRO 49 HG2 PRO 49 5.264 12.002 0.905 386 HG3 PRO 49 HG1 PRO 49 4.030 10.818 0.451 387 HD2 PRO 49 HD2 PRO 49 6.488 10.439 2.040 388 HD3 PRO 49 HD1 PRO 49 5.032 9.427 1.942 389 H GLU 50 HN GLU 50 8.439 10.415 -0.551 390 HA GLU 50 HA GLU 50 9.566 10.258 -3.129 391 HB2 GLU 50 HB2 GLU 50 10.486 12.018 -2.054 392 HB3 GLU 50 HB1 GLU 50 10.336 11.275 -0.469 393 HG2 GLU 50 HG2 GLU 50 12.463 10.720 -0.507 394 HG3 GLU 50 HG1 GLU 50 12.215 9.820 -1.996 395 H CYS 51 HN CYS 51 9.477 8.160 -0.368 396 HA CYS 51 HA CYS 51 11.939 6.841 -1.019 397 HB2 CYS 51 HB2 CYS 51 9.802 6.223 1.040 398 HB3 CYS 51 HB1 CYS 51 11.342 5.377 0.872 399 HG CYS 51 HG CYS 51 12.928 7.296 1.809 400 H GLN 52 HN GLN 52 8.487 6.217 -1.237 401 HA GLN 52 HA GLN 52 8.787 3.700 -2.546 402 HB2 GLN 52 HB2 GLN 52 6.463 3.849 -3.049 403 HB3 GLN 52 HB1 GLN 52 6.673 4.483 -1.426 404 HG2 GLN 52 HG2 GLN 52 6.597 6.765 -2.361 405 HG3 GLN 52 HG1 GLN 52 6.268 6.077 -3.947 406 HE21 GLN 52 HE21 GLN 52 4.749 3.907 -2.671 407 HE22 GLN 52 HE22 GLN 52 3.227 4.569 -2.251 408 H SER 53 HN SER 53 8.706 7.006 -3.360 409 HA SER 53 HA SER 53 8.688 6.781 -6.155 410 HB2 SER 53 HB2 SER 53 9.425 8.814 -4.139 411 HB3 SER 53 HB1 SER 53 9.846 9.108 -5.826 412 HG SER 53 HG SER 53 7.350 8.949 -4.574 413 H ALA 54 HN ALA 54 11.207 6.587 -3.749 414 HA ALA 54 HA ALA 54 13.342 6.487 -5.638 415 HB1 ALA 54 HB1 ALA 54 13.835 6.942 -3.353 416 HB2 ALA 54 HB2 ALA 54 14.558 5.384 -3.747 417 HB3 ALA 54 HB3 ALA 54 13.047 5.456 -2.831 418 H ILE 55 HN ILE 55 10.882 4.428 -4.620 419 HA ILE 55 HA ILE 55 12.197 2.019 -5.441 420 HB ILE 55 HB ILE 55 9.561 2.587 -4.154 421 HG12 ILE 55 HG12 ILE 55 11.769 0.913 -3.057 422 HG13 ILE 55 HG11 ILE 55 11.933 2.673 -3.060 423 HG21 ILE 55 HG21 ILE 55 10.705 -0.064 -4.994 424 HG22 ILE 55 HG22 ILE 55 9.195 0.665 -5.555 425 HG23 ILE 55 HG23 ILE 55 9.356 0.131 -3.879 426 HD11 ILE 55 HD11 ILE 55 10.130 2.956 -1.629 427 HD12 ILE 55 HD12 ILE 55 11.018 1.570 -0.978 428 HD13 ILE 55 HD13 ILE 55 9.525 1.315 -1.901 429 H LYS 56 HN LYS 56 9.702 4.152 -6.876 430 HA LYS 56 HA LYS 56 8.225 2.561 -8.489 431 HB2 LYS 56 HB2 LYS 56 9.692 4.777 -9.864 432 HB3 LYS 56 HB1 LYS 56 8.125 4.110 -10.264 433 HG2 LYS 56 HG2 LYS 56 7.218 5.785 -9.136 434 HG3 LYS 56 HG1 LYS 56 7.935 5.122 -7.662 435 HD2 LYS 56 HD2 LYS 56 9.760 6.421 -7.824 436 HD3 LYS 56 HD1 LYS 56 9.545 6.721 -9.553 437 HE2 LYS 56 HE2 LYS 56 7.670 7.741 -7.428 438 HE3 LYS 56 HE1 LYS 56 8.951 8.694 -8.154 439 HZ1 LYS 56 HZ1 LYS 56 7.916 8.535 -10.267 440 HZ2 LYS 56 HZ2 LYS 56 6.757 9.067 -9.155 441 HZ3 LYS 56 HZ3 LYS 56 6.741 7.465 -9.685 442 HA PRO 57 HA PRO 57 11.836 2.014 -11.794 443 HB2 PRO 57 HB2 PRO 57 14.332 2.031 -10.704 444 HB3 PRO 57 HB1 PRO 57 13.567 3.475 -11.383 445 HG2 PRO 57 HG2 PRO 57 13.601 2.538 -8.523 446 HG3 PRO 57 HG1 PRO 57 14.068 4.137 -9.161 447 HD2 PRO 57 HD2 PRO 57 11.672 3.787 -8.117 448 HD3 PRO 57 HD1 PRO 57 11.802 4.692 -9.630 449 H LEU 58 HN LEU 58 11.881 0.853 -8.516 450 HA LEU 58 HA LEU 58 12.917 -1.774 -9.333 451 HB2 LEU 58 HB2 LEU 58 12.370 -1.140 -6.493 452 HB3 LEU 58 HB1 LEU 58 13.658 -2.126 -7.174 453 HG LEU 58 HG LEU 58 13.539 0.893 -7.088 454 HD11 LEU 58 HD11 LEU 58 15.217 -1.099 -5.572 455 HD12 LEU 58 HD12 LEU 58 13.898 -0.134 -4.915 456 HD13 LEU 58 HD13 LEU 58 15.372 0.655 -5.481 457 HD21 LEU 58 HD21 LEU 58 15.702 -0.944 -8.114 458 HD22 LEU 58 HD22 LEU 58 15.864 0.798 -7.889 459 HD23 LEU 58 HD23 LEU 58 14.720 0.164 -9.072 460 H LYS 59 HN LYS 59 10.224 0.065 -8.475 461 HA LYS 59 HA LYS 59 8.582 -1.667 -7.099 462 HB2 LYS 59 HB2 LYS 59 7.897 0.575 -7.571 463 HB3 LYS 59 HB1 LYS 59 7.892 0.254 -9.292 464 HG2 LYS 59 HG2 LYS 59 5.707 -0.106 -9.088 465 HG3 LYS 59 HG1 LYS 59 6.160 -1.610 -8.296 466 HD2 LYS 59 HD2 LYS 59 5.805 0.986 -6.864 467 HD3 LYS 59 HD1 LYS 59 4.538 -0.237 -6.997 468 HE2 LYS 59 HE2 LYS 59 7.166 -1.140 -6.013 469 HE3 LYS 59 HE1 LYS 59 6.285 -0.056 -4.969 470 HZ1 LYS 59 HZ1 LYS 59 4.401 -1.515 -5.020 471 HZ2 LYS 59 HZ2 LYS 59 5.781 -2.352 -4.483 472 HZ3 LYS 59 HZ3 LYS 59 5.218 -2.580 -6.060 473 H GLY 60 HN GLY 60 8.224 -3.721 -7.449 474 HA2 GLY 60 HA3 GLY 60 7.138 -5.501 -8.531 475 HA3 GLY 60 HA2 GLY 60 7.137 -4.570 -10.021 476 H LYS 61 HN LYS 61 10.102 -4.011 -9.335 477 HA LYS 61 HA LYS 61 11.063 -6.408 -10.746 478 HB2 LYS 61 HB2 LYS 61 12.800 -4.023 -10.514 479 HB3 LYS 61 HB1 LYS 61 12.473 -5.037 -11.911 480 HG2 LYS 61 HG2 LYS 61 10.546 -2.999 -10.844 481 HG3 LYS 61 HG1 LYS 61 11.715 -2.669 -12.115 482 HD2 LYS 61 HD2 LYS 61 9.690 -4.886 -12.297 483 HD3 LYS 61 HD1 LYS 61 9.363 -3.244 -12.860 484 HE2 LYS 61 HE2 LYS 61 11.308 -3.379 -14.339 485 HE3 LYS 61 HE1 LYS 61 11.595 -5.031 -13.799 486 HZ1 LYS 61 HZ1 LYS 61 9.180 -4.067 -15.234 487 HZ2 LYS 61 HZ2 LYS 61 9.425 -5.649 -14.692 488 HZ3 LYS 61 HZ3 LYS 61 10.418 -5.007 -15.897 489 H VAL 62 HN VAL 62 11.986 -7.827 -9.360 490 HA VAL 62 HA VAL 62 13.949 -6.708 -7.483 491 HB VAL 62 HB VAL 62 12.125 -7.719 -6.229 492 HG11 VAL 62 HG11 VAL 62 11.292 -9.310 -7.869 493 HG12 VAL 62 HG12 VAL 62 11.636 -10.109 -6.332 494 HG13 VAL 62 HG13 VAL 62 12.755 -10.279 -7.686 495 HG21 VAL 62 HG21 VAL 62 14.665 -9.335 -6.164 496 HG22 VAL 62 HG22 VAL 62 13.429 -9.355 -4.907 497 HG23 VAL 62 HG23 VAL 62 14.310 -7.868 -5.252 498 HA PRO 63 HA PRO 63 17.161 -8.952 -9.733 499 HB2 PRO 63 HB2 PRO 63 18.087 -9.253 -6.907 500 HB3 PRO 63 HB1 PRO 63 19.011 -8.818 -8.334 501 HG2 PRO 63 HG2 PRO 63 18.295 -6.943 -6.626 502 HG3 PRO 63 HG1 PRO 63 18.178 -6.640 -8.369 503 HD2 PRO 63 HD2 PRO 63 16.020 -7.221 -6.398 504 HD3 PRO 63 HD1 PRO 63 15.991 -6.173 -7.831 505 H ALA 64 HN ALA 64 17.555 -11.074 -10.145 506 HA ALA 64 HA ALA 64 15.714 -12.988 -9.222 507 HB1 ALA 64 HB1 ALA 64 16.735 -13.106 -11.429 508 HB2 ALA 64 HB2 ALA 64 17.019 -14.594 -10.527 509 HB3 ALA 64 HB3 ALA 64 18.307 -13.404 -10.696 510 H GLY 65 HN GLY 65 15.703 -13.542 -7.132 511 HA2 GLY 65 HA3 GLY 65 16.514 -15.215 -5.610 512 HA3 GLY 65 HA2 GLY 65 18.151 -14.816 -6.105 513 H SER 66 HN SER 66 17.134 -11.866 -5.921 514 HA SER 66 HA SER 66 18.005 -11.579 -3.158 515 HB2 SER 66 HB2 SER 66 17.424 -9.465 -5.245 516 HB3 SER 66 HB1 SER 66 18.164 -9.192 -3.666 517 HG SER 66 HG SER 66 19.544 -11.102 -4.858 518 H ASP 67 HN ASP 67 16.935 -9.863 -1.852 519 HA ASP 67 HA ASP 67 14.044 -10.219 -1.807 520 HB2 ASP 67 HB2 ASP 67 15.796 -10.061 0.194 521 HB3 ASP 67 HB1 ASP 67 15.514 -8.341 -0.009 522 H VAL 68 HN VAL 68 12.552 -8.441 -2.109 523 HA VAL 68 HA VAL 68 13.682 -6.397 -3.806 524 HB VAL 68 HB VAL 68 11.654 -5.990 -4.610 525 HG11 VAL 68 HG11 VAL 68 9.983 -7.709 -4.375 526 HG12 VAL 68 HG12 VAL 68 10.785 -8.322 -2.930 527 HG13 VAL 68 HG13 VAL 68 11.592 -8.415 -4.493 528 HG21 VAL 68 HG21 VAL 68 10.625 -5.923 -1.785 529 HG22 VAL 68 HG22 VAL 68 9.634 -5.607 -3.210 530 HG23 VAL 68 HG23 VAL 68 11.003 -4.555 -2.834 531 H ILE 69 HN ILE 69 12.701 -6.779 -0.524 532 HA ILE 69 HA ILE 69 12.419 -4.084 0.170 533 HB ILE 69 HB ILE 69 13.235 -6.479 1.783 534 HG12 ILE 69 HG12 ILE 69 10.974 -6.683 1.189 535 HG13 ILE 69 HG11 ILE 69 10.925 -5.966 2.792 536 HG21 ILE 69 HG21 ILE 69 12.835 -3.635 2.718 537 HG22 ILE 69 HG22 ILE 69 14.251 -4.664 2.929 538 HG23 ILE 69 HG23 ILE 69 12.761 -5.024 3.803 539 HD11 ILE 69 HD11 ILE 69 9.329 -4.881 1.418 540 HD12 ILE 69 HD12 ILE 69 10.554 -4.555 0.183 541 HD13 ILE 69 HD13 ILE 69 10.649 -3.752 1.748 542 H SER 70 HN SER 70 15.155 -6.215 0.291 543 HA SER 70 HA SER 70 17.120 -4.614 1.289 544 HB2 SER 70 HB2 SER 70 17.511 -6.943 0.718 545 HB3 SER 70 HB1 SER 70 17.299 -6.602 -0.996 546 HG SER 70 HG SER 70 19.288 -5.287 0.522 547 H GLU 71 HN GLU 71 15.740 -4.520 -1.939 548 HA GLU 71 HA GLU 71 17.614 -2.594 -2.947 549 HB2 GLU 71 HB2 GLU 71 15.079 -3.568 -4.227 550 HB3 GLU 71 HB1 GLU 71 16.533 -2.962 -5.016 551 HG2 GLU 71 HG2 GLU 71 16.823 -5.335 -3.296 552 HG3 GLU 71 HG1 GLU 71 15.964 -5.545 -4.813 553 H TYR 72 HN TYR 72 14.394 -2.744 -1.716 554 HA TYR 72 HA TYR 72 13.567 -0.190 -2.676 555 HB2 TYR 72 HB2 TYR 72 12.444 -2.214 -0.755 556 HB3 TYR 72 HB1 TYR 72 11.703 -0.630 -0.934 557 HD1 TYR 72 HD1 TYR 72 13.206 -2.077 -3.894 558 HD2 TYR 72 HD2 TYR 72 9.634 -1.800 -1.617 559 HE1 TYR 72 HE1 TYR 72 11.918 -2.892 -5.814 560 HE2 TYR 72 HE2 TYR 72 8.338 -2.628 -3.534 561 HH TYR 72 HH TYR 72 9.929 -3.819 -6.421 562 H VAL 73 HN VAL 73 14.850 -1.534 0.283 563 HA VAL 73 HA VAL 73 14.761 0.861 1.792 564 HB VAL 73 HB VAL 73 16.026 -0.092 3.452 565 HG11 VAL 73 HG11 VAL 73 15.310 -2.420 3.729 566 HG12 VAL 73 HG12 VAL 73 14.703 -2.379 2.072 567 HG13 VAL 73 HG13 VAL 73 14.026 -1.299 3.289 568 HG21 VAL 73 HG21 VAL 73 17.208 -2.237 1.735 569 HG22 VAL 73 HG22 VAL 73 17.736 -1.655 3.324 570 HG23 VAL 73 HG23 VAL 73 17.955 -0.647 1.891 571 H LYS 74 HN LYS 74 16.951 -0.673 -0.413 572 HA LYS 74 HA LYS 74 19.179 1.056 -0.132 573 HB2 LYS 74 HB2 LYS 74 19.491 -1.087 -1.005 574 HB3 LYS 74 HB1 LYS 74 18.198 -0.905 -2.171 575 HG2 LYS 74 HG2 LYS 74 19.675 0.941 -3.171 576 HG3 LYS 74 HG1 LYS 74 20.959 0.200 -2.210 577 HD2 LYS 74 HD2 LYS 74 21.023 -0.812 -4.373 578 HD3 LYS 74 HD1 LYS 74 20.320 -1.990 -3.259 579 HE2 LYS 74 HE2 LYS 74 18.869 -2.104 -5.057 580 HE3 LYS 74 HE1 LYS 74 18.061 -0.961 -3.970 581 HZ1 LYS 74 HZ1 LYS 74 18.898 0.859 -5.278 582 HZ2 LYS 74 HZ2 LYS 74 18.089 -0.216 -6.298 583 HZ3 LYS 74 HZ3 LYS 74 19.777 -0.185 -6.274 584 H ALA 75 HN ALA 75 16.222 1.059 -1.949 585 HA ALA 75 HA ALA 75 16.748 3.164 -3.732 586 HB1 ALA 75 HB1 ALA 75 14.786 1.708 -3.881 587 HB2 ALA 75 HB2 ALA 75 14.324 3.408 -3.849 588 HB3 ALA 75 HB3 ALA 75 14.149 2.417 -2.398 589 H CYS 76 HN CYS 76 15.484 3.110 -0.436 590 HA CYS 76 HA CYS 76 15.679 6.028 -0.312 591 HB2 CYS 76 HB2 CYS 76 13.639 5.124 0.507 592 HB3 CYS 76 HB1 CYS 76 14.469 3.997 1.567 593 HG CYS 76 HG CYS 76 15.623 6.440 2.897 594 H ASP 77 HN ASP 77 17.833 3.690 -0.025 595 HA ASP 77 HA ASP 77 19.125 4.171 2.409 596 HB2 ASP 77 HB2 ASP 77 19.805 2.292 1.167 597 HB3 ASP 77 HB1 ASP 77 20.117 3.230 -0.283 598 H GLY 78 HN GLY 78 18.855 6.104 -0.422 599 HA2 GLY 78 HA3 GLY 78 20.914 7.948 0.567 600 HA3 GLY 78 HA2 GLY 78 20.175 7.999 -1.026 601 H ILE 79 HN ILE 79 17.541 7.511 0.728 602 HA ILE 79 HA ILE 79 16.902 10.328 0.775 603 HB ILE 79 HB ILE 79 15.202 7.923 1.351 604 HG12 ILE 79 HG12 ILE 79 15.253 9.698 -1.089 605 HG13 ILE 79 HG11 ILE 79 16.061 8.133 -0.988 606 HG21 ILE 79 HG21 ILE 79 13.285 9.456 1.043 607 HG22 ILE 79 HG22 ILE 79 14.420 10.807 1.032 608 HG23 ILE 79 HG23 ILE 79 14.252 9.806 2.477 609 HD11 ILE 79 HD11 ILE 79 13.133 8.432 -0.481 610 HD12 ILE 79 HD12 ILE 79 14.041 6.980 -0.907 611 HD13 ILE 79 HD13 ILE 79 13.784 8.250 -2.104 612 H GLY 80 HN GLY 80 16.635 11.557 2.554 613 HA2 GLY 80 HA3 GLY 80 15.591 10.907 4.954 614 HA3 GLY 80 HA2 GLY 80 17.271 10.443 5.131 615 H GLY 81 HN GLY 81 15.114 13.127 4.452 616 HA2 GLY 81 HA3 GLY 81 15.223 15.150 5.653 617 HA3 GLY 81 HA2 GLY 81 16.908 14.827 6.017 618 H ALA 82 HN ALA 82 18.315 16.085 5.014 619 HA ALA 82 HA ALA 82 17.529 18.155 3.329 620 HB1 ALA 82 HB1 ALA 82 19.550 18.185 4.710 621 HB2 ALA 82 HB2 ALA 82 19.878 18.625 3.034 622 HB3 ALA 82 HB3 ALA 82 20.297 17.015 3.621 623 H MET 83 HN MET 83 19.214 15.145 2.481 624 HA MET 83 HA MET 83 19.298 15.653 -0.295 625 HB2 MET 83 HB2 MET 83 19.256 12.987 1.130 626 HB3 MET 83 HB1 MET 83 19.755 13.258 -0.535 627 HG2 MET 83 HG2 MET 83 21.558 14.738 0.312 628 HG3 MET 83 HG1 MET 83 21.104 14.277 1.948 629 HE1 MET 83 HE1 MET 83 24.493 12.382 1.337 630 HE2 MET 83 HE2 MET 83 23.636 13.519 2.377 631 HE3 MET 83 HE3 MET 83 24.039 13.971 0.721 632 H HIS 84 HN HIS 84 16.878 14.351 1.819 633 HA HIS 84 HA HIS 84 15.145 13.259 -0.135 634 HB2 HIS 84 HB2 HIS 84 14.793 12.539 2.086 635 HB3 HIS 84 HB1 HIS 84 14.798 14.179 2.710 636 HD1 HIS 84 HD1 HIS 84 12.561 14.530 3.684 637 HD2 HIS 84 HD2 HIS 84 12.354 12.621 0.003 638 HE1 HIS 84 HE1 HIS 84 10.115 14.314 3.175 639 HE2 HIS 84 HE2 HIS 84 10.010 13.223 0.908 640 H LYS 85 HN LYS 85 15.697 16.489 1.045 641 HA LYS 85 HA LYS 85 13.256 17.511 -0.128 642 HB2 LYS 85 HB2 LYS 85 15.587 19.030 1.054 643 HB3 LYS 85 HB1 LYS 85 13.980 19.664 0.720 644 HG2 LYS 85 HG2 LYS 85 14.634 17.503 2.719 645 HG3 LYS 85 HG1 LYS 85 14.288 19.193 3.097 646 HD2 LYS 85 HD2 LYS 85 12.037 18.960 2.257 647 HD3 LYS 85 HD1 LYS 85 12.380 17.320 1.701 648 HE2 LYS 85 HE2 LYS 85 11.159 17.213 3.773 649 HE3 LYS 85 HE1 LYS 85 12.812 16.655 4.040 650 HZ1 LYS 85 HZ1 LYS 85 13.353 18.856 4.925 651 HZ2 LYS 85 HZ2 LYS 85 12.121 18.115 5.812 652 HZ3 LYS 85 HZ3 LYS 85 11.747 19.345 4.717 653 H ALA 86 HN ALA 86 16.483 16.950 -1.066 654 HA ALA 86 HA ALA 86 16.442 18.784 -3.311 655 HB1 ALA 86 HB1 ALA 86 18.633 17.843 -3.833 656 HB2 ALA 86 HB2 ALA 86 18.410 16.617 -2.585 657 HB3 ALA 86 HB3 ALA 86 18.540 18.318 -2.138 658 H MET 87 HN MET 87 16.298 15.316 -2.731 659 HA MET 87 HA MET 87 16.065 14.677 -5.532 660 HB2 MET 87 HB2 MET 87 15.930 12.988 -3.036 661 HB3 MET 87 HB1 MET 87 15.844 12.343 -4.676 662 HG2 MET 87 HG2 MET 87 18.045 13.275 -5.161 663 HG3 MET 87 HG1 MET 87 18.129 13.917 -3.528 664 HE1 MET 87 HE1 MET 87 18.199 10.583 -1.413 665 HE2 MET 87 HE2 MET 87 16.722 11.380 -1.952 666 HE3 MET 87 HE3 MET 87 18.073 12.341 -1.355 667 H LEU 88 HN LEU 88 13.903 15.563 -3.093 668 HA LEU 88 HA LEU 88 11.582 14.192 -3.647 669 HB2 LEU 88 HB2 LEU 88 12.202 16.158 -2.001 670 HB3 LEU 88 HB1 LEU 88 11.509 17.154 -3.258 671 HG LEU 88 HG LEU 88 9.473 16.793 -2.447 672 HD11 LEU 88 HD11 LEU 88 9.393 14.796 -3.910 673 HD12 LEU 88 HD12 LEU 88 8.413 14.626 -2.451 674 HD13 LEU 88 HD13 LEU 88 9.977 13.822 -2.560 675 HD21 LEU 88 HD21 LEU 88 10.869 14.991 -0.486 676 HD22 LEU 88 HD22 LEU 88 9.219 15.593 -0.312 677 HD23 LEU 88 HD23 LEU 88 10.576 16.720 -0.303 678 H MET 89 HN MET 89 13.232 16.520 -5.601 679 HA MET 89 HA MET 89 10.988 16.989 -7.355 680 HB2 MET 89 HB2 MET 89 12.638 18.746 -7.049 681 HB3 MET 89 HB1 MET 89 13.915 17.682 -7.622 682 HG2 MET 89 HG2 MET 89 12.614 17.538 -9.793 683 HG3 MET 89 HG1 MET 89 11.661 18.892 -9.182 684 HE1 MET 89 HE1 MET 89 16.178 19.054 -10.097 685 HE2 MET 89 HE2 MET 89 15.160 17.625 -10.265 686 HE3 MET 89 HE3 MET 89 15.559 18.239 -8.662 687 H ALA 90 HN ALA 90 13.422 14.607 -7.023 688 HA ALA 90 HA ALA 90 13.254 13.926 -9.887 689 HB1 ALA 90 HB1 ALA 90 15.430 12.775 -9.522 690 HB2 ALA 90 HB2 ALA 90 15.420 13.354 -7.850 691 HB3 ALA 90 HB3 ALA 90 15.497 14.506 -9.186 692 H GLN 91 HN GLN 91 13.818 12.202 -6.790 693 HA GLN 91 HA GLN 91 13.144 9.699 -7.949 694 HB2 GLN 91 HB2 GLN 91 13.283 10.532 -5.067 695 HB3 GLN 91 HB1 GLN 91 13.122 8.873 -5.624 696 HG2 GLN 91 HG2 GLN 91 15.259 8.860 -6.557 697 HG3 GLN 91 HG1 GLN 91 15.392 10.616 -6.483 698 HE21 GLN 91 HE21 GLN 91 14.218 10.749 -3.855 699 HE22 GLN 91 HE22 GLN 91 15.462 10.236 -2.770 700 H LEU 92 HN LEU 92 11.418 11.931 -5.809 701 HA LEU 92 HA LEU 92 9.013 10.751 -5.406 702 HB2 LEU 92 HB2 LEU 92 9.761 13.065 -4.791 703 HB3 LEU 92 HB1 LEU 92 9.257 13.569 -6.390 704 HG LEU 92 HG LEU 92 7.673 13.874 -4.363 705 HD11 LEU 92 HD11 LEU 92 5.718 13.671 -5.792 706 HD12 LEU 92 HD12 LEU 92 6.653 12.704 -6.932 707 HD13 LEU 92 HD13 LEU 92 7.070 14.397 -6.662 708 HD21 LEU 92 HD21 LEU 92 7.050 11.028 -5.071 709 HD22 LEU 92 HD22 LEU 92 6.140 12.053 -3.960 710 HD23 LEU 92 HD23 LEU 92 7.792 11.576 -3.569 711 H GLU 93 HN GLU 93 10.360 11.865 -8.436 712 HA GLU 93 HA GLU 93 7.881 11.147 -9.781 713 HB2 GLU 93 HB2 GLU 93 9.828 13.307 -10.452 714 HB3 GLU 93 HB1 GLU 93 8.361 12.926 -11.378 715 HG2 GLU 93 HG2 GLU 93 7.045 13.268 -9.341 716 HG3 GLU 93 HG1 GLU 93 8.507 13.746 -8.502 717 H2 PRO 1 HT1 PRO 1 5.218 -4.172 -13.634 718 H3 PRO 1 HT2 PRO 1 5.710 -2.704 -14.154 719 HA PRO 1 HA PRO 1 6.455 -2.655 -12.116 720 HB2 PRO 1 HB2 PRO 1 4.455 -1.477 -10.776 721 HB3 PRO 1 HB1 PRO 1 5.239 -0.676 -12.146 722 HG2 PRO 1 HG2 PRO 1 2.569 -1.874 -11.971 723 HG3 PRO 1 HG1 PRO 1 3.202 -0.710 -13.148 724 HD2 PRO 1 HD2 PRO 1 2.930 -3.604 -13.383 725 HD3 PRO 1 HD1 PRO 1 3.352 -2.420 -14.636 726 H SER 2 HN SER 2 4.876 -2.648 -9.672 727 HA SER 2 HA SER 2 4.319 -5.363 -9.097 728 HB2 SER 2 HB2 SER 2 3.131 -2.891 -7.833 729 HB3 SER 2 HB1 SER 2 3.145 -4.506 -7.147 730 HG SER 2 HG SER 2 5.481 -4.389 -7.230 731 H PHE 3 HN PHE 3 2.040 -6.081 -8.555 732 HA PHE 3 HA PHE 3 0.386 -5.677 -10.822 733 HB2 PHE 3 HB2 PHE 3 -1.217 -6.795 -8.883 734 HB3 PHE 3 HB1 PHE 3 -0.232 -7.693 -10.035 735 HD1 PHE 3 HD1 PHE 3 -0.866 -6.863 -6.638 736 HD2 PHE 3 HD2 PHE 3 2.089 -8.432 -9.264 737 HE1 PHE 3 HE1 PHE 3 0.287 -7.866 -4.744 738 HE2 PHE 3 HE2 PHE 3 3.267 -9.431 -7.351 739 HZ PHE 3 HZ PHE 3 2.364 -9.148 -5.077 740 H ASN 4 HN ASN 4 0.104 -4.762 -7.424 741 HA ASN 4 HA ASN 4 -2.530 -3.656 -7.893 742 HB2 ASN 4 HB2 ASN 4 -2.672 -3.535 -5.500 743 HB3 ASN 4 HB1 ASN 4 -1.918 -5.080 -5.909 744 HD21 ASN 4 HD21 ASN 4 0.139 -5.445 -5.344 745 HD22 ASN 4 HD22 ASN 4 1.093 -4.318 -4.446 746 H THR 5 HN THR 5 0.529 -2.396 -8.119 747 HA THR 5 HA THR 5 0.353 -0.127 -6.496 748 HB THR 5 HB THR 5 2.471 -0.907 -7.223 749 HG1 THR 5 HG1 THR 5 2.302 1.360 -6.860 750 HG21 THR 5 HG21 THR 5 1.327 -0.328 -9.897 751 HG22 THR 5 HG22 THR 5 1.915 -1.862 -9.248 752 HG23 THR 5 HG23 THR 5 3.057 -0.567 -9.638 753 H VAL 6 HN VAL 6 -1.464 -0.896 -9.142 754 HA VAL 6 HA VAL 6 -1.972 1.723 -10.151 755 HB VAL 6 HB VAL 6 -3.716 0.785 -11.397 756 HG11 VAL 6 HG11 VAL 6 -1.786 -1.477 -10.942 757 HG12 VAL 6 HG12 VAL 6 -1.600 -0.150 -12.091 758 HG13 VAL 6 HG13 VAL 6 -2.890 -1.332 -12.310 759 HG21 VAL 6 HG21 VAL 6 -5.003 -1.160 -10.854 760 HG22 VAL 6 HG22 VAL 6 -4.913 -0.157 -9.397 761 HG23 VAL 6 HG23 VAL 6 -3.891 -1.591 -9.548 762 H ARG 7 HN ARG 7 -3.465 3.238 -9.321 763 HA ARG 7 HA ARG 7 -5.269 2.303 -7.306 764 HB2 ARG 7 HB2 ARG 7 -4.318 3.841 -5.553 765 HB3 ARG 7 HB1 ARG 7 -3.541 2.315 -5.903 766 HG2 ARG 7 HG2 ARG 7 -2.265 4.142 -7.538 767 HG3 ARG 7 HG1 ARG 7 -2.467 4.942 -5.978 768 HD2 ARG 7 HD2 ARG 7 -1.500 2.986 -4.859 769 HD3 ARG 7 HD1 ARG 7 -1.230 2.218 -6.433 770 HE ARG 7 HE ARG 7 0.231 4.204 -6.915 771 HH11 ARG 7 HH11 ARG 7 -0.278 3.034 -3.659 772 HH12 ARG 7 HH12 ARG 7 1.102 3.843 -3.010 773 HH21 ARG 7 HH21 ARG 7 2.054 5.295 -6.072 774 HH22 ARG 7 HH22 ARG 7 2.438 5.144 -4.388 775 H GLN 8 HN GLN 8 -6.555 3.815 -6.314 776 HA GLN 8 HA GLN 8 -8.131 5.297 -7.862 777 HB2 GLN 8 HB2 GLN 8 -7.851 4.800 -5.132 778 HB3 GLN 8 HB1 GLN 8 -7.943 6.552 -5.250 779 HG2 GLN 8 HG2 GLN 8 -10.023 6.358 -6.506 780 HG3 GLN 8 HG1 GLN 8 -9.929 4.601 -6.391 781 HE21 GLN 8 HE21 GLN 8 -12.012 6.331 -5.449 782 HE22 GLN 8 HE22 GLN 8 -12.107 6.105 -3.725 783 H GLY 9 HN GLY 9 -7.587 6.814 -9.257 784 HA2 GLY 9 HA3 GLY 9 -5.687 8.904 -8.623 785 HA3 GLY 9 HA2 GLY 9 -6.628 8.744 -10.099 786 H SER 10 HN SER 10 -7.177 10.953 -10.078 787 HA SER 10 HA SER 10 -8.262 12.386 -7.965 788 HB2 SER 10 HB2 SER 10 -7.532 13.352 -10.146 789 HB3 SER 10 HB1 SER 10 -8.982 12.683 -10.892 790 HG SER 10 HG SER 10 -8.763 14.729 -8.958 791 H LYS 11 HN LYS 11 -9.781 11.501 -6.742 792 HA LYS 11 HA LYS 11 -11.560 10.262 -6.068 793 HB2 LYS 11 HB2 LYS 11 -13.671 11.290 -6.548 794 HB3 LYS 11 HB1 LYS 11 -12.477 12.535 -6.287 795 HG2 LYS 11 HG2 LYS 11 -12.394 13.043 -8.575 796 HG3 LYS 11 HG1 LYS 11 -13.291 11.603 -9.025 797 HD2 LYS 11 HD2 LYS 11 -15.260 12.527 -7.833 798 HD3 LYS 11 HD1 LYS 11 -14.342 14.005 -7.530 799 HE2 LYS 11 HE2 LYS 11 -14.121 14.386 -9.918 800 HE3 LYS 11 HE1 LYS 11 -14.953 12.871 -10.258 801 HZ1 LYS 11 HZ1 LYS 11 -16.144 15.211 -8.870 802 HZ2 LYS 11 HZ2 LYS 11 -16.939 13.765 -9.233 803 HZ3 LYS 11 HZ3 LYS 11 -16.421 14.777 -10.480 804 H GLU 12 HN GLU 12 -10.292 8.787 -7.999 805 HA GLU 12 HA GLU 12 -11.920 7.816 -10.066 806 HB2 GLU 12 HB2 GLU 12 -9.519 7.342 -9.876 807 HB3 GLU 12 HB1 GLU 12 -9.802 6.400 -8.426 808 HG2 GLU 12 HG2 GLU 12 -11.064 4.762 -9.732 809 HG3 GLU 12 HG1 GLU 12 -10.790 5.721 -11.187 810 HA PRO 13 HA PRO 13 -15.185 5.661 -7.897 811 HB2 PRO 13 HB2 PRO 13 -14.923 3.569 -9.948 812 HB3 PRO 13 HB1 PRO 13 -16.330 4.540 -9.524 813 HG2 PRO 13 HG2 PRO 13 -14.914 4.905 -11.808 814 HG3 PRO 13 HG1 PRO 13 -15.782 6.202 -10.982 815 HD2 PRO 13 HD2 PRO 13 -12.879 5.675 -11.134 816 HD3 PRO 13 HD1 PRO 13 -13.738 7.204 -10.891 817 H TYR 14 HN TYR 14 -14.906 4.381 -6.187 818 HA TYR 14 HA TYR 14 -12.338 3.284 -5.842 819 HB2 TYR 14 HB2 TYR 14 -13.512 4.358 -3.999 820 HB3 TYR 14 HB1 TYR 14 -14.716 3.076 -4.008 821 HD1 TYR 14 HD1 TYR 14 -13.748 0.673 -3.813 822 HD2 TYR 14 HD2 TYR 14 -11.719 4.159 -2.528 823 HE1 TYR 14 HE1 TYR 14 -12.392 -0.709 -2.329 824 HE2 TYR 14 HE2 TYR 14 -10.337 2.798 -1.020 825 HH TYR 14 HH TYR 14 -9.966 0.753 -0.229 826 HA PRO 15 HA PRO 15 -14.576 -1.050 -5.531 827 HB2 PRO 15 HB2 PRO 15 -16.746 -0.650 -7.489 828 HB3 PRO 15 HB1 PRO 15 -16.759 -1.532 -5.964 829 HG2 PRO 15 HG2 PRO 15 -17.981 0.834 -6.253 830 HG3 PRO 15 HG1 PRO 15 -17.251 0.330 -4.731 831 HD2 PRO 15 HD2 PRO 15 -16.290 2.309 -6.727 832 HD3 PRO 15 HD1 PRO 15 -16.066 2.267 -4.973 833 H ASP 16 HN ASP 16 -14.246 1.071 -8.099 834 HA ASP 16 HA ASP 16 -13.601 -0.935 -10.089 835 HB2 ASP 16 HB2 ASP 16 -13.963 2.041 -10.167 836 HB3 ASP 16 HB1 ASP 16 -13.140 1.219 -11.484 837 H PHE 17 HN PHE 17 -12.060 1.713 -8.321 838 HA PHE 17 HA PHE 17 -9.484 1.516 -9.365 839 HB2 PHE 17 HB2 PHE 17 -9.275 3.233 -7.887 840 HB3 PHE 17 HB1 PHE 17 -10.746 2.740 -7.059 841 HD1 PHE 17 HD1 PHE 17 -10.660 1.770 -4.933 842 HD2 PHE 17 HD2 PHE 17 -7.107 2.105 -7.236 843 HE1 PHE 17 HE1 PHE 17 -9.339 1.051 -2.992 844 HE2 PHE 17 HE2 PHE 17 -5.773 1.398 -5.296 845 HZ PHE 17 HZ PHE 17 -6.888 0.871 -3.170 846 H VAL 18 HN VAL 18 -11.044 -0.206 -6.731 847 HA VAL 18 HA VAL 18 -8.746 -1.810 -6.178 848 HB VAL 18 HB VAL 18 -10.095 -1.421 -4.303 849 HG11 VAL 18 HG11 VAL 18 -12.398 -2.335 -6.002 850 HG12 VAL 18 HG12 VAL 18 -12.147 -0.739 -5.286 851 HG13 VAL 18 HG13 VAL 18 -12.484 -2.132 -4.246 852 HG21 VAL 18 HG21 VAL 18 -11.009 -3.672 -3.742 853 HG22 VAL 18 HG22 VAL 18 -9.319 -3.645 -4.258 854 HG23 VAL 18 HG23 VAL 18 -10.580 -4.175 -5.387 855 H ALA 19 HN ALA 19 -11.757 -2.265 -7.999 856 HA ALA 19 HA ALA 19 -11.544 -4.997 -8.491 857 HB1 ALA 19 HB1 ALA 19 -13.476 -3.627 -9.188 858 HB2 ALA 19 HB2 ALA 19 -12.858 -4.633 -10.497 859 HB3 ALA 19 HB3 ALA 19 -12.491 -2.908 -10.461 860 H ARG 20 HN ARG 20 -9.808 -2.312 -10.068 861 HA ARG 20 HA ARG 20 -8.613 -4.164 -11.936 862 HB2 ARG 20 HB2 ARG 20 -7.268 -2.267 -12.725 863 HB3 ARG 20 HB1 ARG 20 -8.979 -1.894 -12.737 864 HG2 ARG 20 HG2 ARG 20 -8.791 -0.379 -10.990 865 HG3 ARG 20 HG1 ARG 20 -7.256 -1.060 -10.439 866 HD2 ARG 20 HD2 ARG 20 -6.083 -0.147 -12.280 867 HD3 ARG 20 HD1 ARG 20 -7.569 0.258 -13.119 868 HE ARG 20 HE ARG 20 -7.841 1.827 -11.034 869 HH11 ARG 20 HH11 ARG 20 -4.934 1.147 -12.874 870 HH12 ARG 20 HH12 ARG 20 -4.215 2.691 -12.554 871 HH21 ARG 20 HH21 ARG 20 -6.911 3.885 -10.650 872 HH22 ARG 20 HH22 ARG 20 -5.331 4.241 -11.287 873 H LEU 21 HN LEU 21 -8.003 -2.654 -8.917 874 HA LEU 21 HA LEU 21 -5.365 -3.234 -8.417 875 HB2 LEU 21 HB2 LEU 21 -7.177 -2.067 -7.003 876 HB3 LEU 21 HB1 LEU 21 -7.580 -3.664 -6.423 877 HG LEU 21 HG LEU 21 -5.455 -3.876 -5.338 878 HD11 LEU 21 HD11 LEU 21 -4.808 -1.218 -6.561 879 HD12 LEU 21 HD12 LEU 21 -4.034 -2.765 -6.919 880 HD13 LEU 21 HD13 LEU 21 -3.849 -2.035 -5.325 881 HD21 LEU 21 HD21 LEU 21 -7.154 -2.766 -4.084 882 HD22 LEU 21 HD22 LEU 21 -6.789 -1.232 -4.874 883 HD23 LEU 21 HD23 LEU 21 -5.616 -1.958 -3.779 884 H GLN 22 HN GLN 22 -8.239 -5.202 -7.923 885 HA GLN 22 HA GLN 22 -6.982 -7.572 -7.109 886 HB2 GLN 22 HB2 GLN 22 -9.567 -7.447 -8.598 887 HB3 GLN 22 HB1 GLN 22 -9.059 -8.581 -7.326 888 HG2 GLN 22 HG2 GLN 22 -9.089 -6.590 -5.810 889 HG3 GLN 22 HG1 GLN 22 -9.870 -5.710 -7.101 890 HE21 GLN 22 HE21 GLN 22 -10.871 -6.223 -4.551 891 HE22 GLN 22 HE22 GLN 22 -12.318 -7.147 -4.719 892 H ASP 23 HN ASP 23 -8.480 -6.624 -10.115 893 HA ASP 23 HA ASP 23 -8.129 -8.864 -11.632 894 HB2 ASP 23 HB2 ASP 23 -7.870 -5.985 -12.312 895 HB3 ASP 23 HB1 ASP 23 -7.761 -7.218 -13.554 896 H VAL 24 HN VAL 24 -5.748 -6.254 -11.191 897 HA VAL 24 HA VAL 24 -3.959 -7.620 -12.944 898 HB VAL 24 HB VAL 24 -3.916 -5.185 -12.960 899 HG11 VAL 24 HG11 VAL 24 -4.554 -4.791 -10.658 900 HG12 VAL 24 HG12 VAL 24 -3.059 -3.935 -11.034 901 HG13 VAL 24 HG13 VAL 24 -3.008 -5.434 -10.103 902 HG21 VAL 24 HG21 VAL 24 -1.390 -6.436 -11.884 903 HG22 VAL 24 HG22 VAL 24 -1.460 -4.822 -12.594 904 HG23 VAL 24 HG23 VAL 24 -1.843 -6.240 -13.576 905 H ALA 25 HN ALA 25 -4.569 -7.426 -9.565 906 HA ALA 25 HA ALA 25 -2.066 -8.431 -8.641 907 HB1 ALA 25 HB1 ALA 25 -3.275 -8.952 -6.560 908 HB2 ALA 25 HB2 ALA 25 -4.805 -8.607 -7.364 909 HB3 ALA 25 HB3 ALA 25 -3.635 -7.314 -7.104 910 H GLN 26 HN GLN 26 -4.954 -9.630 -9.973 911 HA GLN 26 HA GLN 26 -4.593 -12.366 -9.282 912 HB2 GLN 26 HB2 GLN 26 -6.757 -12.246 -9.776 913 HB3 GLN 26 HB1 GLN 26 -6.521 -10.656 -10.482 914 HG2 GLN 26 HG2 GLN 26 -7.349 -11.711 -12.275 915 HG3 GLN 26 HG1 GLN 26 -5.648 -12.099 -12.513 916 HE21 GLN 26 HE21 GLN 26 -5.652 -13.968 -10.264 917 HE22 GLN 26 HE22 GLN 26 -6.445 -15.385 -10.824 918 H LYS 27 HN LYS 27 -3.874 -10.285 -11.964 919 HA LYS 27 HA LYS 27 -3.039 -12.210 -13.846 920 HB2 LYS 27 HB2 LYS 27 -2.139 -9.336 -13.576 921 HB3 LYS 27 HB1 LYS 27 -2.041 -10.330 -15.031 922 HG2 LYS 27 HG2 LYS 27 -4.557 -9.431 -13.653 923 HG3 LYS 27 HG1 LYS 27 -3.896 -8.780 -15.154 924 HD2 LYS 27 HD2 LYS 27 -4.462 -10.669 -16.366 925 HD3 LYS 27 HD1 LYS 27 -4.513 -11.696 -14.931 926 HE2 LYS 27 HE2 LYS 27 -6.566 -10.842 -14.245 927 HE3 LYS 27 HE1 LYS 27 -6.433 -9.439 -15.296 928 HZ1 LYS 27 HZ1 LYS 27 -8.023 -11.076 -16.127 929 HZ2 LYS 27 HZ2 LYS 27 -6.799 -12.238 -16.212 930 HZ3 LYS 27 HZ3 LYS 27 -6.735 -10.874 -17.205 931 H SER 28 HN SER 28 -1.304 -10.490 -11.295 932 HA SER 28 HA SER 28 1.211 -11.581 -12.316 933 HB2 SER 28 HB2 SER 28 0.714 -9.422 -10.272 934 HB3 SER 28 HB1 SER 28 2.291 -9.893 -10.906 935 HG SER 28 HG SER 28 0.614 -9.355 -12.935 936 H ILE 29 HN ILE 29 -1.140 -12.136 -10.032 937 HA ILE 29 HA ILE 29 0.757 -13.519 -8.255 938 HB ILE 29 HB ILE 29 -2.023 -12.495 -7.733 939 HG12 ILE 29 HG12 ILE 29 0.612 -11.785 -6.446 940 HG13 ILE 29 HG11 ILE 29 -0.233 -10.819 -7.660 941 HG21 ILE 29 HG21 ILE 29 -0.273 -14.147 -5.941 942 HG22 ILE 29 HG22 ILE 29 -1.862 -14.569 -6.589 943 HG23 ILE 29 HG23 ILE 29 -1.708 -13.258 -5.416 944 HD11 ILE 29 HD11 ILE 29 -0.571 -10.081 -5.312 945 HD12 ILE 29 HD12 ILE 29 -1.442 -11.600 -5.034 946 HD13 ILE 29 HD13 ILE 29 -2.045 -10.430 -6.215 947 H ALA 30 HN ALA 30 0.691 -15.675 -8.143 948 HA ALA 30 HA ALA 30 -1.257 -17.075 -9.786 949 HB1 ALA 30 HB1 ALA 30 0.162 -19.033 -9.435 950 HB2 ALA 30 HB2 ALA 30 1.159 -18.113 -8.308 951 HB3 ALA 30 HB3 ALA 30 1.104 -17.658 -10.010 952 H ASP 31 HN ASP 31 -1.173 -16.015 -6.674 953 HA ASP 31 HA ASP 31 -2.677 -18.344 -5.678 954 HB2 ASP 31 HB2 ASP 31 -0.406 -17.583 -4.586 955 HB3 ASP 31 HB1 ASP 31 -1.449 -16.393 -3.812 956 H GLU 32 HN GLU 32 -4.602 -18.064 -4.799 957 HA GLU 32 HA GLU 32 -6.060 -15.651 -5.167 958 HB2 GLU 32 HB2 GLU 32 -7.846 -16.854 -4.003 959 HB3 GLU 32 HB1 GLU 32 -7.075 -17.905 -5.185 960 HG2 GLU 32 HG2 GLU 32 -5.652 -18.774 -3.247 961 HG3 GLU 32 HG1 GLU 32 -6.808 -17.945 -2.202 962 H LYS 33 HN LYS 33 -4.206 -17.023 -2.528 963 HA LYS 33 HA LYS 33 -5.420 -15.504 -0.433 964 HB2 LYS 33 HB2 LYS 33 -2.630 -16.666 -0.468 965 HB3 LYS 33 HB1 LYS 33 -3.599 -16.284 0.935 966 HG2 LYS 33 HG2 LYS 33 -4.687 -18.186 0.873 967 HG3 LYS 33 HG1 LYS 33 -4.844 -18.160 -0.881 968 HD2 LYS 33 HD2 LYS 33 -2.417 -18.752 -0.994 969 HD3 LYS 33 HD1 LYS 33 -2.475 -19.022 0.752 970 HE2 LYS 33 HE2 LYS 33 -2.746 -21.089 -0.465 971 HE3 LYS 33 HE1 LYS 33 -4.213 -20.685 0.421 972 HZ1 LYS 33 HZ1 LYS 33 -4.479 -21.486 -1.952 973 HZ2 LYS 33 HZ2 LYS 33 -3.861 -19.978 -2.426 974 HZ3 LYS 33 HZ3 LYS 33 -5.295 -20.068 -1.529 975 H ALA 34 HN ALA 34 -2.356 -15.238 -2.172 976 HA ALA 34 HA ALA 34 -1.613 -12.761 -1.078 977 HB1 ALA 34 HB1 ALA 34 -0.006 -12.658 -2.957 978 HB2 ALA 34 HB2 ALA 34 -0.791 -14.068 -3.672 979 HB3 ALA 34 HB3 ALA 34 0.022 -14.206 -2.115 980 H ARG 35 HN ARG 35 -3.807 -13.647 -3.619 981 HA ARG 35 HA ARG 35 -3.822 -11.141 -4.998 982 HB2 ARG 35 HB2 ARG 35 -4.771 -13.535 -5.679 983 HB3 ARG 35 HB1 ARG 35 -6.237 -12.899 -4.950 984 HG2 ARG 35 HG2 ARG 35 -4.854 -11.186 -6.945 985 HG3 ARG 35 HG1 ARG 35 -5.683 -12.622 -7.535 986 HD2 ARG 35 HD2 ARG 35 -6.880 -10.344 -5.962 987 HD3 ARG 35 HD1 ARG 35 -7.167 -10.750 -7.663 988 HE ARG 35 HE ARG 35 -8.004 -12.978 -6.550 989 HH11 ARG 35 HH11 ARG 35 -8.569 -9.704 -5.430 990 HH12 ARG 35 HH12 ARG 35 -10.092 -10.086 -4.698 991 HH21 ARG 35 HH21 ARG 35 -10.010 -13.466 -5.589 992 HH22 ARG 35 HH22 ARG 35 -10.911 -12.216 -4.791 993 H LYS 36 HN LYS 36 -6.103 -12.680 -2.734 994 HA LYS 36 HA LYS 36 -7.762 -10.509 -2.230 995 HB2 LYS 36 HB2 LYS 36 -6.780 -12.506 -0.205 996 HB3 LYS 36 HB1 LYS 36 -8.227 -11.517 -0.077 997 HG2 LYS 36 HG2 LYS 36 -9.413 -12.821 -1.460 998 HG3 LYS 36 HG1 LYS 36 -7.988 -13.291 -2.416 999 HD2 LYS 36 HD2 LYS 36 -8.848 -15.153 -1.039 1000 HD3 LYS 36 HD1 LYS 36 -7.186 -14.662 -0.630 1001 HE2 LYS 36 HE2 LYS 36 -7.927 -13.488 1.307 1002 HE3 LYS 36 HE1 LYS 36 -9.624 -13.628 0.848 1003 HZ1 LYS 36 HZ1 LYS 36 -9.013 -15.189 2.608 1004 HZ2 LYS 36 HZ2 LYS 36 -7.849 -15.895 1.604 1005 HZ3 LYS 36 HZ3 LYS 36 -9.488 -16.011 1.208 1006 H VAL 37 HN VAL 37 -4.985 -11.600 -0.319 1007 HA VAL 37 HA VAL 37 -5.234 -9.723 1.675 1008 HB VAL 37 HB VAL 37 -2.945 -10.143 2.344 1009 HG11 VAL 37 HG11 VAL 37 -4.323 -12.613 1.286 1010 HG12 VAL 37 HG12 VAL 37 -4.526 -11.877 2.881 1011 HG13 VAL 37 HG13 VAL 37 -2.986 -12.620 2.443 1012 HG21 VAL 37 HG21 VAL 37 -1.494 -11.622 0.935 1013 HG22 VAL 37 HG22 VAL 37 -1.748 -9.996 0.301 1014 HG23 VAL 37 HG23 VAL 37 -2.630 -11.357 -0.389 1015 H ILE 38 HN ILE 38 -3.643 -9.373 -1.450 1016 HA ILE 38 HA ILE 38 -2.663 -6.789 -0.618 1017 HB ILE 38 HB ILE 38 -1.585 -8.579 -2.360 1018 HG12 ILE 38 HG12 ILE 38 -1.063 -5.633 -2.543 1019 HG13 ILE 38 HG11 ILE 38 -0.706 -6.516 -1.066 1020 HG21 ILE 38 HG21 ILE 38 -2.654 -6.320 -4.047 1021 HG22 ILE 38 HG22 ILE 38 -3.318 -7.954 -4.059 1022 HG23 ILE 38 HG23 ILE 38 -1.656 -7.671 -4.586 1023 HD11 ILE 38 HD11 ILE 38 0.618 -8.039 -2.765 1024 HD12 ILE 38 HD12 ILE 38 1.304 -6.568 -2.082 1025 HD13 ILE 38 HD13 ILE 38 0.620 -6.537 -3.696 1026 H VAL 39 HN VAL 39 -5.250 -8.007 -2.728 1027 HA VAL 39 HA VAL 39 -5.848 -5.415 -3.715 1028 HB VAL 39 HB VAL 39 -7.854 -6.229 -4.576 1029 HG11 VAL 39 HG11 VAL 39 -7.298 -8.411 -5.567 1030 HG12 VAL 39 HG12 VAL 39 -5.965 -8.565 -4.429 1031 HG13 VAL 39 HG13 VAL 39 -5.955 -7.266 -5.622 1032 HG21 VAL 39 HG21 VAL 39 -8.878 -7.118 -2.553 1033 HG22 VAL 39 HG22 VAL 39 -7.797 -8.509 -2.602 1034 HG23 VAL 39 HG23 VAL 39 -8.996 -8.277 -3.876 1035 H GLU 40 HN GLU 40 -7.153 -7.280 -1.019 1036 HA GLU 40 HA GLU 40 -8.843 -5.395 0.071 1037 HB2 GLU 40 HB2 GLU 40 -7.307 -7.685 1.243 1038 HB3 GLU 40 HB1 GLU 40 -8.469 -6.759 2.169 1039 HG2 GLU 40 HG2 GLU 40 -10.248 -7.490 0.936 1040 HG3 GLU 40 HG1 GLU 40 -9.274 -7.883 -0.462 1041 H LEU 41 HN LEU 41 -5.379 -5.728 0.367 1042 HA LEU 41 HA LEU 41 -5.223 -3.844 2.571 1043 HB2 LEU 41 HB2 LEU 41 -3.578 -5.827 1.500 1044 HB3 LEU 41 HB1 LEU 41 -2.742 -4.329 1.154 1045 HG LEU 41 HG LEU 41 -1.875 -5.052 3.190 1046 HD11 LEU 41 HD11 LEU 41 -2.577 -2.682 3.112 1047 HD12 LEU 41 HD12 LEU 41 -2.426 -3.359 4.727 1048 HD13 LEU 41 HD13 LEU 41 -4.021 -3.138 4.013 1049 HD21 LEU 41 HD21 LEU 41 -3.448 -6.775 3.743 1050 HD22 LEU 41 HD22 LEU 41 -4.701 -5.580 4.071 1051 HD23 LEU 41 HD23 LEU 41 -3.287 -5.684 5.122 1052 H MET 42 HN MET 42 -4.182 -3.863 -0.841 1053 HA MET 42 HA MET 42 -3.178 -1.213 -0.853 1054 HB2 MET 42 HB2 MET 42 -4.125 -2.917 -3.152 1055 HB3 MET 42 HB1 MET 42 -3.107 -1.476 -3.309 1056 HG2 MET 42 HG2 MET 42 -2.424 -4.063 -1.949 1057 HG3 MET 42 HG1 MET 42 -1.756 -3.407 -3.439 1058 HE1 MET 42 HE1 MET 42 0.153 -4.430 -1.240 1059 HE2 MET 42 HE2 MET 42 1.325 -3.113 -1.167 1060 HE3 MET 42 HE3 MET 42 0.687 -3.643 -2.728 1061 H ALA 43 HN ALA 43 -6.273 -2.614 -1.187 1062 HA ALA 43 HA ALA 43 -7.819 -0.679 -2.321 1063 HB1 ALA 43 HB1 ALA 43 -8.301 -2.381 0.107 1064 HB2 ALA 43 HB2 ALA 43 -8.785 -2.702 -1.557 1065 HB3 ALA 43 HB3 ALA 43 -9.553 -1.395 -0.650 1066 H TYR 44 HN TYR 44 -6.143 -0.660 0.733 1067 HA TYR 44 HA TYR 44 -7.205 2.019 1.357 1068 HB2 TYR 44 HB2 TYR 44 -7.324 0.496 3.244 1069 HB3 TYR 44 HB1 TYR 44 -5.659 0.006 2.975 1070 HD1 TYR 44 HD1 TYR 44 -7.810 2.257 4.758 1071 HD2 TYR 44 HD2 TYR 44 -3.819 1.747 3.414 1072 HE1 TYR 44 HE1 TYR 44 -7.045 3.867 6.430 1073 HE2 TYR 44 HE2 TYR 44 -3.046 3.369 5.081 1074 HH TYR 44 HH TYR 44 -4.872 4.340 7.672 1075 H GLU 45 HN GLU 45 -4.171 0.219 1.612 1076 HA GLU 45 HA GLU 45 -2.484 2.306 2.006 1077 HB2 GLU 45 HB2 GLU 45 -1.729 -0.098 0.411 1078 HB3 GLU 45 HB1 GLU 45 -0.715 0.834 1.502 1079 HG2 GLU 45 HG2 GLU 45 -3.011 -0.934 2.227 1080 HG3 GLU 45 HG1 GLU 45 -1.318 -1.282 2.501 1081 H ASN 46 HN ASN 46 -3.869 1.256 -1.031 1082 HA ASN 46 HA ASN 46 -2.042 2.994 -2.491 1083 HB2 ASN 46 HB2 ASN 46 -3.673 0.576 -3.192 1084 HB3 ASN 46 HB1 ASN 46 -3.203 1.713 -4.441 1085 HD21 ASN 46 HD21 ASN 46 -1.767 0.333 -5.516 1086 HD22 ASN 46 HD22 ASN 46 -0.324 -0.220 -4.768 1087 H ALA 47 HN ALA 47 -5.291 2.734 -1.399 1088 HA ALA 47 HA ALA 47 -6.688 3.951 -3.507 1089 HB1 ALA 47 HB1 ALA 47 -8.450 4.406 -1.878 1090 HB2 ALA 47 HB2 ALA 47 -7.344 3.983 -0.572 1091 HB3 ALA 47 HB3 ALA 47 -7.837 2.756 -1.740 1092 H ASN 48 HN ASN 48 -8.031 5.988 -2.994 1093 HA ASN 48 HA ASN 48 -6.354 8.246 -2.966 1094 HB2 ASN 48 HB2 ASN 48 -9.281 7.759 -2.912 1095 HB3 ASN 48 HB1 ASN 48 -8.733 9.327 -2.325 1096 HD21 ASN 48 HD21 ASN 48 -10.195 8.382 -4.811 1097 HD22 ASN 48 HD22 ASN 48 -9.292 9.107 -6.099 1098 HA PRO 49 HA PRO 49 -5.186 8.917 1.189 1099 HB2 PRO 49 HB2 PRO 49 -6.320 11.640 0.766 1100 HB3 PRO 49 HB1 PRO 49 -4.748 11.170 1.413 1101 HG2 PRO 49 HG2 PRO 49 -5.058 12.066 -1.117 1102 HG3 PRO 49 HG1 PRO 49 -3.827 10.875 -0.668 1103 HD2 PRO 49 HD2 PRO 49 -6.292 10.509 -2.250 1104 HD3 PRO 49 HD1 PRO 49 -4.840 9.490 -2.156 1105 H GLU 50 HN GLU 50 -8.232 10.501 0.343 1106 HA GLU 50 HA GLU 50 -9.361 10.353 2.919 1107 HB2 GLU 50 HB2 GLU 50 -10.274 12.116 1.839 1108 HB3 GLU 50 HB1 GLU 50 -10.127 11.370 0.257 1109 HG2 GLU 50 HG2 GLU 50 -12.256 10.824 0.295 1110 HG3 GLU 50 HG1 GLU 50 -12.013 9.925 1.787 1111 H CYS 51 HN CYS 51 -9.284 8.248 0.160 1112 HA CYS 51 HA CYS 51 -11.751 6.943 0.819 1113 HB2 CYS 51 HB2 CYS 51 -9.619 6.308 -1.240 1114 HB3 CYS 51 HB1 CYS 51 -11.165 5.472 -1.068 1115 HG CYS 51 HG CYS 51 -12.740 7.395 -2.011 1116 H GLN 52 HN GLN 52 -8.301 6.303 1.037 1117 HA GLN 52 HA GLN 52 -8.618 3.791 2.351 1118 HB2 GLN 52 HB2 GLN 52 -6.293 3.926 2.855 1119 HB3 GLN 52 HB1 GLN 52 -6.499 4.560 1.230 1120 HG2 GLN 52 HG2 GLN 52 -6.413 6.842 2.162 1121 HG3 GLN 52 HG1 GLN 52 -6.089 6.154 3.748 1122 HE21 GLN 52 HE21 GLN 52 -4.572 3.979 2.466 1123 HE22 GLN 52 HE22 GLN 52 -3.047 4.640 2.050 1124 H SER 53 HN SER 53 -8.521 7.096 3.156 1125 HA SER 53 HA SER 53 -8.499 6.879 5.952 1126 HB2 SER 53 HB2 SER 53 -9.227 8.912 3.931 1127 HB3 SER 53 HB1 SER 53 -9.638 9.216 5.619 1128 HG SER 53 HG SER 53 -7.147 9.034 4.359 1129 H ALA 54 HN ALA 54 -11.023 6.689 3.551 1130 HA ALA 54 HA ALA 54 -13.157 6.606 5.445 1131 HB1 ALA 54 HB1 ALA 54 -13.648 7.063 3.158 1132 HB2 ALA 54 HB2 ALA 54 -14.380 5.507 3.553 1133 HB3 ALA 54 HB3 ALA 54 -12.868 5.572 2.637 1134 H ILE 55 HN ILE 55 -10.706 4.535 4.429 1135 HA ILE 55 HA ILE 55 -12.033 2.135 5.252 1136 HB ILE 55 HB ILE 55 -9.394 2.685 3.964 1137 HG12 ILE 55 HG12 ILE 55 -11.613 1.022 2.872 1138 HG13 ILE 55 HG11 ILE 55 -11.768 2.783 2.870 1139 HG21 ILE 55 HG21 ILE 55 -10.553 0.042 4.810 1140 HG22 ILE 55 HG22 ILE 55 -9.037 0.765 5.367 1141 HG23 ILE 55 HG23 ILE 55 -9.203 0.228 3.692 1142 HD11 ILE 55 HD11 ILE 55 -9.963 3.050 1.437 1143 HD12 ILE 55 HD12 ILE 55 -10.861 1.668 0.789 1144 HD13 ILE 55 HD13 ILE 55 -9.367 1.407 1.712 1145 H LYS 56 HN LYS 56 -9.528 4.257 6.684 1146 HA LYS 56 HA LYS 56 -8.060 2.662 8.299 1147 HB2 LYS 56 HB2 LYS 56 -9.515 4.888 9.671 1148 HB3 LYS 56 HB1 LYS 56 -7.953 4.213 10.072 1149 HG2 LYS 56 HG2 LYS 56 -7.035 5.880 8.941 1150 HG3 LYS 56 HG1 LYS 56 -7.754 5.219 7.468 1151 HD2 LYS 56 HD2 LYS 56 -9.573 6.527 7.627 1152 HD3 LYS 56 HD1 LYS 56 -9.353 6.834 9.355 1153 HE2 LYS 56 HE2 LYS 56 -7.477 7.833 7.221 1154 HE3 LYS 56 HE1 LYS 56 -8.754 8.797 7.944 1155 HZ1 LYS 56 HZ1 LYS 56 -7.719 8.644 10.056 1156 HZ2 LYS 56 HZ2 LYS 56 -6.558 9.164 8.941 1157 HZ3 LYS 56 HZ3 LYS 56 -6.550 7.564 9.481 1158 HA PRO 57 HA PRO 57 -11.671 2.143 11.608 1159 HB2 PRO 57 HB2 PRO 57 -14.169 2.174 10.521 1160 HB3 PRO 57 HB1 PRO 57 -13.394 3.617 11.194 1161 HG2 PRO 57 HG2 PRO 57 -13.433 2.668 8.337 1162 HG3 PRO 57 HG1 PRO 57 -13.895 4.271 8.967 1163 HD2 PRO 57 HD2 PRO 57 -11.500 3.906 7.926 1164 HD3 PRO 57 HD1 PRO 57 -11.623 4.816 9.437 1165 H LEU 58 HN LEU 58 -11.717 0.973 8.331 1166 HA LEU 58 HA LEU 58 -12.772 -1.643 9.155 1167 HB2 LEU 58 HB2 LEU 58 -12.222 -1.021 6.312 1168 HB3 LEU 58 HB1 LEU 58 -13.516 -1.997 6.996 1169 HG LEU 58 HG LEU 58 -13.384 1.021 6.906 1170 HD11 LEU 58 HD11 LEU 58 -15.068 -0.967 5.393 1171 HD12 LEU 58 HD12 LEU 58 -13.748 -0.005 4.733 1172 HD13 LEU 58 HD13 LEU 58 -15.221 0.787 5.302 1173 HD21 LEU 58 HD21 LEU 58 -15.558 -0.805 7.928 1174 HD22 LEU 58 HD22 LEU 58 -15.707 0.938 7.706 1175 HD23 LEU 58 HD23 LEU 58 -14.569 0.296 8.890 1176 H LYS 59 HN LYS 59 -10.070 0.177 8.292 1177 HA LYS 59 HA LYS 59 -8.439 -1.563 6.917 1178 HB2 LYS 59 HB2 LYS 59 -7.739 0.675 7.385 1179 HB3 LYS 59 HB1 LYS 59 -7.736 0.358 9.105 1180 HG2 LYS 59 HG2 LYS 59 -5.555 -0.017 8.905 1181 HG3 LYS 59 HG1 LYS 59 -6.017 -1.518 8.113 1182 HD2 LYS 59 HD2 LYS 59 -5.650 1.073 6.676 1183 HD3 LYS 59 HD1 LYS 59 -4.386 -0.154 6.815 1184 HE2 LYS 59 HE2 LYS 59 -7.018 -1.049 5.831 1185 HE3 LYS 59 HE1 LYS 59 -6.125 0.023 4.782 1186 HZ1 LYS 59 HZ1 LYS 59 -4.252 -1.445 4.852 1187 HZ2 LYS 59 HZ2 LYS 59 -5.632 -2.275 4.312 1188 HZ3 LYS 59 HZ3 LYS 59 -5.077 -2.502 5.894 1189 H GLY 60 HN GLY 60 -8.102 -3.623 7.272 1190 HA2 GLY 60 HA3 GLY 60 -7.012 -5.398 8.360 1191 HA3 GLY 60 HA2 GLY 60 -7.011 -4.463 9.846 1192 H LYS 61 HN LYS 61 -9.967 -3.895 9.162 1193 HA LYS 61 HA LYS 61 -10.940 -6.286 10.573 1194 HB2 LYS 61 HB2 LYS 61 -12.665 -3.893 10.338 1195 HB3 LYS 61 HB1 LYS 61 -12.343 -4.906 11.735 1196 HG2 LYS 61 HG2 LYS 61 -10.407 -2.879 10.667 1197 HG3 LYS 61 HG1 LYS 61 -11.574 -2.541 11.935 1198 HD2 LYS 61 HD2 LYS 61 -9.560 -4.765 12.122 1199 HD3 LYS 61 HD1 LYS 61 -9.226 -3.125 12.680 1200 HE2 LYS 61 HE2 LYS 61 -11.164 -3.246 14.165 1201 HE3 LYS 61 HE1 LYS 61 -11.468 -4.895 13.626 1202 HZ1 LYS 61 HZ1 LYS 61 -9.037 -3.953 15.050 1203 HZ2 LYS 61 HZ2 LYS 61 -9.300 -5.532 14.511 1204 HZ3 LYS 61 HZ3 LYS 61 -10.283 -4.879 15.721 1205 H VAL 62 HN VAL 62 -11.867 -7.707 9.189 1206 HA VAL 62 HA VAL 62 -13.829 -6.578 7.316 1207 HB VAL 62 HB VAL 62 -12.015 -7.606 6.064 1208 HG11 VAL 62 HG11 VAL 62 -11.192 -9.197 7.709 1209 HG12 VAL 62 HG12 VAL 62 -11.537 -9.999 6.175 1210 HG13 VAL 62 HG13 VAL 62 -12.659 -10.159 7.529 1211 HG21 VAL 62 HG21 VAL 62 -14.563 -9.207 6.005 1212 HG22 VAL 62 HG22 VAL 62 -13.328 -9.240 4.746 1213 HG23 VAL 62 HG23 VAL 62 -14.198 -7.745 5.088 1214 HA PRO 63 HA PRO 63 -17.053 -8.800 9.572 1215 HB2 PRO 63 HB2 PRO 63 -17.983 -9.105 6.749 1216 HB3 PRO 63 HB1 PRO 63 -18.903 -8.660 8.175 1217 HG2 PRO 63 HG2 PRO 63 -18.179 -6.793 6.462 1218 HG3 PRO 63 HG1 PRO 63 -18.058 -6.487 8.204 1219 HD2 PRO 63 HD2 PRO 63 -15.904 -7.088 6.233 1220 HD3 PRO 63 HD1 PRO 63 -15.869 -6.036 7.661 1221 H ALA 64 HN ALA 64 -17.452 -10.918 9.990 1222 HA ALA 64 HA ALA 64 -15.624 -12.844 9.077 1223 HB1 ALA 64 HB1 ALA 64 -16.654 -12.954 11.280 1224 HB2 ALA 64 HB2 ALA 64 -16.940 -14.443 10.378 1225 HB3 ALA 64 HB3 ALA 64 -18.227 -13.248 10.540 1226 H GLY 65 HN GLY 65 -15.604 -13.421 6.992 1227 HA2 GLY 65 HA3 GLY 65 -16.422 -15.078 5.458 1228 HA3 GLY 65 HA2 GLY 65 -18.056 -14.680 5.958 1229 H SER 66 HN SER 66 -17.044 -11.729 5.773 1230 HA SER 66 HA SER 66 -17.907 -11.441 3.009 1231 HB2 SER 66 HB2 SER 66 -17.316 -9.324 5.088 1232 HB3 SER 66 HB1 SER 66 -18.061 -9.055 3.510 1233 HG SER 66 HG SER 66 -19.457 -10.950 4.701 1234 H ASP 67 HN ASP 67 -16.827 -9.738 1.704 1235 HA ASP 67 HA ASP 67 -13.941 -10.103 1.655 1236 HB2 ASP 67 HB2 ASP 67 -15.692 -9.943 -0.346 1237 HB3 ASP 67 HB1 ASP 67 -15.406 -8.225 -0.142 1238 H VAL 68 HN VAL 68 -12.442 -8.331 1.952 1239 HA VAL 68 HA VAL 68 -13.563 -6.278 3.644 1240 HB VAL 68 HB VAL 68 -11.530 -5.878 4.441 1241 HG11 VAL 68 HG11 VAL 68 -9.869 -7.606 4.212 1242 HG12 VAL 68 HG12 VAL 68 -10.674 -8.217 2.766 1243 HG13 VAL 68 HG13 VAL 68 -11.483 -8.306 4.328 1244 HG21 VAL 68 HG21 VAL 68 -10.508 -5.824 1.614 1245 HG22 VAL 68 HG22 VAL 68 -9.512 -5.510 3.036 1246 HG23 VAL 68 HG23 VAL 68 -10.875 -4.451 2.660 1247 H ILE 69 HN ILE 69 -12.582 -6.673 0.363 1248 HA ILE 69 HA ILE 69 -12.291 -3.983 -0.345 1249 HB ILE 69 HB ILE 69 -13.120 -6.378 -1.951 1250 HG12 ILE 69 HG12 ILE 69 -10.859 -6.590 -1.355 1251 HG13 ILE 69 HG11 ILE 69 -10.806 -5.880 -2.961 1252 HG21 ILE 69 HG21 ILE 69 -12.705 -3.537 -2.890 1253 HG22 ILE 69 HG22 ILE 69 -14.128 -4.557 -3.101 1254 HG23 ILE 69 HG23 ILE 69 -12.640 -4.928 -3.975 1255 HD11 ILE 69 HD11 ILE 69 -9.207 -4.796 -1.592 1256 HD12 ILE 69 HD12 ILE 69 -10.428 -4.463 -0.356 1257 HD13 ILE 69 HD13 ILE 69 -10.523 -3.663 -1.923 1258 H SER 70 HN SER 70 -15.039 -6.102 -0.461 1259 HA SER 70 HA SER 70 -16.996 -4.489 -1.458 1260 HB2 SER 70 HB2 SER 70 -17.393 -6.822 -0.880 1261 HB3 SER 70 HB1 SER 70 -17.200 -6.470 0.834 1262 HG SER 70 HG SER 70 -19.158 -5.114 -0.682 1263 H GLU 71 HN GLU 71 -15.611 -4.398 1.768 1264 HA GLU 71 HA GLU 71 -17.472 -2.458 2.773 1265 HB2 GLU 71 HB2 GLU 71 -14.943 -3.440 4.053 1266 HB3 GLU 71 HB1 GLU 71 -16.395 -2.824 4.839 1267 HG2 GLU 71 HG2 GLU 71 -16.705 -5.202 3.130 1268 HG3 GLU 71 HG1 GLU 71 -15.831 -5.413 4.638 1269 H TYR 72 HN TYR 72 -14.255 -2.627 1.538 1270 HA TYR 72 HA TYR 72 -13.415 -0.074 2.494 1271 HB2 TYR 72 HB2 TYR 72 -12.303 -2.110 0.578 1272 HB3 TYR 72 HB1 TYR 72 -11.555 -0.528 0.753 1273 HD1 TYR 72 HD1 TYR 72 -13.065 -1.962 3.716 1274 HD2 TYR 72 HD2 TYR 72 -9.492 -1.708 1.440 1275 HE1 TYR 72 HE1 TYR 72 -11.780 -2.777 5.640 1276 HE2 TYR 72 HE2 TYR 72 -8.198 -2.538 3.358 1277 HH TYR 72 HH TYR 72 -9.787 -3.721 6.246 1278 H VAL 73 HN VAL 73 -14.711 -1.420 -0.458 1279 HA VAL 73 HA VAL 73 -14.607 0.970 -1.974 1280 HB VAL 73 HB VAL 73 -15.881 0.022 -3.632 1281 HG11 VAL 73 HG11 VAL 73 -15.176 -2.310 -3.906 1282 HG12 VAL 73 HG12 VAL 73 -14.568 -2.270 -2.248 1283 HG13 VAL 73 HG13 VAL 73 -13.885 -1.196 -3.468 1284 HG21 VAL 73 HG21 VAL 73 -17.073 -2.114 -1.910 1285 HG22 VAL 73 HG22 VAL 73 -17.598 -1.531 -3.499 1286 HG23 VAL 73 HG23 VAL 73 -17.811 -0.520 -2.067 1287 H LYS 74 HN LYS 74 -16.809 -0.549 0.233 1288 HA LYS 74 HA LYS 74 -19.024 1.195 -0.049 1289 HB2 LYS 74 HB2 LYS 74 -19.344 -0.949 0.828 1290 HB3 LYS 74 HB1 LYS 74 -18.051 -0.766 1.996 1291 HG2 LYS 74 HG2 LYS 74 -19.520 1.088 2.987 1292 HG3 LYS 74 HG1 LYS 74 -20.806 0.351 2.026 1293 HD2 LYS 74 HD2 LYS 74 -20.880 -0.654 4.195 1294 HD3 LYS 74 HD1 LYS 74 -20.181 -1.841 3.087 1295 HE2 LYS 74 HE2 LYS 74 -18.730 -1.949 4.890 1296 HE3 LYS 74 HE1 LYS 74 -17.916 -0.817 3.794 1297 HZ1 LYS 74 HZ1 LYS 74 -18.767 1.016 5.081 1298 HZ2 LYS 74 HZ2 LYS 74 -17.943 -0.041 6.109 1299 HZ3 LYS 74 HZ3 LYS 74 -19.630 -0.025 6.093 1300 H ALA 75 HN ALA 75 -16.064 1.186 1.766 1301 HA ALA 75 HA ALA 75 -16.576 3.300 3.541 1302 HB1 ALA 75 HB1 ALA 75 -14.622 1.833 3.696 1303 HB2 ALA 75 HB2 ALA 75 -14.151 3.531 3.656 1304 HB3 ALA 75 HB3 ALA 75 -13.981 2.532 2.211 1305 H CYS 76 HN CYS 76 -15.316 3.226 0.242 1306 HA CYS 76 HA CYS 76 -15.492 6.147 0.118 1307 HB2 CYS 76 HB2 CYS 76 -13.460 5.238 -0.709 1308 HB3 CYS 76 HB1 CYS 76 -14.296 4.107 -1.760 1309 HG CYS 76 HG CYS 76 -15.451 6.546 -3.098 1310 H ASP 77 HN ASP 77 -17.659 3.823 -0.160 1311 HA ASP 77 HA ASP 77 -18.951 4.302 -2.591 1312 HB2 ASP 77 HB2 ASP 77 -19.639 2.430 -1.346 1313 HB3 ASP 77 HB1 ASP 77 -19.947 3.371 0.103 1314 H GLY 78 HN GLY 78 -18.672 6.247 0.231 1315 HA2 GLY 78 HA3 GLY 78 -20.724 8.093 -0.770 1316 HA3 GLY 78 HA2 GLY 78 -19.983 8.149 0.822 1317 H ILE 79 HN ILE 79 -17.353 7.635 -0.930 1318 HA ILE 79 HA ILE 79 -16.700 10.450 -0.988 1319 HB ILE 79 HB ILE 79 -15.009 8.034 -1.554 1320 HG12 ILE 79 HG12 ILE 79 -15.052 9.818 0.881 1321 HG13 ILE 79 HG11 ILE 79 -15.868 8.258 0.785 1322 HG21 ILE 79 HG21 ILE 79 -13.085 9.561 -1.250 1323 HG22 ILE 79 HG22 ILE 79 -14.215 10.917 -1.243 1324 HG23 ILE 79 HG23 ILE 79 -14.052 9.911 -2.685 1325 HD11 ILE 79 HD11 ILE 79 -12.938 8.539 0.275 1326 HD12 ILE 79 HD12 ILE 79 -13.855 7.094 0.707 1327 HD13 ILE 79 HD13 ILE 79 -13.591 8.366 1.900 1328 H GLY 80 HN GLY 80 -16.430 11.668 -2.766 1329 HA2 GLY 80 HA3 GLY 80 -15.385 11.018 -5.165 1330 HA3 GLY 80 HA2 GLY 80 -17.066 10.562 -5.344 1331 H GLY 81 HN GLY 81 -14.893 13.231 -4.671 1332 HA2 GLY 81 HA3 GLY 81 -14.987 15.256 -5.871 1333 HA3 GLY 81 HA2 GLY 81 -16.675 14.942 -6.237 1334 H ALA 82 HN ALA 82 -18.082 16.197 -5.226 1335 HA ALA 82 HA ALA 82 -17.282 18.275 -3.555 1336 HB1 ALA 82 HB1 ALA 82 -19.304 18.314 -4.936 1337 HB2 ALA 82 HB2 ALA 82 -19.628 18.761 -3.260 1338 HB3 ALA 82 HB3 ALA 82 -20.055 17.152 -3.842 1339 H MET 83 HN MET 83 -18.981 15.279 -2.703 1340 HA MET 83 HA MET 83 -19.067 15.791 0.072 1341 HB2 MET 83 HB2 MET 83 -19.035 13.122 -1.347 1342 HB3 MET 83 HB1 MET 83 -19.538 13.399 0.315 1343 HG2 MET 83 HG2 MET 83 -21.331 14.888 -0.547 1344 HG3 MET 83 HG1 MET 83 -20.878 14.407 -2.178 1345 HE1 MET 83 HE1 MET 83 -24.284 12.541 -1.550 1346 HE2 MET 83 HE2 MET 83 -23.421 13.673 -2.591 1347 HE3 MET 83 HE3 MET 83 -23.825 14.130 -0.935 1348 H HIS 84 HN HIS 84 -16.651 14.469 -2.034 1349 HA HIS 84 HA HIS 84 -14.922 13.377 -0.079 1350 HB2 HIS 84 HB2 HIS 84 -14.577 12.650 -2.302 1351 HB3 HIS 84 HB1 HIS 84 -14.573 14.291 -2.927 1352 HD1 HIS 84 HD1 HIS 84 -12.333 14.629 -3.899 1353 HD2 HIS 84 HD2 HIS 84 -12.141 12.717 -0.221 1354 HE1 HIS 84 HE1 HIS 84 -9.891 14.394 -3.393 1355 HE2 HIS 84 HE2 HIS 84 -9.796 13.347 -1.106 1356 H LYS 85 HN LYS 85 -15.458 16.608 -1.272 1357 HA LYS 85 HA LYS 85 -13.012 17.618 -0.099 1358 HB2 LYS 85 HB2 LYS 85 -15.333 19.151 -1.281 1359 HB3 LYS 85 HB1 LYS 85 -13.722 19.775 -0.951 1360 HG2 LYS 85 HG2 LYS 85 -14.392 17.615 -2.945 1361 HG3 LYS 85 HG1 LYS 85 -14.035 19.303 -3.326 1362 HD2 LYS 85 HD2 LYS 85 -11.788 19.054 -2.493 1363 HD3 LYS 85 HD1 LYS 85 -12.140 17.419 -1.931 1364 HE2 LYS 85 HE2 LYS 85 -10.926 17.300 -4.010 1365 HE3 LYS 85 HE1 LYS 85 -12.579 16.741 -4.262 1366 HZ1 LYS 85 HZ1 LYS 85 -13.121 18.931 -5.165 1367 HZ2 LYS 85 HZ2 LYS 85 -11.888 18.185 -6.048 1368 HZ3 LYS 85 HZ3 LYS 85 -11.515 19.423 -4.965 1369 H ALA 86 HN ALA 86 -16.239 17.073 0.841 1370 HA ALA 86 HA ALA 86 -16.188 18.916 3.077 1371 HB1 ALA 86 HB1 ALA 86 -18.386 17.997 3.602 1372 HB2 ALA 86 HB2 ALA 86 -18.175 16.764 2.358 1373 HB3 ALA 86 HB3 ALA 86 -18.291 18.465 1.905 1374 H MET 87 HN MET 87 -16.062 15.443 2.512 1375 HA MET 87 HA MET 87 -15.835 14.813 5.315 1376 HB2 MET 87 HB2 MET 87 -15.708 13.115 2.824 1377 HB3 MET 87 HB1 MET 87 -15.624 12.473 4.466 1378 HG2 MET 87 HG2 MET 87 -17.821 13.416 4.949 1379 HG3 MET 87 HG1 MET 87 -17.906 14.052 3.313 1380 HE1 MET 87 HE1 MET 87 -17.991 10.718 1.206 1381 HE2 MET 87 HE2 MET 87 -16.509 11.509 1.744 1382 HE3 MET 87 HE3 MET 87 -17.858 12.476 1.148 1383 H LEU 88 HN LEU 88 -13.668 15.676 2.873 1384 HA LEU 88 HA LEU 88 -11.355 14.297 3.430 1385 HB2 LEU 88 HB2 LEU 88 -11.965 16.259 1.777 1386 HB3 LEU 88 HB1 LEU 88 -11.268 17.257 3.029 1387 HG LEU 88 HG LEU 88 -9.233 16.882 2.221 1388 HD11 LEU 88 HD11 LEU 88 -9.161 14.889 3.689 1389 HD12 LEU 88 HD12 LEU 88 -8.188 14.706 2.227 1390 HD13 LEU 88 HD13 LEU 88 -9.756 13.915 2.344 1391 HD21 LEU 88 HD21 LEU 88 -10.640 15.086 0.266 1392 HD22 LEU 88 HD22 LEU 88 -8.986 15.677 0.092 1393 HD23 LEU 88 HD23 LEU 88 -10.338 16.813 0.081 1394 H MET 89 HN MET 89 -12.990 16.639 5.379 1395 HA MET 89 HA MET 89 -10.743 17.105 7.132 1396 HB2 MET 89 HB2 MET 89 -12.388 18.870 6.820 1397 HB3 MET 89 HB1 MET 89 -13.668 17.813 7.398 1398 HG2 MET 89 HG2 MET 89 -12.363 17.667 9.565 1399 HG3 MET 89 HG1 MET 89 -11.406 19.017 8.951 1400 HE1 MET 89 HE1 MET 89 -15.923 19.204 9.866 1401 HE2 MET 89 HE2 MET 89 -14.914 17.770 10.045 1402 HE3 MET 89 HE3 MET 89 -15.304 18.379 8.438 1403 H ALA 90 HN ALA 90 -13.186 14.732 6.804 1404 HA ALA 90 HA ALA 90 -13.023 14.052 9.667 1405 HB1 ALA 90 HB1 ALA 90 -15.202 12.915 9.304 1406 HB2 ALA 90 HB2 ALA 90 -15.188 13.491 7.631 1407 HB3 ALA 90 HB3 ALA 90 -15.258 14.645 8.967 1408 H GLN 91 HN GLN 91 -13.599 12.328 6.578 1409 HA GLN 91 HA GLN 91 -12.941 9.824 7.743 1410 HB2 GLN 91 HB2 GLN 91 -13.077 10.651 4.858 1411 HB3 GLN 91 HB1 GLN 91 -12.924 8.993 5.419 1412 HG2 GLN 91 HG2 GLN 91 -15.061 8.994 6.355 1413 HG3 GLN 91 HG1 GLN 91 -15.181 10.752 6.274 1414 HE21 GLN 91 HE21 GLN 91 -14.012 10.869 3.647 1415 HE22 GLN 91 HE22 GLN 91 -15.259 10.359 2.564 1416 H LEU 92 HN LEU 92 -11.202 12.045 5.599 1417 HA LEU 92 HA LEU 92 -8.805 10.847 5.196 1418 HB2 LEU 92 HB2 LEU 92 -9.540 13.162 4.573 1419 HB3 LEU 92 HB1 LEU 92 -9.031 13.670 6.169 1420 HG LEU 92 HG LEU 92 -7.448 13.959 4.142 1421 HD11 LEU 92 HD11 LEU 92 -5.495 13.750 5.568 1422 HD12 LEU 92 HD12 LEU 92 -6.431 12.785 6.710 1423 HD13 LEU 92 HD13 LEU 92 -6.842 14.478 6.442 1424 HD21 LEU 92 HD21 LEU 92 -6.842 11.112 4.854 1425 HD22 LEU 92 HD22 LEU 92 -5.927 12.130 3.744 1426 HD23 LEU 92 HD23 LEU 92 -7.580 11.663 3.350 1427 H GLU 93 HN GLU 93 -10.146 11.981 8.221 1428 HA GLU 93 HA GLU 93 -7.675 11.249 9.571 1429 HB2 GLU 93 HB2 GLU 93 -9.602 13.428 10.237 1430 HB3 GLU 93 HB1 GLU 93 -8.136 13.040 11.160 1431 HG2 GLU 93 HG2 GLU 93 -6.821 13.366 9.124 1432 HG3 GLU 93 HG1 GLU 93 -8.280 13.843 8.281 Start of MODEL 14 1 H2 PRO 1 HT1 PRO 1 -5.270 -4.022 13.088 2 H3 PRO 1 HT2 PRO 1 -5.610 -2.531 13.670 3 HA PRO 1 HA PRO 1 -6.248 -2.299 11.609 4 HB2 PRO 1 HB2 PRO 1 -4.066 -1.275 10.440 5 HB3 PRO 1 HB1 PRO 1 -4.833 -0.473 11.810 6 HG2 PRO 1 HG2 PRO 1 -2.292 -1.919 11.699 7 HG3 PRO 1 HG1 PRO 1 -2.881 -0.784 12.924 8 HD2 PRO 1 HD2 PRO 1 -2.916 -3.704 12.935 9 HD3 PRO 1 HD1 PRO 1 -3.254 -2.579 14.267 10 H SER 2 HN SER 2 -4.356 -2.336 9.294 11 HA SER 2 HA SER 2 -4.237 -5.063 8.546 12 HB2 SER 2 HB2 SER 2 -2.401 -2.832 7.628 13 HB3 SER 2 HB1 SER 2 -2.753 -4.331 6.779 14 HG SER 2 HG SER 2 -3.888 -2.213 6.238 15 H PHE 3 HN PHE 3 -2.016 -6.160 8.201 16 HA PHE 3 HA PHE 3 -0.342 -5.924 10.486 17 HB2 PHE 3 HB2 PHE 3 1.251 -6.980 8.463 18 HB3 PHE 3 HB1 PHE 3 0.303 -7.912 9.619 19 HD1 PHE 3 HD1 PHE 3 0.783 -6.940 6.205 20 HD2 PHE 3 HD2 PHE 3 -1.989 -8.692 8.927 21 HE1 PHE 3 HE1 PHE 3 -0.447 -7.940 4.339 22 HE2 PHE 3 HE2 PHE 3 -3.235 -9.669 7.049 23 HZ PHE 3 HZ PHE 3 -2.462 -9.292 4.741 24 H ASN 4 HN ASN 4 -0.226 -4.819 7.174 25 HA ASN 4 HA ASN 4 2.433 -3.762 7.504 26 HB2 ASN 4 HB2 ASN 4 2.299 -3.417 5.097 27 HB3 ASN 4 HB1 ASN 4 1.823 -5.058 5.528 28 HD21 ASN 4 HD21 ASN 4 0.575 -1.864 4.702 29 HD22 ASN 4 HD22 ASN 4 -0.936 -2.431 4.067 30 H THR 5 HN THR 5 -0.404 -2.384 8.315 31 HA THR 5 HA THR 5 -0.496 -0.009 6.770 32 HB THR 5 HB THR 5 -1.522 0.803 9.099 33 HG1 THR 5 HG1 THR 5 -1.279 -0.894 10.403 34 HG21 THR 5 HG21 THR 5 -2.807 0.760 7.116 35 HG22 THR 5 HG22 THR 5 -3.685 -0.180 8.327 36 HG23 THR 5 HG23 THR 5 -2.770 -1.001 7.065 37 H VAL 6 HN VAL 6 1.786 -1.063 8.990 38 HA VAL 6 HA VAL 6 2.535 1.459 10.071 39 HB VAL 6 HB VAL 6 4.322 0.358 11.092 40 HG11 VAL 6 HG11 VAL 6 2.213 -0.533 11.898 41 HG12 VAL 6 HG12 VAL 6 3.470 -1.769 11.947 42 HG13 VAL 6 HG13 VAL 6 2.259 -1.794 10.664 43 HG21 VAL 6 HG21 VAL 6 5.453 -1.582 10.306 44 HG22 VAL 6 HG22 VAL 6 5.248 -0.497 8.917 45 HG23 VAL 6 HG23 VAL 6 4.189 -1.900 9.110 46 H ARG 7 HN ARG 7 3.849 2.980 9.106 47 HA ARG 7 HA ARG 7 5.537 2.097 6.978 48 HB2 ARG 7 HB2 ARG 7 4.499 3.533 5.261 49 HB3 ARG 7 HB1 ARG 7 3.608 2.110 5.768 50 HG2 ARG 7 HG2 ARG 7 2.600 4.063 7.386 51 HG3 ARG 7 HG1 ARG 7 2.833 4.871 5.829 52 HD2 ARG 7 HD2 ARG 7 1.642 3.059 4.709 53 HD3 ARG 7 HD1 ARG 7 1.409 2.245 6.253 54 HE ARG 7 HE ARG 7 0.185 4.462 6.834 55 HH11 ARG 7 HH11 ARG 7 0.134 2.811 3.746 56 HH12 ARG 7 HH12 ARG 7 -1.327 3.567 3.225 57 HH21 ARG 7 HH21 ARG 7 -1.741 5.473 6.146 58 HH22 ARG 7 HH22 ARG 7 -2.402 5.091 4.589 59 H GLN 8 HN GLN 8 6.763 3.632 5.967 60 HA GLN 8 HA GLN 8 8.339 5.124 7.578 61 HB2 GLN 8 HB2 GLN 8 8.166 4.491 4.876 62 HB3 GLN 8 HB1 GLN 8 8.245 6.245 4.895 63 HG2 GLN 8 HG2 GLN 8 10.281 6.112 6.251 64 HG3 GLN 8 HG1 GLN 8 10.206 4.353 6.168 65 HE21 GLN 8 HE21 GLN 8 12.326 6.009 5.251 66 HE22 GLN 8 HE22 GLN 8 12.449 5.787 3.529 67 H GLY 9 HN GLY 9 7.659 6.667 8.890 68 HA2 GLY 9 HA3 GLY 9 5.684 8.622 8.111 69 HA3 GLY 9 HA2 GLY 9 6.584 8.582 9.622 70 H SER 10 HN SER 10 7.399 10.593 9.783 71 HA SER 10 HA SER 10 8.293 12.143 7.598 72 HB2 SER 10 HB2 SER 10 7.586 12.990 9.889 73 HB3 SER 10 HB1 SER 10 9.162 12.461 10.477 74 HG SER 10 HG SER 10 8.483 14.656 8.982 75 H LYS 11 HN LYS 11 9.814 11.284 6.334 76 HA LYS 11 HA LYS 11 11.588 10.023 5.654 77 HB2 LYS 11 HB2 LYS 11 13.737 11.075 6.085 78 HB3 LYS 11 HB1 LYS 11 12.530 12.279 5.683 79 HG2 LYS 11 HG2 LYS 11 13.149 11.687 8.550 80 HG3 LYS 11 HG1 LYS 11 14.212 12.726 7.603 81 HD2 LYS 11 HD2 LYS 11 12.372 14.226 7.121 82 HD3 LYS 11 HD1 LYS 11 11.245 13.151 7.950 83 HE2 LYS 11 HE2 LYS 11 12.486 13.509 10.045 84 HE3 LYS 11 HE1 LYS 11 13.554 14.630 9.205 85 HZ1 LYS 11 HZ1 LYS 11 10.619 14.970 9.489 86 HZ2 LYS 11 HZ2 LYS 11 11.691 16.066 8.772 87 HZ3 LYS 11 HZ3 LYS 11 11.783 15.758 10.430 88 H GLU 12 HN GLU 12 10.406 8.605 7.596 89 HA GLU 12 HA GLU 12 11.949 7.775 9.773 90 HB2 GLU 12 HB2 GLU 12 9.579 7.299 9.522 91 HB3 GLU 12 HB1 GLU 12 9.887 6.312 8.108 92 HG2 GLU 12 HG2 GLU 12 11.097 4.694 9.533 93 HG3 GLU 12 HG1 GLU 12 10.733 5.703 10.936 94 HA PRO 13 HA PRO 13 15.321 5.403 8.006 95 HB2 PRO 13 HB2 PRO 13 14.737 3.442 10.144 96 HB3 PRO 13 HB1 PRO 13 16.253 4.256 9.764 97 HG2 PRO 13 HG2 PRO 13 14.783 4.925 11.902 98 HG3 PRO 13 HG1 PRO 13 15.704 6.118 10.980 99 HD2 PRO 13 HD2 PRO 13 12.778 5.615 11.030 100 HD3 PRO 13 HD1 PRO 13 13.657 7.129 10.777 101 H TYR 14 HN TYR 14 15.161 4.063 6.314 102 HA TYR 14 HA TYR 14 12.577 3.027 5.827 103 HB2 TYR 14 HB2 TYR 14 13.841 4.106 4.053 104 HB3 TYR 14 HB1 TYR 14 15.016 2.794 4.089 105 HD1 TYR 14 HD1 TYR 14 14.161 0.457 3.671 106 HD2 TYR 14 HD2 TYR 14 11.924 3.910 2.768 107 HE1 TYR 14 HE1 TYR 14 12.793 -0.868 2.149 108 HE2 TYR 14 HE2 TYR 14 10.525 2.628 1.224 109 HH TYR 14 HH TYR 14 10.352 0.657 0.136 110 HA PRO 15 HA PRO 15 14.723 -1.326 5.502 111 HB2 PRO 15 HB2 PRO 15 16.900 -1.053 7.464 112 HB3 PRO 15 HB1 PRO 15 16.898 -1.864 5.902 113 HG2 PRO 15 HG2 PRO 15 18.175 0.462 6.320 114 HG3 PRO 15 HG1 PRO 15 17.471 0.034 4.768 115 HD2 PRO 15 HD2 PRO 15 16.510 1.959 6.814 116 HD3 PRO 15 HD1 PRO 15 16.319 1.983 5.054 117 H ASP 16 HN ASP 16 14.409 0.772 8.068 118 HA ASP 16 HA ASP 16 13.717 -1.198 10.066 119 HB2 ASP 16 HB2 ASP 16 14.180 1.748 10.041 120 HB3 ASP 16 HB1 ASP 16 13.182 1.087 11.328 121 H PHE 17 HN PHE 17 12.217 1.446 8.267 122 HA PHE 17 HA PHE 17 9.619 1.263 9.241 123 HB2 PHE 17 HB2 PHE 17 9.479 2.983 7.771 124 HB3 PHE 17 HB1 PHE 17 10.960 2.469 6.973 125 HD1 PHE 17 HD1 PHE 17 10.894 1.531 4.832 126 HD2 PHE 17 HD2 PHE 17 7.319 1.901 7.084 127 HE1 PHE 17 HE1 PHE 17 9.588 0.889 2.856 128 HE2 PHE 17 HE2 PHE 17 5.995 1.272 5.109 129 HZ PHE 17 HZ PHE 17 7.132 0.765 2.990 130 H VAL 18 HN VAL 18 11.247 -0.493 6.667 131 HA VAL 18 HA VAL 18 8.927 -2.043 6.068 132 HB VAL 18 HB VAL 18 10.250 -1.702 4.184 133 HG11 VAL 18 HG11 VAL 18 12.295 -0.997 5.297 134 HG12 VAL 18 HG12 VAL 18 12.642 -2.236 4.080 135 HG13 VAL 18 HG13 VAL 18 12.608 -2.658 5.803 136 HG21 VAL 18 HG21 VAL 18 9.488 -3.945 4.210 137 HG22 VAL 18 HG22 VAL 18 10.778 -4.435 5.314 138 HG23 VAL 18 HG23 VAL 18 11.163 -3.974 3.650 139 H ALA 19 HN ALA 19 11.895 -2.573 7.942 140 HA ALA 19 HA ALA 19 11.600 -5.336 8.325 141 HB1 ALA 19 HB1 ALA 19 13.002 -5.094 10.295 142 HB2 ALA 19 HB2 ALA 19 12.719 -3.353 10.315 143 HB3 ALA 19 HB3 ALA 19 13.619 -4.085 8.987 144 H ARG 20 HN ARG 20 9.892 -2.667 9.883 145 HA ARG 20 HA ARG 20 8.645 -4.515 11.739 146 HB2 ARG 20 HB2 ARG 20 7.279 -2.593 12.472 147 HB3 ARG 20 HB1 ARG 20 8.998 -2.278 12.597 148 HG2 ARG 20 HG2 ARG 20 8.971 -0.727 10.884 149 HG3 ARG 20 HG1 ARG 20 7.476 -1.365 10.193 150 HD2 ARG 20 HD2 ARG 20 6.179 -0.473 11.980 151 HD3 ARG 20 HD1 ARG 20 7.614 -0.059 12.896 152 HE ARG 20 HE ARG 20 7.953 1.443 10.720 153 HH11 ARG 20 HH11 ARG 20 5.141 0.943 12.751 154 HH12 ARG 20 HH12 ARG 20 4.482 2.518 12.446 155 HH21 ARG 20 HH21 ARG 20 7.115 3.542 10.357 156 HH22 ARG 20 HH22 ARG 20 5.599 3.991 11.087 157 H LEU 21 HN LEU 21 8.135 -2.967 8.714 158 HA LEU 21 HA LEU 21 5.473 -3.518 8.214 159 HB2 LEU 21 HB2 LEU 21 7.323 -2.277 6.841 160 HB3 LEU 21 HB1 LEU 21 7.611 -3.845 6.129 161 HG LEU 21 HG LEU 21 5.579 -3.844 4.990 162 HD11 LEU 21 HD11 LEU 21 4.039 -3.298 6.717 163 HD12 LEU 21 HD12 LEU 21 3.809 -2.115 5.424 164 HD13 LEU 21 HD13 LEU 21 4.709 -1.678 6.881 165 HD21 LEU 21 HD21 LEU 21 5.472 -1.631 3.898 166 HD22 LEU 21 HD22 LEU 21 7.100 -2.301 4.001 167 HD23 LEU 21 HD23 LEU 21 6.595 -1.027 5.112 168 H GLN 22 HN GLN 22 8.357 -5.479 7.619 169 HA GLN 22 HA GLN 22 7.041 -7.811 6.780 170 HB2 GLN 22 HB2 GLN 22 9.682 -7.846 8.176 171 HB3 GLN 22 HB1 GLN 22 9.102 -8.844 6.838 172 HG2 GLN 22 HG2 GLN 22 9.238 -6.863 5.408 173 HG3 GLN 22 HG1 GLN 22 9.902 -5.961 6.758 174 HE21 GLN 22 HE21 GLN 22 11.077 -6.401 4.290 175 HE22 GLN 22 HE22 GLN 22 12.537 -7.294 4.509 176 H ASP 23 HN ASP 23 8.421 -6.797 9.819 177 HA ASP 23 HA ASP 23 8.173 -9.061 11.335 178 HB2 ASP 23 HB2 ASP 23 9.019 -6.738 11.988 179 HB3 ASP 23 HB1 ASP 23 7.338 -6.387 12.375 180 H VAL 24 HN VAL 24 5.649 -6.594 10.930 181 HA VAL 24 HA VAL 24 3.849 -8.184 12.519 182 HB VAL 24 HB VAL 24 3.776 -5.778 12.808 183 HG11 VAL 24 HG11 VAL 24 3.045 -4.296 10.998 184 HG12 VAL 24 HG12 VAL 24 3.062 -5.667 9.891 185 HG13 VAL 24 HG13 VAL 24 4.564 -5.110 10.630 186 HG21 VAL 24 HG21 VAL 24 1.302 -6.840 11.448 187 HG22 VAL 24 HG22 VAL 24 1.352 -5.331 12.364 188 HG23 VAL 24 HG23 VAL 24 1.663 -6.871 13.173 189 H ALA 25 HN ALA 25 4.605 -7.698 9.198 190 HA ALA 25 HA ALA 25 2.155 -8.769 8.149 191 HB1 ALA 25 HB1 ALA 25 4.896 -8.598 6.880 192 HB2 ALA 25 HB2 ALA 25 3.618 -7.392 6.732 193 HB3 ALA 25 HB3 ALA 25 3.398 -8.999 6.040 194 H GLN 26 HN GLN 26 4.954 -9.865 9.649 195 HA GLN 26 HA GLN 26 4.720 -12.596 8.759 196 HB2 GLN 26 HB2 GLN 26 6.894 -12.373 9.196 197 HB3 GLN 26 HB1 GLN 26 6.602 -10.885 10.078 198 HG2 GLN 26 HG2 GLN 26 7.520 -12.124 11.712 199 HG3 GLN 26 HG1 GLN 26 5.829 -12.548 11.956 200 HE21 GLN 26 HE21 GLN 26 5.723 -14.168 9.554 201 HE22 GLN 26 HE22 GLN 26 6.539 -15.635 9.920 202 H LYS 27 HN LYS 27 4.079 -10.635 11.564 203 HA LYS 27 HA LYS 27 3.218 -12.659 13.329 204 HB2 LYS 27 HB2 LYS 27 2.340 -9.768 13.231 205 HB3 LYS 27 HB1 LYS 27 2.245 -10.843 14.629 206 HG2 LYS 27 HG2 LYS 27 4.753 -9.866 13.289 207 HG3 LYS 27 HG1 LYS 27 4.118 -9.338 14.848 208 HD2 LYS 27 HD2 LYS 27 4.683 -11.323 15.890 209 HD3 LYS 27 HD1 LYS 27 4.710 -12.228 14.377 210 HE2 LYS 27 HE2 LYS 27 6.763 -11.327 13.737 211 HE3 LYS 27 HE1 LYS 27 6.656 -10.027 14.920 212 HZ1 LYS 27 HZ1 LYS 27 6.855 -11.745 16.671 213 HZ2 LYS 27 HZ2 LYS 27 8.221 -11.652 15.683 214 HZ3 LYS 27 HZ3 LYS 27 7.110 -12.910 15.472 215 H SER 28 HN SER 28 1.549 -10.892 10.802 216 HA SER 28 HA SER 28 -1.011 -11.897 11.815 217 HB2 SER 28 HB2 SER 28 -0.469 -9.694 9.838 218 HB3 SER 28 HB1 SER 28 -2.025 -10.074 10.583 219 HG SER 28 HG SER 28 0.277 -8.905 11.717 220 H ILE 29 HN ILE 29 1.312 -12.501 9.534 221 HA ILE 29 HA ILE 29 -0.656 -13.754 7.731 222 HB ILE 29 HB ILE 29 2.095 -12.707 7.104 223 HG12 ILE 29 HG12 ILE 29 -0.594 -11.870 6.017 224 HG13 ILE 29 HG11 ILE 29 0.332 -10.994 7.240 225 HG21 ILE 29 HG21 ILE 29 1.702 -13.356 4.799 226 HG22 ILE 29 HG22 ILE 29 0.196 -14.150 5.277 227 HG23 ILE 29 HG23 ILE 29 1.744 -14.750 5.879 228 HD11 ILE 29 HD11 ILE 29 2.090 -10.565 5.712 229 HD12 ILE 29 HD12 ILE 29 0.571 -10.107 4.932 230 HD13 ILE 29 HD13 ILE 29 1.368 -11.628 4.497 231 H ALA 30 HN ALA 30 -0.594 -15.910 7.582 232 HA ALA 30 HA ALA 30 1.612 -17.375 8.804 233 HB1 ALA 30 HB1 ALA 30 -0.975 -18.372 7.622 234 HB2 ALA 30 HB2 ALA 30 -0.682 -18.038 9.328 235 HB3 ALA 30 HB3 ALA 30 0.196 -19.337 8.519 236 H ASP 31 HN ASP 31 0.836 -16.130 5.849 237 HA ASP 31 HA ASP 31 2.107 -18.257 4.279 238 HB2 ASP 31 HB2 ASP 31 0.212 -16.052 3.721 239 HB3 ASP 31 HB1 ASP 31 1.384 -16.390 2.459 240 H GLU 32 HN GLU 32 4.296 -18.028 4.353 241 HA GLU 32 HA GLU 32 5.721 -15.638 4.686 242 HB2 GLU 32 HB2 GLU 32 7.658 -16.858 3.829 243 HB3 GLU 32 HB1 GLU 32 6.729 -17.884 4.914 244 HG2 GLU 32 HG2 GLU 32 5.679 -18.947 2.940 245 HG3 GLU 32 HG1 GLU 32 6.725 -17.976 1.908 246 H LYS 33 HN LYS 33 4.165 -16.969 1.903 247 HA LYS 33 HA LYS 33 5.524 -15.427 -0.076 248 HB2 LYS 33 HB2 LYS 33 2.799 -16.732 -0.136 249 HB3 LYS 33 HB1 LYS 33 3.585 -16.001 -1.524 250 HG2 LYS 33 HG2 LYS 33 4.207 -18.141 -1.898 251 HG3 LYS 33 HG1 LYS 33 5.516 -17.691 -0.804 252 HD2 LYS 33 HD2 LYS 33 4.643 -19.809 -0.107 253 HD3 LYS 33 HD1 LYS 33 4.173 -18.592 1.080 254 HE2 LYS 33 HE2 LYS 33 2.334 -20.124 0.579 255 HE3 LYS 33 HE1 LYS 33 1.948 -18.470 0.111 256 HZ1 LYS 33 HZ1 LYS 33 2.403 -19.014 -2.177 257 HZ2 LYS 33 HZ2 LYS 33 1.282 -20.117 -1.559 258 HZ3 LYS 33 HZ3 LYS 33 2.897 -20.580 -1.753 259 H ALA 34 HN ALA 34 2.360 -15.137 1.487 260 HA ALA 34 HA ALA 34 1.776 -12.590 0.441 261 HB1 ALA 34 HB1 ALA 34 0.038 -14.042 1.334 262 HB2 ALA 34 HB2 ALA 34 0.036 -12.487 2.165 263 HB3 ALA 34 HB3 ALA 34 0.733 -13.904 2.949 264 H ARG 35 HN ARG 35 3.784 -13.678 3.032 265 HA ARG 35 HA ARG 35 3.842 -11.257 4.542 266 HB2 ARG 35 HB2 ARG 35 4.638 -13.681 5.186 267 HB3 ARG 35 HB1 ARG 35 6.152 -13.169 4.453 268 HG2 ARG 35 HG2 ARG 35 4.882 -11.452 6.550 269 HG3 ARG 35 HG1 ARG 35 5.769 -12.899 7.018 270 HD2 ARG 35 HD2 ARG 35 6.848 -10.552 5.453 271 HD3 ARG 35 HD1 ARG 35 7.204 -10.972 7.138 272 HE ARG 35 HE ARG 35 8.064 -13.159 6.015 273 HH11 ARG 35 HH11 ARG 35 8.414 -9.924 4.710 274 HH12 ARG 35 HH12 ARG 35 9.910 -10.272 3.906 275 HH21 ARG 35 HH21 ARG 35 10.027 -13.613 4.962 276 HH22 ARG 35 HH22 ARG 35 10.830 -12.373 4.055 277 H LYS 36 HN LYS 36 6.192 -12.742 2.296 278 HA LYS 36 HA LYS 36 7.899 -10.578 1.967 279 HB2 LYS 36 HB2 LYS 36 6.959 -12.376 -0.258 280 HB3 LYS 36 HB1 LYS 36 8.455 -11.456 -0.210 281 HG2 LYS 36 HG2 LYS 36 9.504 -12.972 1.057 282 HG3 LYS 36 HG1 LYS 36 8.030 -13.410 1.950 283 HD2 LYS 36 HD2 LYS 36 8.827 -15.208 0.422 284 HD3 LYS 36 HD1 LYS 36 7.185 -14.622 0.081 285 HE2 LYS 36 HE2 LYS 36 8.019 -13.245 -1.731 286 HE3 LYS 36 HE1 LYS 36 9.682 -13.686 -1.362 287 HZ1 LYS 36 HZ1 LYS 36 8.863 -14.934 -3.239 288 HZ2 LYS 36 HZ2 LYS 36 7.558 -15.520 -2.341 289 HZ3 LYS 36 HZ3 LYS 36 9.134 -15.988 -1.943 290 H VAL 37 HN VAL 37 5.136 -11.481 -0.066 291 HA VAL 37 HA VAL 37 5.518 -9.518 -1.954 292 HB VAL 37 HB VAL 37 3.237 -9.837 -2.721 293 HG11 VAL 37 HG11 VAL 37 4.533 -12.404 -1.769 294 HG12 VAL 37 HG12 VAL 37 4.849 -11.561 -3.291 295 HG13 VAL 37 HG13 VAL 37 3.272 -12.297 -3.002 296 HG21 VAL 37 HG21 VAL 37 1.748 -11.416 -1.435 297 HG22 VAL 37 HG22 VAL 37 1.958 -9.808 -0.743 298 HG23 VAL 37 HG23 VAL 37 2.834 -11.178 -0.064 299 H ILE 38 HN ILE 38 3.758 -9.260 1.113 300 HA ILE 38 HA ILE 38 2.840 -6.645 0.309 301 HB ILE 38 HB ILE 38 1.649 -8.467 1.925 302 HG12 ILE 38 HG12 ILE 38 1.244 -5.499 2.159 303 HG13 ILE 38 HG11 ILE 38 0.774 -6.405 0.728 304 HG21 ILE 38 HG21 ILE 38 3.256 -8.051 3.752 305 HG22 ILE 38 HG22 ILE 38 1.611 -7.593 4.191 306 HG23 ILE 38 HG23 ILE 38 2.783 -6.349 3.751 307 HD11 ILE 38 HD11 ILE 38 -1.162 -6.179 1.960 308 HD12 ILE 38 HD12 ILE 38 -0.339 -6.444 3.483 309 HD13 ILE 38 HD13 ILE 38 -0.610 -7.801 2.382 310 H VAL 39 HN VAL 39 5.408 -7.941 2.315 311 HA VAL 39 HA VAL 39 5.958 -5.367 3.434 312 HB VAL 39 HB VAL 39 7.859 -6.229 4.424 313 HG11 VAL 39 HG11 VAL 39 5.939 -8.499 4.027 314 HG12 VAL 39 HG12 VAL 39 5.983 -7.330 5.347 315 HG13 VAL 39 HG13 VAL 39 7.264 -8.538 5.183 316 HG21 VAL 39 HG21 VAL 39 7.996 -8.418 2.357 317 HG22 VAL 39 HG22 VAL 39 9.092 -8.220 3.726 318 HG23 VAL 39 HG23 VAL 39 9.048 -7.007 2.447 319 H GLU 40 HN GLU 40 7.366 -7.250 0.790 320 HA GLU 40 HA GLU 40 9.077 -5.320 -0.234 321 HB2 GLU 40 HB2 GLU 40 7.650 -7.492 -1.753 322 HB3 GLU 40 HB1 GLU 40 9.166 -6.750 -2.176 323 HG2 GLU 40 HG2 GLU 40 9.283 -7.817 0.463 324 HG3 GLU 40 HG1 GLU 40 8.752 -9.029 -0.675 325 H LEU 41 HN LEU 41 5.640 -5.707 -0.550 326 HA LEU 41 HA LEU 41 5.448 -3.806 -2.725 327 HB2 LEU 41 HB2 LEU 41 3.762 -5.753 -1.653 328 HB3 LEU 41 HB1 LEU 41 2.974 -4.227 -1.298 329 HG LEU 41 HG LEU 41 2.067 -4.794 -3.340 330 HD11 LEU 41 HD11 LEU 41 3.193 -2.537 -3.285 331 HD12 LEU 41 HD12 LEU 41 2.793 -3.193 -4.864 332 HD13 LEU 41 HD13 LEU 41 4.455 -3.256 -4.285 333 HD21 LEU 41 HD21 LEU 41 3.315 -5.728 -5.208 334 HD22 LEU 41 HD22 LEU 41 3.466 -6.732 -3.767 335 HD23 LEU 41 HD23 LEU 41 4.796 -5.679 -4.249 336 H MET 42 HN MET 42 4.299 -3.811 0.667 337 HA MET 42 HA MET 42 3.405 -1.140 0.661 338 HB2 MET 42 HB2 MET 42 4.294 -2.861 2.973 339 HB3 MET 42 HB1 MET 42 3.430 -1.326 3.143 340 HG2 MET 42 HG2 MET 42 2.454 -3.872 1.870 341 HG3 MET 42 HG1 MET 42 1.895 -3.130 3.357 342 HE1 MET 42 HE1 MET 42 -0.573 -3.466 2.471 343 HE2 MET 42 HE2 MET 42 0.057 -4.143 0.967 344 HE3 MET 42 HE3 MET 42 -1.140 -2.848 0.916 345 H ALA 43 HN ALA 43 6.473 -2.576 1.005 346 HA ALA 43 HA ALA 43 8.102 -0.689 2.067 347 HB1 ALA 43 HB1 ALA 43 8.448 -2.369 -0.401 348 HB2 ALA 43 HB2 ALA 43 8.953 -2.749 1.246 349 HB3 ALA 43 HB3 ALA 43 9.753 -1.452 0.352 350 H TYR 44 HN TYR 44 6.293 -0.555 -0.921 351 HA TYR 44 HA TYR 44 7.477 2.067 -1.603 352 HB2 TYR 44 HB2 TYR 44 7.578 0.526 -3.465 353 HB3 TYR 44 HB1 TYR 44 5.910 0.060 -3.201 354 HD1 TYR 44 HD1 TYR 44 8.111 2.360 -4.912 355 HD2 TYR 44 HD2 TYR 44 4.073 1.692 -3.798 356 HE1 TYR 44 HE1 TYR 44 7.391 3.939 -6.643 357 HE2 TYR 44 HE2 TYR 44 3.333 3.272 -5.520 358 HH TYR 44 HH TYR 44 5.241 4.295 -8.016 359 H GLU 45 HN GLU 45 4.395 0.377 -1.945 360 HA GLU 45 HA GLU 45 2.739 2.468 -2.252 361 HB2 GLU 45 HB2 GLU 45 1.913 0.158 -0.572 362 HB3 GLU 45 HB1 GLU 45 0.968 1.035 -1.764 363 HG2 GLU 45 HG2 GLU 45 3.255 -0.803 -2.307 364 HG3 GLU 45 HG1 GLU 45 1.565 -1.197 -2.525 365 H ASN 46 HN ASN 46 4.110 1.341 0.783 366 HA ASN 46 HA ASN 46 2.371 3.151 2.261 367 HB2 ASN 46 HB2 ASN 46 3.732 0.576 2.859 368 HB3 ASN 46 HB1 ASN 46 3.531 1.721 4.177 369 HD21 ASN 46 HD21 ASN 46 2.001 0.339 5.252 370 HD22 ASN 46 HD22 ASN 46 0.409 0.173 4.654 371 H ALA 47 HN ALA 47 5.609 2.797 1.188 372 HA ALA 47 HA ALA 47 7.088 3.847 3.347 373 HB1 ALA 47 HB1 ALA 47 8.861 4.213 1.769 374 HB2 ALA 47 HB2 ALA 47 7.730 4.082 0.424 375 HB3 ALA 47 HB3 ALA 47 8.067 2.674 1.432 376 H ASN 48 HN ASN 48 8.594 5.927 2.726 377 HA ASN 48 HA ASN 48 7.114 8.287 2.976 378 HB2 ASN 48 HB2 ASN 48 9.741 7.970 1.479 379 HB3 ASN 48 HB1 ASN 48 9.045 9.499 1.964 380 HD21 ASN 48 HD21 ASN 48 8.359 8.195 4.697 381 HD22 ASN 48 HD22 ASN 48 9.884 8.245 5.492 382 HA PRO 49 HA PRO 49 5.265 8.639 -1.107 383 HB2 PRO 49 HB2 PRO 49 5.172 11.402 -1.205 384 HB3 PRO 49 HB1 PRO 49 3.940 10.385 -0.460 385 HG2 PRO 49 HG2 PRO 49 6.182 11.895 0.804 386 HG3 PRO 49 HG1 PRO 49 4.526 11.643 1.386 387 HD2 PRO 49 HD2 PRO 49 6.613 10.266 2.378 388 HD3 PRO 49 HD1 PRO 49 5.004 9.537 2.211 389 H GLU 50 HN GLU 50 8.153 10.121 -0.045 390 HA GLU 50 HA GLU 50 9.243 10.721 -2.629 391 HB2 GLU 50 HB2 GLU 50 10.093 12.204 -1.116 392 HB3 GLU 50 HB1 GLU 50 10.028 11.061 0.215 393 HG2 GLU 50 HG2 GLU 50 12.226 10.988 -0.036 394 HG3 GLU 50 HG1 GLU 50 11.863 9.928 -1.371 395 H CYS 51 HN CYS 51 9.377 8.183 -0.176 396 HA CYS 51 HA CYS 51 11.784 7.104 -1.256 397 HB2 CYS 51 HB2 CYS 51 11.427 6.935 1.095 398 HB3 CYS 51 HB1 CYS 51 9.928 6.038 0.870 399 HG CYS 51 HG CYS 51 11.642 4.176 -0.797 400 H GLN 52 HN GLN 52 8.371 6.404 -1.364 401 HA GLN 52 HA GLN 52 8.713 3.991 -2.853 402 HB2 GLN 52 HB2 GLN 52 6.383 4.179 -3.409 403 HB3 GLN 52 HB1 GLN 52 6.589 4.581 -1.712 404 HG2 GLN 52 HG2 GLN 52 6.530 6.987 -2.373 405 HG3 GLN 52 HG1 GLN 52 6.084 6.462 -3.997 406 HE21 GLN 52 HE21 GLN 52 4.683 4.159 -2.930 407 HE22 GLN 52 HE22 GLN 52 3.205 4.723 -2.274 408 H SER 53 HN SER 53 8.641 7.326 -3.375 409 HA SER 53 HA SER 53 8.700 7.297 -6.199 410 HB2 SER 53 HB2 SER 53 9.278 9.282 -4.050 411 HB3 SER 53 HB1 SER 53 9.582 9.682 -5.750 412 HG SER 53 HG SER 53 7.235 9.555 -4.383 413 H ALA 54 HN ALA 54 11.050 6.804 -3.689 414 HA ALA 54 HA ALA 54 13.261 6.848 -5.547 415 HB1 ALA 54 HB1 ALA 54 12.974 5.725 -2.771 416 HB2 ALA 54 HB2 ALA 54 13.734 7.246 -3.238 417 HB3 ALA 54 HB3 ALA 54 14.480 5.716 -3.692 418 H ILE 55 HN ILE 55 10.829 4.674 -4.604 419 HA ILE 55 HA ILE 55 12.314 2.312 -5.328 420 HB ILE 55 HB ILE 55 9.648 2.757 -4.062 421 HG12 ILE 55 HG12 ILE 55 11.912 1.190 -2.934 422 HG13 ILE 55 HG11 ILE 55 12.015 2.956 -2.954 423 HG21 ILE 55 HG21 ILE 55 9.502 0.322 -3.770 424 HG22 ILE 55 HG22 ILE 55 10.907 0.135 -4.819 425 HG23 ILE 55 HG23 ILE 55 9.410 0.806 -5.463 426 HD11 ILE 55 HD11 ILE 55 9.786 1.353 -1.719 427 HD12 ILE 55 HD12 ILE 55 9.979 3.114 -1.683 428 HD13 ILE 55 HD13 ILE 55 11.149 2.076 -0.850 429 H LYS 56 HN LYS 56 9.663 4.207 -6.735 430 HA LYS 56 HA LYS 56 8.285 2.378 -8.154 431 HB2 LYS 56 HB2 LYS 56 8.788 4.437 -10.070 432 HB3 LYS 56 HB1 LYS 56 7.316 4.049 -9.204 433 HG2 LYS 56 HG2 LYS 56 7.616 6.221 -8.602 434 HG3 LYS 56 HG1 LYS 56 8.478 5.413 -7.289 435 HD2 LYS 56 HD2 LYS 56 10.488 6.057 -8.014 436 HD3 LYS 56 HD1 LYS 56 10.040 5.996 -9.719 437 HE2 LYS 56 HE2 LYS 56 9.718 8.242 -7.732 438 HE3 LYS 56 HE1 LYS 56 10.359 8.258 -9.378 439 HZ1 LYS 56 HZ1 LYS 56 7.492 7.946 -8.670 440 HZ2 LYS 56 HZ2 LYS 56 8.121 7.914 -10.239 441 HZ3 LYS 56 HZ3 LYS 56 8.217 9.329 -9.324 442 HA PRO 57 HA PRO 57 11.622 2.061 -11.750 443 HB2 PRO 57 HB2 PRO 57 14.179 2.083 -10.828 444 HB3 PRO 57 HB1 PRO 57 13.372 3.530 -11.450 445 HG2 PRO 57 HG2 PRO 57 13.597 2.587 -8.604 446 HG3 PRO 57 HG1 PRO 57 14.022 4.184 -9.269 447 HD2 PRO 57 HD2 PRO 57 11.699 3.841 -8.076 448 HD3 PRO 57 HD1 PRO 57 11.736 4.739 -9.603 449 H LEU 58 HN LEU 58 12.091 0.971 -8.442 450 HA LEU 58 HA LEU 58 13.052 -1.654 -9.305 451 HB2 LEU 58 HB2 LEU 58 12.514 -1.067 -6.453 452 HB3 LEU 58 HB1 LEU 58 13.822 -2.004 -7.169 453 HG LEU 58 HG LEU 58 13.630 1.017 -7.103 454 HD11 LEU 58 HD11 LEU 58 15.457 0.824 -5.453 455 HD12 LEU 58 HD12 LEU 58 15.244 -0.926 -5.462 456 HD13 LEU 58 HD13 LEU 58 13.942 0.116 -4.892 457 HD21 LEU 58 HD21 LEU 58 15.959 0.969 -7.851 458 HD22 LEU 58 HD22 LEU 58 14.888 0.217 -9.032 459 HD23 LEU 58 HD23 LEU 58 15.887 -0.790 -7.981 460 H LYS 59 HN LYS 59 10.331 0.073 -8.379 461 HA LYS 59 HA LYS 59 8.769 -1.784 -7.046 462 HB2 LYS 59 HB2 LYS 59 8.078 0.522 -7.309 463 HB3 LYS 59 HB1 LYS 59 7.930 0.304 -9.044 464 HG2 LYS 59 HG2 LYS 59 5.762 0.014 -8.560 465 HG3 LYS 59 HG1 LYS 59 6.293 -1.620 -8.191 466 HD2 LYS 59 HD2 LYS 59 5.990 0.606 -6.210 467 HD3 LYS 59 HD1 LYS 59 4.854 -0.731 -6.420 468 HE2 LYS 59 HE2 LYS 59 7.746 -0.934 -5.546 469 HE3 LYS 59 HE1 LYS 59 6.336 -1.119 -4.517 470 HZ1 LYS 59 HZ1 LYS 59 7.211 -3.259 -5.098 471 HZ2 LYS 59 HZ2 LYS 59 7.123 -2.899 -6.744 472 HZ3 LYS 59 HZ3 LYS 59 5.705 -3.062 -5.846 473 H GLY 60 HN GLY 60 8.472 -3.806 -7.620 474 HA2 GLY 60 HA3 GLY 60 7.312 -5.422 -8.919 475 HA3 GLY 60 HA2 GLY 60 7.468 -4.365 -10.315 476 H LYS 61 HN LYS 61 10.356 -3.882 -9.503 477 HA LYS 61 HA LYS 61 11.388 -6.319 -10.782 478 HB2 LYS 61 HB2 LYS 61 13.051 -3.873 -10.436 479 HB3 LYS 61 HB1 LYS 61 12.996 -5.005 -11.775 480 HG2 LYS 61 HG2 LYS 61 10.867 -2.981 -11.172 481 HG3 LYS 61 HG1 LYS 61 12.161 -2.749 -12.336 482 HD2 LYS 61 HD2 LYS 61 10.120 -4.968 -12.450 483 HD3 LYS 61 HD1 LYS 61 10.027 -3.467 -13.374 484 HE2 LYS 61 HE2 LYS 61 12.148 -3.997 -14.453 485 HE3 LYS 61 HE1 LYS 61 12.251 -5.490 -13.526 486 HZ1 LYS 61 HZ1 LYS 61 10.114 -4.839 -15.481 487 HZ2 LYS 61 HZ2 LYS 61 10.261 -6.284 -14.616 488 HZ3 LYS 61 HZ3 LYS 61 11.424 -5.868 -15.770 489 H VAL 62 HN VAL 62 12.072 -7.704 -9.273 490 HA VAL 62 HA VAL 62 14.044 -6.672 -7.353 491 HB VAL 62 HB VAL 62 12.124 -7.554 -6.139 492 HG11 VAL 62 HG11 VAL 62 11.433 -9.899 -6.299 493 HG12 VAL 62 HG12 VAL 62 12.564 -10.133 -7.632 494 HG13 VAL 62 HG13 VAL 62 11.195 -9.039 -7.822 495 HG21 VAL 62 HG21 VAL 62 13.230 -9.311 -4.803 496 HG22 VAL 62 HG22 VAL 62 14.267 -7.922 -5.118 497 HG23 VAL 62 HG23 VAL 62 14.490 -9.414 -6.032 498 HA PRO 63 HA PRO 63 17.093 -9.278 -9.480 499 HB2 PRO 63 HB2 PRO 63 17.915 -9.810 -6.671 500 HB3 PRO 63 HB1 PRO 63 18.901 -9.378 -8.051 501 HG2 PRO 63 HG2 PRO 63 18.329 -7.569 -6.197 502 HG3 PRO 63 HG1 PRO 63 18.361 -7.126 -7.911 503 HD2 PRO 63 HD2 PRO 63 16.030 -7.542 -6.110 504 HD3 PRO 63 HD1 PRO 63 16.214 -6.431 -7.481 505 H ALA 64 HN ALA 64 17.096 -11.401 -9.988 506 HA ALA 64 HA ALA 64 15.001 -13.037 -9.090 507 HB1 ALA 64 HB1 ALA 64 15.986 -14.775 -10.476 508 HB2 ALA 64 HB2 ALA 64 17.483 -13.851 -10.595 509 HB3 ALA 64 HB3 ALA 64 16.003 -13.226 -11.321 510 H GLY 65 HN GLY 65 14.927 -13.631 -7.011 511 HA2 GLY 65 HA3 GLY 65 15.498 -15.442 -5.530 512 HA3 GLY 65 HA2 GLY 65 17.171 -15.263 -6.032 513 H SER 66 HN SER 66 16.444 -12.192 -5.773 514 HA SER 66 HA SER 66 17.385 -12.081 -3.008 515 HB2 SER 66 HB2 SER 66 17.162 -9.871 -5.058 516 HB3 SER 66 HB1 SER 66 18.000 -9.785 -3.509 517 HG SER 66 HG SER 66 19.164 -11.745 -4.462 518 H ASP 67 HN ASP 67 16.609 -10.260 -1.695 519 HA ASP 67 HA ASP 67 13.725 -10.154 -1.534 520 HB2 ASP 67 HB2 ASP 67 16.065 -9.305 0.102 521 HB3 ASP 67 HB1 ASP 67 14.560 -8.432 0.360 522 H VAL 68 HN VAL 68 12.437 -8.378 -2.093 523 HA VAL 68 HA VAL 68 13.671 -6.470 -3.806 524 HB VAL 68 HB VAL 68 11.692 -5.821 -4.571 525 HG11 VAL 68 HG11 VAL 68 9.942 -7.381 -4.511 526 HG12 VAL 68 HG12 VAL 68 10.449 -8.021 -2.940 527 HG13 VAL 68 HG13 VAL 68 11.442 -8.300 -4.383 528 HG21 VAL 68 HG21 VAL 68 9.768 -5.233 -3.170 529 HG22 VAL 68 HG22 VAL 68 11.253 -4.403 -2.705 530 HG23 VAL 68 HG23 VAL 68 10.673 -5.769 -1.745 531 H ILE 69 HN ILE 69 12.644 -6.635 -0.553 532 HA ILE 69 HA ILE 69 12.534 -3.979 0.161 533 HB ILE 69 HB ILE 69 13.380 -6.391 1.737 534 HG12 ILE 69 HG12 ILE 69 11.098 -6.584 1.173 535 HG13 ILE 69 HG11 ILE 69 11.089 -5.902 2.793 536 HG21 ILE 69 HG21 ILE 69 12.945 -3.563 2.710 537 HG22 ILE 69 HG22 ILE 69 14.417 -4.528 2.823 538 HG23 ILE 69 HG23 ILE 69 12.996 -4.972 3.773 539 HD11 ILE 69 HD11 ILE 69 9.455 -4.807 1.453 540 HD12 ILE 69 HD12 ILE 69 10.671 -4.423 0.224 541 HD13 ILE 69 HD13 ILE 69 10.762 -3.671 1.815 542 H SER 70 HN SER 70 15.285 -6.144 0.195 543 HA SER 70 HA SER 70 17.296 -4.576 1.141 544 HB2 SER 70 HB2 SER 70 17.535 -6.929 0.415 545 HB3 SER 70 HB1 SER 70 17.437 -6.412 -1.265 546 HG SER 70 HG SER 70 19.443 -5.672 0.610 547 H GLU 71 HN GLU 71 15.787 -4.412 -2.026 548 HA GLU 71 HA GLU 71 17.656 -2.464 -3.067 549 HB2 GLU 71 HB2 GLU 71 15.059 -3.375 -4.281 550 HB3 GLU 71 HB1 GLU 71 16.468 -2.718 -5.108 551 HG2 GLU 71 HG2 GLU 71 16.979 -5.135 -3.560 552 HG3 GLU 71 HG1 GLU 71 15.865 -5.344 -4.908 553 H TYR 72 HN TYR 72 14.507 -2.622 -1.702 554 HA TYR 72 HA TYR 72 13.688 -0.043 -2.609 555 HB2 TYR 72 HB2 TYR 72 12.553 -2.067 -0.697 556 HB3 TYR 72 HB1 TYR 72 11.829 -0.480 -0.900 557 HD1 TYR 72 HD1 TYR 72 13.344 -1.946 -3.832 558 HD2 TYR 72 HD2 TYR 72 9.754 -1.655 -1.590 559 HE1 TYR 72 HE1 TYR 72 12.078 -2.774 -5.753 560 HE2 TYR 72 HE2 TYR 72 8.475 -2.499 -3.510 561 HH TYR 72 HH TYR 72 10.064 -3.787 -6.324 562 H VAL 73 HN VAL 73 15.022 -1.450 0.312 563 HA VAL 73 HA VAL 73 15.067 0.971 1.797 564 HB VAL 73 HB VAL 73 16.322 -0.035 3.431 565 HG11 VAL 73 HG11 VAL 73 15.623 -2.367 3.718 566 HG12 VAL 73 HG12 VAL 73 15.011 -2.351 2.066 567 HG13 VAL 73 HG13 VAL 73 14.309 -1.284 3.275 568 HG21 VAL 73 HG21 VAL 73 18.178 -0.614 1.715 569 HG22 VAL 73 HG22 VAL 73 17.464 -2.231 1.783 570 HG23 VAL 73 HG23 VAL 73 18.084 -1.469 3.259 571 H LYS 74 HN LYS 74 17.094 -0.613 -0.522 572 HA LYS 74 HA LYS 74 19.365 1.075 -0.399 573 HB2 LYS 74 HB2 LYS 74 18.587 -1.194 -1.786 574 HB3 LYS 74 HB1 LYS 74 18.677 0.040 -3.035 575 HG2 LYS 74 HG2 LYS 74 20.812 -0.705 -3.139 576 HG3 LYS 74 HG1 LYS 74 21.016 0.513 -1.881 577 HD2 LYS 74 HD2 LYS 74 20.446 -2.395 -1.327 578 HD3 LYS 74 HD1 LYS 74 22.071 -1.710 -1.384 579 HE2 LYS 74 HE2 LYS 74 19.894 -0.730 0.450 580 HE3 LYS 74 HE1 LYS 74 21.097 -1.933 0.911 581 HZ1 LYS 74 HZ1 LYS 74 21.642 0.380 1.582 582 HZ2 LYS 74 HZ2 LYS 74 21.786 0.786 -0.054 583 HZ3 LYS 74 HZ3 LYS 74 22.829 -0.352 0.627 584 H ALA 75 HN ALA 75 16.264 1.217 -1.949 585 HA ALA 75 HA ALA 75 16.716 3.385 -3.696 586 HB1 ALA 75 HB1 ALA 75 14.189 2.495 -2.313 587 HB2 ALA 75 HB2 ALA 75 14.767 1.961 -3.891 588 HB3 ALA 75 HB3 ALA 75 14.264 3.635 -3.659 589 H CYS 76 HN CYS 76 15.535 3.233 -0.361 590 HA CYS 76 HA CYS 76 15.700 6.142 -0.150 591 HB2 CYS 76 HB2 CYS 76 13.760 5.141 0.811 592 HB3 CYS 76 HB1 CYS 76 14.716 4.027 1.758 593 HG CYS 76 HG CYS 76 15.879 6.546 3.011 594 H ASP 77 HN ASP 77 17.907 3.827 -0.095 595 HA ASP 77 HA ASP 77 19.464 4.326 2.164 596 HB2 ASP 77 HB2 ASP 77 20.079 2.501 0.826 597 HB3 ASP 77 HB1 ASP 77 20.112 3.452 -0.650 598 H GLY 78 HN GLY 78 18.789 6.261 -0.601 599 HA2 GLY 78 HA3 GLY 78 20.810 8.228 0.201 600 HA3 GLY 78 HA2 GLY 78 19.891 8.255 -1.292 601 H ILE 79 HN ILE 79 17.552 7.541 0.807 602 HA ILE 79 HA ILE 79 16.785 10.338 1.051 603 HB ILE 79 HB ILE 79 15.157 7.841 1.432 604 HG12 ILE 79 HG12 ILE 79 15.030 9.859 -0.815 605 HG13 ILE 79 HG11 ILE 79 15.886 8.316 -0.916 606 HG21 ILE 79 HG21 ILE 79 13.197 9.291 1.461 607 HG22 ILE 79 HG22 ILE 79 14.239 10.708 1.359 608 HG23 ILE 79 HG23 ILE 79 14.296 9.675 2.788 609 HD11 ILE 79 HD11 ILE 79 13.907 7.095 -0.819 610 HD12 ILE 79 HD12 ILE 79 13.544 8.458 -1.884 611 HD13 ILE 79 HD13 ILE 79 12.989 8.472 -0.213 612 H GLY 80 HN GLY 80 16.495 11.340 2.968 613 HA2 GLY 80 HA3 GLY 80 15.542 10.290 5.295 614 HA3 GLY 80 HA2 GLY 80 17.278 10.072 5.400 615 H GLY 81 HN GLY 81 17.985 12.447 3.970 616 HA2 GLY 81 HA3 GLY 81 16.735 14.604 5.467 617 HA3 GLY 81 HA2 GLY 81 18.451 14.349 5.727 618 H ALA 82 HN ALA 82 19.889 15.099 4.240 619 HA ALA 82 HA ALA 82 19.025 17.348 2.802 620 HB1 ALA 82 HB1 ALA 82 21.320 17.583 2.109 621 HB2 ALA 82 HB2 ALA 82 21.660 15.927 2.609 622 HB3 ALA 82 HB3 ALA 82 21.229 17.141 3.813 623 H MET 83 HN MET 83 20.118 14.166 1.615 624 HA MET 83 HA MET 83 19.801 14.883 -1.122 625 HB2 MET 83 HB2 MET 83 19.802 12.118 0.096 626 HB3 MET 83 HB1 MET 83 20.021 12.499 -1.604 627 HG2 MET 83 HG2 MET 83 22.073 13.741 -1.020 628 HG3 MET 83 HG1 MET 83 21.867 13.230 0.652 629 HE1 MET 83 HE1 MET 83 21.096 11.053 -2.569 630 HE2 MET 83 HE2 MET 83 22.669 10.303 -2.831 631 HE3 MET 83 HE3 MET 83 22.479 12.046 -3.031 632 H HIS 84 HN HIS 84 17.711 13.529 1.314 633 HA HIS 84 HA HIS 84 15.481 12.885 -0.280 634 HB2 HIS 84 HB2 HIS 84 15.466 12.121 1.955 635 HB3 HIS 84 HB1 HIS 84 15.832 13.712 2.598 636 HD1 HIS 84 HD1 HIS 84 13.901 14.143 4.077 637 HD2 HIS 84 HD2 HIS 84 12.707 12.802 0.332 638 HE1 HIS 84 HE1 HIS 84 11.400 14.314 4.067 639 HE2 HIS 84 HE2 HIS 84 10.686 13.399 1.829 640 H LYS 85 HN LYS 85 16.746 15.932 0.875 641 HA LYS 85 HA LYS 85 14.351 17.382 0.151 642 HB2 LYS 85 HB2 LYS 85 17.072 18.433 0.949 643 HB3 LYS 85 HB1 LYS 85 15.584 19.367 0.853 644 HG2 LYS 85 HG2 LYS 85 16.053 17.052 2.725 645 HG3 LYS 85 HG1 LYS 85 16.177 18.759 3.160 646 HD2 LYS 85 HD2 LYS 85 13.857 19.102 2.811 647 HD3 LYS 85 HD1 LYS 85 13.676 17.536 2.017 648 HE2 LYS 85 HE2 LYS 85 14.109 16.377 4.083 649 HE3 LYS 85 HE1 LYS 85 14.476 17.899 4.898 650 HZ1 LYS 85 HZ1 LYS 85 12.203 18.604 4.603 651 HZ2 LYS 85 HZ2 LYS 85 12.232 17.112 5.393 652 HZ3 LYS 85 HZ3 LYS 85 11.826 17.193 3.754 653 H ALA 86 HN ALA 86 17.258 16.372 -1.346 654 HA ALA 86 HA ALA 86 17.109 18.278 -3.517 655 HB1 ALA 86 HB1 ALA 86 18.821 15.821 -3.217 656 HB2 ALA 86 HB2 ALA 86 19.286 17.457 -2.749 657 HB3 ALA 86 HB3 ALA 86 19.003 17.072 -4.445 658 H MET 87 HN MET 87 16.440 14.899 -2.932 659 HA MET 87 HA MET 87 15.619 14.433 -5.663 660 HB2 MET 87 HB2 MET 87 15.616 12.647 -3.226 661 HB3 MET 87 HB1 MET 87 15.234 12.122 -4.864 662 HG2 MET 87 HG2 MET 87 17.748 13.540 -4.743 663 HG3 MET 87 HG1 MET 87 17.729 12.150 -3.670 664 HE1 MET 87 HE1 MET 87 19.744 11.108 -5.073 665 HE2 MET 87 HE2 MET 87 19.728 12.499 -6.155 666 HE3 MET 87 HE3 MET 87 19.698 10.865 -6.818 667 H LEU 88 HN LEU 88 14.189 15.530 -2.818 668 HA LEU 88 HA LEU 88 11.636 14.589 -2.769 669 HB2 LEU 88 HB2 LEU 88 12.960 16.514 -1.496 670 HB3 LEU 88 HB1 LEU 88 11.994 17.521 -2.553 671 HG LEU 88 HG LEU 88 10.111 17.181 -1.352 672 HD11 LEU 88 HD11 LEU 88 9.837 14.859 -2.054 673 HD12 LEU 88 HD12 LEU 88 9.470 15.029 -0.339 674 HD13 LEU 88 HD13 LEU 88 11.013 14.340 -0.846 675 HD21 LEU 88 HD21 LEU 88 11.763 17.796 0.308 676 HD22 LEU 88 HD22 LEU 88 12.163 16.096 0.549 677 HD23 LEU 88 HD23 LEU 88 10.567 16.700 1.004 678 H MET 89 HN MET 89 12.965 17.058 -4.925 679 HA MET 89 HA MET 89 10.420 17.510 -6.228 680 HB2 MET 89 HB2 MET 89 12.047 19.341 -5.865 681 HB3 MET 89 HB1 MET 89 13.175 18.528 -6.939 682 HG2 MET 89 HG2 MET 89 11.684 18.822 -8.804 683 HG3 MET 89 HG1 MET 89 10.452 19.510 -7.752 684 HE1 MET 89 HE1 MET 89 11.596 22.581 -9.892 685 HE2 MET 89 HE2 MET 89 10.231 21.590 -9.378 686 HE3 MET 89 HE3 MET 89 11.470 20.907 -10.430 687 H ALA 90 HN ALA 90 12.930 15.286 -6.511 688 HA ALA 90 HA ALA 90 12.680 14.992 -9.414 689 HB1 ALA 90 HB1 ALA 90 14.575 13.624 -7.498 690 HB2 ALA 90 HB2 ALA 90 14.934 15.104 -8.395 691 HB3 ALA 90 HB3 ALA 90 14.654 13.594 -9.261 692 H GLN 91 HN GLN 91 12.061 13.289 -6.430 693 HA GLN 91 HA GLN 91 11.101 10.978 -7.960 694 HB2 GLN 91 HB2 GLN 91 11.861 11.192 -5.058 695 HB3 GLN 91 HB1 GLN 91 11.415 9.720 -5.908 696 HG2 GLN 91 HG2 GLN 91 13.363 9.910 -7.315 697 HG3 GLN 91 HG1 GLN 91 13.807 11.420 -6.526 698 HE21 GLN 91 HE21 GLN 91 13.015 10.676 -3.943 699 HE22 GLN 91 HE22 GLN 91 14.111 9.476 -3.390 700 H LEU 92 HN LEU 92 10.344 12.701 -4.926 701 HA LEU 92 HA LEU 92 7.717 11.858 -4.615 702 HB2 LEU 92 HB2 LEU 92 9.205 13.087 -3.002 703 HB3 LEU 92 HB1 LEU 92 8.789 14.558 -3.851 704 HG LEU 92 HG LEU 92 7.512 13.574 -1.652 705 HD11 LEU 92 HD11 LEU 92 6.409 15.395 -3.775 706 HD12 LEU 92 HD12 LEU 92 7.434 15.862 -2.419 707 HD13 LEU 92 HD13 LEU 92 5.801 15.266 -2.125 708 HD21 LEU 92 HD21 LEU 92 5.240 12.963 -2.388 709 HD22 LEU 92 HD22 LEU 92 6.456 11.754 -2.803 710 HD23 LEU 92 HD23 LEU 92 5.840 12.849 -4.042 711 H GLU 93 HN GLU 93 8.998 13.587 -7.121 712 HA GLU 93 HA GLU 93 7.468 15.694 -7.821 713 HB2 GLU 93 HB2 GLU 93 7.874 15.017 -10.206 714 HB3 GLU 93 HB1 GLU 93 9.313 15.068 -9.195 715 HG2 GLU 93 HG2 GLU 93 9.517 12.751 -9.149 716 HG3 GLU 93 HG1 GLU 93 7.844 12.492 -9.636 717 H2 PRO 1 HT1 PRO 1 5.411 -4.047 -13.255 718 H3 PRO 1 HT2 PRO 1 5.759 -2.562 -13.840 719 HA PRO 1 HA PRO 1 6.402 -2.331 -11.778 720 HB2 PRO 1 HB2 PRO 1 4.226 -1.289 -10.611 721 HB3 PRO 1 HB1 PRO 1 4.998 -0.495 -11.985 722 HG2 PRO 1 HG2 PRO 1 2.447 -1.926 -11.867 723 HG3 PRO 1 HG1 PRO 1 3.044 -0.798 -13.096 724 HD2 PRO 1 HD2 PRO 1 3.064 -3.718 -13.096 725 HD3 PRO 1 HD1 PRO 1 3.404 -2.600 -14.433 726 H SER 2 HN SER 2 4.505 -2.358 -9.461 727 HA SER 2 HA SER 2 4.367 -5.083 -8.713 728 HB2 SER 2 HB2 SER 2 2.539 -2.842 -7.803 729 HB3 SER 2 HB1 SER 2 2.883 -4.341 -6.950 730 HG SER 2 HG SER 2 4.025 -2.234 -6.404 731 H PHE 3 HN PHE 3 2.137 -6.161 -8.362 732 HA PHE 3 HA PHE 3 0.467 -5.920 -10.655 733 HB2 PHE 3 HB2 PHE 3 -1.134 -6.965 -8.633 734 HB3 PHE 3 HB1 PHE 3 -0.191 -7.904 -9.790 735 HD1 PHE 3 HD1 PHE 3 -0.668 -6.927 -6.375 736 HD2 PHE 3 HD2 PHE 3 2.096 -8.699 -9.094 737 HE1 PHE 3 HE1 PHE 3 0.555 -7.932 -4.508 738 HE2 PHE 3 HE2 PHE 3 3.333 -9.681 -7.212 739 HZ PHE 3 HZ PHE 3 2.561 -9.298 -4.908 740 H ASN 4 HN ASN 4 0.357 -4.812 -7.347 741 HA ASN 4 HA ASN 4 -2.296 -3.739 -7.681 742 HB2 ASN 4 HB2 ASN 4 -2.163 -3.393 -5.273 743 HB3 ASN 4 HB1 ASN 4 -1.697 -5.037 -5.704 744 HD21 ASN 4 HD21 ASN 4 -0.428 -1.851 -4.877 745 HD22 ASN 4 HD22 ASN 4 1.080 -2.429 -4.240 746 H THR 5 HN THR 5 0.553 -2.381 -8.487 747 HA THR 5 HA THR 5 0.655 -0.003 -6.952 748 HB THR 5 HB THR 5 1.690 0.799 -9.274 749 HG1 THR 5 HG1 THR 5 1.433 -0.885 -10.585 750 HG21 THR 5 HG21 THR 5 2.969 0.743 -7.290 751 HG22 THR 5 HG22 THR 5 3.846 -0.199 -8.497 752 HG23 THR 5 HG23 THR 5 2.922 -1.017 -7.239 753 H VAL 6 HN VAL 6 -1.634 -1.045 -9.163 754 HA VAL 6 HA VAL 6 -2.365 1.481 -10.250 755 HB VAL 6 HB VAL 6 -4.156 0.386 -11.272 756 HG11 VAL 6 HG11 VAL 6 -2.052 -0.519 -12.075 757 HG12 VAL 6 HG12 VAL 6 -3.315 -1.747 -12.122 758 HG13 VAL 6 HG13 VAL 6 -2.106 -1.776 -10.838 759 HG21 VAL 6 HG21 VAL 6 -5.298 -1.546 -10.485 760 HG22 VAL 6 HG22 VAL 6 -5.087 -0.460 -9.098 761 HG23 VAL 6 HG23 VAL 6 -4.037 -1.868 -9.287 762 H ARG 7 HN ARG 7 -3.654 3.013 -9.277 763 HA ARG 7 HA ARG 7 -5.364 2.138 -7.159 764 HB2 ARG 7 HB2 ARG 7 -4.317 3.568 -5.443 765 HB3 ARG 7 HB1 ARG 7 -3.436 2.138 -5.947 766 HG2 ARG 7 HG2 ARG 7 -2.416 4.082 -7.568 767 HG3 ARG 7 HG1 ARG 7 -2.642 4.892 -6.012 768 HD2 ARG 7 HD2 ARG 7 -1.462 3.076 -4.891 769 HD3 ARG 7 HD1 ARG 7 -1.237 2.258 -6.433 770 HE ARG 7 HE ARG 7 0.005 4.457 -7.021 771 HH11 ARG 7 HH11 ARG 7 0.043 2.819 -3.930 772 HH12 ARG 7 HH12 ARG 7 1.496 3.584 -3.399 773 HH21 ARG 7 HH21 ARG 7 1.933 5.472 -6.324 774 HH22 ARG 7 HH22 ARG 7 2.582 5.096 -4.764 775 H GLN 8 HN GLN 8 -6.580 3.682 -6.150 776 HA GLN 8 HA GLN 8 -8.141 5.183 -7.766 777 HB2 GLN 8 HB2 GLN 8 -7.978 4.554 -5.061 778 HB3 GLN 8 HB1 GLN 8 -8.049 6.309 -5.085 779 HG2 GLN 8 HG2 GLN 8 -10.082 6.184 -6.444 780 HG3 GLN 8 HG1 GLN 8 -10.017 4.424 -6.362 781 HE21 GLN 8 HE21 GLN 8 -12.128 6.095 -5.447 782 HE22 GLN 8 HE22 GLN 8 -12.253 5.875 -3.727 783 H GLY 9 HN GLY 9 -7.445 6.715 -9.080 784 HA2 GLY 9 HA3 GLY 9 -5.467 8.670 -8.301 785 HA3 GLY 9 HA2 GLY 9 -6.359 8.623 -9.817 786 H SER 10 HN SER 10 -7.168 10.640 -9.984 787 HA SER 10 HA SER 10 -8.050 12.200 -7.800 788 HB2 SER 10 HB2 SER 10 -7.339 13.036 -10.094 789 HB3 SER 10 HB1 SER 10 -8.920 12.526 -10.679 790 HG SER 10 HG SER 10 -8.211 14.709 -9.166 791 H LYS 11 HN LYS 11 -9.575 11.349 -6.529 792 HA LYS 11 HA LYS 11 -11.361 10.105 -5.849 793 HB2 LYS 11 HB2 LYS 11 -13.503 11.167 -6.281 794 HB3 LYS 11 HB1 LYS 11 -12.290 12.365 -5.880 795 HG2 LYS 11 HG2 LYS 11 -12.912 11.774 -8.747 796 HG3 LYS 11 HG1 LYS 11 -13.970 12.821 -7.801 797 HD2 LYS 11 HD2 LYS 11 -12.122 14.307 -7.318 798 HD3 LYS 11 HD1 LYS 11 -11.002 13.224 -8.143 799 HE2 LYS 11 HE2 LYS 11 -12.232 13.586 -10.241 800 HE3 LYS 11 HE1 LYS 11 -13.300 14.711 -9.405 801 HZ1 LYS 11 HZ1 LYS 11 -10.363 15.036 -9.683 802 HZ2 LYS 11 HZ2 LYS 11 -11.428 16.139 -8.962 803 HZ3 LYS 11 HZ3 LYS 11 -11.522 15.835 -10.621 804 H GLU 12 HN GLU 12 -10.188 8.680 -7.792 805 HA GLU 12 HA GLU 12 -11.735 7.859 -9.967 806 HB2 GLU 12 HB2 GLU 12 -9.371 7.373 -9.717 807 HB3 GLU 12 HB1 GLU 12 -9.681 6.389 -8.301 808 HG2 GLU 12 HG2 GLU 12 -10.899 4.774 -9.728 809 HG3 GLU 12 HG1 GLU 12 -10.521 5.780 -11.131 810 HA PRO 13 HA PRO 13 -15.124 5.501 -8.206 811 HB2 PRO 13 HB2 PRO 13 -14.541 3.539 -10.343 812 HB3 PRO 13 HB1 PRO 13 -16.055 4.356 -9.965 813 HG2 PRO 13 HG2 PRO 13 -14.590 5.025 -12.101 814 HG3 PRO 13 HG1 PRO 13 -15.500 6.222 -11.172 815 HD2 PRO 13 HD2 PRO 13 -12.578 5.694 -11.228 816 HD3 PRO 13 HD1 PRO 13 -13.443 7.217 -10.980 817 H TYR 14 HN TYR 14 -14.968 4.165 -6.515 818 HA TYR 14 HA TYR 14 -12.394 3.111 -6.022 819 HB2 TYR 14 HB2 TYR 14 -13.656 4.203 -4.252 820 HB3 TYR 14 HB1 TYR 14 -14.839 2.899 -4.289 821 HD1 TYR 14 HD1 TYR 14 -14.002 0.555 -3.865 822 HD2 TYR 14 HD2 TYR 14 -11.743 3.996 -2.961 823 HE1 TYR 14 HE1 TYR 14 -12.643 -0.776 -2.341 824 HE2 TYR 14 HE2 TYR 14 -10.354 2.706 -1.414 825 HH TYR 14 HH TYR 14 -10.195 0.737 -0.326 826 HA PRO 15 HA PRO 15 -14.572 -1.225 -5.693 827 HB2 PRO 15 HB2 PRO 15 -16.746 -0.943 -7.657 828 HB3 PRO 15 HB1 PRO 15 -16.751 -1.749 -6.092 829 HG2 PRO 15 HG2 PRO 15 -18.011 0.584 -6.514 830 HG3 PRO 15 HG1 PRO 15 -17.307 0.156 -4.963 831 HD2 PRO 15 HD2 PRO 15 -16.333 2.066 -7.018 832 HD3 PRO 15 HD1 PRO 15 -16.143 2.096 -5.260 833 H ASP 16 HN ASP 16 -14.247 0.863 -8.264 834 HA ASP 16 HA ASP 16 -13.563 -1.115 -10.254 835 HB2 ASP 16 HB2 ASP 16 -14.017 1.832 -10.235 836 HB3 ASP 16 HB1 ASP 16 -13.016 1.168 -11.518 837 H PHE 17 HN PHE 17 -12.050 1.519 -8.450 838 HA PHE 17 HA PHE 17 -9.452 1.326 -9.429 839 HB2 PHE 17 HB2 PHE 17 -9.300 3.046 -7.963 840 HB3 PHE 17 HB1 PHE 17 -10.785 2.546 -7.164 841 HD1 PHE 17 HD1 PHE 17 -10.725 1.607 -5.022 842 HD2 PHE 17 HD2 PHE 17 -7.148 1.955 -7.271 843 HE1 PHE 17 HE1 PHE 17 -9.425 0.958 -3.044 844 HE2 PHE 17 HE2 PHE 17 -5.829 1.319 -5.294 845 HZ PHE 17 HZ PHE 17 -6.969 0.819 -3.176 846 H VAL 18 HN VAL 18 -11.087 -0.418 -6.854 847 HA VAL 18 HA VAL 18 -8.779 -1.983 -6.253 848 HB VAL 18 HB VAL 18 -10.104 -1.631 -4.371 849 HG11 VAL 18 HG11 VAL 18 -12.142 -0.915 -5.488 850 HG12 VAL 18 HG12 VAL 18 -12.500 -2.149 -4.270 851 HG13 VAL 18 HG13 VAL 18 -12.466 -2.574 -5.992 852 HG21 VAL 18 HG21 VAL 18 -9.356 -3.878 -4.391 853 HG22 VAL 18 HG22 VAL 18 -10.646 -4.361 -5.500 854 HG23 VAL 18 HG23 VAL 18 -11.035 -3.896 -3.839 855 H ALA 19 HN ALA 19 -11.753 -2.496 -8.127 856 HA ALA 19 HA ALA 19 -11.472 -5.259 -8.515 857 HB1 ALA 19 HB1 ALA 19 -12.872 -5.005 -10.485 858 HB2 ALA 19 HB2 ALA 19 -12.574 -3.267 -10.504 859 HB3 ALA 19 HB3 ALA 19 -13.482 -3.990 -9.177 860 H ARG 20 HN ARG 20 -9.747 -2.598 -10.070 861 HA ARG 20 HA ARG 20 -8.510 -4.458 -11.923 862 HB2 ARG 20 HB2 ARG 20 -7.131 -2.544 -12.658 863 HB3 ARG 20 HB1 ARG 20 -8.850 -2.219 -12.784 864 HG2 ARG 20 HG2 ARG 20 -8.813 -0.666 -11.073 865 HG3 ARG 20 HG1 ARG 20 -7.323 -1.315 -10.378 866 HD2 ARG 20 HD2 ARG 20 -6.017 -0.432 -12.163 867 HD3 ARG 20 HD1 ARG 20 -7.448 -0.008 -13.082 868 HE ARG 20 HE ARG 20 -7.777 1.498 -10.906 869 HH11 ARG 20 HH11 ARG 20 -4.970 0.975 -12.938 870 HH12 ARG 20 HH12 ARG 20 -4.308 2.552 -12.648 871 HH21 ARG 20 HH21 ARG 20 -6.934 3.594 -10.557 872 HH22 ARG 20 HH22 ARG 20 -5.417 4.037 -11.287 873 H LEU 21 HN LEU 21 -7.993 -2.910 -8.900 874 HA LEU 21 HA LEU 21 -5.336 -3.479 -8.395 875 HB2 LEU 21 HB2 LEU 21 -7.179 -2.224 -7.025 876 HB3 LEU 21 HB1 LEU 21 -7.477 -3.789 -6.311 877 HG LEU 21 HG LEU 21 -5.445 -3.801 -5.171 878 HD11 LEU 21 HD11 LEU 21 -3.900 -3.266 -6.897 879 HD12 LEU 21 HD12 LEU 21 -3.662 -2.085 -5.604 880 HD13 LEU 21 HD13 LEU 21 -4.557 -1.640 -7.061 881 HD21 LEU 21 HD21 LEU 21 -5.323 -1.585 -4.082 882 HD22 LEU 21 HD22 LEU 21 -6.954 -2.250 -4.181 883 HD23 LEU 21 HD23 LEU 21 -6.448 -0.979 -5.294 884 H GLN 22 HN GLN 22 -8.234 -5.423 -7.802 885 HA GLN 22 HA GLN 22 -6.929 -7.758 -6.957 886 HB2 GLN 22 HB2 GLN 22 -9.568 -7.781 -8.354 887 HB3 GLN 22 HB1 GLN 22 -8.997 -8.782 -7.016 888 HG2 GLN 22 HG2 GLN 22 -9.120 -6.792 -5.590 889 HG3 GLN 22 HG1 GLN 22 -9.788 -5.896 -6.943 890 HE21 GLN 22 HE21 GLN 22 -10.968 -6.312 -4.477 891 HE22 GLN 22 HE22 GLN 22 -12.428 -7.205 -4.693 892 H ASP 23 HN ASP 23 -8.301 -6.741 -9.994 893 HA ASP 23 HA ASP 23 -8.066 -9.003 -11.511 894 HB2 ASP 23 HB2 ASP 23 -8.890 -6.675 -12.170 895 HB3 ASP 23 HB1 ASP 23 -7.204 -6.337 -12.548 896 H VAL 24 HN VAL 24 -5.523 -6.555 -11.106 897 HA VAL 24 HA VAL 24 -3.733 -8.159 -12.693 898 HB VAL 24 HB VAL 24 -3.643 -5.755 -12.986 899 HG11 VAL 24 HG11 VAL 24 -2.908 -4.274 -11.179 900 HG12 VAL 24 HG12 VAL 24 -2.934 -5.643 -10.067 901 HG13 VAL 24 HG13 VAL 24 -4.431 -5.080 -10.809 902 HG21 VAL 24 HG21 VAL 24 -1.180 -6.830 -11.616 903 HG22 VAL 24 HG22 VAL 24 -1.220 -5.324 -12.536 904 HG23 VAL 24 HG23 VAL 24 -1.538 -6.865 -13.341 905 H ALA 25 HN ALA 25 -4.491 -7.662 -9.375 906 HA ALA 25 HA ALA 25 -2.050 -8.750 -8.320 907 HB1 ALA 25 HB1 ALA 25 -4.791 -8.562 -7.054 908 HB2 ALA 25 HB2 ALA 25 -3.506 -7.365 -6.905 909 HB3 ALA 25 HB3 ALA 25 -3.296 -8.972 -6.215 910 H GLN 26 HN GLN 26 -4.854 -9.828 -9.820 911 HA GLN 26 HA GLN 26 -4.639 -12.562 -8.928 912 HB2 GLN 26 HB2 GLN 26 -6.810 -12.320 -9.369 913 HB3 GLN 26 HB1 GLN 26 -6.505 -10.837 -10.254 914 HG2 GLN 26 HG2 GLN 26 -7.430 -12.071 -11.885 915 HG3 GLN 26 HG1 GLN 26 -5.742 -12.508 -12.127 916 HE21 GLN 26 HE21 GLN 26 -5.647 -14.133 -9.729 917 HE22 GLN 26 HE22 GLN 26 -6.480 -15.592 -10.095 918 H LYS 27 HN LYS 27 -3.979 -10.607 -11.736 919 HA LYS 27 HA LYS 27 -3.137 -12.639 -13.497 920 HB2 LYS 27 HB2 LYS 27 -2.237 -9.756 -13.402 921 HB3 LYS 27 HB1 LYS 27 -2.147 -10.834 -14.798 922 HG2 LYS 27 HG2 LYS 27 -4.650 -9.834 -13.466 923 HG3 LYS 27 HG1 LYS 27 -4.006 -9.314 -15.023 924 HD2 LYS 27 HD2 LYS 27 -4.583 -11.295 -16.065 925 HD3 LYS 27 HD1 LYS 27 -4.619 -12.198 -14.552 926 HE2 LYS 27 HE2 LYS 27 -6.668 -11.282 -13.916 927 HE3 LYS 27 HE1 LYS 27 -6.550 -9.986 -15.100 928 HZ1 LYS 27 HZ1 LYS 27 -6.765 -11.708 -16.851 929 HZ2 LYS 27 HZ2 LYS 27 -8.127 -11.603 -15.858 930 HZ3 LYS 27 HZ3 LYS 27 -7.027 -12.868 -15.647 931 H SER 28 HN SER 28 -1.456 -10.883 -10.976 932 HA SER 28 HA SER 28 1.100 -11.902 -11.985 933 HB2 SER 28 HB2 SER 28 0.567 -9.698 -10.006 934 HB3 SER 28 HB1 SER 28 2.120 -10.084 -10.751 935 HG SER 28 HG SER 28 -0.173 -8.898 -11.878 936 H ILE 29 HN ILE 29 -1.230 -12.494 -9.704 937 HA ILE 29 HA ILE 29 0.732 -13.753 -7.895 938 HB ILE 29 HB ILE 29 -2.014 -12.687 -7.273 939 HG12 ILE 29 HG12 ILE 29 0.679 -11.869 -6.184 940 HG13 ILE 29 HG11 ILE 29 -0.240 -10.987 -7.408 941 HG21 ILE 29 HG21 ILE 29 -1.629 -13.339 -4.965 942 HG22 ILE 29 HG22 ILE 29 -0.129 -14.144 -5.443 943 HG23 ILE 29 HG23 ILE 29 -1.680 -14.733 -6.046 944 HD11 ILE 29 HD11 ILE 29 -1.996 -10.544 -5.883 945 HD12 ILE 29 HD12 ILE 29 -0.474 -10.096 -5.103 946 HD13 ILE 29 HD13 ILE 29 -1.283 -11.610 -4.666 947 H ALA 30 HN ALA 30 0.658 -15.912 -7.746 948 HA ALA 30 HA ALA 30 -1.564 -17.357 -8.965 949 HB1 ALA 30 HB1 ALA 30 1.017 -18.377 -7.792 950 HB2 ALA 30 HB2 ALA 30 0.725 -18.038 -9.498 951 HB3 ALA 30 HB3 ALA 30 -0.162 -19.332 -8.690 952 H ASP 31 HN ASP 31 -0.777 -16.121 -6.012 953 HA ASP 31 HA ASP 31 -2.072 -18.238 -4.441 954 HB2 ASP 31 HB2 ASP 31 -0.155 -16.053 -3.879 955 HB3 ASP 31 HB1 ASP 31 -1.334 -16.375 -2.621 956 H GLU 32 HN GLU 32 -4.256 -17.990 -4.530 957 HA GLU 32 HA GLU 32 -5.664 -15.593 -4.854 958 HB2 GLU 32 HB2 GLU 32 -7.604 -16.803 -3.998 959 HB3 GLU 32 HB1 GLU 32 -6.680 -17.835 -5.080 960 HG2 GLU 32 HG2 GLU 32 -5.645 -18.912 -3.112 961 HG3 GLU 32 HG1 GLU 32 -6.662 -17.916 -2.073 962 H LYS 33 HN LYS 33 -4.121 -16.934 -2.067 963 HA LYS 33 HA LYS 33 -5.472 -15.382 -0.094 964 HB2 LYS 33 HB2 LYS 33 -2.753 -16.702 -0.029 965 HB3 LYS 33 HB1 LYS 33 -3.538 -15.964 1.359 966 HG2 LYS 33 HG2 LYS 33 -4.171 -18.098 1.734 967 HG3 LYS 33 HG1 LYS 33 -5.477 -17.644 0.637 968 HD2 LYS 33 HD2 LYS 33 -4.616 -19.768 -0.054 969 HD3 LYS 33 HD1 LYS 33 -4.140 -18.556 -1.243 970 HE2 LYS 33 HE2 LYS 33 -2.308 -20.096 -0.743 971 HE3 LYS 33 HE1 LYS 33 -1.913 -18.447 -0.271 972 HZ1 LYS 33 HZ1 LYS 33 -2.375 -18.994 2.015 973 HZ2 LYS 33 HZ2 LYS 33 -1.260 -20.102 1.396 974 HZ3 LYS 33 HZ3 LYS 33 -2.878 -20.554 1.587 975 H ALA 34 HN ALA 34 -2.299 -15.112 -1.648 976 HA ALA 34 HA ALA 34 -1.701 -12.566 -0.608 977 HB1 ALA 34 HB1 ALA 34 0.028 -14.033 -1.499 978 HB2 ALA 34 HB2 ALA 34 0.041 -12.477 -2.331 979 HB3 ALA 34 HB3 ALA 34 -0.665 -13.889 -3.114 980 H ARG 35 HN ARG 35 -3.715 -13.642 -3.196 981 HA ARG 35 HA ARG 35 -3.754 -11.224 -4.711 982 HB2 ARG 35 HB2 ARG 35 -4.567 -13.643 -5.353 983 HB3 ARG 35 HB1 ARG 35 -6.078 -13.119 -4.623 984 HG2 ARG 35 HG2 ARG 35 -4.791 -11.415 -6.720 985 HG3 ARG 35 HG1 ARG 35 -5.686 -12.858 -7.189 986 HD2 ARG 35 HD2 ARG 35 -6.755 -10.500 -5.628 987 HD3 ARG 35 HD1 ARG 35 -7.106 -10.919 -7.314 988 HE ARG 35 HE ARG 35 -7.986 -13.099 -6.202 989 HH11 ARG 35 HH11 ARG 35 -8.314 -9.865 -4.892 990 HH12 ARG 35 HH12 ARG 35 -9.811 -10.203 -4.085 991 HH21 ARG 35 HH21 ARG 35 -9.947 -13.545 -5.143 992 HH22 ARG 35 HH22 ARG 35 -10.735 -12.300 -4.230 993 H LYS 36 HN LYS 36 -6.119 -12.693 -2.470 994 HA LYS 36 HA LYS 36 -7.811 -10.516 -2.142 995 HB2 LYS 36 HB2 LYS 36 -6.885 -12.317 0.085 996 HB3 LYS 36 HB1 LYS 36 -8.374 -11.388 0.032 997 HG2 LYS 36 HG2 LYS 36 -9.433 -12.899 -1.231 998 HG3 LYS 36 HG1 LYS 36 -7.961 -13.345 -2.123 999 HD2 LYS 36 HD2 LYS 36 -8.767 -15.140 -0.599 1000 HD3 LYS 36 HD1 LYS 36 -7.124 -14.563 -0.257 1001 HE2 LYS 36 HE2 LYS 36 -7.951 -13.182 1.555 1002 HE3 LYS 36 HE1 LYS 36 -9.617 -13.614 1.183 1003 HZ1 LYS 36 HZ1 LYS 36 -8.812 -14.876 3.054 1004 HZ2 LYS 36 HZ2 LYS 36 -7.500 -15.456 2.163 1005 HZ3 LYS 36 HZ3 LYS 36 -9.072 -15.921 1.753 1006 H VAL 37 HN VAL 37 -5.056 -11.435 -0.106 1007 HA VAL 37 HA VAL 37 -5.429 -9.469 1.780 1008 HB VAL 37 HB VAL 37 -3.153 -9.803 2.550 1009 HG11 VAL 37 HG11 VAL 37 -4.460 -12.363 1.598 1010 HG12 VAL 37 HG12 VAL 37 -4.774 -11.515 3.119 1011 HG13 VAL 37 HG13 VAL 37 -3.200 -12.260 2.832 1012 HG21 VAL 37 HG21 VAL 37 -1.670 -11.392 1.271 1013 HG22 VAL 37 HG22 VAL 37 -1.867 -9.783 0.576 1014 HG23 VAL 37 HG23 VAL 37 -2.749 -11.149 -0.105 1015 H ILE 38 HN ILE 38 -3.667 -9.225 -1.286 1016 HA ILE 38 HA ILE 38 -2.730 -6.618 -0.482 1017 HB ILE 38 HB ILE 38 -1.550 -8.447 -2.097 1018 HG12 ILE 38 HG12 ILE 38 -1.125 -5.482 -2.332 1019 HG13 ILE 38 HG11 ILE 38 -0.663 -6.390 -0.899 1020 HG21 ILE 38 HG21 ILE 38 -3.151 -8.023 -3.927 1021 HG22 ILE 38 HG22 ILE 38 -1.502 -7.573 -4.364 1022 HG23 ILE 38 HG23 ILE 38 -2.668 -6.323 -3.926 1023 HD11 ILE 38 HD11 ILE 38 1.275 -6.179 -2.126 1024 HD12 ILE 38 HD12 ILE 38 0.452 -6.436 -3.651 1025 HD13 ILE 38 HD13 ILE 38 0.713 -7.796 -2.551 1026 H VAL 39 HN VAL 39 -5.305 -7.897 -2.489 1027 HA VAL 39 HA VAL 39 -5.836 -5.321 -3.613 1028 HB VAL 39 HB VAL 39 -7.740 -6.170 -4.602 1029 HG11 VAL 39 HG11 VAL 39 -5.839 -8.454 -4.201 1030 HG12 VAL 39 HG12 VAL 39 -5.870 -7.284 -5.521 1031 HG13 VAL 39 HG13 VAL 39 -7.161 -8.482 -5.360 1032 HG21 VAL 39 HG21 VAL 39 -7.890 -8.359 -2.536 1033 HG22 VAL 39 HG22 VAL 39 -8.984 -8.155 -3.906 1034 HG23 VAL 39 HG23 VAL 39 -8.936 -6.943 -2.627 1035 H GLU 40 HN GLU 40 -7.256 -7.190 -0.967 1036 HA GLU 40 HA GLU 40 -8.957 -5.247 0.052 1037 HB2 GLU 40 HB2 GLU 40 -7.543 -7.428 1.574 1038 HB3 GLU 40 HB1 GLU 40 -9.056 -6.677 1.995 1039 HG2 GLU 40 HG2 GLU 40 -9.176 -7.742 -0.644 1040 HG3 GLU 40 HG1 GLU 40 -8.655 -8.956 0.495 1041 H LEU 41 HN LEU 41 -5.523 -5.658 0.373 1042 HA LEU 41 HA LEU 41 -5.321 -3.756 2.546 1043 HB2 LEU 41 HB2 LEU 41 -3.646 -5.715 1.476 1044 HB3 LEU 41 HB1 LEU 41 -2.848 -4.194 1.123 1045 HG LEU 41 HG LEU 41 -1.949 -4.768 3.167 1046 HD11 LEU 41 HD11 LEU 41 -3.060 -2.503 3.108 1047 HD12 LEU 41 HD12 LEU 41 -2.668 -3.161 4.689 1048 HD13 LEU 41 HD13 LEU 41 -4.329 -3.214 4.106 1049 HD21 LEU 41 HD21 LEU 41 -3.210 -5.690 5.034 1050 HD22 LEU 41 HD22 LEU 41 -3.361 -6.697 3.595 1051 HD23 LEU 41 HD23 LEU 41 -4.686 -5.633 4.071 1052 H MET 42 HN MET 42 -4.171 -3.773 -0.846 1053 HA MET 42 HA MET 42 -3.259 -1.108 -0.841 1054 HB2 MET 42 HB2 MET 42 -4.158 -2.824 -3.152 1055 HB3 MET 42 HB1 MET 42 -3.282 -1.295 -3.321 1056 HG2 MET 42 HG2 MET 42 -2.324 -3.846 -2.044 1057 HG3 MET 42 HG1 MET 42 -1.758 -3.110 -3.532 1058 HE1 MET 42 HE1 MET 42 0.708 -3.460 -2.642 1059 HE2 MET 42 HE2 MET 42 0.073 -4.133 -1.139 1060 HE3 MET 42 HE3 MET 42 1.277 -2.844 -1.087 1061 H ALA 43 HN ALA 43 -6.334 -2.525 -1.186 1062 HA ALA 43 HA ALA 43 -7.950 -0.627 -2.254 1063 HB1 ALA 43 HB1 ALA 43 -8.311 -2.305 0.215 1064 HB2 ALA 43 HB2 ALA 43 -8.818 -2.681 -1.433 1065 HB3 ALA 43 HB3 ALA 43 -9.609 -1.379 -0.540 1066 H TYR 44 HN TYR 44 -6.143 -0.500 0.737 1067 HA TYR 44 HA TYR 44 -7.311 2.130 1.417 1068 HB2 TYR 44 HB2 TYR 44 -7.425 0.586 3.278 1069 HB3 TYR 44 HB1 TYR 44 -5.758 0.112 3.016 1070 HD1 TYR 44 HD1 TYR 44 -7.950 2.426 4.723 1071 HD2 TYR 44 HD2 TYR 44 -3.916 1.731 3.614 1072 HE1 TYR 44 HE1 TYR 44 -7.221 4.000 6.457 1073 HE2 TYR 44 HE2 TYR 44 -3.167 3.303 5.339 1074 HH TYR 44 HH TYR 44 -5.051 4.323 7.837 1075 H GLU 45 HN GLU 45 -4.239 0.418 1.759 1076 HA GLU 45 HA GLU 45 -2.572 2.499 2.072 1077 HB2 GLU 45 HB2 GLU 45 -1.759 0.181 0.396 1078 HB3 GLU 45 HB1 GLU 45 -0.808 1.054 1.587 1079 HG2 GLU 45 HG2 GLU 45 -3.110 -0.767 2.130 1080 HG3 GLU 45 HG1 GLU 45 -1.423 -1.173 2.353 1081 H ASN 46 HN ASN 46 -3.945 1.384 -0.963 1082 HA ASN 46 HA ASN 46 -2.194 3.178 -2.445 1083 HB2 ASN 46 HB2 ASN 46 -3.574 0.610 -3.036 1084 HB3 ASN 46 HB1 ASN 46 -3.363 1.750 -4.358 1085 HD21 ASN 46 HD21 ASN 46 -1.841 0.360 -5.431 1086 HD22 ASN 46 HD22 ASN 46 -0.251 0.180 -4.829 1087 H ALA 47 HN ALA 47 -5.437 2.841 -1.376 1088 HA ALA 47 HA ALA 47 -6.907 3.898 -3.534 1089 HB1 ALA 47 HB1 ALA 47 -8.679 4.279 -1.958 1090 HB2 ALA 47 HB2 ALA 47 -7.549 4.145 -0.611 1091 HB3 ALA 47 HB3 ALA 47 -7.894 2.736 -1.617 1092 H ASN 48 HN ASN 48 -8.402 5.987 -2.913 1093 HA ASN 48 HA ASN 48 -6.907 8.339 -3.167 1094 HB2 ASN 48 HB2 ASN 48 -9.538 8.042 -1.673 1095 HB3 ASN 48 HB1 ASN 48 -8.831 9.565 -2.159 1096 HD21 ASN 48 HD21 ASN 48 -8.144 8.260 -4.885 1097 HD22 ASN 48 HD22 ASN 48 -9.665 8.317 -5.685 1098 HA PRO 49 HA PRO 49 -5.057 8.682 0.914 1099 HB2 PRO 49 HB2 PRO 49 -4.948 11.445 1.012 1100 HB3 PRO 49 HB1 PRO 49 -3.720 10.420 0.269 1101 HG2 PRO 49 HG2 PRO 49 -5.950 11.944 -0.998 1102 HG3 PRO 49 HG1 PRO 49 -4.297 11.680 -1.579 1103 HD2 PRO 49 HD2 PRO 49 -6.393 10.319 -2.570 1104 HD3 PRO 49 HD1 PRO 49 -4.789 9.577 -2.405 1105 H GLU 50 HN GLU 50 -7.934 10.186 -0.149 1106 HA GLU 50 HA GLU 50 -9.023 10.791 2.434 1107 HB2 GLU 50 HB2 GLU 50 -9.862 12.281 0.918 1108 HB3 GLU 50 HB1 GLU 50 -9.803 11.138 -0.413 1109 HG2 GLU 50 HG2 GLU 50 -12.003 11.078 -0.164 1110 HG3 GLU 50 HG1 GLU 50 -11.649 10.017 1.173 1111 H CYS 51 HN CYS 51 -9.169 8.253 -0.016 1112 HA CYS 51 HA CYS 51 -11.588 7.193 1.059 1113 HB2 CYS 51 HB2 CYS 51 -11.228 7.018 -1.291 1114 HB3 CYS 51 HB1 CYS 51 -9.734 6.111 -1.062 1115 HG CYS 51 HG CYS 51 -11.463 4.263 0.603 1116 H GLN 52 HN GLN 52 -8.181 6.469 1.172 1117 HA GLN 52 HA GLN 52 -8.537 4.061 2.664 1118 HB2 GLN 52 HB2 GLN 52 -6.207 4.236 3.221 1119 HB3 GLN 52 HB1 GLN 52 -6.408 4.640 1.525 1120 HG2 GLN 52 HG2 GLN 52 -6.333 7.046 2.186 1121 HG3 GLN 52 HG1 GLN 52 -5.898 6.517 3.813 1122 HE21 GLN 52 HE21 GLN 52 -4.507 4.205 2.746 1123 HE22 GLN 52 HE22 GLN 52 -3.028 4.758 2.084 1124 H SER 53 HN SER 53 -8.446 7.396 3.181 1125 HA SER 53 HA SER 53 -8.504 7.372 6.005 1126 HB2 SER 53 HB2 SER 53 -9.072 9.358 3.854 1127 HB3 SER 53 HB1 SER 53 -9.379 9.762 5.551 1128 HG SER 53 HG SER 53 -7.025 9.600 4.184 1129 H ALA 54 HN ALA 54 -10.859 6.893 3.493 1130 HA ALA 54 HA ALA 54 -13.069 6.950 5.348 1131 HB1 ALA 54 HB1 ALA 54 -12.785 5.824 2.574 1132 HB2 ALA 54 HB2 ALA 54 -13.540 7.347 3.041 1133 HB3 ALA 54 HB3 ALA 54 -14.293 5.820 3.493 1134 H ILE 55 HN ILE 55 -10.654 4.757 4.408 1135 HA ILE 55 HA ILE 55 -12.153 2.404 5.136 1136 HB ILE 55 HB ILE 55 -9.483 2.834 3.872 1137 HG12 ILE 55 HG12 ILE 55 -11.758 1.281 2.743 1138 HG13 ILE 55 HG11 ILE 55 -11.846 3.048 2.763 1139 HG21 ILE 55 HG21 ILE 55 -9.351 0.398 3.583 1140 HG22 ILE 55 HG22 ILE 55 -10.758 0.220 4.631 1141 HG23 ILE 55 HG23 ILE 55 -9.255 0.881 5.276 1142 HD11 ILE 55 HD11 ILE 55 -9.627 1.429 1.530 1143 HD12 ILE 55 HD12 ILE 55 -9.810 3.192 1.492 1144 HD13 ILE 55 HD13 ILE 55 -10.985 2.159 0.658 1145 H LYS 56 HN LYS 56 -9.498 4.290 6.545 1146 HA LYS 56 HA LYS 56 -8.128 2.451 7.961 1147 HB2 LYS 56 HB2 LYS 56 -8.618 4.514 9.877 1148 HB3 LYS 56 HB1 LYS 56 -7.147 4.118 9.013 1149 HG2 LYS 56 HG2 LYS 56 -7.434 6.290 8.410 1150 HG3 LYS 56 HG1 LYS 56 -8.300 5.487 7.096 1151 HD2 LYS 56 HD2 LYS 56 -10.307 6.141 7.820 1152 HD3 LYS 56 HD1 LYS 56 -9.861 6.080 9.525 1153 HE2 LYS 56 HE2 LYS 56 -9.525 8.323 7.537 1154 HE3 LYS 56 HE1 LYS 56 -10.169 8.346 9.181 1155 HZ1 LYS 56 HZ1 LYS 56 -7.304 8.018 8.480 1156 HZ2 LYS 56 HZ2 LYS 56 -7.934 7.991 10.048 1157 HZ3 LYS 56 HZ3 LYS 56 -8.023 9.404 9.128 1158 HA PRO 57 HA PRO 57 -11.467 2.154 11.557 1159 HB2 PRO 57 HB2 PRO 57 -14.025 2.194 10.640 1160 HB3 PRO 57 HB1 PRO 57 -13.206 3.637 11.258 1161 HG2 PRO 57 HG2 PRO 57 -13.438 2.687 8.414 1162 HG3 PRO 57 HG1 PRO 57 -13.855 4.286 9.074 1163 HD2 PRO 57 HD2 PRO 57 -11.533 3.934 7.882 1164 HD3 PRO 57 HD1 PRO 57 -11.567 4.832 9.409 1165 H LEU 58 HN LEU 58 -11.942 1.068 8.249 1166 HA LEU 58 HA LEU 58 -12.919 -1.551 9.115 1167 HB2 LEU 58 HB2 LEU 58 -12.377 -0.971 6.263 1168 HB3 LEU 58 HB1 LEU 58 -13.691 -1.900 6.981 1169 HG LEU 58 HG LEU 58 -13.480 1.119 6.911 1170 HD11 LEU 58 HD11 LEU 58 -15.304 0.937 5.260 1171 HD12 LEU 58 HD12 LEU 58 -15.099 -0.815 5.270 1172 HD13 LEU 58 HD13 LEU 58 -13.791 0.219 4.703 1173 HD21 LEU 58 HD21 LEU 58 -15.810 1.082 7.655 1174 HD22 LEU 58 HD22 LEU 58 -14.745 0.326 8.839 1175 HD23 LEU 58 HD23 LEU 58 -15.746 -0.676 7.786 1176 H LYS 59 HN LYS 59 -10.187 0.160 8.193 1177 HA LYS 59 HA LYS 59 -8.635 -1.710 6.862 1178 HB2 LYS 59 HB2 LYS 59 -7.927 0.593 7.124 1179 HB3 LYS 59 HB1 LYS 59 -7.782 0.374 8.859 1180 HG2 LYS 59 HG2 LYS 59 -5.615 0.068 8.378 1181 HG3 LYS 59 HG1 LYS 59 -6.157 -1.563 8.010 1182 HD2 LYS 59 HD2 LYS 59 -5.837 0.660 6.027 1183 HD3 LYS 59 HD1 LYS 59 -4.709 -0.685 6.238 1184 HE2 LYS 59 HE2 LYS 59 -7.602 -0.869 5.365 1185 HE3 LYS 59 HE1 LYS 59 -6.193 -1.062 4.336 1186 HZ1 LYS 59 HZ1 LYS 59 -7.083 -3.195 4.910 1187 HZ2 LYS 59 HZ2 LYS 59 -6.992 -2.842 6.559 1188 HZ3 LYS 59 HZ3 LYS 59 -5.573 -3.011 5.659 1189 H GLY 60 HN GLY 60 -8.360 -3.732 7.443 1190 HA2 GLY 60 HA3 GLY 60 -7.204 -5.354 8.740 1191 HA3 GLY 60 HA2 GLY 60 -7.356 -4.298 10.139 1192 H LYS 61 HN LYS 61 -10.240 -3.797 9.326 1193 HA LYS 61 HA LYS 61 -11.287 -6.232 10.598 1194 HB2 LYS 61 HB2 LYS 61 -12.935 -3.774 10.249 1195 HB3 LYS 61 HB1 LYS 61 -12.887 -4.904 11.591 1196 HG2 LYS 61 HG2 LYS 61 -10.749 -2.890 10.986 1197 HG3 LYS 61 HG1 LYS 61 -12.043 -2.651 12.148 1198 HD2 LYS 61 HD2 LYS 61 -10.010 -4.873 12.265 1199 HD3 LYS 61 HD1 LYS 61 -9.913 -3.372 13.188 1200 HE2 LYS 61 HE2 LYS 61 -12.035 -3.894 14.265 1201 HE3 LYS 61 HE1 LYS 61 -12.143 -5.389 13.339 1202 HZ1 LYS 61 HZ1 LYS 61 -10.017 -4.735 15.303 1203 HZ2 LYS 61 HZ2 LYS 61 -10.145 -6.179 14.431 1204 HZ3 LYS 61 HZ3 LYS 61 -11.321 -5.775 15.578 1205 H VAL 62 HN VAL 62 -11.982 -7.606 9.089 1206 HA VAL 62 HA VAL 62 -13.941 -6.566 7.162 1207 HB VAL 62 HB VAL 62 -12.024 -7.462 5.954 1208 HG11 VAL 62 HG11 VAL 62 -11.353 -9.815 6.122 1209 HG12 VAL 62 HG12 VAL 62 -12.485 -10.033 7.458 1210 HG13 VAL 62 HG13 VAL 62 -11.105 -8.949 7.639 1211 HG21 VAL 62 HG21 VAL 62 -13.140 -9.215 4.619 1212 HG22 VAL 62 HG22 VAL 62 -14.168 -7.817 4.929 1213 HG23 VAL 62 HG23 VAL 62 -14.404 -9.304 5.847 1214 HA PRO 63 HA PRO 63 -17.009 -9.147 9.289 1215 HB2 PRO 63 HB2 PRO 63 -17.833 -9.675 6.478 1216 HB3 PRO 63 HB1 PRO 63 -18.818 -9.236 7.858 1217 HG2 PRO 63 HG2 PRO 63 -18.231 -7.431 6.006 1218 HG3 PRO 63 HG1 PRO 63 -18.260 -6.988 7.721 1219 HD2 PRO 63 HD2 PRO 63 -15.932 -7.424 5.919 1220 HD3 PRO 63 HD1 PRO 63 -16.109 -6.311 7.288 1221 H ALA 64 HN ALA 64 -17.033 -11.274 9.798 1222 HA ALA 64 HA ALA 64 -14.943 -12.921 8.904 1223 HB1 ALA 64 HB1 ALA 64 -15.940 -14.647 10.294 1224 HB2 ALA 64 HB2 ALA 64 -17.433 -13.716 10.407 1225 HB3 ALA 64 HB3 ALA 64 -15.950 -13.097 11.133 1226 H GLY 65 HN GLY 65 -14.874 -13.523 6.828 1227 HA2 GLY 65 HA3 GLY 65 -15.453 -15.338 5.353 1228 HA3 GLY 65 HA2 GLY 65 -17.129 -15.142 5.845 1229 H SER 66 HN SER 66 -16.395 -12.079 5.586 1230 HA SER 66 HA SER 66 -17.321 -11.961 2.817 1231 HB2 SER 66 HB2 SER 66 -17.081 -9.751 4.869 1232 HB3 SER 66 HB1 SER 66 -17.923 -9.662 3.323 1233 HG SER 66 HG SER 66 -19.102 -11.613 4.286 1234 H ASP 67 HN ASP 67 -16.529 -10.144 1.509 1235 HA ASP 67 HA ASP 67 -13.644 -10.057 1.357 1236 HB2 ASP 67 HB2 ASP 67 -15.970 -9.198 -0.291 1237 HB3 ASP 67 HB1 ASP 67 -14.462 -8.331 -0.542 1238 H VAL 68 HN VAL 68 -12.343 -8.289 1.914 1239 HA VAL 68 HA VAL 68 -13.565 -6.370 3.620 1240 HB VAL 68 HB VAL 68 -11.583 -5.731 4.386 1241 HG11 VAL 68 HG11 VAL 68 -9.843 -7.301 4.333 1242 HG12 VAL 68 HG12 VAL 68 -10.347 -7.940 2.760 1243 HG13 VAL 68 HG13 VAL 68 -11.348 -8.214 4.199 1244 HG21 VAL 68 HG21 VAL 68 -9.653 -5.157 2.987 1245 HG22 VAL 68 HG22 VAL 68 -11.133 -4.318 2.520 1246 HG23 VAL 68 HG23 VAL 68 -10.559 -5.689 1.561 1247 H ILE 69 HN ILE 69 -12.538 -6.543 0.368 1248 HA ILE 69 HA ILE 69 -12.406 -3.890 -0.350 1249 HB ILE 69 HB ILE 69 -13.265 -6.299 -1.923 1250 HG12 ILE 69 HG12 ILE 69 -10.987 -6.503 -1.359 1251 HG13 ILE 69 HG11 ILE 69 -10.971 -5.822 -2.977 1252 HG21 ILE 69 HG21 ILE 69 -12.815 -3.473 -2.902 1253 HG22 ILE 69 HG22 ILE 69 -14.292 -4.430 -3.014 1254 HG23 ILE 69 HG23 ILE 69 -12.873 -4.884 -3.962 1255 HD11 ILE 69 HD11 ILE 69 -9.330 -4.735 -1.638 1256 HD12 ILE 69 HD12 ILE 69 -10.545 -4.344 -0.410 1257 HD13 ILE 69 HD13 ILE 69 -10.630 -3.591 -2.002 1258 H SER 70 HN SER 70 -15.170 -6.032 -0.382 1259 HA SER 70 HA SER 70 -17.165 -4.448 -1.333 1260 HB2 SER 70 HB2 SER 70 -17.405 -6.807 -0.604 1261 HB3 SER 70 HB1 SER 70 -17.342 -6.280 1.073 1262 HG SER 70 HG SER 70 -19.296 -5.498 -0.843 1263 H GLU 71 HN GLU 71 -15.663 -4.297 1.835 1264 HA GLU 71 HA GLU 71 -17.522 -2.339 2.875 1265 HB2 GLU 71 HB2 GLU 71 -14.933 -3.267 4.091 1266 HB3 GLU 71 HB1 GLU 71 -16.338 -2.600 4.916 1267 HG2 GLU 71 HG2 GLU 71 -16.873 -5.010 3.371 1268 HG3 GLU 71 HG1 GLU 71 -15.748 -5.232 4.707 1269 H TYR 72 HN TYR 72 -14.372 -2.518 1.516 1270 HA TYR 72 HA TYR 72 -13.539 0.058 2.417 1271 HB2 TYR 72 HB2 TYR 72 -12.413 -1.976 0.508 1272 HB3 TYR 72 HB1 TYR 72 -11.680 -0.391 0.710 1273 HD1 TYR 72 HD1 TYR 72 -13.208 -1.846 3.643 1274 HD2 TYR 72 HD2 TYR 72 -9.614 -1.579 1.403 1275 HE1 TYR 72 HE1 TYR 72 -11.948 -2.681 5.565 1276 HE2 TYR 72 HE2 TYR 72 -8.342 -2.430 3.326 1277 HH TYR 72 HH TYR 72 -9.952 -3.697 6.148 1278 H VAL 73 HN VAL 73 -14.876 -1.344 -0.506 1279 HA VAL 73 HA VAL 73 -14.907 1.074 -1.992 1280 HB VAL 73 HB VAL 73 -16.163 0.077 -3.624 1281 HG11 VAL 73 HG11 VAL 73 -15.481 -2.261 -3.911 1282 HG12 VAL 73 HG12 VAL 73 -14.870 -2.247 -2.257 1283 HG13 VAL 73 HG13 VAL 73 -14.159 -1.187 -3.470 1284 HG21 VAL 73 HG21 VAL 73 -18.027 -0.492 -1.914 1285 HG22 VAL 73 HG22 VAL 73 -17.324 -2.112 -1.982 1286 HG23 VAL 73 HG23 VAL 73 -17.935 -1.345 -3.458 1287 H LYS 74 HN LYS 74 -16.948 -0.492 0.326 1288 HA LYS 74 HA LYS 74 -19.204 1.214 0.198 1289 HB2 LYS 74 HB2 LYS 74 -18.445 -1.062 1.586 1290 HB3 LYS 74 HB1 LYS 74 -18.528 0.172 2.834 1291 HG2 LYS 74 HG2 LYS 74 -20.669 -0.553 2.937 1292 HG3 LYS 74 HG1 LYS 74 -20.865 0.661 1.673 1293 HD2 LYS 74 HD2 LYS 74 -20.306 -2.251 1.132 1294 HD3 LYS 74 HD1 LYS 74 -21.928 -1.561 1.190 1295 HE2 LYS 74 HE2 LYS 74 -19.749 -0.595 -0.647 1296 HE3 LYS 74 HE1 LYS 74 -20.962 -1.789 -1.106 1297 HZ1 LYS 74 HZ1 LYS 74 -21.496 0.520 -1.780 1298 HZ2 LYS 74 HZ2 LYS 74 -21.628 0.937 -0.145 1299 HZ3 LYS 74 HZ3 LYS 74 -22.683 -0.200 -0.815 1300 H ALA 75 HN ALA 75 -16.103 1.331 1.751 1301 HA ALA 75 HA ALA 75 -16.543 3.508 3.495 1302 HB1 ALA 75 HB1 ALA 75 -14.021 2.599 2.119 1303 HB2 ALA 75 HB2 ALA 75 -14.608 2.068 3.694 1304 HB3 ALA 75 HB3 ALA 75 -14.090 3.738 3.465 1305 H CYS 76 HN CYS 76 -15.358 3.342 0.160 1306 HA CYS 76 HA CYS 76 -15.506 6.254 -0.052 1307 HB2 CYS 76 HB2 CYS 76 -13.573 5.240 -1.013 1308 HB3 CYS 76 HB1 CYS 76 -14.535 4.128 -1.957 1309 HG CYS 76 HG CYS 76 -15.687 6.655 -3.212 1310 H ASP 77 HN ASP 77 -17.728 3.957 -0.102 1311 HA ASP 77 HA ASP 77 -19.283 4.463 -2.361 1312 HB2 ASP 77 HB2 ASP 77 -19.898 2.642 -1.018 1313 HB3 ASP 77 HB1 ASP 77 -19.942 3.598 0.453 1314 H GLY 78 HN GLY 78 -18.611 6.392 0.414 1315 HA2 GLY 78 HA3 GLY 78 -20.605 8.376 -0.414 1316 HA3 GLY 78 HA2 GLY 78 -19.693 8.400 1.087 1317 H ILE 79 HN ILE 79 -17.349 7.665 -0.998 1318 HA ILE 79 HA ILE 79 -16.564 10.456 -1.253 1319 HB ILE 79 HB ILE 79 -14.953 7.948 -1.633 1320 HG12 ILE 79 HG12 ILE 79 -14.813 9.966 0.613 1321 HG13 ILE 79 HG11 ILE 79 -15.681 8.429 0.714 1322 HG21 ILE 79 HG21 ILE 79 -12.983 9.385 -1.661 1323 HG22 ILE 79 HG22 ILE 79 -14.016 10.809 -1.561 1324 HG23 ILE 79 HG23 ILE 79 -14.078 9.775 -2.989 1325 HD11 ILE 79 HD11 ILE 79 -13.712 7.195 0.622 1326 HD12 ILE 79 HD12 ILE 79 -13.339 8.557 1.684 1327 HD13 ILE 79 HD13 ILE 79 -12.782 8.563 0.013 1328 H GLY 80 HN GLY 80 -16.267 11.456 -3.171 1329 HA2 GLY 80 HA3 GLY 80 -15.314 10.398 -5.493 1330 HA3 GLY 80 HA2 GLY 80 -17.049 10.183 -5.601 1331 H GLY 81 HN GLY 81 -17.750 12.568 -4.178 1332 HA2 GLY 81 HA3 GLY 81 -16.480 14.716 -5.673 1333 HA3 GLY 81 HA2 GLY 81 -18.197 14.474 -5.938 1334 H ALA 82 HN ALA 82 -19.632 15.231 -4.458 1335 HA ALA 82 HA ALA 82 -18.760 17.474 -3.017 1336 HB1 ALA 82 HB1 ALA 82 -21.054 17.723 -2.326 1337 HB2 ALA 82 HB2 ALA 82 -21.404 16.067 -2.821 1338 HB3 ALA 82 HB3 ALA 82 -20.966 17.275 -4.029 1339 H MET 83 HN MET 83 -19.879 14.303 -1.826 1340 HA MET 83 HA MET 83 -19.556 15.020 0.909 1341 HB2 MET 83 HB2 MET 83 -19.571 12.252 -0.306 1342 HB3 MET 83 HB1 MET 83 -19.788 12.639 1.393 1343 HG2 MET 83 HG2 MET 83 -21.834 13.888 0.809 1344 HG3 MET 83 HG1 MET 83 -21.629 13.380 -0.864 1345 HE1 MET 83 HE1 MET 83 -20.870 11.198 2.356 1346 HE2 MET 83 HE2 MET 83 -22.450 10.463 2.620 1347 HE3 MET 83 HE3 MET 83 -22.244 12.203 2.813 1348 H HIS 84 HN HIS 84 -17.471 13.651 -1.524 1349 HA HIS 84 HA HIS 84 -15.246 12.996 0.076 1350 HB2 HIS 84 HB2 HIS 84 -15.228 12.229 -2.159 1351 HB3 HIS 84 HB1 HIS 84 -15.587 13.819 -2.805 1352 HD1 HIS 84 HD1 HIS 84 -13.651 14.247 -4.281 1353 HD2 HIS 84 HD2 HIS 84 -12.468 12.894 -0.535 1354 HE1 HIS 84 HE1 HIS 84 -11.149 14.404 -4.267 1355 HE2 HIS 84 HE2 HIS 84 -10.440 13.465 -2.038 1356 H LYS 85 HN LYS 85 -16.495 16.052 -1.077 1357 HA LYS 85 HA LYS 85 -14.086 17.485 -0.361 1358 HB2 LYS 85 HB2 LYS 85 -16.800 18.556 -1.161 1359 HB3 LYS 85 HB1 LYS 85 -15.306 19.481 -1.064 1360 HG2 LYS 85 HG2 LYS 85 -15.791 17.169 -2.937 1361 HG3 LYS 85 HG1 LYS 85 -15.902 18.876 -3.372 1362 HD2 LYS 85 HD2 LYS 85 -13.580 19.202 -3.019 1363 HD3 LYS 85 HD1 LYS 85 -13.412 17.637 -2.224 1364 HE2 LYS 85 HE2 LYS 85 -13.845 16.476 -4.285 1365 HE3 LYS 85 HE1 LYS 85 -14.207 17.997 -5.106 1366 HZ1 LYS 85 HZ1 LYS 85 -11.928 18.696 -4.803 1367 HZ2 LYS 85 HZ2 LYS 85 -11.967 17.207 -5.601 1368 HZ3 LYS 85 HZ3 LYS 85 -11.559 17.277 -3.962 1369 H ALA 86 HN ALA 86 -16.998 16.498 1.138 1370 HA ALA 86 HA ALA 86 -16.844 18.408 3.304 1371 HB1 ALA 86 HB1 ALA 86 -18.569 15.957 3.005 1372 HB2 ALA 86 HB2 ALA 86 -19.026 17.595 2.537 1373 HB3 ALA 86 HB3 ALA 86 -18.746 17.208 4.235 1374 H MET 87 HN MET 87 -16.200 15.021 2.731 1375 HA MET 87 HA MET 87 -15.379 14.550 5.458 1376 HB2 MET 87 HB2 MET 87 -15.385 12.763 3.021 1377 HB3 MET 87 HB1 MET 87 -15.007 12.237 4.660 1378 HG2 MET 87 HG2 MET 87 -17.513 13.668 4.538 1379 HG3 MET 87 HG1 MET 87 -17.501 12.277 3.465 1380 HE1 MET 87 HE1 MET 87 -19.519 11.240 4.861 1381 HE2 MET 87 HE2 MET 87 -19.501 12.632 5.945 1382 HE3 MET 87 HE3 MET 87 -19.478 10.998 6.608 1383 H LEU 88 HN LEU 88 -13.940 15.635 2.614 1384 HA LEU 88 HA LEU 88 -11.393 14.674 2.567 1385 HB2 LEU 88 HB2 LEU 88 -12.701 16.608 1.289 1386 HB3 LEU 88 HB1 LEU 88 -11.730 17.608 2.346 1387 HG LEU 88 HG LEU 88 -9.848 17.254 1.147 1388 HD11 LEU 88 HD11 LEU 88 -9.590 14.933 1.853 1389 HD12 LEU 88 HD12 LEU 88 -9.219 15.098 0.139 1390 HD13 LEU 88 HD13 LEU 88 -10.766 14.419 0.644 1391 HD21 LEU 88 HD21 LEU 88 -11.494 17.880 -0.513 1392 HD22 LEU 88 HD22 LEU 88 -11.908 16.182 -0.751 1393 HD23 LEU 88 HD23 LEU 88 -10.309 16.773 -1.211 1394 H MET 89 HN MET 89 -12.714 17.154 4.718 1395 HA MET 89 HA MET 89 -10.165 17.588 6.021 1396 HB2 MET 89 HB2 MET 89 -11.781 19.431 5.657 1397 HB3 MET 89 HB1 MET 89 -12.913 18.629 6.732 1398 HG2 MET 89 HG2 MET 89 -11.416 18.912 8.596 1399 HG3 MET 89 HG1 MET 89 -10.181 19.594 7.539 1400 HE1 MET 89 HE1 MET 89 -11.313 22.673 9.679 1401 HE2 MET 89 HE2 MET 89 -9.953 21.675 9.168 1402 HE3 MET 89 HE3 MET 89 -11.196 20.999 10.221 1403 H ALA 90 HN ALA 90 -12.688 15.379 6.303 1404 HA ALA 90 HA ALA 90 -12.446 15.089 9.205 1405 HB1 ALA 90 HB1 ALA 90 -14.355 13.734 7.295 1406 HB2 ALA 90 HB2 ALA 90 -14.700 15.219 8.189 1407 HB3 ALA 90 HB3 ALA 90 -14.433 13.710 9.060 1408 H GLN 91 HN GLN 91 -11.827 13.384 6.226 1409 HA GLN 91 HA GLN 91 -10.887 11.066 7.762 1410 HB2 GLN 91 HB2 GLN 91 -11.645 11.278 4.858 1411 HB3 GLN 91 HB1 GLN 91 -11.210 9.805 5.712 1412 HG2 GLN 91 HG2 GLN 91 -13.158 10.008 7.113 1413 HG3 GLN 91 HG1 GLN 91 -13.590 11.523 6.327 1414 HE21 GLN 91 HE21 GLN 91 -12.799 10.769 3.743 1415 HE22 GLN 91 HE22 GLN 91 -13.904 9.580 3.189 1416 H LEU 92 HN LEU 92 -10.118 12.781 4.724 1417 HA LEU 92 HA LEU 92 -7.499 11.921 4.417 1418 HB2 LEU 92 HB2 LEU 92 -8.972 13.162 2.801 1419 HB3 LEU 92 HB1 LEU 92 -8.550 14.628 3.653 1420 HG LEU 92 HG LEU 92 -7.274 13.643 1.457 1421 HD11 LEU 92 HD11 LEU 92 -6.156 15.449 3.588 1422 HD12 LEU 92 HD12 LEU 92 -7.177 15.930 2.234 1423 HD13 LEU 92 HD13 LEU 92 -5.549 15.320 1.937 1424 HD21 LEU 92 HD21 LEU 92 -5.008 13.012 2.194 1425 HD22 LEU 92 HD22 LEU 92 -6.235 11.811 2.604 1426 HD23 LEU 92 HD23 LEU 92 -5.612 12.896 3.845 1427 H GLU 93 HN GLU 93 -8.772 13.668 6.921 1428 HA GLU 93 HA GLU 93 -7.231 15.762 7.621 1429 HB2 GLU 93 HB2 GLU 93 -7.633 15.090 10.010 1430 HB3 GLU 93 HB1 GLU 93 -9.075 15.149 9.000 1431 HG2 GLU 93 HG2 GLU 93 -9.288 12.830 8.956 1432 HG3 GLU 93 HG1 GLU 93 -7.619 12.566 9.453 Start of MODEL 15 1 H2 PRO 1 HT1 PRO 1 -5.201 -3.874 13.114 2 H3 PRO 1 HT2 PRO 1 -5.545 -2.400 13.727 3 HA PRO 1 HA PRO 1 -6.146 -2.103 11.666 4 HB2 PRO 1 HB2 PRO 1 -3.923 -1.117 10.533 5 HB3 PRO 1 HB1 PRO 1 -4.705 -0.304 11.888 6 HG2 PRO 1 HG2 PRO 1 -2.185 -1.777 11.824 7 HG3 PRO 1 HG1 PRO 1 -2.792 -0.655 13.049 8 HD2 PRO 1 HD2 PRO 1 -2.847 -3.573 13.016 9 HD3 PRO 1 HD1 PRO 1 -3.201 -2.466 14.359 10 H SER 2 HN SER 2 -4.260 -2.146 9.355 11 HA SER 2 HA SER 2 -4.146 -4.876 8.619 12 HB2 SER 2 HB2 SER 2 -2.281 -2.682 7.662 13 HB3 SER 2 HB1 SER 2 -2.703 -4.170 6.827 14 HG SER 2 HG SER 2 -3.783 -1.965 6.385 15 H PHE 3 HN PHE 3 -1.964 -6.020 8.342 16 HA PHE 3 HA PHE 3 -0.315 -5.774 10.639 17 HB2 PHE 3 HB2 PHE 3 1.288 -6.893 8.678 18 HB3 PHE 3 HB1 PHE 3 0.272 -7.794 9.802 19 HD1 PHE 3 HD1 PHE 3 0.819 -6.712 6.409 20 HD2 PHE 3 HD2 PHE 3 -1.939 -8.620 9.036 21 HE1 PHE 3 HE1 PHE 3 -0.385 -7.651 4.493 22 HE2 PHE 3 HE2 PHE 3 -3.159 -9.536 7.110 23 HZ PHE 3 HZ PHE 3 -2.380 -9.051 4.826 24 H ASN 4 HN ASN 4 -0.096 -4.757 7.308 25 HA ASN 4 HA ASN 4 2.571 -3.763 7.615 26 HB2 ASN 4 HB2 ASN 4 2.387 -3.294 5.234 27 HB3 ASN 4 HB1 ASN 4 1.848 -4.930 5.595 28 HD21 ASN 4 HD21 ASN 4 0.755 -1.656 4.916 29 HD22 ASN 4 HD22 ASN 4 -0.806 -2.105 4.307 30 H THR 5 HN THR 5 -0.168 -2.315 8.602 31 HA THR 5 HA THR 5 -0.184 0.100 7.113 32 HB THR 5 HB THR 5 -1.271 0.840 9.455 33 HG1 THR 5 HG1 THR 5 -1.047 -1.031 10.570 34 HG21 THR 5 HG21 THR 5 -2.533 -0.775 7.259 35 HG22 THR 5 HG22 THR 5 -2.412 0.982 7.355 36 HG23 THR 5 HG23 THR 5 -3.435 0.102 8.492 37 H VAL 6 HN VAL 6 2.114 -1.035 9.219 38 HA VAL 6 HA VAL 6 2.876 1.471 10.360 39 HB VAL 6 HB VAL 6 4.667 0.348 11.347 40 HG11 VAL 6 HG11 VAL 6 2.578 -0.539 12.180 41 HG12 VAL 6 HG12 VAL 6 3.812 -1.798 12.170 42 HG13 VAL 6 HG13 VAL 6 2.573 -1.770 10.915 43 HG21 VAL 6 HG21 VAL 6 5.738 -1.646 10.542 44 HG22 VAL 6 HG22 VAL 6 5.630 -0.485 9.209 45 HG23 VAL 6 HG23 VAL 6 4.505 -1.847 9.289 46 H ARG 7 HN ARG 7 4.271 2.983 9.457 47 HA ARG 7 HA ARG 7 5.914 2.135 7.273 48 HB2 ARG 7 HB2 ARG 7 4.960 3.796 5.672 49 HB3 ARG 7 HB1 ARG 7 4.063 2.336 6.012 50 HG2 ARG 7 HG2 ARG 7 3.137 4.270 7.795 51 HG3 ARG 7 HG1 ARG 7 3.199 5.003 6.190 52 HD2 ARG 7 HD2 ARG 7 1.879 3.254 5.255 53 HD3 ARG 7 HD1 ARG 7 1.989 2.304 6.734 54 HE ARG 7 HE ARG 7 0.815 4.737 7.415 55 HH11 ARG 7 HH11 ARG 7 0.145 2.015 5.384 56 HH12 ARG 7 HH12 ARG 7 -1.575 2.154 5.498 57 HH21 ARG 7 HH21 ARG 7 -1.462 4.936 7.652 58 HH22 ARG 7 HH22 ARG 7 -2.498 3.815 6.833 59 H GLN 8 HN GLN 8 7.197 3.673 6.317 60 HA GLN 8 HA GLN 8 8.871 5.023 7.920 61 HB2 GLN 8 HB2 GLN 8 8.535 4.630 5.174 62 HB3 GLN 8 HB1 GLN 8 8.707 6.371 5.357 63 HG2 GLN 8 HG2 GLN 8 10.780 6.008 6.622 64 HG3 GLN 8 HG1 GLN 8 10.613 4.273 6.360 65 HE21 GLN 8 HE21 GLN 8 12.778 5.938 5.539 66 HE22 GLN 8 HE22 GLN 8 12.853 5.845 3.802 67 H GLY 9 HN GLY 9 8.355 6.484 9.370 68 HA2 GLY 9 HA3 GLY 9 6.518 8.651 8.793 69 HA3 GLY 9 HA2 GLY 9 7.406 8.390 10.288 70 H SER 10 HN SER 10 8.001 10.586 10.374 71 HA SER 10 HA SER 10 9.204 12.096 8.402 72 HB2 SER 10 HB2 SER 10 8.458 12.854 10.699 73 HB3 SER 10 HB1 SER 10 9.963 12.190 11.330 74 HG SER 10 HG SER 10 9.511 14.462 9.785 75 H LYS 11 HN LYS 11 10.701 11.212 7.139 76 HA LYS 11 HA LYS 11 12.450 9.968 6.403 77 HB2 LYS 11 HB2 LYS 11 14.572 10.913 6.916 78 HB3 LYS 11 HB1 LYS 11 13.412 12.220 6.839 79 HG2 LYS 11 HG2 LYS 11 13.372 12.378 9.212 80 HG3 LYS 11 HG1 LYS 11 14.375 10.949 9.393 81 HD2 LYS 11 HD2 LYS 11 16.200 12.142 8.232 82 HD3 LYS 11 HD1 LYS 11 15.185 13.582 8.164 83 HE2 LYS 11 HE2 LYS 11 16.119 12.186 10.670 84 HE3 LYS 11 HE1 LYS 11 16.765 13.693 10.026 85 HZ1 LYS 11 HZ1 LYS 11 13.993 13.256 10.992 86 HZ2 LYS 11 HZ2 LYS 11 14.576 14.700 10.339 87 HZ3 LYS 11 HZ3 LYS 11 15.200 14.119 11.800 88 H GLU 12 HN GLU 12 11.104 8.429 8.247 89 HA GLU 12 HA GLU 12 12.644 7.328 10.312 90 HB2 GLU 12 HB2 GLU 12 10.213 6.991 9.993 91 HB3 GLU 12 HB1 GLU 12 10.540 6.000 8.585 92 HG2 GLU 12 HG2 GLU 12 11.625 4.333 9.979 93 HG3 GLU 12 HG1 GLU 12 11.393 5.356 11.398 94 HA PRO 13 HA PRO 13 15.849 5.053 8.174 95 HB2 PRO 13 HB2 PRO 13 15.454 2.961 10.206 96 HB3 PRO 13 HB1 PRO 13 16.913 3.871 9.813 97 HG2 PRO 13 HG2 PRO 13 15.486 4.285 12.072 98 HG3 PRO 13 HG1 PRO 13 16.402 5.558 11.258 99 HD2 PRO 13 HD2 PRO 13 13.478 5.102 11.355 100 HD3 PRO 13 HD1 PRO 13 14.379 6.615 11.173 101 H TYR 14 HN TYR 14 15.549 3.783 6.449 102 HA TYR 14 HA TYR 14 12.907 2.848 6.091 103 HB2 TYR 14 HB2 TYR 14 14.086 3.951 4.288 104 HB3 TYR 14 HB1 TYR 14 15.243 2.626 4.219 105 HD1 TYR 14 HD1 TYR 14 14.321 0.310 3.758 106 HD2 TYR 14 HD2 TYR 14 12.131 3.842 3.069 107 HE1 TYR 14 HE1 TYR 14 12.881 -0.923 2.227 108 HE2 TYR 14 HE2 TYR 14 10.663 2.659 1.510 109 HH TYR 14 HH TYR 14 10.423 0.729 0.342 110 HA PRO 15 HA PRO 15 14.955 -1.551 5.516 111 HB2 PRO 15 HB2 PRO 15 17.151 -1.335 7.474 112 HB3 PRO 15 HB1 PRO 15 17.120 -2.145 5.912 113 HG2 PRO 15 HG2 PRO 15 18.441 0.153 6.296 114 HG3 PRO 15 HG1 PRO 15 17.677 -0.249 4.762 115 HD2 PRO 15 HD2 PRO 15 16.818 1.672 6.856 116 HD3 PRO 15 HD1 PRO 15 16.572 1.724 5.104 117 H ASP 16 HN ASP 16 14.765 0.451 8.199 118 HA ASP 16 HA ASP 16 14.004 -1.607 10.083 119 HB2 ASP 16 HB2 ASP 16 14.686 1.288 10.276 120 HB3 ASP 16 HB1 ASP 16 13.646 0.610 11.523 121 H PHE 17 HN PHE 17 12.620 1.200 8.442 122 HA PHE 17 HA PHE 17 10.042 1.134 9.487 123 HB2 PHE 17 HB2 PHE 17 9.948 2.901 8.048 124 HB3 PHE 17 HB1 PHE 17 11.369 2.323 7.188 125 HD1 PHE 17 HD1 PHE 17 11.182 1.447 5.036 126 HD2 PHE 17 HD2 PHE 17 7.702 1.890 7.423 127 HE1 PHE 17 HE1 PHE 17 9.787 0.861 3.103 128 HE2 PHE 17 HE2 PHE 17 6.293 1.321 5.487 129 HZ PHE 17 HZ PHE 17 7.337 0.806 3.324 130 H VAL 18 HN VAL 18 11.478 -0.605 6.793 131 HA VAL 18 HA VAL 18 9.076 -2.035 6.211 132 HB VAL 18 HB VAL 18 10.415 -1.621 4.321 133 HG11 VAL 18 HG11 VAL 18 12.697 -2.954 5.771 134 HG12 VAL 18 HG12 VAL 18 12.534 -1.215 5.512 135 HG13 VAL 18 HG13 VAL 18 12.738 -2.304 4.125 136 HG21 VAL 18 HG21 VAL 18 9.471 -3.772 4.172 137 HG22 VAL 18 HG22 VAL 18 10.681 -4.446 5.271 138 HG23 VAL 18 HG23 VAL 18 11.151 -3.928 3.646 139 H ALA 19 HN ALA 19 12.058 -2.721 7.972 140 HA ALA 19 HA ALA 19 11.719 -5.458 8.364 141 HB1 ALA 19 HB1 ALA 19 12.820 -3.515 10.390 142 HB2 ALA 19 HB2 ALA 19 13.732 -4.192 9.042 143 HB3 ALA 19 HB3 ALA 19 13.122 -5.250 10.313 144 H ARG 20 HN ARG 20 10.128 -2.765 10.047 145 HA ARG 20 HA ARG 20 8.842 -4.646 11.840 146 HB2 ARG 20 HB2 ARG 20 7.605 -2.700 12.718 147 HB3 ARG 20 HB1 ARG 20 9.342 -2.462 12.774 148 HG2 ARG 20 HG2 ARG 20 9.305 -0.814 11.181 149 HG3 ARG 20 HG1 ARG 20 7.812 -1.407 10.448 150 HD2 ARG 20 HD2 ARG 20 6.501 -0.568 12.233 151 HD3 ARG 20 HD1 ARG 20 7.919 -0.244 13.213 152 HE ARG 20 HE ARG 20 8.357 1.367 11.133 153 HH11 ARG 20 HH11 ARG 20 5.499 0.833 13.081 154 HH12 ARG 20 HH12 ARG 20 4.881 2.436 12.847 155 HH21 ARG 20 HH21 ARG 20 7.571 3.494 10.857 156 HH22 ARG 20 HH22 ARG 20 6.049 3.941 11.577 157 H LEU 21 HN LEU 21 8.367 -3.052 8.858 158 HA LEU 21 HA LEU 21 5.652 -3.461 8.422 159 HB2 LEU 21 HB2 LEU 21 7.492 -2.260 7.015 160 HB3 LEU 21 HB1 LEU 21 7.744 -3.832 6.298 161 HG LEU 21 HG LEU 21 5.680 -3.808 5.209 162 HD11 LEU 21 HD11 LEU 21 3.957 -2.074 5.634 163 HD12 LEU 21 HD12 LEU 21 4.918 -1.523 7.010 164 HD13 LEU 21 HD13 LEU 21 4.234 -3.148 7.006 165 HD21 LEU 21 HD21 LEU 21 7.243 -2.345 4.159 166 HD22 LEU 21 HD22 LEU 21 6.800 -1.028 5.245 167 HD23 LEU 21 HD23 LEU 21 5.637 -1.620 4.061 168 H GLN 22 HN GLN 22 8.462 -5.512 7.859 169 HA GLN 22 HA GLN 22 7.019 -7.761 6.936 170 HB2 GLN 22 HB2 GLN 22 9.761 -7.813 8.164 171 HB3 GLN 22 HB1 GLN 22 9.050 -8.918 6.978 172 HG2 GLN 22 HG2 GLN 22 8.990 -6.940 5.436 173 HG3 GLN 22 HG1 GLN 22 9.987 -6.109 6.594 174 HE21 GLN 22 HE21 GLN 22 11.397 -5.950 4.785 175 HE22 GLN 22 HE22 GLN 22 12.495 -7.242 4.455 176 H ASP 23 HN ASP 23 8.499 -6.834 9.963 177 HA ASP 23 HA ASP 23 8.181 -9.094 11.471 178 HB2 ASP 23 HB2 ASP 23 9.166 -6.871 12.142 179 HB3 ASP 23 HB1 ASP 23 7.508 -6.348 12.446 180 H VAL 24 HN VAL 24 5.756 -6.521 11.056 181 HA VAL 24 HA VAL 24 3.917 -8.003 12.696 182 HB VAL 24 HB VAL 24 3.922 -5.582 12.902 183 HG11 VAL 24 HG11 VAL 24 3.120 -5.552 10.006 184 HG12 VAL 24 HG12 VAL 24 4.668 -5.031 10.670 185 HG13 VAL 24 HG13 VAL 24 3.196 -4.145 11.065 186 HG21 VAL 24 HG21 VAL 24 1.796 -6.635 13.351 187 HG22 VAL 24 HG22 VAL 24 1.385 -6.619 11.638 188 HG23 VAL 24 HG23 VAL 24 1.503 -5.099 12.529 189 H ALA 25 HN ALA 25 4.643 -7.600 9.357 190 HA ALA 25 HA ALA 25 2.165 -8.625 8.337 191 HB1 ALA 25 HB1 ALA 25 3.673 -7.337 6.885 192 HB2 ALA 25 HB2 ALA 25 3.406 -8.953 6.237 193 HB3 ALA 25 HB3 ALA 25 4.913 -8.576 7.071 194 H GLN 26 HN GLN 26 4.945 -9.778 9.844 195 HA GLN 26 HA GLN 26 4.622 -12.522 9.022 196 HB2 GLN 26 HB2 GLN 26 6.808 -12.382 9.432 197 HB3 GLN 26 HB1 GLN 26 6.587 -10.836 10.234 198 HG2 GLN 26 HG2 GLN 26 7.490 -12.023 11.918 199 HG3 GLN 26 HG1 GLN 26 5.790 -12.350 12.220 200 HE21 GLN 26 HE21 GLN 26 5.635 -14.088 9.858 201 HE22 GLN 26 HE22 GLN 26 6.367 -15.572 10.321 202 H LYS 27 HN LYS 27 4.055 -10.479 11.785 203 HA LYS 27 HA LYS 27 3.214 -12.442 13.620 204 HB2 LYS 27 HB2 LYS 27 2.329 -9.556 13.442 205 HB3 LYS 27 HB1 LYS 27 2.258 -10.586 14.873 206 HG2 LYS 27 HG2 LYS 27 4.748 -9.654 13.468 207 HG3 LYS 27 HG1 LYS 27 4.127 -9.056 15.007 208 HD2 LYS 27 HD2 LYS 27 4.722 -10.986 16.135 209 HD3 LYS 27 HD1 LYS 27 4.724 -11.964 14.668 210 HE2 LYS 27 HE2 LYS 27 6.765 -11.104 13.950 211 HE3 LYS 27 HE1 LYS 27 6.673 -9.732 15.050 212 HZ1 LYS 27 HZ1 LYS 27 6.996 -11.255 16.904 213 HZ2 LYS 27 HZ2 LYS 27 8.274 -11.379 15.807 214 HZ3 LYS 27 HZ3 LYS 27 7.074 -12.568 15.843 215 H SER 28 HN SER 28 1.532 -10.758 11.060 216 HA SER 28 HA SER 28 -1.028 -11.741 12.090 217 HB2 SER 28 HB2 SER 28 -0.462 -9.589 10.056 218 HB3 SER 28 HB1 SER 28 -2.036 -9.969 10.755 219 HG SER 28 HG SER 28 0.203 -8.736 11.934 220 H ILE 29 HN ILE 29 1.309 -12.363 9.797 221 HA ILE 29 HA ILE 29 -0.640 -13.716 8.053 222 HB ILE 29 HB ILE 29 2.047 -12.571 7.325 223 HG12 ILE 29 HG12 ILE 29 -0.692 -11.804 6.317 224 HG13 ILE 29 HG11 ILE 29 0.230 -10.906 7.527 225 HG21 ILE 29 HG21 ILE 29 1.778 -14.572 6.095 226 HG22 ILE 29 HG22 ILE 29 1.482 -13.209 5.014 227 HG23 ILE 29 HG23 ILE 29 0.124 -14.145 5.650 228 HD11 ILE 29 HD11 ILE 29 0.402 -10.005 5.212 229 HD12 ILE 29 HD12 ILE 29 1.242 -11.498 4.762 230 HD13 ILE 29 HD13 ILE 29 1.945 -10.410 5.968 231 H ALA 30 HN ALA 30 -0.484 -15.874 7.970 232 HA ALA 30 HA ALA 30 1.836 -17.195 9.151 233 HB1 ALA 30 HB1 ALA 30 -0.780 -18.337 8.173 234 HB2 ALA 30 HB2 ALA 30 -0.388 -17.927 9.843 235 HB3 ALA 30 HB3 ALA 30 0.481 -19.226 9.026 236 H ASP 31 HN ASP 31 1.069 -16.015 6.248 237 HA ASP 31 HA ASP 31 2.226 -18.212 4.653 238 HB2 ASP 31 HB2 ASP 31 -0.074 -17.236 4.127 239 HB3 ASP 31 HB1 ASP 31 0.786 -15.783 3.655 240 H GLU 32 HN GLU 32 4.298 -17.973 4.244 241 HA GLU 32 HA GLU 32 5.796 -15.640 4.601 242 HB2 GLU 32 HB2 GLU 32 7.556 -16.780 3.355 243 HB3 GLU 32 HB1 GLU 32 6.772 -17.912 4.448 244 HG2 GLU 32 HG2 GLU 32 6.513 -19.265 2.721 245 HG3 GLU 32 HG1 GLU 32 5.346 -18.122 2.063 246 H LYS 33 HN LYS 33 3.872 -16.724 1.874 247 HA LYS 33 HA LYS 33 5.293 -15.127 -0.037 248 HB2 LYS 33 HB2 LYS 33 2.557 -16.395 -0.260 249 HB3 LYS 33 HB1 LYS 33 3.451 -15.670 -1.585 250 HG2 LYS 33 HG2 LYS 33 4.157 -17.749 -1.997 251 HG3 LYS 33 HG1 LYS 33 5.247 -17.491 -0.631 252 HD2 LYS 33 HD2 LYS 33 4.075 -19.610 -0.413 253 HD3 LYS 33 HD1 LYS 33 3.612 -18.497 0.873 254 HE2 LYS 33 HE2 LYS 33 1.682 -19.699 -0.015 255 HE3 LYS 33 HE1 LYS 33 1.549 -17.969 -0.296 256 HZ1 LYS 33 HZ1 LYS 33 2.387 -18.393 -2.578 257 HZ2 LYS 33 HZ2 LYS 33 0.879 -19.090 -2.258 258 HZ3 LYS 33 HZ3 LYS 33 2.274 -20.053 -2.274 259 H ALA 34 HN ALA 34 2.072 -14.970 1.428 260 HA ALA 34 HA ALA 34 1.446 -12.378 0.578 261 HB1 ALA 34 HB1 ALA 34 -0.234 -13.885 1.479 262 HB2 ALA 34 HB2 ALA 34 -0.213 -12.384 2.403 263 HB3 ALA 34 HB3 ALA 34 0.538 -13.836 3.063 264 H ARG 35 HN ARG 35 3.482 -13.521 3.169 265 HA ARG 35 HA ARG 35 3.572 -11.101 4.695 266 HB2 ARG 35 HB2 ARG 35 4.321 -13.542 5.315 267 HB3 ARG 35 HB1 ARG 35 5.842 -13.058 4.586 268 HG2 ARG 35 HG2 ARG 35 4.656 -11.284 6.663 269 HG3 ARG 35 HG1 ARG 35 5.388 -12.803 7.172 270 HD2 ARG 35 HD2 ARG 35 6.709 -10.571 5.641 271 HD3 ARG 35 HD1 ARG 35 7.019 -11.055 7.317 272 HE ARG 35 HE ARG 35 7.607 -13.308 6.061 273 HH11 ARG 35 HH11 ARG 35 8.460 -10.027 5.199 274 HH12 ARG 35 HH12 ARG 35 9.967 -10.474 4.470 275 HH21 ARG 35 HH21 ARG 35 9.581 -13.901 5.077 276 HH22 ARG 35 HH22 ARG 35 10.600 -12.673 4.394 277 H LYS 36 HN LYS 36 5.848 -12.611 2.427 278 HA LYS 36 HA LYS 36 7.633 -10.464 2.204 279 HB2 LYS 36 HB2 LYS 36 6.851 -12.373 0.013 280 HB3 LYS 36 HB1 LYS 36 8.336 -11.429 0.108 281 HG2 LYS 36 HG2 LYS 36 9.302 -12.842 1.534 282 HG3 LYS 36 HG1 LYS 36 7.783 -13.171 2.392 283 HD2 LYS 36 HD2 LYS 36 8.454 -15.164 1.238 284 HD3 LYS 36 HD1 LYS 36 7.027 -14.468 0.443 285 HE2 LYS 36 HE2 LYS 36 8.780 -13.259 -1.056 286 HE3 LYS 36 HE1 LYS 36 9.880 -14.506 -0.449 287 HZ1 LYS 36 HZ1 LYS 36 7.335 -15.026 -1.875 288 HZ2 LYS 36 HZ2 LYS 36 8.371 -16.209 -1.257 289 HZ3 LYS 36 HZ3 LYS 36 8.888 -15.208 -2.518 290 H VAL 37 HN VAL 37 4.929 -11.366 0.087 291 HA VAL 37 HA VAL 37 5.408 -9.426 -1.818 292 HB VAL 37 HB VAL 37 3.147 -9.696 -2.641 293 HG11 VAL 37 HG11 VAL 37 4.565 -11.464 -3.270 294 HG12 VAL 37 HG12 VAL 37 3.074 -12.235 -2.718 295 HG13 VAL 37 HG13 VAL 37 4.494 -12.199 -1.666 296 HG21 VAL 37 HG21 VAL 37 2.610 -11.042 -0.006 297 HG22 VAL 37 HG22 VAL 37 1.541 -11.157 -1.403 298 HG23 VAL 37 HG23 VAL 37 1.844 -9.591 -0.650 299 H ILE 38 HN ILE 38 3.616 -9.136 1.215 300 HA ILE 38 HA ILE 38 2.772 -6.489 0.435 301 HB ILE 38 HB ILE 38 1.555 -8.287 2.061 302 HG12 ILE 38 HG12 ILE 38 1.214 -5.318 2.352 303 HG13 ILE 38 HG11 ILE 38 0.770 -6.158 0.870 304 HG21 ILE 38 HG21 ILE 38 3.203 -7.913 3.868 305 HG22 ILE 38 HG22 ILE 38 1.575 -7.424 4.336 306 HG23 ILE 38 HG23 ILE 38 2.763 -6.203 3.882 307 HD11 ILE 38 HD11 ILE 38 -0.473 -6.183 3.552 308 HD12 ILE 38 HD12 ILE 38 -0.636 -7.610 2.524 309 HD13 ILE 38 HD13 ILE 38 -1.214 -6.041 1.964 310 H VAL 39 HN VAL 39 5.298 -7.885 2.448 311 HA VAL 39 HA VAL 39 6.009 -5.350 3.531 312 HB VAL 39 HB VAL 39 7.920 -6.247 4.390 313 HG11 VAL 39 HG11 VAL 39 6.033 -7.254 5.426 314 HG12 VAL 39 HG12 VAL 39 7.295 -8.485 5.285 315 HG13 VAL 39 HG13 VAL 39 5.935 -8.487 4.169 316 HG21 VAL 39 HG21 VAL 39 7.872 -8.463 2.350 317 HG22 VAL 39 HG22 VAL 39 9.020 -8.332 3.686 318 HG23 VAL 39 HG23 VAL 39 9.005 -7.113 2.413 319 H GLU 40 HN GLU 40 7.310 -7.251 0.835 320 HA GLU 40 HA GLU 40 9.028 -5.346 -0.198 321 HB2 GLU 40 HB2 GLU 40 7.514 -7.459 -1.717 322 HB3 GLU 40 HB1 GLU 40 9.026 -6.731 -2.179 323 HG2 GLU 40 HG2 GLU 40 9.220 -7.836 0.443 324 HG3 GLU 40 HG1 GLU 40 8.631 -9.023 -0.691 325 H LEU 41 HN LEU 41 5.557 -5.606 -0.475 326 HA LEU 41 HA LEU 41 5.444 -3.628 -2.587 327 HB2 LEU 41 HB2 LEU 41 3.665 -5.544 -1.610 328 HB3 LEU 41 HB1 LEU 41 2.930 -3.998 -1.232 329 HG LEU 41 HG LEU 41 2.054 -4.540 -3.319 330 HD11 LEU 41 HD11 LEU 41 2.937 -2.935 -4.872 331 HD12 LEU 41 HD12 LEU 41 4.447 -2.840 -3.972 332 HD13 LEU 41 HD13 LEU 41 2.950 -2.262 -3.245 333 HD21 LEU 41 HD21 LEU 41 3.485 -6.432 -3.802 334 HD22 LEU 41 HD22 LEU 41 4.816 -5.343 -4.193 335 HD23 LEU 41 HD23 LEU 41 3.367 -5.362 -5.198 336 H MET 42 HN MET 42 4.363 -3.688 0.835 337 HA MET 42 HA MET 42 3.503 -0.991 0.868 338 HB2 MET 42 HB2 MET 42 4.352 -2.750 3.165 339 HB3 MET 42 HB1 MET 42 3.519 -1.197 3.347 340 HG2 MET 42 HG2 MET 42 2.506 -3.769 2.174 341 HG3 MET 42 HG1 MET 42 1.880 -2.852 3.535 342 HE1 MET 42 HE1 MET 42 0.127 -4.034 1.148 343 HE2 MET 42 HE2 MET 42 -1.005 -2.695 0.945 344 HE3 MET 42 HE3 MET 42 -0.506 -3.193 2.565 345 H ALA 43 HN ALA 43 6.530 -2.506 1.187 346 HA ALA 43 HA ALA 43 8.189 -0.650 2.272 347 HB1 ALA 43 HB1 ALA 43 9.021 -2.709 1.426 348 HB2 ALA 43 HB2 ALA 43 9.829 -1.411 0.539 349 HB3 ALA 43 HB3 ALA 43 8.510 -2.314 -0.214 350 H TYR 44 HN TYR 44 6.379 -0.494 -0.710 351 HA TYR 44 HA TYR 44 7.485 2.172 -1.327 352 HB2 TYR 44 HB2 TYR 44 7.546 0.662 -3.229 353 HB3 TYR 44 HB1 TYR 44 5.877 0.207 -2.940 354 HD1 TYR 44 HD1 TYR 44 8.075 2.584 -4.585 355 HD2 TYR 44 HD2 TYR 44 4.047 1.823 -3.485 356 HE1 TYR 44 HE1 TYR 44 7.328 4.203 -6.258 357 HE2 TYR 44 HE2 TYR 44 3.282 3.462 -5.145 358 HH TYR 44 HH TYR 44 4.288 5.519 -6.309 359 H GLU 45 HN GLU 45 4.398 0.435 -1.549 360 HA GLU 45 HA GLU 45 2.735 2.568 -1.830 361 HB2 GLU 45 HB2 GLU 45 2.055 0.048 -0.349 362 HB3 GLU 45 HB1 GLU 45 0.938 1.099 -1.204 363 HG2 GLU 45 HG2 GLU 45 3.127 -0.541 -2.437 364 HG3 GLU 45 HG1 GLU 45 1.417 -0.925 -2.474 365 H ASN 46 HN ASN 46 4.220 1.466 1.119 366 HA ASN 46 HA ASN 46 2.465 3.236 2.644 367 HB2 ASN 46 HB2 ASN 46 3.898 0.688 3.265 368 HB3 ASN 46 HB1 ASN 46 3.583 1.835 4.555 369 HD21 ASN 46 HD21 ASN 46 2.118 0.521 5.634 370 HD22 ASN 46 HD22 ASN 46 0.569 0.150 4.994 371 H ALA 47 HN ALA 47 5.670 2.839 1.506 372 HA ALA 47 HA ALA 47 7.217 3.860 3.600 373 HB1 ALA 47 HB1 ALA 47 7.739 4.077 0.648 374 HB2 ALA 47 HB2 ALA 47 8.195 2.728 1.691 375 HB3 ALA 47 HB3 ALA 47 8.924 4.320 1.928 376 H ASN 48 HN ASN 48 8.687 5.835 3.070 377 HA ASN 48 HA ASN 48 7.168 8.186 3.371 378 HB2 ASN 48 HB2 ASN 48 10.030 7.497 3.121 379 HB3 ASN 48 HB1 ASN 48 9.606 9.116 2.567 380 HD21 ASN 48 HD21 ASN 48 11.087 8.031 4.994 381 HD22 ASN 48 HD22 ASN 48 10.284 8.790 6.328 382 HA PRO 49 HA PRO 49 5.738 9.221 -0.645 383 HB2 PRO 49 HB2 PRO 49 6.971 11.880 -0.079 384 HB3 PRO 49 HB1 PRO 49 5.346 11.498 -0.657 385 HG2 PRO 49 HG2 PRO 49 5.827 12.182 1.904 386 HG3 PRO 49 HG1 PRO 49 4.558 11.031 1.455 387 HD2 PRO 49 HD2 PRO 49 7.144 10.542 2.800 388 HD3 PRO 49 HD1 PRO 49 5.667 9.556 2.786 389 H GLU 50 HN GLU 50 8.909 10.583 0.152 390 HA GLU 50 HA GLU 50 9.828 10.629 -2.529 391 HB2 GLU 50 HB2 GLU 50 10.930 12.264 -1.435 392 HB3 GLU 50 HB1 GLU 50 10.804 11.458 0.119 393 HG2 GLU 50 HG2 GLU 50 12.867 10.714 -0.037 394 HG3 GLU 50 HG1 GLU 50 12.539 10.001 -1.609 395 H CYS 51 HN CYS 51 9.749 8.288 0.009 396 HA CYS 51 HA CYS 51 12.152 7.031 -0.911 397 HB2 CYS 51 HB2 CYS 51 11.706 7.092 1.437 398 HB3 CYS 51 HB1 CYS 51 10.198 6.202 1.231 399 HG CYS 51 HG CYS 51 11.867 4.175 -0.215 400 H GLN 52 HN GLN 52 8.687 6.431 -0.868 401 HA GLN 52 HA GLN 52 8.876 4.005 -2.334 402 HB2 GLN 52 HB2 GLN 52 6.538 4.257 -2.782 403 HB3 GLN 52 HB1 GLN 52 6.826 4.734 -1.119 404 HG2 GLN 52 HG2 GLN 52 6.761 7.087 -1.809 405 HG3 GLN 52 HG1 GLN 52 6.400 6.580 -3.454 406 HE21 GLN 52 HE21 GLN 52 4.875 4.300 -2.423 407 HE22 GLN 52 HE22 GLN 52 3.363 4.917 -1.911 408 H SER 53 HN SER 53 8.838 7.350 -2.968 409 HA SER 53 HA SER 53 8.790 7.290 -5.771 410 HB2 SER 53 HB2 SER 53 9.665 9.147 -3.627 411 HB3 SER 53 HB1 SER 53 10.043 9.544 -5.308 412 HG SER 53 HG SER 53 7.623 9.514 -3.960 413 H ALA 54 HN ALA 54 11.372 6.869 -3.397 414 HA ALA 54 HA ALA 54 13.440 6.751 -5.372 415 HB1 ALA 54 HB1 ALA 54 14.735 5.635 -3.572 416 HB2 ALA 54 HB2 ALA 54 13.269 5.624 -2.584 417 HB3 ALA 54 HB3 ALA 54 13.996 7.153 -3.070 418 H ILE 55 HN ILE 55 10.970 4.715 -4.340 419 HA ILE 55 HA ILE 55 12.271 2.290 -5.157 420 HB ILE 55 HB ILE 55 9.679 2.873 -3.787 421 HG12 ILE 55 HG12 ILE 55 11.905 1.177 -2.756 422 HG13 ILE 55 HG11 ILE 55 12.093 2.935 -2.763 423 HG21 ILE 55 HG21 ILE 55 10.779 0.210 -4.649 424 HG22 ILE 55 HG22 ILE 55 9.274 0.957 -5.185 425 HG23 ILE 55 HG23 ILE 55 9.453 0.428 -3.510 426 HD11 ILE 55 HD11 ILE 55 9.776 1.500 -1.491 427 HD12 ILE 55 HD12 ILE 55 10.212 3.214 -1.358 428 HD13 ILE 55 HD13 ILE 55 11.257 1.978 -0.640 429 H LYS 56 HN LYS 56 9.672 4.381 -6.440 430 HA LYS 56 HA LYS 56 8.185 2.591 -7.836 431 HB2 LYS 56 HB2 LYS 56 8.671 4.735 -9.695 432 HB3 LYS 56 HB1 LYS 56 7.193 4.256 -8.894 433 HG2 LYS 56 HG2 LYS 56 7.320 6.337 -8.064 434 HG3 LYS 56 HG1 LYS 56 8.413 5.585 -6.895 435 HD2 LYS 56 HD2 LYS 56 10.252 6.436 -7.831 436 HD3 LYS 56 HD1 LYS 56 9.586 6.459 -9.460 437 HE2 LYS 56 HE2 LYS 56 9.229 8.529 -7.261 438 HE3 LYS 56 HE1 LYS 56 9.843 8.725 -8.895 439 HZ1 LYS 56 HZ1 LYS 56 7.027 8.122 -8.193 440 HZ2 LYS 56 HZ2 LYS 56 7.631 8.290 -9.762 441 HZ3 LYS 56 HZ3 LYS 56 7.630 9.612 -8.712 442 HA PRO 57 HA PRO 57 11.433 2.354 -11.531 443 HB2 PRO 57 HB2 PRO 57 14.006 2.322 -10.651 444 HB3 PRO 57 HB1 PRO 57 13.205 3.792 -11.228 445 HG2 PRO 57 HG2 PRO 57 13.455 2.779 -8.406 446 HG3 PRO 57 HG1 PRO 57 13.898 4.384 -9.039 447 HD2 PRO 57 HD2 PRO 57 11.583 4.065 -7.828 448 HD3 PRO 57 HD1 PRO 57 11.614 4.975 -9.349 449 H LEU 58 HN LEU 58 11.904 1.149 -8.269 450 HA LEU 58 HA LEU 58 12.785 -1.479 -9.227 451 HB2 LEU 58 HB2 LEU 58 12.355 -0.955 -6.343 452 HB3 LEU 58 HB1 LEU 58 13.619 -1.906 -7.116 453 HG LEU 58 HG LEU 58 13.502 1.115 -6.946 454 HD11 LEU 58 HD11 LEU 58 15.174 -0.908 -5.469 455 HD12 LEU 58 HD12 LEU 58 13.874 0.067 -4.790 456 HD13 LEU 58 HD13 LEU 58 15.351 0.842 -5.363 457 HD21 LEU 58 HD21 LEU 58 14.664 0.370 -8.953 458 HD22 LEU 58 HD22 LEU 58 15.678 -0.702 -7.984 459 HD23 LEU 58 HD23 LEU 58 15.796 1.048 -7.786 460 H LYS 59 HN LYS 59 10.148 0.324 -8.184 461 HA LYS 59 HA LYS 59 8.575 -1.468 -6.798 462 HB2 LYS 59 HB2 LYS 59 7.890 0.813 -7.051 463 HB3 LYS 59 HB1 LYS 59 7.766 0.628 -8.792 464 HG2 LYS 59 HG2 LYS 59 5.573 0.409 -8.310 465 HG3 LYS 59 HG1 LYS 59 6.058 -1.257 -8.035 466 HD2 LYS 59 HD2 LYS 59 5.776 0.864 -5.944 467 HD3 LYS 59 HD1 LYS 59 4.653 -0.475 -6.214 468 HE2 LYS 59 HE2 LYS 59 7.550 -0.686 -5.375 469 HE3 LYS 59 HE1 LYS 59 6.155 -0.934 -4.338 470 HZ1 LYS 59 HZ1 LYS 59 6.749 -2.587 -6.718 471 HZ2 LYS 59 HZ2 LYS 59 5.563 -2.878 -5.554 472 HZ3 LYS 59 HZ3 LYS 59 7.201 -3.005 -5.145 473 H GLY 60 HN GLY 60 8.207 -3.491 -7.294 474 HA2 GLY 60 HA3 GLY 60 6.919 -5.114 -8.445 475 HA3 GLY 60 HA2 GLY 60 6.964 -4.093 -9.876 476 H LYS 61 HN LYS 61 9.917 -3.672 -9.264 477 HA LYS 61 HA LYS 61 10.789 -6.077 -10.708 478 HB2 LYS 61 HB2 LYS 61 12.561 -3.707 -10.426 479 HB3 LYS 61 HB1 LYS 61 12.284 -4.736 -11.823 480 HG2 LYS 61 HG2 LYS 61 10.342 -2.672 -10.837 481 HG3 LYS 61 HG1 LYS 61 11.523 -2.391 -12.106 482 HD2 LYS 61 HD2 LYS 61 9.434 -4.557 -12.214 483 HD3 LYS 61 HD1 LYS 61 9.211 -2.948 -12.904 484 HE2 LYS 61 HE2 LYS 61 11.158 -3.283 -14.325 485 HE3 LYS 61 HE1 LYS 61 11.400 -4.884 -13.633 486 HZ1 LYS 61 HZ1 LYS 61 9.239 -5.541 -14.520 487 HZ2 LYS 61 HZ2 LYS 61 10.271 -5.027 -15.751 488 HZ3 LYS 61 HZ3 LYS 61 9.035 -4.011 -15.211 489 H VAL 62 HN VAL 62 11.622 -7.530 -9.334 490 HA VAL 62 HA VAL 62 13.671 -6.540 -7.475 491 HB VAL 62 HB VAL 62 11.850 -7.510 -6.191 492 HG11 VAL 62 HG11 VAL 62 12.244 -10.005 -7.830 493 HG12 VAL 62 HG12 VAL 62 10.831 -8.950 -7.838 494 HG13 VAL 62 HG13 VAL 62 11.229 -9.880 -6.391 495 HG21 VAL 62 HG21 VAL 62 14.261 -9.311 -6.291 496 HG22 VAL 62 HG22 VAL 62 13.074 -9.285 -4.987 497 HG23 VAL 62 HG23 VAL 62 14.059 -7.859 -5.311 498 HA PRO 63 HA PRO 63 16.692 -8.833 -9.916 499 HB2 PRO 63 HB2 PRO 63 17.736 -9.328 -7.167 500 HB3 PRO 63 HB1 PRO 63 18.601 -8.829 -8.604 501 HG2 PRO 63 HG2 PRO 63 18.025 -7.060 -6.721 502 HG3 PRO 63 HG1 PRO 63 17.888 -6.622 -8.432 503 HD2 PRO 63 HD2 PRO 63 15.746 -7.218 -6.456 504 HD3 PRO 63 HD1 PRO 63 15.734 -6.100 -7.833 505 H ALA 64 HN ALA 64 16.909 -10.944 -10.457 506 HA ALA 64 HA ALA 64 14.974 -12.763 -9.553 507 HB1 ALA 64 HB1 ALA 64 16.063 -14.383 -11.007 508 HB2 ALA 64 HB2 ALA 64 17.471 -13.329 -11.144 509 HB3 ALA 64 HB3 ALA 64 15.920 -12.820 -11.810 510 H GLY 65 HN GLY 65 15.019 -13.381 -7.469 511 HA2 GLY 65 HA3 GLY 65 15.758 -15.181 -6.050 512 HA3 GLY 65 HA2 GLY 65 17.397 -14.891 -6.612 513 H SER 66 HN SER 66 16.518 -11.876 -6.270 514 HA SER 66 HA SER 66 17.632 -11.735 -3.588 515 HB2 SER 66 HB2 SER 66 16.993 -9.529 -5.556 516 HB3 SER 66 HB1 SER 66 17.924 -9.358 -4.069 517 HG SER 66 HG SER 66 19.326 -11.053 -5.057 518 H ASP 67 HN ASP 67 16.792 -9.865 -2.241 519 HA ASP 67 HA ASP 67 13.924 -10.166 -1.769 520 HB2 ASP 67 HB2 ASP 67 16.031 -10.069 -0.084 521 HB3 ASP 67 HB1 ASP 67 15.695 -8.351 -0.186 522 H VAL 68 HN VAL 68 12.419 -8.397 -2.176 523 HA VAL 68 HA VAL 68 13.538 -6.380 -3.861 524 HB VAL 68 HB VAL 68 11.539 -5.746 -4.554 525 HG11 VAL 68 HG11 VAL 68 10.320 -7.981 -2.958 526 HG12 VAL 68 HG12 VAL 68 11.320 -8.241 -4.399 527 HG13 VAL 68 HG13 VAL 68 9.822 -7.321 -4.527 528 HG21 VAL 68 HG21 VAL 68 11.163 -4.387 -2.626 529 HG22 VAL 68 HG22 VAL 68 10.585 -5.783 -1.708 530 HG23 VAL 68 HG23 VAL 68 9.661 -5.185 -3.097 531 H ILE 69 HN ILE 69 12.627 -6.685 -0.582 532 HA ILE 69 HA ILE 69 12.522 -4.038 0.197 533 HB ILE 69 HB ILE 69 13.340 -6.502 1.704 534 HG12 ILE 69 HG12 ILE 69 11.051 -6.645 1.202 535 HG13 ILE 69 HG11 ILE 69 11.074 -5.955 2.820 536 HG21 ILE 69 HG21 ILE 69 13.016 -5.133 3.785 537 HG22 ILE 69 HG22 ILE 69 12.996 -3.693 2.763 538 HG23 ILE 69 HG23 ILE 69 14.438 -4.705 2.833 539 HD11 ILE 69 HD11 ILE 69 10.650 -4.485 0.244 540 HD12 ILE 69 HD12 ILE 69 10.781 -3.721 1.827 541 HD13 ILE 69 HD13 ILE 69 9.445 -4.833 1.491 542 H SER 70 HN SER 70 15.270 -6.217 0.150 543 HA SER 70 HA SER 70 17.252 -4.634 1.173 544 HB2 SER 70 HB2 SER 70 17.638 -6.950 0.541 545 HB3 SER 70 HB1 SER 70 17.411 -6.563 -1.160 546 HG SER 70 HG SER 70 19.443 -6.098 -1.228 547 H GLU 71 HN GLU 71 15.785 -4.442 -2.000 548 HA GLU 71 HA GLU 71 17.678 -2.533 -3.034 549 HB2 GLU 71 HB2 GLU 71 15.096 -3.293 -4.329 550 HB3 GLU 71 HB1 GLU 71 16.652 -2.947 -5.074 551 HG2 GLU 71 HG2 GLU 71 16.360 -5.322 -3.309 552 HG3 GLU 71 HG1 GLU 71 15.759 -5.387 -4.952 553 H TYR 72 HN TYR 72 14.519 -2.655 -1.678 554 HA TYR 72 HA TYR 72 13.720 -0.047 -2.525 555 HB2 TYR 72 HB2 TYR 72 12.598 -2.098 -0.629 556 HB3 TYR 72 HB1 TYR 72 11.897 -0.493 -0.760 557 HD1 TYR 72 HD1 TYR 72 13.286 -1.934 -3.781 558 HD2 TYR 72 HD2 TYR 72 9.781 -1.573 -1.415 559 HE1 TYR 72 HE1 TYR 72 11.926 -2.681 -5.675 560 HE2 TYR 72 HE2 TYR 72 8.413 -2.338 -3.306 561 HH TYR 72 HH TYR 72 9.871 -3.611 -6.201 562 H VAL 73 HN VAL 73 15.047 -1.536 0.360 563 HA VAL 73 HA VAL 73 15.127 0.827 1.927 564 HB VAL 73 HB VAL 73 16.402 -0.241 3.512 565 HG11 VAL 73 HG11 VAL 73 15.681 -2.583 3.721 566 HG12 VAL 73 HG12 VAL 73 15.020 -2.479 2.090 567 HG13 VAL 73 HG13 VAL 73 14.376 -1.456 3.369 568 HG21 VAL 73 HG21 VAL 73 18.245 -0.772 1.801 569 HG22 VAL 73 HG22 VAL 73 17.491 -2.367 1.727 570 HG23 VAL 73 HG23 VAL 73 18.116 -1.749 3.265 571 H LYS 74 HN LYS 74 17.142 -0.721 -0.407 572 HA LYS 74 HA LYS 74 19.436 0.908 -0.249 573 HB2 LYS 74 HB2 LYS 74 18.991 -1.363 -1.399 574 HB3 LYS 74 HB1 LYS 74 18.383 -0.398 -2.726 575 HG2 LYS 74 HG2 LYS 74 20.415 0.093 -3.448 576 HG3 LYS 74 HG1 LYS 74 20.987 0.489 -1.827 577 HD2 LYS 74 HD2 LYS 74 20.663 -2.307 -2.904 578 HD3 LYS 74 HD1 LYS 74 22.190 -1.424 -2.848 579 HE2 LYS 74 HE2 LYS 74 20.494 -1.973 -0.419 580 HE3 LYS 74 HE1 LYS 74 21.801 -3.035 -0.950 581 HZ1 LYS 74 HZ1 LYS 74 23.367 -1.272 -0.638 582 HZ2 LYS 74 HZ2 LYS 74 22.463 -1.430 0.782 583 HZ3 LYS 74 HZ3 LYS 74 22.142 -0.163 -0.284 584 H ALA 75 HN ALA 75 16.367 1.129 -1.870 585 HA ALA 75 HA ALA 75 16.870 3.329 -3.549 586 HB1 ALA 75 HB1 ALA 75 14.432 3.659 -3.482 587 HB2 ALA 75 HB2 ALA 75 14.329 2.516 -2.142 588 HB3 ALA 75 HB3 ALA 75 14.866 1.968 -3.727 589 H CYS 76 HN CYS 76 15.807 3.103 -0.191 590 HA CYS 76 HA CYS 76 16.046 6.010 0.115 591 HB2 CYS 76 HB2 CYS 76 14.091 4.965 1.056 592 HB3 CYS 76 HB1 CYS 76 15.074 3.859 1.991 593 HG CYS 76 HG CYS 76 16.237 6.363 3.247 594 H ASP 77 HN ASP 77 18.194 3.607 0.083 595 HA ASP 77 HA ASP 77 19.738 4.027 2.373 596 HB2 ASP 77 HB2 ASP 77 20.266 2.174 1.018 597 HB3 ASP 77 HB1 ASP 77 20.432 3.141 -0.437 598 H GLY 78 HN GLY 78 19.066 6.072 -0.273 599 HA2 GLY 78 HA3 GLY 78 21.162 7.946 0.593 600 HA3 GLY 78 HA2 GLY 78 20.307 8.026 -0.939 601 H ILE 79 HN ILE 79 17.923 7.323 1.195 602 HA ILE 79 HA ILE 79 17.219 10.147 1.462 603 HB ILE 79 HB ILE 79 15.433 7.748 1.759 604 HG12 ILE 79 HG12 ILE 79 15.580 9.641 -0.589 605 HG13 ILE 79 HG11 ILE 79 16.359 8.053 -0.555 606 HG21 ILE 79 HG21 ILE 79 14.483 9.559 2.943 607 HG22 ILE 79 HG22 ILE 79 13.625 9.465 1.400 608 HG23 ILE 79 HG23 ILE 79 14.866 10.695 1.648 609 HD11 ILE 79 HD11 ILE 79 13.436 8.387 -0.053 610 HD12 ILE 79 HD12 ILE 79 14.318 6.943 -0.555 611 HD13 ILE 79 HD13 ILE 79 14.093 8.283 -1.680 612 H GLY 80 HN GLY 80 17.098 11.088 3.417 613 HA2 GLY 80 HA3 GLY 80 15.947 10.127 5.681 614 HA3 GLY 80 HA2 GLY 80 17.605 9.567 5.802 615 H GLY 81 HN GLY 81 15.835 12.537 4.994 616 HA2 GLY 81 HA3 GLY 81 16.109 14.697 5.767 617 HA3 GLY 81 HA2 GLY 81 17.260 14.080 6.947 618 H ALA 82 HN ALA 82 17.853 16.432 5.860 619 HA ALA 82 HA ALA 82 19.408 17.628 4.727 620 HB1 ALA 82 HB1 ALA 82 20.909 16.286 6.072 621 HB2 ALA 82 HB2 ALA 82 21.616 16.598 4.485 622 HB3 ALA 82 HB3 ALA 82 20.910 15.024 4.843 623 H MET 83 HN MET 83 20.479 14.732 3.070 624 HA MET 83 HA MET 83 20.295 15.911 0.516 625 HB2 MET 83 HB2 MET 83 20.503 12.999 1.295 626 HB3 MET 83 HB1 MET 83 20.689 13.606 -0.342 627 HG2 MET 83 HG2 MET 83 22.621 14.924 0.375 628 HG3 MET 83 HG1 MET 83 22.441 14.284 2.006 629 HE1 MET 83 HE1 MET 83 25.007 13.529 1.915 630 HE2 MET 83 HE2 MET 83 25.148 14.126 0.263 631 HE3 MET 83 HE3 MET 83 25.673 12.489 0.657 632 H HIS 84 HN HIS 84 18.072 14.049 2.427 633 HA HIS 84 HA HIS 84 16.227 13.144 0.594 634 HB2 HIS 84 HB2 HIS 84 15.970 12.601 2.912 635 HB3 HIS 84 HB1 HIS 84 15.827 14.296 3.355 636 HD1 HIS 84 HD1 HIS 84 13.542 14.252 4.405 637 HD2 HIS 84 HD2 HIS 84 13.579 12.547 0.615 638 HE1 HIS 84 HE1 HIS 84 11.136 13.818 3.837 639 HE2 HIS 84 HE2 HIS 84 11.174 12.916 1.488 640 H LYS 85 HN LYS 85 16.604 16.438 1.814 641 HA LYS 85 HA LYS 85 14.182 17.227 0.446 642 HB2 LYS 85 HB2 LYS 85 16.020 18.661 2.331 643 HB3 LYS 85 HB1 LYS 85 14.634 19.437 1.547 644 HG2 LYS 85 HG2 LYS 85 13.101 18.045 2.572 645 HG3 LYS 85 HG1 LYS 85 14.311 16.821 2.937 646 HD2 LYS 85 HD2 LYS 85 15.312 18.483 4.545 647 HD3 LYS 85 HD1 LYS 85 13.835 19.437 4.319 648 HE2 LYS 85 HE2 LYS 85 12.493 17.495 4.931 649 HE3 LYS 85 HE1 LYS 85 13.963 16.549 5.167 650 HZ1 LYS 85 HZ1 LYS 85 13.245 18.989 6.717 651 HZ2 LYS 85 HZ2 LYS 85 14.591 18.001 6.975 652 HZ3 LYS 85 HZ3 LYS 85 13.039 17.404 7.263 653 H ALA 86 HN ALA 86 17.505 17.173 -0.208 654 HA ALA 86 HA ALA 86 17.393 19.159 -2.319 655 HB1 ALA 86 HB1 ALA 86 19.667 18.432 -2.826 656 HB2 ALA 86 HB2 ALA 86 19.499 17.087 -1.696 657 HB3 ALA 86 HB3 ALA 86 19.491 18.749 -1.099 658 H MET 87 HN MET 87 17.477 15.699 -1.934 659 HA MET 87 HA MET 87 17.236 15.115 -4.737 660 HB2 MET 87 HB2 MET 87 17.106 13.363 -2.279 661 HB3 MET 87 HB1 MET 87 17.103 12.771 -3.942 662 HG2 MET 87 HG2 MET 87 19.287 13.758 -4.318 663 HG3 MET 87 HG1 MET 87 19.285 14.405 -2.686 664 HE1 MET 87 HE1 MET 87 22.022 11.592 -2.538 665 HE2 MET 87 HE2 MET 87 21.681 13.304 -2.293 666 HE3 MET 87 HE3 MET 87 21.657 12.625 -3.920 667 H LEU 88 HN LEU 88 15.096 16.006 -2.318 668 HA LEU 88 HA LEU 88 12.796 14.552 -2.832 669 HB2 LEU 88 HB2 LEU 88 13.414 16.600 -1.211 670 HB3 LEU 88 HB1 LEU 88 12.516 17.478 -2.421 671 HG LEU 88 HG LEU 88 10.657 16.974 -1.315 672 HD11 LEU 88 HD11 LEU 88 9.691 14.762 -1.476 673 HD12 LEU 88 HD12 LEU 88 11.264 14.072 -1.860 674 HD13 LEU 88 HD13 LEU 88 10.489 15.173 -2.996 675 HD21 LEU 88 HD21 LEU 88 10.661 15.530 0.682 676 HD22 LEU 88 HD22 LEU 88 11.960 16.723 0.703 677 HD23 LEU 88 HD23 LEU 88 12.312 15.043 0.299 678 H MET 89 HN MET 89 14.399 16.835 -4.838 679 HA MET 89 HA MET 89 12.117 17.268 -6.555 680 HB2 MET 89 HB2 MET 89 13.864 18.991 -6.333 681 HB3 MET 89 HB1 MET 89 15.044 17.878 -7.011 682 HG2 MET 89 HG2 MET 89 14.338 19.419 -8.707 683 HG3 MET 89 HG1 MET 89 13.743 17.802 -9.092 684 HE1 MET 89 HE1 MET 89 12.802 21.348 -7.690 685 HE2 MET 89 HE2 MET 89 12.267 20.284 -6.390 686 HE3 MET 89 HE3 MET 89 11.081 21.156 -7.358 687 H ALA 90 HN ALA 90 14.570 14.909 -6.170 688 HA ALA 90 HA ALA 90 14.317 14.049 -8.978 689 HB1 ALA 90 HB1 ALA 90 16.538 12.983 -8.619 690 HB2 ALA 90 HB2 ALA 90 16.568 13.667 -6.987 691 HB3 ALA 90 HB3 ALA 90 16.565 14.732 -8.398 692 H GLN 91 HN GLN 91 14.859 12.620 -5.726 693 HA GLN 91 HA GLN 91 14.297 9.994 -6.692 694 HB2 GLN 91 HB2 GLN 91 14.454 11.094 -3.894 695 HB3 GLN 91 HB1 GLN 91 14.272 9.385 -4.277 696 HG2 GLN 91 HG2 GLN 91 16.384 9.311 -5.337 697 HG3 GLN 91 HG1 GLN 91 16.536 11.064 -5.286 698 HE21 GLN 91 HE21 GLN 91 15.467 11.247 -2.620 699 HE22 GLN 91 HE22 GLN 91 16.731 10.730 -1.574 700 H LEU 92 HN LEU 92 12.484 12.359 -4.791 701 HA LEU 92 HA LEU 92 10.042 11.228 -4.501 702 HB2 LEU 92 HB2 LEU 92 10.800 13.579 -4.000 703 HB3 LEU 92 HB1 LEU 92 10.392 13.968 -5.656 704 HG LEU 92 HG LEU 92 8.711 14.432 -3.733 705 HD11 LEU 92 HD11 LEU 92 6.829 14.149 -5.260 706 HD12 LEU 92 HD12 LEU 92 7.842 13.151 -6.303 707 HD13 LEU 92 HD13 LEU 92 8.232 14.854 -6.064 708 HD21 LEU 92 HD21 LEU 92 8.688 12.220 -2.772 709 HD22 LEU 92 HD22 LEU 92 8.107 11.549 -4.296 710 HD23 LEU 92 HD23 LEU 92 7.089 12.654 -3.374 711 H GLU 93 HN GLU 93 11.610 12.191 -7.503 712 HA GLU 93 HA GLU 93 9.352 11.091 -8.933 713 HB2 GLU 93 HB2 GLU 93 10.809 13.610 -9.465 714 HB3 GLU 93 HB1 GLU 93 9.753 12.862 -10.664 715 HG2 GLU 93 HG2 GLU 93 8.009 12.834 -8.961 716 HG3 GLU 93 HG1 GLU 93 9.036 13.756 -7.907 717 H2 PRO 1 HT1 PRO 1 5.313 -3.949 -13.329 718 H3 PRO 1 HT2 PRO 1 5.663 -2.478 -13.944 719 HA PRO 1 HA PRO 1 6.276 -2.182 -11.887 720 HB2 PRO 1 HB2 PRO 1 4.064 -1.176 -10.748 721 HB3 PRO 1 HB1 PRO 1 4.848 -0.373 -12.106 722 HG2 PRO 1 HG2 PRO 1 2.315 -1.824 -12.033 723 HG3 PRO 1 HG1 PRO 1 2.928 -0.709 -13.263 724 HD2 PRO 1 HD2 PRO 1 2.959 -3.629 -13.226 725 HD3 PRO 1 HD1 PRO 1 3.319 -2.525 -14.570 726 H SER 2 HN SER 2 4.399 -2.208 -9.566 727 HA SER 2 HA SER 2 4.263 -4.936 -8.829 728 HB2 SER 2 HB2 SER 2 2.422 -2.723 -7.865 729 HB3 SER 2 HB1 SER 2 2.825 -4.219 -7.034 730 HG SER 2 HG SER 2 3.942 -2.013 -6.611 731 H PHE 3 HN PHE 3 2.063 -6.061 -8.538 732 HA PHE 3 HA PHE 3 0.414 -5.802 -10.838 733 HB2 PHE 3 HB2 PHE 3 -1.194 -6.913 -8.875 734 HB3 PHE 3 HB1 PHE 3 -0.185 -7.819 -10.001 735 HD1 PHE 3 HD1 PHE 3 -0.718 -6.732 -6.605 736 HD2 PHE 3 HD2 PHE 3 2.016 -8.663 -9.240 737 HE1 PHE 3 HE1 PHE 3 0.483 -7.680 -4.693 738 HE2 PHE 3 HE2 PHE 3 3.234 -9.590 -7.318 739 HZ PHE 3 HZ PHE 3 2.465 -9.098 -5.031 740 H ASN 4 HN ASN 4 0.207 -4.790 -7.504 741 HA ASN 4 HA ASN 4 -2.448 -3.768 -7.810 742 HB2 ASN 4 HB2 ASN 4 -2.254 -3.301 -5.430 743 HB3 ASN 4 HB1 ASN 4 -1.728 -4.941 -5.791 744 HD21 ASN 4 HD21 ASN 4 -0.608 -1.675 -5.115 745 HD22 ASN 4 HD22 ASN 4 0.953 -2.137 -4.512 746 H THR 5 HN THR 5 0.304 -2.344 -8.802 747 HA THR 5 HA THR 5 0.338 0.072 -7.317 748 HB THR 5 HB THR 5 1.429 0.803 -9.658 749 HG1 THR 5 HG1 THR 5 1.181 -1.071 -10.775 750 HG21 THR 5 HG21 THR 5 2.681 -0.826 -7.468 751 HG22 THR 5 HG22 THR 5 2.579 0.931 -7.563 752 HG23 THR 5 HG23 THR 5 3.589 0.042 -8.703 753 H VAL 6 HN VAL 6 -1.977 -1.049 -9.413 754 HA VAL 6 HA VAL 6 -2.712 1.464 -10.559 755 HB VAL 6 HB VAL 6 -4.521 0.361 -11.539 756 HG11 VAL 6 HG11 VAL 6 -2.441 -0.544 -12.381 757 HG12 VAL 6 HG12 VAL 6 -3.689 -1.789 -12.373 758 HG13 VAL 6 HG13 VAL 6 -2.447 -1.778 -11.121 759 HG21 VAL 6 HG21 VAL 6 -5.605 -1.624 -10.732 760 HG22 VAL 6 HG22 VAL 6 -5.481 -0.466 -9.398 761 HG23 VAL 6 HG23 VAL 6 -4.369 -1.838 -9.485 762 H ARG 7 HN ARG 7 -4.105 2.989 -9.658 763 HA ARG 7 HA ARG 7 -5.738 2.156 -7.463 764 HB2 ARG 7 HB2 ARG 7 -4.764 3.815 -5.867 765 HB3 ARG 7 HB1 ARG 7 -3.883 2.347 -6.208 766 HG2 ARG 7 HG2 ARG 7 -2.943 4.265 -8.002 767 HG3 ARG 7 HG1 ARG 7 -2.996 5.006 -6.397 768 HD2 ARG 7 HD2 ARG 7 -1.689 3.247 -5.460 769 HD3 ARG 7 HD1 ARG 7 -1.812 2.293 -6.934 770 HE ARG 7 HE ARG 7 -0.615 4.708 -7.636 771 HH11 ARG 7 HH11 ARG 7 0.031 1.992 -5.586 772 HH12 ARG 7 HH12 ARG 7 1.753 2.117 -5.703 773 HH21 ARG 7 HH21 ARG 7 1.657 4.885 -7.873 774 HH22 ARG 7 HH22 ARG 7 2.686 3.758 -7.054 775 H GLN 8 HN GLN 8 -7.008 3.708 -6.502 776 HA GLN 8 HA GLN 8 -8.678 5.069 -8.104 777 HB2 GLN 8 HB2 GLN 8 -8.338 4.677 -5.359 778 HB3 GLN 8 HB1 GLN 8 -8.494 6.419 -5.543 779 HG2 GLN 8 HG2 GLN 8 -10.571 6.074 -6.806 780 HG3 GLN 8 HG1 GLN 8 -10.422 4.337 -6.542 781 HE21 GLN 8 HE21 GLN 8 -12.573 6.027 -5.720 782 HE22 GLN 8 HE22 GLN 8 -12.645 5.930 -3.980 783 H GLY 9 HN GLY 9 -8.147 6.524 -9.560 784 HA2 GLY 9 HA3 GLY 9 -6.293 8.675 -8.988 785 HA3 GLY 9 HA2 GLY 9 -7.188 8.424 -10.481 786 H SER 10 HN SER 10 -7.763 10.626 -10.559 787 HA SER 10 HA SER 10 -8.949 12.140 -8.581 788 HB2 SER 10 HB2 SER 10 -8.205 12.901 -10.877 789 HB3 SER 10 HB1 SER 10 -9.718 12.252 -11.503 790 HG SER 10 HG SER 10 -9.235 14.537 -10.035 791 H LYS 11 HN LYS 11 -10.448 11.268 -7.322 792 HA LYS 11 HA LYS 11 -12.208 10.043 -6.578 793 HB2 LYS 11 HB2 LYS 11 -14.322 11.006 -7.089 794 HB3 LYS 11 HB1 LYS 11 -13.150 12.300 -7.015 795 HG2 LYS 11 HG2 LYS 11 -13.114 12.457 -9.390 796 HG3 LYS 11 HG1 LYS 11 -14.132 11.038 -9.566 797 HD2 LYS 11 HD2 LYS 11 -15.942 12.248 -8.398 798 HD3 LYS 11 HD1 LYS 11 -14.911 13.677 -8.332 799 HE2 LYS 11 HE2 LYS 11 -15.863 12.295 -10.837 800 HE3 LYS 11 HE1 LYS 11 -16.497 13.804 -10.189 801 HZ1 LYS 11 HZ1 LYS 11 -13.730 13.351 -11.163 802 HZ2 LYS 11 HZ2 LYS 11 -14.302 14.797 -10.506 803 HZ3 LYS 11 HZ3 LYS 11 -14.936 14.221 -11.964 804 H GLU 12 HN GLU 12 -10.876 8.500 -8.440 805 HA GLU 12 HA GLU 12 -12.433 7.406 -10.492 806 HB2 GLU 12 HB2 GLU 12 -10.004 7.048 -10.181 807 HB3 GLU 12 HB1 GLU 12 -10.336 6.061 -8.770 808 HG2 GLU 12 HG2 GLU 12 -11.445 4.403 -10.158 809 HG3 GLU 12 HG1 GLU 12 -11.205 5.421 -11.579 810 HA PRO 13 HA PRO 13 -15.650 5.162 -8.343 811 HB2 PRO 13 HB2 PRO 13 -15.279 3.062 -10.373 812 HB3 PRO 13 HB1 PRO 13 -16.729 3.985 -9.978 813 HG2 PRO 13 HG2 PRO 13 -15.304 4.385 -12.243 814 HG3 PRO 13 HG1 PRO 13 -16.206 5.666 -11.428 815 HD2 PRO 13 HD2 PRO 13 -13.288 5.183 -11.532 816 HD3 PRO 13 HD1 PRO 13 -14.174 6.705 -11.349 817 H TYR 14 HN TYR 14 -15.359 3.889 -6.617 818 HA TYR 14 HA TYR 14 -12.723 2.929 -6.265 819 HB2 TYR 14 HB2 TYR 14 -13.888 4.046 -4.460 820 HB3 TYR 14 HB1 TYR 14 -15.057 2.732 -4.387 821 HD1 TYR 14 HD1 TYR 14 -14.153 0.407 -3.928 822 HD2 TYR 14 HD2 TYR 14 -11.930 3.918 -3.244 823 HE1 TYR 14 HE1 TYR 14 -12.723 -0.839 -2.398 824 HE2 TYR 14 HE2 TYR 14 -10.470 2.722 -1.687 825 HH TYR 14 HH TYR 14 -10.244 0.793 -0.523 826 HA PRO 15 HA PRO 15 -14.806 -1.448 -5.681 827 HB2 PRO 15 HB2 PRO 15 -17.006 -1.219 -7.634 828 HB3 PRO 15 HB1 PRO 15 -16.978 -2.025 -6.070 829 HG2 PRO 15 HG2 PRO 15 -18.282 0.283 -6.455 830 HG3 PRO 15 HG1 PRO 15 -17.518 -0.121 -4.923 831 HD2 PRO 15 HD2 PRO 15 -16.647 1.787 -7.025 832 HD3 PRO 15 HD1 PRO 15 -16.399 1.842 -5.272 833 H ASP 16 HN ASP 16 -14.605 0.552 -8.362 834 HA ASP 16 HA ASP 16 -13.868 -1.515 -10.248 835 HB2 ASP 16 HB2 ASP 16 -14.532 1.382 -10.446 836 HB3 ASP 16 HB1 ASP 16 -13.496 0.696 -11.691 837 H PHE 17 HN PHE 17 -12.457 1.285 -8.615 838 HA PHE 17 HA PHE 17 -9.882 1.192 -9.664 839 HB2 PHE 17 HB2 PHE 17 -9.768 2.957 -8.228 840 HB3 PHE 17 HB1 PHE 17 -11.192 2.394 -7.364 841 HD1 PHE 17 HD1 PHE 17 -11.007 1.517 -5.213 842 HD2 PHE 17 HD2 PHE 17 -7.531 1.927 -7.608 843 HE1 PHE 17 HE1 PHE 17 -9.614 0.919 -3.284 844 HE2 PHE 17 HE2 PHE 17 -6.122 1.347 -5.676 845 HZ PHE 17 HZ PHE 17 -7.163 0.842 -3.510 846 H VAL 18 HN VAL 18 -11.330 -0.536 -6.969 847 HA VAL 18 HA VAL 18 -8.935 -1.985 -6.393 848 HB VAL 18 HB VAL 18 -10.267 -1.560 -4.500 849 HG11 VAL 18 HG11 VAL 18 -12.563 -2.879 -5.939 850 HG12 VAL 18 HG12 VAL 18 -12.387 -1.138 -5.686 851 HG13 VAL 18 HG13 VAL 18 -12.593 -2.221 -4.295 852 HG21 VAL 18 HG21 VAL 18 -9.342 -3.718 -4.351 853 HG22 VAL 18 HG22 VAL 18 -10.562 -4.382 -5.447 854 HG23 VAL 18 HG23 VAL 18 -11.022 -3.856 -3.821 855 H ALA 19 HN ALA 19 -11.924 -2.644 -8.150 856 HA ALA 19 HA ALA 19 -11.612 -5.387 -8.535 857 HB1 ALA 19 HB1 ALA 19 -12.704 -3.437 -10.562 858 HB2 ALA 19 HB2 ALA 19 -13.615 -4.108 -9.209 859 HB3 ALA 19 HB3 ALA 19 -13.018 -5.172 -10.481 860 H ARG 20 HN ARG 20 -10.002 -2.712 -10.224 861 HA ARG 20 HA ARG 20 -8.737 -4.602 -12.020 862 HB2 ARG 20 HB2 ARG 20 -7.485 -2.670 -12.901 863 HB3 ARG 20 HB1 ARG 20 -9.221 -2.413 -12.953 864 HG2 ARG 20 HG2 ARG 20 -9.164 -0.767 -11.358 865 HG3 ARG 20 HG1 ARG 20 -7.674 -1.373 -10.629 866 HD2 ARG 20 HD2 ARG 20 -6.359 -0.544 -12.418 867 HD3 ARG 20 HD1 ARG 20 -7.777 -0.205 -13.391 868 HE ARG 20 HE ARG 20 -8.194 1.408 -11.309 869 HH11 ARG 20 HH11 ARG 20 -5.341 0.856 -13.264 870 HH12 ARG 20 HH12 ARG 20 -4.720 2.458 -13.034 871 HH21 ARG 20 HH21 ARG 20 -7.397 3.531 -11.040 872 HH22 ARG 20 HH22 ARG 20 -5.876 3.969 -11.763 873 H LEU 21 HN LEU 21 -8.237 -3.006 -9.042 874 HA LEU 21 HA LEU 21 -5.526 -3.441 -8.612 875 HB2 LEU 21 HB2 LEU 21 -7.355 -2.224 -7.200 876 HB3 LEU 21 HB1 LEU 21 -7.617 -3.794 -6.482 877 HG LEU 21 HG LEU 21 -5.550 -3.786 -5.397 878 HD11 LEU 21 HD11 LEU 21 -3.816 -2.064 -5.826 879 HD12 LEU 21 HD12 LEU 21 -4.775 -1.509 -7.203 880 HD13 LEU 21 HD13 LEU 21 -4.103 -3.139 -7.195 881 HD21 LEU 21 HD21 LEU 21 -7.100 -2.309 -4.342 882 HD22 LEU 21 HD22 LEU 21 -6.648 -0.995 -5.430 883 HD23 LEU 21 HD23 LEU 21 -5.488 -1.598 -4.249 884 H GLN 22 HN GLN 22 -8.353 -5.469 -8.035 885 HA GLN 22 HA GLN 22 -6.927 -7.731 -7.123 886 HB2 GLN 22 HB2 GLN 22 -9.675 -7.758 -8.340 887 HB3 GLN 22 HB1 GLN 22 -8.969 -8.868 -7.156 888 HG2 GLN 22 HG2 GLN 22 -8.887 -6.886 -5.616 889 HG3 GLN 22 HG1 GLN 22 -9.886 -6.053 -6.770 890 HE21 GLN 22 HE21 GLN 22 -11.285 -5.884 -4.956 891 HE22 GLN 22 HE22 GLN 22 -12.383 -7.176 -4.617 892 H ASP 23 HN ASP 23 -8.402 -6.783 -10.141 893 HA ASP 23 HA ASP 23 -8.115 -9.049 -11.649 894 HB2 ASP 23 HB2 ASP 23 -9.075 -6.806 -12.305 895 HB3 ASP 23 HB1 ASP 23 -7.413 -6.316 -12.636 896 H VAL 24 HN VAL 24 -5.661 -6.501 -11.243 897 HA VAL 24 HA VAL 24 -3.840 -8.001 -12.888 898 HB VAL 24 HB VAL 24 -3.830 -5.579 -13.100 899 HG11 VAL 24 HG11 VAL 24 -3.017 -5.554 -10.204 900 HG12 VAL 24 HG12 VAL 24 -4.565 -5.021 -10.863 901 HG13 VAL 24 HG13 VAL 24 -3.086 -4.146 -11.262 902 HG21 VAL 24 HG21 VAL 24 -1.709 -6.648 -13.551 903 HG22 VAL 24 HG22 VAL 24 -1.296 -6.635 -11.838 904 HG23 VAL 24 HG23 VAL 24 -1.403 -5.114 -12.729 905 H ALA 25 HN ALA 25 -4.555 -7.586 -9.548 906 HA ALA 25 HA ALA 25 -2.085 -8.632 -8.533 907 HB1 ALA 25 HB1 ALA 25 -3.580 -7.332 -7.078 908 HB2 ALA 25 HB2 ALA 25 -3.326 -8.952 -6.430 909 HB3 ALA 25 HB3 ALA 25 -4.830 -8.562 -7.263 910 H GLN 26 HN GLN 26 -4.874 -9.760 -10.033 911 HA GLN 26 HA GLN 26 -4.576 -12.506 -9.209 912 HB2 GLN 26 HB2 GLN 26 -6.762 -12.350 -9.613 913 HB3 GLN 26 HB1 GLN 26 -6.531 -10.806 -10.417 914 HG2 GLN 26 HG2 GLN 26 -7.447 -11.987 -12.098 915 HG3 GLN 26 HG1 GLN 26 -5.751 -12.333 -12.402 916 HE21 GLN 26 HE21 GLN 26 -5.596 -14.069 -10.049 917 HE22 GLN 26 HE22 GLN 26 -6.349 -15.544 -10.502 918 H LYS 27 HN LYS 27 -3.998 -10.472 -11.978 919 HA LYS 27 HA LYS 27 -3.178 -12.445 -13.811 920 HB2 LYS 27 HB2 LYS 27 -2.266 -9.567 -13.641 921 HB3 LYS 27 HB1 LYS 27 -2.212 -10.600 -15.072 922 HG2 LYS 27 HG2 LYS 27 -4.686 -9.645 -13.652 923 HG3 LYS 27 HG1 LYS 27 -4.069 -9.052 -15.195 924 HD2 LYS 27 HD2 LYS 27 -4.674 -10.982 -16.317 925 HD3 LYS 27 HD1 LYS 27 -4.687 -11.955 -14.849 926 HE2 LYS 27 HE2 LYS 27 -6.721 -11.075 -14.136 927 HE3 LYS 27 HE1 LYS 27 -6.615 -9.706 -15.239 928 HZ1 LYS 27 HZ1 LYS 27 -6.936 -11.239 -17.091 929 HZ2 LYS 27 HZ2 LYS 27 -8.229 -11.330 -16.006 930 HZ3 LYS 27 HZ3 LYS 27 -7.048 -12.541 -16.020 931 H SER 28 HN SER 28 -1.474 -10.767 -11.258 932 HA SER 28 HA SER 28 1.074 -11.779 -12.292 933 HB2 SER 28 HB2 SER 28 0.536 -9.620 -10.258 934 HB3 SER 28 HB1 SER 28 2.106 -10.021 -10.958 935 HG SER 28 HG SER 28 -0.125 -8.772 -12.146 936 H ILE 29 HN ILE 29 -1.265 -12.386 -9.998 937 HA ILE 29 HA ILE 29 0.678 -13.752 -8.257 938 HB ILE 29 HB ILE 29 -1.997 -12.580 -7.521 939 HG12 ILE 29 HG12 ILE 29 0.753 -11.839 -6.519 940 HG13 ILE 29 HG11 ILE 29 -0.164 -10.931 -7.727 941 HG21 ILE 29 HG21 ILE 29 -1.741 -14.584 -6.292 942 HG22 ILE 29 HG22 ILE 29 -1.434 -13.222 -5.212 943 HG23 ILE 29 HG23 ILE 29 -0.084 -14.170 -5.849 944 HD11 ILE 29 HD11 ILE 29 -0.323 -10.031 -5.409 945 HD12 ILE 29 HD12 ILE 29 -1.176 -11.517 -4.961 946 HD13 ILE 29 HD13 ILE 29 -1.871 -10.421 -6.164 947 H ALA 30 HN ALA 30 0.499 -15.909 -8.157 948 HA ALA 30 HA ALA 30 -1.835 -17.205 -9.348 949 HB1 ALA 30 HB1 ALA 30 0.771 -18.380 -8.377 950 HB2 ALA 30 HB2 ALA 30 0.380 -17.963 -10.046 951 HB3 ALA 30 HB3 ALA 30 -0.503 -19.254 -9.229 952 H ASP 31 HN ASP 31 -1.037 -16.036 -6.440 953 HA ASP 31 HA ASP 31 -2.217 -18.224 -4.844 954 HB2 ASP 31 HB2 ASP 31 0.092 -17.268 -4.319 955 HB3 ASP 31 HB1 ASP 31 -0.755 -15.805 -3.850 956 H GLU 32 HN GLU 32 -4.289 -17.968 -4.431 957 HA GLU 32 HA GLU 32 -5.764 -15.618 -4.788 958 HB2 GLU 32 HB2 GLU 32 -7.535 -16.740 -3.538 959 HB3 GLU 32 HB1 GLU 32 -6.762 -17.879 -4.633 960 HG2 GLU 32 HG2 GLU 32 -6.507 -19.236 -2.908 961 HG3 GLU 32 HG1 GLU 32 -5.337 -18.100 -2.246 962 H LYS 33 HN LYS 33 -3.844 -16.718 -2.064 963 HA LYS 33 HA LYS 33 -5.248 -15.105 -0.151 964 HB2 LYS 33 HB2 LYS 33 -2.522 -16.394 0.071 965 HB3 LYS 33 HB1 LYS 33 -3.411 -15.660 1.394 966 HG2 LYS 33 HG2 LYS 33 -4.128 -17.735 1.808 967 HG3 LYS 33 HG1 LYS 33 -5.219 -17.470 0.444 968 HD2 LYS 33 HD2 LYS 33 -4.062 -19.596 0.227 969 HD3 LYS 33 HD1 LYS 33 -3.593 -18.488 -1.061 970 HE2 LYS 33 HE2 LYS 33 -1.672 -19.694 -0.184 971 HE3 LYS 33 HE1 LYS 33 -1.528 -17.969 0.113 972 HZ1 LYS 33 HZ1 LYS 33 -2.360 -18.413 2.395 973 HZ2 LYS 33 HZ2 LYS 33 -0.857 -19.115 2.058 974 HZ3 LYS 33 HZ3 LYS 33 -2.257 -20.072 2.071 975 H ALA 34 HN ALA 34 -2.029 -14.977 -1.624 976 HA ALA 34 HA ALA 34 -1.377 -12.391 -0.774 977 HB1 ALA 34 HB1 ALA 34 0.286 -13.912 -1.676 978 HB2 ALA 34 HB2 ALA 34 0.277 -12.412 -2.605 979 HB3 ALA 34 HB3 ALA 34 -0.487 -13.861 -3.258 980 H ARG 35 HN ARG 35 -3.428 -13.517 -3.363 981 HA ARG 35 HA ARG 35 -3.503 -11.095 -4.888 982 HB2 ARG 35 HB2 ARG 35 -4.273 -13.532 -5.506 983 HB3 ARG 35 HB1 ARG 35 -5.789 -13.034 -4.773 984 HG2 ARG 35 HG2 ARG 35 -4.592 -11.273 -6.855 985 HG3 ARG 35 HG1 ARG 35 -5.343 -12.785 -7.359 986 HD2 ARG 35 HD2 ARG 35 -6.630 -10.536 -5.824 987 HD3 ARG 35 HD1 ARG 35 -6.957 -11.021 -7.498 988 HE ARG 35 HE ARG 35 -7.551 -13.264 -6.222 989 HH11 ARG 35 HH11 ARG 35 -8.381 -9.975 -5.377 990 HH12 ARG 35 HH12 ARG 35 -9.890 -10.406 -4.644 991 HH21 ARG 35 HH21 ARG 35 -9.527 -13.841 -5.253 992 HH22 ARG 35 HH22 ARG 35 -10.533 -12.609 -4.564 993 H LYS 36 HN LYS 36 -5.790 -12.586 -2.619 994 HA LYS 36 HA LYS 36 -7.553 -10.425 -2.388 995 HB2 LYS 36 HB2 LYS 36 -6.780 -12.337 -0.200 996 HB3 LYS 36 HB1 LYS 36 -8.255 -11.379 -0.290 997 HG2 LYS 36 HG2 LYS 36 -9.244 -12.783 -1.712 998 HG3 LYS 36 HG1 LYS 36 -7.730 -13.130 -2.574 999 HD2 LYS 36 HD2 LYS 36 -8.414 -15.115 -1.413 1000 HD3 LYS 36 HD1 LYS 36 -6.978 -14.431 -0.623 1001 HE2 LYS 36 HE2 LYS 36 -8.719 -13.205 0.881 1002 HE3 LYS 36 HE1 LYS 36 -9.829 -14.444 0.280 1003 HZ1 LYS 36 HZ1 LYS 36 -7.284 -14.977 1.704 1004 HZ2 LYS 36 HZ2 LYS 36 -8.322 -16.157 1.085 1005 HZ3 LYS 36 HZ3 LYS 36 -8.837 -15.153 2.346 1006 H VAL 37 HN VAL 37 -4.855 -11.348 -0.276 1007 HA VAL 37 HA VAL 37 -5.311 -9.403 1.629 1008 HB VAL 37 HB VAL 37 -3.050 -9.691 2.447 1009 HG11 VAL 37 HG11 VAL 37 -4.484 -11.447 3.082 1010 HG12 VAL 37 HG12 VAL 37 -3.000 -12.230 2.527 1011 HG13 VAL 37 HG13 VAL 37 -4.422 -12.184 1.479 1012 HG21 VAL 37 HG21 VAL 37 -2.532 -11.047 -0.187 1013 HG22 VAL 37 HG22 VAL 37 -1.461 -11.167 1.208 1014 HG23 VAL 37 HG23 VAL 37 -1.753 -9.601 0.452 1015 H ILE 38 HN ILE 38 -3.525 -9.129 -1.408 1016 HA ILE 38 HA ILE 38 -2.656 -6.490 -0.629 1017 HB ILE 38 HB ILE 38 -1.456 -8.298 -2.259 1018 HG12 ILE 38 HG12 ILE 38 -1.092 -5.331 -2.552 1019 HG13 ILE 38 HG11 ILE 38 -0.653 -6.173 -1.071 1020 HG21 ILE 38 HG21 ILE 38 -3.106 -7.913 -4.061 1021 HG22 ILE 38 HG22 ILE 38 -1.475 -7.435 -4.532 1022 HG23 ILE 38 HG23 ILE 38 -2.654 -6.207 -4.077 1023 HD11 ILE 38 HD11 ILE 38 0.589 -6.213 -3.755 1024 HD12 ILE 38 HD12 ILE 38 0.742 -7.639 -2.725 1025 HD13 ILE 38 HD13 ILE 38 1.334 -6.074 -2.170 1026 H VAL 39 HN VAL 39 -5.199 -7.866 -2.633 1027 HA VAL 39 HA VAL 39 -5.889 -5.326 -3.716 1028 HB VAL 39 HB VAL 39 -7.810 -6.205 -4.569 1029 HG11 VAL 39 HG11 VAL 39 -5.934 -7.229 -5.611 1030 HG12 VAL 39 HG12 VAL 39 -7.209 -8.446 -5.470 1031 HG13 VAL 39 HG13 VAL 39 -5.847 -8.465 -4.356 1032 HG21 VAL 39 HG21 VAL 39 -7.777 -8.418 -2.528 1033 HG22 VAL 39 HG22 VAL 39 -8.923 -8.285 -3.863 1034 HG23 VAL 39 HG23 VAL 39 -8.903 -7.061 -2.594 1035 H GLU 40 HN GLU 40 -7.204 -7.215 -1.017 1036 HA GLU 40 HA GLU 40 -8.900 -5.294 0.021 1037 HB2 GLU 40 HB2 GLU 40 -7.402 -7.420 1.537 1038 HB3 GLU 40 HB1 GLU 40 -8.908 -6.677 2.001 1039 HG2 GLU 40 HG2 GLU 40 -9.113 -7.787 -0.620 1040 HG3 GLU 40 HG1 GLU 40 -8.540 -8.978 0.519 1041 H LEU 41 HN LEU 41 -5.431 -5.589 0.294 1042 HA LEU 41 HA LEU 41 -5.296 -3.604 2.397 1043 HB2 LEU 41 HB2 LEU 41 -3.535 -5.537 1.420 1044 HB3 LEU 41 HB1 LEU 41 -2.787 -3.998 1.040 1045 HG LEU 41 HG LEU 41 -1.915 -4.543 3.125 1046 HD11 LEU 41 HD11 LEU 41 -2.781 -2.931 4.675 1047 HD12 LEU 41 HD12 LEU 41 -4.293 -2.827 3.781 1048 HD13 LEU 41 HD13 LEU 41 -2.795 -2.260 3.049 1049 HD21 LEU 41 HD21 LEU 41 -3.363 -6.424 3.606 1050 HD22 LEU 41 HD22 LEU 41 -4.682 -5.322 4.005 1051 HD23 LEU 41 HD23 LEU 41 -3.229 -5.357 5.003 1052 H MET 42 HN MET 42 -4.227 -3.677 -1.030 1053 HA MET 42 HA MET 42 -3.341 -0.988 -1.063 1054 HB2 MET 42 HB2 MET 42 -4.209 -2.740 -3.358 1055 HB3 MET 42 HB1 MET 42 -3.364 -1.193 -3.542 1056 HG2 MET 42 HG2 MET 42 -2.371 -3.772 -2.369 1057 HG3 MET 42 HG1 MET 42 -1.739 -2.862 -3.732 1058 HE1 MET 42 HE1 MET 42 0.008 -4.057 -1.351 1059 HE2 MET 42 HE2 MET 42 1.150 -2.728 -1.148 1060 HE3 MET 42 HE3 MET 42 0.644 -3.220 -2.768 1061 H ALA 43 HN ALA 43 -6.381 -2.476 -1.376 1062 HA ALA 43 HA ALA 43 -8.027 -0.606 -2.458 1063 HB1 ALA 43 HB1 ALA 43 -8.876 -2.658 -1.607 1064 HB2 ALA 43 HB2 ALA 43 -9.671 -1.354 -0.720 1065 HB3 ALA 43 HB3 ALA 43 -8.356 -2.267 0.029 1066 H TYR 44 HN TYR 44 -6.207 -0.461 0.518 1067 HA TYR 44 HA TYR 44 -7.291 2.212 1.140 1068 HB2 TYR 44 HB2 TYR 44 -7.360 0.703 3.042 1069 HB3 TYR 44 HB1 TYR 44 -5.697 0.234 2.749 1070 HD1 TYR 44 HD1 TYR 44 -7.871 2.626 4.399 1071 HD2 TYR 44 HD2 TYR 44 -3.852 1.833 3.288 1072 HE1 TYR 44 HE1 TYR 44 -7.107 4.236 6.074 1073 HE2 TYR 44 HE2 TYR 44 -3.069 3.462 4.950 1074 HH TYR 44 HH TYR 44 -4.073 5.535 6.116 1075 H GLU 45 HN GLU 45 -4.216 0.451 1.362 1076 HA GLU 45 HA GLU 45 -2.537 2.569 1.632 1077 HB2 GLU 45 HB2 GLU 45 -1.883 0.043 0.152 1078 HB3 GLU 45 HB1 GLU 45 -0.752 1.087 1.000 1079 HG2 GLU 45 HG2 GLU 45 -2.950 -0.533 2.246 1080 HG3 GLU 45 HG1 GLU 45 -1.241 -0.927 2.280 1081 H ASN 46 HN ASN 46 -4.035 1.473 -1.314 1082 HA ASN 46 HA ASN 46 -2.272 3.228 -2.844 1083 HB2 ASN 46 HB2 ASN 46 -3.731 0.695 -3.461 1084 HB3 ASN 46 HB1 ASN 46 -3.405 1.838 -4.751 1085 HD21 ASN 46 HD21 ASN 46 -1.948 0.516 -5.835 1086 HD22 ASN 46 HD22 ASN 46 -0.406 0.128 -5.193 1087 H ALA 47 HN ALA 47 -5.477 2.859 -1.700 1088 HA ALA 47 HA ALA 47 -7.020 3.895 -3.789 1089 HB1 ALA 47 HB1 ALA 47 -7.532 4.119 -0.837 1090 HB2 ALA 47 HB2 ALA 47 -8.004 2.773 -1.876 1091 HB3 ALA 47 HB3 ALA 47 -8.718 4.371 -2.115 1092 H ASN 48 HN ASN 48 -8.471 5.882 -3.254 1093 HA ASN 48 HA ASN 48 -6.933 8.221 -3.562 1094 HB2 ASN 48 HB2 ASN 48 -9.801 7.557 -3.306 1095 HB3 ASN 48 HB1 ASN 48 -9.362 9.172 -2.749 1096 HD21 ASN 48 HD21 ASN 48 -10.854 8.095 -5.181 1097 HD22 ASN 48 HD22 ASN 48 -10.048 8.850 -6.516 1098 HA PRO 49 HA PRO 49 -5.484 9.240 0.450 1099 HB2 PRO 49 HB2 PRO 49 -6.693 11.909 -0.107 1100 HB3 PRO 49 HB1 PRO 49 -5.071 11.512 0.461 1101 HG2 PRO 49 HG2 PRO 49 -5.557 12.206 -2.097 1102 HG3 PRO 49 HG1 PRO 49 -4.296 11.043 -1.654 1103 HD2 PRO 49 HD2 PRO 49 -6.891 10.580 -2.990 1104 HD3 PRO 49 HD1 PRO 49 -5.424 9.580 -2.985 1105 H GLU 50 HN GLU 50 -8.642 10.635 -0.335 1106 HA GLU 50 HA GLU 50 -9.560 10.687 2.345 1107 HB2 GLU 50 HB2 GLU 50 -10.646 12.331 1.249 1108 HB3 GLU 50 HB1 GLU 50 -10.534 11.519 -0.304 1109 HG2 GLU 50 HG2 GLU 50 -12.605 10.800 -0.137 1110 HG3 GLU 50 HG1 GLU 50 -12.276 10.082 1.433 1111 H CYS 51 HN CYS 51 -9.503 8.342 -0.189 1112 HA CYS 51 HA CYS 51 -11.917 7.106 0.735 1113 HB2 CYS 51 HB2 CYS 51 -11.475 7.167 -1.615 1114 HB3 CYS 51 HB1 CYS 51 -9.975 6.264 -1.414 1115 HG CYS 51 HG CYS 51 -11.655 4.247 0.034 1116 H GLN 52 HN GLN 52 -8.456 6.480 0.684 1117 HA GLN 52 HA GLN 52 -8.665 4.055 2.151 1118 HB2 GLN 52 HB2 GLN 52 -6.324 4.290 2.597 1119 HB3 GLN 52 HB1 GLN 52 -6.609 4.764 0.933 1120 HG2 GLN 52 HG2 GLN 52 -6.526 7.119 1.618 1121 HG3 GLN 52 HG1 GLN 52 -6.162 6.611 3.263 1122 HE21 GLN 52 HE21 GLN 52 -4.658 4.317 2.230 1123 HE22 GLN 52 HE22 GLN 52 -3.143 4.923 1.717 1124 H SER 53 HN SER 53 -8.593 7.399 2.784 1125 HA SER 53 HA SER 53 -8.540 7.339 5.584 1126 HB2 SER 53 HB2 SER 53 -9.408 9.203 3.442 1127 HB3 SER 53 HB1 SER 53 -9.764 9.607 5.126 1128 HG SER 53 HG SER 53 -7.365 9.568 3.752 1129 H ALA 54 HN ALA 54 -11.131 6.942 3.216 1130 HA ALA 54 HA ALA 54 -13.196 6.844 5.196 1131 HB1 ALA 54 HB1 ALA 54 -14.506 5.737 3.401 1132 HB2 ALA 54 HB2 ALA 54 -13.043 5.714 2.409 1133 HB3 ALA 54 HB3 ALA 54 -13.756 7.249 2.897 1134 H ILE 55 HN ILE 55 -10.748 4.784 4.160 1135 HA ILE 55 HA ILE 55 -12.069 2.371 4.979 1136 HB ILE 55 HB ILE 55 -9.473 2.931 3.608 1137 HG12 ILE 55 HG12 ILE 55 -11.717 1.256 2.578 1138 HG13 ILE 55 HG11 ILE 55 -11.888 3.015 2.586 1139 HG21 ILE 55 HG21 ILE 55 -10.597 0.278 4.470 1140 HG22 ILE 55 HG22 ILE 55 -9.083 1.010 5.002 1141 HG23 ILE 55 HG23 ILE 55 -9.270 0.482 3.329 1142 HD11 ILE 55 HD11 ILE 55 -9.587 1.560 1.311 1143 HD12 ILE 55 HD12 ILE 55 -10.008 3.277 1.177 1144 HD13 ILE 55 HD13 ILE 55 -11.065 2.050 0.463 1145 H LYS 56 HN LYS 56 -9.447 4.439 6.256 1146 HA LYS 56 HA LYS 56 -7.972 2.637 7.649 1147 HB2 LYS 56 HB2 LYS 56 -8.440 4.785 9.508 1148 HB3 LYS 56 HB1 LYS 56 -6.967 4.294 8.705 1149 HG2 LYS 56 HG2 LYS 56 -7.075 6.374 7.873 1150 HG3 LYS 56 HG1 LYS 56 -8.181 5.633 6.709 1151 HD2 LYS 56 HD2 LYS 56 -10.006 6.501 7.654 1152 HD3 LYS 56 HD1 LYS 56 -9.331 6.520 9.280 1153 HE2 LYS 56 HE2 LYS 56 -8.964 8.585 7.074 1154 HE3 LYS 56 HE1 LYS 56 -9.574 8.788 8.709 1155 HZ1 LYS 56 HZ1 LYS 56 -6.767 8.158 7.998 1156 HZ2 LYS 56 HZ2 LYS 56 -7.365 8.332 9.569 1157 HZ3 LYS 56 HZ3 LYS 56 -7.354 9.656 8.519 1158 HA PRO 57 HA PRO 57 -11.213 2.425 11.355 1159 HB2 PRO 57 HB2 PRO 57 -13.787 2.421 10.481 1160 HB3 PRO 57 HB1 PRO 57 -12.969 3.883 11.054 1161 HG2 PRO 57 HG2 PRO 57 -13.234 2.868 8.235 1162 HG3 PRO 57 HG1 PRO 57 -13.665 4.477 8.865 1163 HD2 PRO 57 HD2 PRO 57 -11.357 4.141 7.652 1164 HD3 PRO 57 HD1 PRO 57 -11.377 5.050 9.175 1165 H LEU 58 HN LEU 58 -11.697 1.226 8.095 1166 HA LEU 58 HA LEU 58 -12.603 -1.394 9.053 1167 HB2 LEU 58 HB2 LEU 58 -12.174 -0.870 6.169 1168 HB3 LEU 58 HB1 LEU 58 -13.445 -1.812 6.943 1169 HG LEU 58 HG LEU 58 -13.304 1.207 6.774 1170 HD11 LEU 58 HD11 LEU 58 -14.998 -0.803 5.302 1171 HD12 LEU 58 HD12 LEU 58 -13.692 0.164 4.618 1172 HD13 LEU 58 HD13 LEU 58 -15.164 0.949 5.195 1173 HD21 LEU 58 HD21 LEU 58 -14.466 0.473 8.784 1174 HD22 LEU 58 HD22 LEU 58 -15.490 -0.593 7.821 1175 HD23 LEU 58 HD23 LEU 58 -15.600 1.157 7.619 1176 H LYS 59 HN LYS 59 -9.954 0.386 8.006 1177 HA LYS 59 HA LYS 59 -8.399 -1.417 6.615 1178 HB2 LYS 59 HB2 LYS 59 -7.698 0.859 6.864 1179 HB3 LYS 59 HB1 LYS 59 -7.570 0.673 8.605 1180 HG2 LYS 59 HG2 LYS 59 -5.379 0.433 8.116 1181 HG3 LYS 59 HG1 LYS 59 -5.881 -1.228 7.844 1182 HD2 LYS 59 HD2 LYS 59 -5.589 0.889 5.750 1183 HD3 LYS 59 HD1 LYS 59 -4.477 -0.459 6.018 1184 HE2 LYS 59 HE2 LYS 59 -7.376 -0.647 5.183 1185 HE3 LYS 59 HE1 LYS 59 -5.985 -0.906 4.144 1186 HZ1 LYS 59 HZ1 LYS 59 -6.593 -2.560 6.524 1187 HZ2 LYS 59 HZ2 LYS 59 -5.408 -2.858 5.363 1188 HZ3 LYS 59 HZ3 LYS 59 -7.045 -2.975 4.951 1189 H GLY 60 HN GLY 60 -8.043 -3.443 7.111 1190 HA2 GLY 60 HA3 GLY 60 -6.766 -5.071 8.266 1191 HA3 GLY 60 HA2 GLY 60 -6.808 -4.050 9.697 1192 H LYS 61 HN LYS 61 -9.758 -3.612 9.081 1193 HA LYS 61 HA LYS 61 -10.645 -6.008 10.530 1194 HB2 LYS 61 HB2 LYS 61 -12.396 -3.623 10.252 1195 HB3 LYS 61 HB1 LYS 61 -12.125 -4.653 11.649 1196 HG2 LYS 61 HG2 LYS 61 -10.167 -2.607 10.655 1197 HG3 LYS 61 HG1 LYS 61 -11.342 -2.315 11.928 1198 HD2 LYS 61 HD2 LYS 61 -9.272 -4.502 12.033 1199 HD3 LYS 61 HD1 LYS 61 -9.029 -2.893 12.720 1200 HE2 LYS 61 HE2 LYS 61 -10.971 -3.201 14.150 1201 HE3 LYS 61 HE1 LYS 61 -11.244 -4.794 13.455 1202 HZ1 LYS 61 HZ1 LYS 61 -9.097 -5.499 14.329 1203 HZ2 LYS 61 HZ2 LYS 61 -10.111 -4.961 15.571 1204 HZ3 LYS 61 HZ3 LYS 61 -8.855 -3.973 15.019 1205 H VAL 62 HN VAL 62 -11.495 -7.452 9.157 1206 HA VAL 62 HA VAL 62 -13.535 -6.448 7.301 1207 HB VAL 62 HB VAL 62 -11.723 -7.432 6.017 1208 HG11 VAL 62 HG11 VAL 62 -12.135 -9.926 7.660 1209 HG12 VAL 62 HG12 VAL 62 -10.712 -8.883 7.666 1210 HG13 VAL 62 HG13 VAL 62 -11.120 -9.810 6.219 1211 HG21 VAL 62 HG21 VAL 62 -14.148 -9.215 6.124 1212 HG22 VAL 62 HG22 VAL 62 -12.965 -9.199 4.817 1213 HG23 VAL 62 HG23 VAL 62 -13.938 -7.765 5.143 1214 HA PRO 63 HA PRO 63 -16.563 -8.712 9.749 1215 HB2 PRO 63 HB2 PRO 63 -17.620 -9.199 7.006 1216 HB3 PRO 63 HB1 PRO 63 -18.475 -8.693 8.447 1217 HG2 PRO 63 HG2 PRO 63 -17.894 -6.927 6.565 1218 HG3 PRO 63 HG1 PRO 63 -17.745 -6.492 8.276 1219 HD2 PRO 63 HD2 PRO 63 -15.617 -7.106 6.289 1220 HD3 PRO 63 HD1 PRO 63 -15.588 -5.989 7.668 1221 H ALA 64 HN ALA 64 -16.795 -10.819 10.300 1222 HA ALA 64 HA ALA 64 -14.886 -12.662 9.387 1223 HB1 ALA 64 HB1 ALA 64 -15.991 -14.270 10.845 1224 HB2 ALA 64 HB2 ALA 64 -17.385 -13.199 10.988 1225 HB3 ALA 64 HB3 ALA 64 -15.826 -12.709 11.649 1226 H GLY 65 HN GLY 65 -14.942 -13.279 7.303 1227 HA2 GLY 65 HA3 GLY 65 -15.703 -15.075 5.890 1228 HA3 GLY 65 HA2 GLY 65 -17.338 -14.766 6.455 1229 H SER 66 HN SER 66 -16.420 -11.761 6.108 1230 HA SER 66 HA SER 66 -17.543 -11.612 3.428 1231 HB2 SER 66 HB2 SER 66 -16.897 -9.412 5.399 1232 HB3 SER 66 HB1 SER 66 -17.824 -9.233 3.911 1233 HG SER 66 HG SER 66 -19.232 -10.928 4.888 1234 H ASP 67 HN ASP 67 -16.695 -9.743 2.086 1235 HA ASP 67 HA ASP 67 -13.829 -10.068 1.604 1236 HB2 ASP 67 HB2 ASP 67 -15.935 -9.959 -0.080 1237 HB3 ASP 67 HB1 ASP 67 -15.588 -8.244 0.021 1238 H VAL 68 HN VAL 68 -12.311 -8.312 2.008 1239 HA VAL 68 HA VAL 68 -13.410 -6.287 3.691 1240 HB VAL 68 HB VAL 68 -11.404 -5.672 4.379 1241 HG11 VAL 68 HG11 VAL 68 -10.207 -7.918 2.782 1242 HG12 VAL 68 HG12 VAL 68 -11.207 -8.169 4.224 1243 HG13 VAL 68 HG13 VAL 68 -9.700 -7.263 4.349 1244 HG21 VAL 68 HG21 VAL 68 -11.018 -4.315 2.451 1245 HG22 VAL 68 HG22 VAL 68 -10.455 -5.715 1.532 1246 HG23 VAL 68 HG23 VAL 68 -9.523 -5.128 2.921 1247 H ILE 69 HN ILE 69 -12.508 -6.599 0.411 1248 HA ILE 69 HA ILE 69 -12.385 -3.958 -0.370 1249 HB ILE 69 HB ILE 69 -13.228 -6.416 -1.875 1250 HG12 ILE 69 HG12 ILE 69 -10.937 -6.584 -1.381 1251 HG13 ILE 69 HG11 ILE 69 -10.959 -5.887 -2.997 1252 HG21 ILE 69 HG21 ILE 69 -12.897 -5.049 -3.957 1253 HG22 ILE 69 HG22 ILE 69 -12.863 -3.611 -2.935 1254 HG23 ILE 69 HG23 ILE 69 -14.313 -4.610 -3.000 1255 HD11 ILE 69 HD11 ILE 69 -10.516 -4.422 -0.421 1256 HD12 ILE 69 HD12 ILE 69 -10.642 -3.658 -2.003 1257 HD13 ILE 69 HD13 ILE 69 -9.315 -4.782 -1.669 1258 H SER 70 HN SER 70 -15.150 -6.113 -0.313 1259 HA SER 70 HA SER 70 -17.125 -4.514 -1.328 1260 HB2 SER 70 HB2 SER 70 -17.538 -6.823 -0.699 1261 HB3 SER 70 HB1 SER 70 -17.288 -6.446 1.003 1262 HG SER 70 HG SER 70 -19.316 -5.957 1.091 1263 H GLU 71 HN GLU 71 -15.647 -4.334 1.839 1264 HA GLU 71 HA GLU 71 -17.519 -2.407 2.876 1265 HB2 GLU 71 HB2 GLU 71 -14.938 -3.188 4.163 1266 HB3 GLU 71 HB1 GLU 71 -16.490 -2.826 4.916 1267 HG2 GLU 71 HG2 GLU 71 -16.220 -5.205 3.151 1268 HG3 GLU 71 HG1 GLU 71 -15.624 -5.275 4.794 1269 H TYR 72 HN TYR 72 -14.365 -2.559 1.509 1270 HA TYR 72 HA TYR 72 -13.541 0.042 2.355 1271 HB2 TYR 72 HB2 TYR 72 -12.443 -2.018 0.455 1272 HB3 TYR 72 HB1 TYR 72 -11.729 -0.419 0.583 1273 HD1 TYR 72 HD1 TYR 72 -13.120 -1.845 3.610 1274 HD2 TYR 72 HD2 TYR 72 -9.620 -1.516 1.234 1275 HE1 TYR 72 HE1 TYR 72 -11.762 -2.603 5.501 1276 HE2 TYR 72 HE2 TYR 72 -8.253 -2.291 3.122 1277 HH TYR 72 HH TYR 72 -9.711 -3.552 6.018 1278 H VAL 73 HN VAL 73 -14.891 -1.434 -0.526 1279 HA VAL 73 HA VAL 73 -14.950 0.929 -2.094 1280 HB VAL 73 HB VAL 73 -16.237 -0.128 -3.677 1281 HG11 VAL 73 HG11 VAL 73 -15.538 -2.476 -3.887 1282 HG12 VAL 73 HG12 VAL 73 -14.872 -2.378 -2.258 1283 HG13 VAL 73 HG13 VAL 73 -14.223 -1.361 -3.539 1284 HG21 VAL 73 HG21 VAL 73 -18.083 -0.639 -1.962 1285 HG22 VAL 73 HG22 VAL 73 -17.345 -2.242 -1.888 1286 HG23 VAL 73 HG23 VAL 73 -17.966 -1.619 -3.425 1287 H LYS 74 HN LYS 74 -16.971 -0.596 0.250 1288 HA LYS 74 HA LYS 74 -19.253 1.050 0.092 1289 HB2 LYS 74 HB2 LYS 74 -18.824 -1.224 1.242 1290 HB3 LYS 74 HB1 LYS 74 -18.208 -0.263 2.568 1291 HG2 LYS 74 HG2 LYS 74 -20.236 0.243 3.293 1292 HG3 LYS 74 HG1 LYS 74 -20.811 0.645 1.673 1293 HD2 LYS 74 HD2 LYS 74 -20.503 -2.154 2.752 1294 HD3 LYS 74 HD1 LYS 74 -22.023 -1.259 2.696 1295 HE2 LYS 74 HE2 LYS 74 -20.334 -1.824 0.266 1296 HE3 LYS 74 HE1 LYS 74 -21.644 -2.878 0.803 1297 HZ1 LYS 74 HZ1 LYS 74 -23.200 -1.097 0.499 1298 HZ2 LYS 74 HZ2 LYS 74 -22.315 -1.286 -0.929 1299 HZ3 LYS 74 HZ3 LYS 74 -21.967 -0.007 0.119 1300 H ALA 75 HN ALA 75 -16.182 1.242 1.712 1301 HA ALA 75 HA ALA 75 -16.657 3.446 3.389 1302 HB1 ALA 75 HB1 ALA 75 -14.219 3.754 3.316 1303 HB2 ALA 75 HB2 ALA 75 -14.128 2.615 1.970 1304 HB3 ALA 75 HB3 ALA 75 -14.664 2.066 3.557 1305 H CYS 76 HN CYS 76 -15.607 3.214 0.025 1306 HA CYS 76 HA CYS 76 -15.823 6.122 -0.282 1307 HB2 CYS 76 HB2 CYS 76 -13.879 5.054 -1.225 1308 HB3 CYS 76 HB1 CYS 76 -14.876 3.964 -2.162 1309 HG CYS 76 HG CYS 76 -16.008 6.477 -3.422 1310 H ASP 77 HN ASP 77 -17.989 3.732 -0.248 1311 HA ASP 77 HA ASP 77 -19.530 4.162 -2.536 1312 HB2 ASP 77 HB2 ASP 77 -20.072 2.319 -1.174 1313 HB3 ASP 77 HB1 ASP 77 -20.227 3.293 0.278 1314 H GLY 78 HN GLY 78 -18.848 6.201 0.117 1315 HA2 GLY 78 HA3 GLY 78 -20.922 8.095 -0.752 1316 HA3 GLY 78 HA2 GLY 78 -20.067 8.165 0.779 1317 H ILE 79 HN ILE 79 -17.693 7.446 -1.363 1318 HA ILE 79 HA ILE 79 -16.967 10.264 -1.630 1319 HB ILE 79 HB ILE 79 -15.198 7.852 -1.930 1320 HG12 ILE 79 HG12 ILE 79 -15.325 9.747 0.416 1321 HG13 ILE 79 HG11 ILE 79 -16.116 8.167 0.386 1322 HG21 ILE 79 HG21 ILE 79 -14.236 9.659 -3.116 1323 HG22 ILE 79 HG22 ILE 79 -13.375 9.555 -1.575 1324 HG23 ILE 79 HG23 ILE 79 -14.606 10.794 -1.818 1325 HD11 ILE 79 HD11 ILE 79 -13.191 8.476 -0.121 1326 HD12 ILE 79 HD12 ILE 79 -14.085 7.038 0.381 1327 HD13 ILE 79 HD13 ILE 79 -13.848 8.375 1.506 1328 H GLY 80 HN GLY 80 -16.852 11.204 -3.589 1329 HA2 GLY 80 HA3 GLY 80 -15.694 10.231 -5.855 1330 HA3 GLY 80 HA2 GLY 80 -17.357 9.689 -5.975 1331 H GLY 81 HN GLY 81 -15.575 12.652 -5.144 1332 HA2 GLY 81 HA3 GLY 81 -15.827 14.812 -5.938 1333 HA3 GLY 81 HA2 GLY 81 -16.977 14.198 -7.119 1334 H ALA 82 HN ALA 82 -17.545 16.563 -6.020 1335 HA ALA 82 HA ALA 82 -19.104 17.766 -4.893 1336 HB1 ALA 82 HB1 ALA 82 -20.614 16.428 -6.229 1337 HB2 ALA 82 HB2 ALA 82 -21.312 16.739 -4.640 1338 HB3 ALA 82 HB3 ALA 82 -20.611 15.163 -5.002 1339 H MET 83 HN MET 83 -20.189 14.884 -3.225 1340 HA MET 83 HA MET 83 -19.987 16.063 -0.675 1341 HB2 MET 83 HB2 MET 83 -20.225 13.150 -1.441 1342 HB3 MET 83 HB1 MET 83 -20.404 13.766 0.192 1343 HG2 MET 83 HG2 MET 83 -22.326 15.094 -0.530 1344 HG3 MET 83 HG1 MET 83 -22.149 14.449 -2.159 1345 HE1 MET 83 HE1 MET 83 -24.716 13.710 -2.066 1346 HE2 MET 83 HE2 MET 83 -24.854 14.309 -0.414 1347 HE3 MET 83 HE3 MET 83 -25.389 12.676 -0.806 1348 H HIS 84 HN HIS 84 -17.790 14.157 -2.578 1349 HA HIS 84 HA HIS 84 -15.944 13.258 -0.758 1350 HB2 HIS 84 HB2 HIS 84 -15.699 12.711 -3.078 1351 HB3 HIS 84 HB1 HIS 84 -15.540 14.404 -3.519 1352 HD1 HIS 84 HD1 HIS 84 -13.261 14.346 -4.566 1353 HD2 HIS 84 HD2 HIS 84 -13.304 12.628 -0.786 1354 HE1 HIS 84 HE1 HIS 84 -10.860 13.869 -4.017 1355 HE2 HIS 84 HE2 HIS 84 -10.897 13.018 -1.653 1356 H LYS 85 HN LYS 85 -16.292 16.547 -1.988 1357 HA LYS 85 HA LYS 85 -13.866 17.324 -0.620 1358 HB2 LYS 85 HB2 LYS 85 -15.695 18.767 -2.506 1359 HB3 LYS 85 HB1 LYS 85 -14.300 19.532 -1.728 1360 HG2 LYS 85 HG2 LYS 85 -12.783 18.125 -2.756 1361 HG3 LYS 85 HG1 LYS 85 -14.005 16.910 -3.115 1362 HD2 LYS 85 HD2 LYS 85 -14.997 18.578 -4.722 1363 HD3 LYS 85 HD1 LYS 85 -13.515 19.520 -4.498 1364 HE2 LYS 85 HE2 LYS 85 -12.188 17.572 -5.113 1365 HE3 LYS 85 HE1 LYS 85 -13.664 16.637 -5.352 1366 HZ1 LYS 85 HZ1 LYS 85 -12.930 19.078 -6.897 1367 HZ2 LYS 85 HZ2 LYS 85 -14.282 18.099 -7.154 1368 HZ3 LYS 85 HZ3 LYS 85 -12.733 17.492 -7.447 1369 H ALA 86 HN ALA 86 -17.191 17.292 0.039 1370 HA ALA 86 HA ALA 86 -17.054 19.285 2.143 1371 HB1 ALA 86 HB1 ALA 86 -19.332 18.576 2.663 1372 HB2 ALA 86 HB2 ALA 86 -19.181 17.229 1.534 1373 HB3 ALA 86 HB3 ALA 86 -19.163 18.889 0.935 1374 H MET 87 HN MET 87 -17.165 15.825 1.764 1375 HA MET 87 HA MET 87 -16.923 15.239 4.568 1376 HB2 MET 87 HB2 MET 87 -16.815 13.487 2.110 1377 HB3 MET 87 HB1 MET 87 -16.810 12.893 3.772 1378 HG2 MET 87 HG2 MET 87 -18.985 13.901 4.156 1379 HG3 MET 87 HG1 MET 87 -18.986 14.540 2.521 1380 HE1 MET 87 HE1 MET 87 -21.741 11.751 2.379 1381 HE2 MET 87 HE2 MET 87 -21.383 13.460 2.134 1382 HE3 MET 87 HE3 MET 87 -21.370 12.782 3.760 1383 H LEU 88 HN LEU 88 -14.780 16.106 2.139 1384 HA LEU 88 HA LEU 88 -12.491 14.638 2.654 1385 HB2 LEU 88 HB2 LEU 88 -13.097 16.686 1.030 1386 HB3 LEU 88 HB1 LEU 88 -12.189 17.562 2.237 1387 HG LEU 88 HG LEU 88 -10.336 17.040 1.131 1388 HD11 LEU 88 HD11 LEU 88 -9.392 14.816 1.292 1389 HD12 LEU 88 HD12 LEU 88 -10.970 14.142 1.678 1390 HD13 LEU 88 HD13 LEU 88 -10.181 15.238 2.813 1391 HD21 LEU 88 HD21 LEU 88 -10.355 15.595 -0.868 1392 HD22 LEU 88 HD22 LEU 88 -11.644 16.799 -0.887 1393 HD23 LEU 88 HD23 LEU 88 -12.010 15.121 -0.481 1394 H MET 89 HN MET 89 -14.073 16.930 4.662 1395 HA MET 89 HA MET 89 -11.785 17.345 6.375 1396 HB2 MET 89 HB2 MET 89 -13.518 19.083 6.151 1397 HB3 MET 89 HB1 MET 89 -14.702 17.982 6.842 1398 HG2 MET 89 HG2 MET 89 -13.964 19.522 8.530 1399 HG3 MET 89 HG1 MET 89 -13.388 17.898 8.913 1400 HE1 MET 89 HE1 MET 89 -12.425 21.426 7.509 1401 HE2 MET 89 HE2 MET 89 -11.901 20.367 6.199 1402 HE3 MET 89 HE3 MET 89 -10.707 21.229 7.168 1403 H ALA 90 HN ALA 90 -14.260 15.010 5.996 1404 HA ALA 90 HA ALA 90 -14.010 14.148 8.803 1405 HB1 ALA 90 HB1 ALA 90 -16.239 13.098 8.450 1406 HB2 ALA 90 HB2 ALA 90 -16.266 13.784 6.817 1407 HB3 ALA 90 HB3 ALA 90 -16.252 14.848 8.228 1408 H GLN 91 HN GLN 91 -14.559 12.726 5.550 1409 HA GLN 91 HA GLN 91 -14.021 10.095 6.518 1410 HB2 GLN 91 HB2 GLN 91 -14.178 11.194 3.720 1411 HB3 GLN 91 HB1 GLN 91 -14.009 9.485 4.103 1412 HG2 GLN 91 HG2 GLN 91 -16.117 9.431 5.172 1413 HG3 GLN 91 HG1 GLN 91 -16.256 11.186 5.118 1414 HE21 GLN 91 HE21 GLN 91 -15.196 11.353 2.445 1415 HE22 GLN 91 HE22 GLN 91 -16.471 10.842 1.405 1416 H LEU 92 HN LEU 92 -12.190 12.443 4.614 1417 HA LEU 92 HA LEU 92 -9.759 11.289 4.320 1418 HB2 LEU 92 HB2 LEU 92 -10.498 13.646 3.818 1419 HB3 LEU 92 HB1 LEU 92 -10.083 14.033 5.474 1420 HG LEU 92 HG LEU 92 -8.403 14.481 3.545 1421 HD11 LEU 92 HD11 LEU 92 -6.519 14.186 5.069 1422 HD12 LEU 92 HD12 LEU 92 -7.534 13.194 6.115 1423 HD13 LEU 92 HD13 LEU 92 -7.913 14.900 5.878 1424 HD21 LEU 92 HD21 LEU 92 -8.404 12.268 2.586 1425 HD22 LEU 92 HD22 LEU 92 -7.825 11.593 4.109 1426 HD23 LEU 92 HD23 LEU 92 -6.800 12.686 3.183 1427 H GLU 93 HN GLU 93 -11.315 12.264 7.322 1428 HA GLU 93 HA GLU 93 -9.064 11.149 8.752 1429 HB2 GLU 93 HB2 GLU 93 -10.501 13.680 9.281 1430 HB3 GLU 93 HB1 GLU 93 -9.449 12.924 10.479 1431 HG2 GLU 93 HG2 GLU 93 -7.706 12.886 8.778 1432 HG3 GLU 93 HG1 GLU 93 -8.726 13.812 7.719 Start of MODEL 16 1 H2 PRO 1 HT1 PRO 1 -4.963 -2.822 13.370 2 H3 PRO 1 HT2 PRO 1 -5.184 -1.245 13.736 3 HA PRO 1 HA PRO 1 -5.946 -1.279 11.705 4 HB2 PRO 1 HB2 PRO 1 -3.801 -0.587 10.263 5 HB3 PRO 1 HB1 PRO 1 -4.417 0.460 11.546 6 HG2 PRO 1 HG2 PRO 1 -1.981 -1.175 11.491 7 HG3 PRO 1 HG1 PRO 1 -2.402 0.180 12.557 8 HD2 PRO 1 HD2 PRO 1 -2.614 -2.688 13.038 9 HD3 PRO 1 HD1 PRO 1 -2.799 -1.348 14.190 10 H SER 2 HN SER 2 -4.324 -1.798 9.290 11 HA SER 2 HA SER 2 -4.312 -4.623 9.009 12 HB2 SER 2 HB2 SER 2 -2.766 -2.505 7.499 13 HB3 SER 2 HB1 SER 2 -2.938 -4.179 7.004 14 HG SER 2 HG SER 2 -5.239 -3.802 6.949 15 H PHE 3 HN PHE 3 -1.971 -5.581 8.321 16 HA PHE 3 HA PHE 3 -0.278 -5.284 10.608 17 HB2 PHE 3 HB2 PHE 3 1.240 -6.562 8.699 18 HB3 PHE 3 HB1 PHE 3 0.187 -7.364 9.861 19 HD1 PHE 3 HD1 PHE 3 0.791 -6.481 6.424 20 HD2 PHE 3 HD2 PHE 3 -2.065 -8.107 9.130 21 HE1 PHE 3 HE1 PHE 3 -0.442 -7.464 4.557 22 HE2 PHE 3 HE2 PHE 3 -3.317 -9.071 7.247 23 HZ PHE 3 HZ PHE 3 -2.503 -8.748 4.947 24 H ASN 4 HN ASN 4 0.013 -4.528 7.194 25 HA ASN 4 HA ASN 4 2.678 -3.559 7.425 26 HB2 ASN 4 HB2 ASN 4 2.623 -3.440 5.122 27 HB3 ASN 4 HB1 ASN 4 1.377 -4.643 5.429 28 HD21 ASN 4 HD21 ASN 4 -0.847 -3.647 5.787 29 HD22 ASN 4 HD22 ASN 4 -1.271 -2.368 4.714 30 H THR 5 HN THR 5 -0.225 -2.101 8.126 31 HA THR 5 HA THR 5 -0.182 0.316 6.723 32 HB THR 5 HB THR 5 -1.399 0.951 9.033 33 HG1 THR 5 HG1 THR 5 -0.924 -1.063 9.989 34 HG21 THR 5 HG21 THR 5 -2.407 1.052 6.854 35 HG22 THR 5 HG22 THR 5 -3.462 0.184 7.973 36 HG23 THR 5 HG23 THR 5 -2.496 -0.709 6.799 37 H VAL 6 HN VAL 6 2.105 -0.665 8.939 38 HA VAL 6 HA VAL 6 2.759 1.903 9.973 39 HB VAL 6 HB VAL 6 4.773 0.952 10.723 40 HG11 VAL 6 HG11 VAL 6 2.754 0.150 11.830 41 HG12 VAL 6 HG12 VAL 6 4.053 -1.044 11.888 42 HG13 VAL 6 HG13 VAL 6 2.720 -1.244 10.746 43 HG21 VAL 6 HG21 VAL 6 4.366 -1.373 8.845 44 HG22 VAL 6 HG22 VAL 6 5.681 -1.194 10.010 45 HG23 VAL 6 HG23 VAL 6 5.553 -0.079 8.644 46 H ARG 7 HN ARG 7 3.386 3.534 8.713 47 HA ARG 7 HA ARG 7 4.915 2.857 6.321 48 HB2 ARG 7 HB2 ARG 7 3.101 5.180 6.832 49 HB3 ARG 7 HB1 ARG 7 4.306 5.134 5.560 50 HG2 ARG 7 HG2 ARG 7 2.194 4.768 4.640 51 HG3 ARG 7 HG1 ARG 7 3.127 3.306 4.580 52 HD2 ARG 7 HD2 ARG 7 0.871 2.854 5.135 53 HD3 ARG 7 HD1 ARG 7 1.939 2.421 6.456 54 HE ARG 7 HE ARG 7 1.273 4.785 7.310 55 HH11 ARG 7 HH11 ARG 7 -0.896 2.615 5.580 56 HH12 ARG 7 HH12 ARG 7 -2.302 3.192 6.419 57 HH21 ARG 7 HH21 ARG 7 -0.586 5.544 8.368 58 HH22 ARG 7 HH22 ARG 7 -2.131 4.847 7.998 59 H GLN 8 HN GLN 8 6.586 4.255 5.751 60 HA GLN 8 HA GLN 8 8.362 5.161 7.636 61 HB2 GLN 8 HB2 GLN 8 8.142 4.982 4.851 62 HB3 GLN 8 HB1 GLN 8 8.542 6.663 5.165 63 HG2 GLN 8 HG2 GLN 8 10.510 6.019 6.379 64 HG3 GLN 8 HG1 GLN 8 10.086 4.315 6.236 65 HE21 GLN 8 HE21 GLN 8 12.472 5.683 5.383 66 HE22 GLN 8 HE22 GLN 8 12.578 5.448 3.661 67 H GLY 9 HN GLY 9 7.980 6.670 9.130 68 HA2 GLY 9 HA3 GLY 9 6.346 8.985 8.641 69 HA3 GLY 9 HA2 GLY 9 7.326 8.675 10.067 70 H SER 10 HN SER 10 7.916 10.953 9.943 71 HA SER 10 HA SER 10 9.126 12.216 7.805 72 HB2 SER 10 HB2 SER 10 10.284 13.603 9.625 73 HB3 SER 10 HB1 SER 10 8.523 13.547 9.663 74 HG SER 10 HG SER 10 10.205 11.837 11.187 75 H LYS 11 HN LYS 11 10.619 11.266 6.633 76 HA LYS 11 HA LYS 11 12.352 9.968 5.981 77 HB2 LYS 11 HB2 LYS 11 14.489 10.884 6.477 78 HB3 LYS 11 HB1 LYS 11 13.367 12.219 6.383 79 HG2 LYS 11 HG2 LYS 11 13.293 12.292 8.811 80 HG3 LYS 11 HG1 LYS 11 14.444 10.970 8.900 81 HD2 LYS 11 HD2 LYS 11 15.996 12.444 7.529 82 HD3 LYS 11 HD1 LYS 11 14.876 13.762 7.876 83 HE2 LYS 11 HE2 LYS 11 16.677 13.799 9.477 84 HE3 LYS 11 HE1 LYS 11 15.179 13.344 10.286 85 HZ1 LYS 11 HZ1 LYS 11 17.291 11.454 9.393 86 HZ2 LYS 11 HZ2 LYS 11 15.870 11.037 10.207 87 HZ3 LYS 11 HZ3 LYS 11 17.042 11.968 10.987 88 H GLU 12 HN GLU 12 10.882 8.542 7.842 89 HA GLU 12 HA GLU 12 12.365 7.425 9.942 90 HB2 GLU 12 HB2 GLU 12 9.929 7.155 9.644 91 HB3 GLU 12 HB1 GLU 12 10.203 6.146 8.235 92 HG2 GLU 12 HG2 GLU 12 11.231 4.444 9.605 93 HG3 GLU 12 HG1 GLU 12 11.103 5.483 11.029 94 HA PRO 13 HA PRO 13 15.584 5.175 7.847 95 HB2 PRO 13 HB2 PRO 13 15.196 3.092 9.885 96 HB3 PRO 13 HB1 PRO 13 16.645 4.014 9.501 97 HG2 PRO 13 HG2 PRO 13 15.173 4.421 11.742 98 HG3 PRO 13 HG1 PRO 13 16.121 5.684 10.951 99 HD2 PRO 13 HD2 PRO 13 13.198 5.289 11.024 100 HD3 PRO 13 HD1 PRO 13 14.132 6.775 10.785 101 H TYR 14 HN TYR 14 15.345 3.894 6.129 102 HA TYR 14 HA TYR 14 12.732 2.932 5.698 103 HB2 TYR 14 HB2 TYR 14 13.994 3.994 3.904 104 HB3 TYR 14 HB1 TYR 14 15.132 2.652 3.905 105 HD1 TYR 14 HD1 TYR 14 14.162 0.330 3.532 106 HD2 TYR 14 HD2 TYR 14 12.098 3.887 2.547 107 HE1 TYR 14 HE1 TYR 14 12.750 -0.952 2.012 108 HE2 TYR 14 HE2 TYR 14 10.664 2.634 1.003 109 HH TYR 14 HH TYR 14 10.328 0.640 0.029 110 HA PRO 15 HA PRO 15 14.778 -1.502 5.389 111 HB2 PRO 15 HB2 PRO 15 16.919 -1.174 7.402 112 HB3 PRO 15 HB1 PRO 15 16.925 -2.087 5.895 113 HG2 PRO 15 HG2 PRO 15 18.250 0.215 6.148 114 HG3 PRO 15 HG1 PRO 15 17.500 -0.266 4.630 115 HD2 PRO 15 HD2 PRO 15 16.627 1.772 6.612 116 HD3 PRO 15 HD1 PRO 15 16.425 1.737 4.854 117 H ASP 16 HN ASP 16 14.483 0.639 7.960 118 HA ASP 16 HA ASP 16 13.704 -1.354 9.918 119 HB2 ASP 16 HB2 ASP 16 14.217 1.592 10.038 120 HB3 ASP 16 HB1 ASP 16 13.295 0.822 11.320 121 H PHE 17 HN PHE 17 12.301 1.351 8.125 122 HA PHE 17 HA PHE 17 9.701 1.246 9.144 123 HB2 PHE 17 HB2 PHE 17 9.622 3.010 7.726 124 HB3 PHE 17 HB1 PHE 17 11.054 2.446 6.874 125 HD1 PHE 17 HD1 PHE 17 10.828 1.084 4.861 126 HD2 PHE 17 HD2 PHE 17 7.424 2.577 6.918 127 HE1 PHE 17 HE1 PHE 17 9.447 0.618 2.892 128 HE2 PHE 17 HE2 PHE 17 6.022 2.146 4.950 129 HZ PHE 17 HZ PHE 17 7.034 1.142 2.929 130 H VAL 18 HN VAL 18 11.302 -0.556 6.602 131 HA VAL 18 HA VAL 18 8.932 -2.040 5.975 132 HB VAL 18 HB VAL 18 10.303 -1.669 4.107 133 HG11 VAL 18 HG11 VAL 18 12.387 -1.154 5.241 134 HG12 VAL 18 HG12 VAL 18 12.642 -2.395 4.003 135 HG13 VAL 18 HG13 VAL 18 12.561 -2.848 5.713 136 HG21 VAL 18 HG21 VAL 18 11.091 -3.970 3.520 137 HG22 VAL 18 HG22 VAL 18 9.403 -3.840 4.019 138 HG23 VAL 18 HG23 VAL 18 10.617 -4.456 5.152 139 H ALA 19 HN ALA 19 11.901 -2.630 7.816 140 HA ALA 19 HA ALA 19 11.577 -5.357 8.285 141 HB1 ALA 19 HB1 ALA 19 13.576 -4.068 8.960 142 HB2 ALA 19 HB2 ALA 19 12.949 -5.089 10.254 143 HB3 ALA 19 HB3 ALA 19 12.642 -3.353 10.274 144 H ARG 20 HN ARG 20 9.885 -2.649 9.812 145 HA ARG 20 HA ARG 20 8.625 -4.500 11.660 146 HB2 ARG 20 HB2 ARG 20 7.318 -2.557 12.451 147 HB3 ARG 20 HB1 ARG 20 9.048 -2.309 12.577 148 HG2 ARG 20 HG2 ARG 20 9.068 -0.693 10.932 149 HG3 ARG 20 HG1 ARG 20 7.567 -1.270 10.201 150 HD2 ARG 20 HD2 ARG 20 6.273 -0.433 12.019 151 HD3 ARG 20 HD1 ARG 20 7.712 -0.075 12.953 152 HE ARG 20 HE ARG 20 8.017 1.487 10.770 153 HH11 ARG 20 HH11 ARG 20 5.409 1.019 13.056 154 HH12 ARG 20 HH12 ARG 20 4.796 2.632 12.884 155 HH21 ARG 20 HH21 ARG 20 7.231 3.630 10.567 156 HH22 ARG 20 HH22 ARG 20 5.815 4.106 11.461 157 H LEU 21 HN LEU 21 8.119 -2.869 8.685 158 HA LEU 21 HA LEU 21 5.466 -3.380 8.126 159 HB2 LEU 21 HB2 LEU 21 7.395 -2.222 6.806 160 HB3 LEU 21 HB1 LEU 21 7.656 -3.801 6.110 161 HG LEU 21 HG LEU 21 5.556 -3.734 4.993 162 HD11 LEU 21 HD11 LEU 21 4.240 -2.770 6.786 163 HD12 LEU 21 HD12 LEU 21 3.982 -1.932 5.258 164 HD13 LEU 21 HD13 LEU 21 5.008 -1.209 6.502 165 HD21 LEU 21 HD21 LEU 21 5.733 -1.610 3.725 166 HD22 LEU 21 HD22 LEU 21 7.246 -2.509 3.852 167 HD23 LEU 21 HD23 LEU 21 6.969 -1.095 4.871 168 H GLN 22 HN GLN 22 8.319 -5.435 7.727 169 HA GLN 22 HA GLN 22 6.918 -7.724 6.852 170 HB2 GLN 22 HB2 GLN 22 9.626 -7.714 8.157 171 HB3 GLN 22 HB1 GLN 22 8.950 -8.874 7.009 172 HG2 GLN 22 HG2 GLN 22 8.932 -6.955 5.383 173 HG3 GLN 22 HG1 GLN 22 9.923 -6.097 6.525 174 HE21 GLN 22 HE21 GLN 22 11.362 -6.034 4.739 175 HE22 GLN 22 HE22 GLN 22 12.446 -7.356 4.475 176 H ASP 23 HN ASP 23 8.315 -6.701 9.893 177 HA ASP 23 HA ASP 23 7.984 -8.983 11.397 178 HB2 ASP 23 HB2 ASP 23 9.005 -6.733 12.035 179 HB3 ASP 23 HB1 ASP 23 7.360 -6.261 12.458 180 H VAL 24 HN VAL 24 5.601 -6.375 10.972 181 HA VAL 24 HA VAL 24 3.745 -7.805 12.655 182 HB VAL 24 HB VAL 24 3.827 -5.373 12.847 183 HG11 VAL 24 HG11 VAL 24 4.521 -4.844 10.602 184 HG12 VAL 24 HG12 VAL 24 3.064 -3.941 11.015 185 HG13 VAL 24 HG13 VAL 24 2.957 -5.361 9.974 186 HG21 VAL 24 HG21 VAL 24 1.392 -4.830 12.467 187 HG22 VAL 24 HG22 VAL 24 1.692 -6.304 13.396 188 HG23 VAL 24 HG23 VAL 24 1.240 -6.415 11.696 189 H ALA 25 HN ALA 25 4.454 -7.412 9.309 190 HA ALA 25 HA ALA 25 1.959 -8.424 8.319 191 HB1 ALA 25 HB1 ALA 25 3.165 -8.768 6.207 192 HB2 ALA 25 HB2 ALA 25 4.688 -8.405 7.016 193 HB3 ALA 25 HB3 ALA 25 3.461 -7.151 6.846 194 H GLN 26 HN GLN 26 4.711 -9.589 9.835 195 HA GLN 26 HA GLN 26 4.368 -12.329 9.016 196 HB2 GLN 26 HB2 GLN 26 6.552 -12.161 9.421 197 HB3 GLN 26 HB1 GLN 26 6.317 -10.664 10.307 198 HG2 GLN 26 HG2 GLN 26 7.189 -11.924 11.946 199 HG3 GLN 26 HG1 GLN 26 5.488 -12.316 12.179 200 HE21 GLN 26 HE21 GLN 26 5.337 -13.936 9.793 201 HE22 GLN 26 HE22 GLN 26 6.147 -15.411 10.144 202 H LYS 27 HN LYS 27 3.802 -10.276 11.784 203 HA LYS 27 HA LYS 27 2.883 -12.247 13.576 204 HB2 LYS 27 HB2 LYS 27 2.132 -9.320 13.476 205 HB3 LYS 27 HB1 LYS 27 2.022 -10.382 14.881 206 HG2 LYS 27 HG2 LYS 27 4.537 -9.513 13.482 207 HG3 LYS 27 HG1 LYS 27 3.962 -8.959 15.053 208 HD2 LYS 27 HD2 LYS 27 4.488 -10.955 16.089 209 HD3 LYS 27 HD1 LYS 27 4.417 -11.874 14.584 210 HE2 LYS 27 HE2 LYS 27 6.473 -11.002 13.840 211 HE3 LYS 27 HE1 LYS 27 6.484 -9.769 15.093 212 HZ1 LYS 27 HZ1 LYS 27 8.009 -11.616 15.558 213 HZ2 LYS 27 HZ2 LYS 27 6.705 -12.691 15.576 214 HZ3 LYS 27 HZ3 LYS 27 6.814 -11.477 16.747 215 H SER 28 HN SER 28 1.225 -10.371 11.095 216 HA SER 28 HA SER 28 -1.341 -11.326 12.133 217 HB2 SER 28 HB2 SER 28 -1.058 -8.885 11.908 218 HB3 SER 28 HB1 SER 28 -0.732 -9.099 10.191 219 HG SER 28 HG SER 28 -3.125 -10.078 11.320 220 H ILE 29 HN ILE 29 0.940 -11.972 9.822 221 HA ILE 29 HA ILE 29 -1.067 -13.257 8.088 222 HB ILE 29 HB ILE 29 1.711 -12.326 7.400 223 HG12 ILE 29 HG12 ILE 29 -0.954 -11.395 6.336 224 HG13 ILE 29 HG11 ILE 29 0.043 -10.533 7.511 225 HG21 ILE 29 HG21 ILE 29 1.261 -14.375 6.232 226 HG22 ILE 29 HG22 ILE 29 1.249 -13.007 5.116 227 HG23 ILE 29 HG23 ILE 29 -0.276 -13.733 5.645 228 HD11 ILE 29 HD11 ILE 29 1.017 -11.300 4.788 229 HD12 ILE 29 HD12 ILE 29 1.765 -10.199 5.955 230 HD13 ILE 29 HD13 ILE 29 0.258 -9.745 5.157 231 H ALA 30 HN ALA 30 -1.062 -15.418 8.065 232 HA ALA 30 HA ALA 30 1.047 -16.860 9.454 233 HB1 ALA 30 HB1 ALA 30 -1.263 -17.477 9.891 234 HB2 ALA 30 HB2 ALA 30 -0.402 -18.817 9.135 235 HB3 ALA 30 HB3 ALA 30 -1.508 -17.830 8.182 236 H ASP 31 HN ASP 31 0.454 -15.779 6.376 237 HA ASP 31 HA ASP 31 1.693 -18.062 5.022 238 HB2 ASP 31 HB2 ASP 31 -0.438 -16.947 4.186 239 HB3 ASP 31 HB1 ASP 31 0.578 -15.574 3.776 240 H GLU 32 HN GLU 32 3.689 -17.961 4.182 241 HA GLU 32 HA GLU 32 5.403 -15.758 4.876 242 HB2 GLU 32 HB2 GLU 32 7.130 -17.081 3.696 243 HB3 GLU 32 HB1 GLU 32 6.241 -18.054 4.862 244 HG2 GLU 32 HG2 GLU 32 4.881 -18.987 3.065 245 HG3 GLU 32 HG1 GLU 32 5.759 -18.005 1.893 246 H LYS 33 HN LYS 33 3.545 -16.667 2.069 247 HA LYS 33 HA LYS 33 5.193 -15.142 0.251 248 HB2 LYS 33 HB2 LYS 33 2.476 -16.390 -0.176 249 HB3 LYS 33 HB1 LYS 33 3.447 -15.635 -1.431 250 HG2 LYS 33 HG2 LYS 33 4.085 -17.756 -1.816 251 HG3 LYS 33 HG1 LYS 33 5.215 -17.426 -0.506 252 HD2 LYS 33 HD2 LYS 33 4.129 -19.556 -0.132 253 HD3 LYS 33 HD1 LYS 33 3.607 -18.394 1.090 254 HE2 LYS 33 HE2 LYS 33 1.734 -19.720 0.263 255 HE3 LYS 33 HE1 LYS 33 1.533 -18.018 -0.129 256 HZ1 LYS 33 HZ1 LYS 33 2.506 -18.615 -2.369 257 HZ2 LYS 33 HZ2 LYS 33 0.945 -19.184 -2.050 258 HZ3 LYS 33 HZ3 LYS 33 2.270 -20.234 -1.939 259 H ALA 34 HN ALA 34 1.915 -14.937 1.557 260 HA ALA 34 HA ALA 34 1.324 -12.359 0.657 261 HB1 ALA 34 HB1 ALA 34 -0.367 -13.842 1.601 262 HB2 ALA 34 HB2 ALA 34 -0.350 -12.298 2.452 263 HB3 ALA 34 HB3 ALA 34 0.391 -13.715 3.187 264 H ARG 35 HN ARG 35 3.356 -13.467 3.249 265 HA ARG 35 HA ARG 35 3.482 -11.038 4.743 266 HB2 ARG 35 HB2 ARG 35 4.300 -13.529 5.281 267 HB3 ARG 35 HB1 ARG 35 5.809 -12.903 4.634 268 HG2 ARG 35 HG2 ARG 35 4.367 -11.400 6.789 269 HG3 ARG 35 HG1 ARG 35 5.360 -12.800 7.188 270 HD2 ARG 35 HD2 ARG 35 6.276 -10.323 5.740 271 HD3 ARG 35 HD1 ARG 35 6.592 -10.720 7.434 272 HE ARG 35 HE ARG 35 7.568 -12.452 5.259 273 HH11 ARG 35 HH11 ARG 35 8.119 -10.545 8.138 274 HH12 ARG 35 HH12 ARG 35 9.792 -10.980 8.263 275 HH21 ARG 35 HH21 ARG 35 9.779 -13.034 5.426 276 HH22 ARG 35 HH22 ARG 35 10.730 -12.395 6.728 277 H LYS 36 HN LYS 36 5.752 -12.586 2.489 278 HA LYS 36 HA LYS 36 7.530 -10.456 2.182 279 HB2 LYS 36 HB2 LYS 36 6.677 -12.371 0.025 280 HB3 LYS 36 HB1 LYS 36 8.173 -11.448 0.084 281 HG2 LYS 36 HG2 LYS 36 9.151 -12.858 1.509 282 HG3 LYS 36 HG1 LYS 36 7.631 -13.238 2.354 283 HD2 LYS 36 HD2 LYS 36 8.350 -15.175 1.111 284 HD3 LYS 36 HD1 LYS 36 6.897 -14.471 0.363 285 HE2 LYS 36 HE2 LYS 36 8.495 -13.195 -1.162 286 HE3 LYS 36 HE1 LYS 36 9.770 -14.240 -0.542 287 HZ1 LYS 36 HZ1 LYS 36 8.885 -15.084 -2.620 288 HZ2 LYS 36 HZ2 LYS 36 7.337 -15.177 -1.956 289 HZ3 LYS 36 HZ3 LYS 36 8.570 -16.165 -1.361 290 H VAL 37 HN VAL 37 4.784 -11.371 0.130 291 HA VAL 37 HA VAL 37 5.255 -9.491 -1.837 292 HB VAL 37 HB VAL 37 2.986 -9.788 -2.628 293 HG11 VAL 37 HG11 VAL 37 4.455 -11.583 -3.167 294 HG12 VAL 37 HG12 VAL 37 2.914 -12.300 -2.691 295 HG13 VAL 37 HG13 VAL 37 4.273 -12.296 -1.562 296 HG21 VAL 37 HG21 VAL 37 2.487 -11.019 0.070 297 HG22 VAL 37 HG22 VAL 37 1.405 -11.221 -1.306 298 HG23 VAL 37 HG23 VAL 37 1.698 -9.614 -0.645 299 H ILE 38 HN ILE 38 3.546 -9.123 1.222 300 HA ILE 38 HA ILE 38 2.697 -6.489 0.407 301 HB ILE 38 HB ILE 38 1.526 -8.235 2.130 302 HG12 ILE 38 HG12 ILE 38 1.208 -5.254 2.314 303 HG13 ILE 38 HG11 ILE 38 0.710 -6.151 0.885 304 HG21 ILE 38 HG21 ILE 38 2.776 -6.085 3.839 305 HG22 ILE 38 HG22 ILE 38 3.250 -7.785 3.860 306 HG23 ILE 38 HG23 ILE 38 1.627 -7.312 4.371 307 HD11 ILE 38 HD11 ILE 38 -0.446 -6.041 3.599 308 HD12 ILE 38 HD12 ILE 38 -0.633 -7.529 2.664 309 HD13 ILE 38 HD13 ILE 38 -1.237 -5.999 2.032 310 H VAL 39 HN VAL 39 5.208 -7.869 2.481 311 HA VAL 39 HA VAL 39 5.983 -5.344 3.510 312 HB VAL 39 HB VAL 39 7.863 -6.275 4.363 313 HG11 VAL 39 HG11 VAL 39 5.933 -7.356 5.309 314 HG12 VAL 39 HG12 VAL 39 7.271 -8.508 5.233 315 HG13 VAL 39 HG13 VAL 39 5.970 -8.591 4.052 316 HG21 VAL 39 HG21 VAL 39 7.861 -8.445 2.274 317 HG22 VAL 39 HG22 VAL 39 9.021 -8.297 3.598 318 HG23 VAL 39 HG23 VAL 39 8.953 -7.062 2.341 319 H GLU 40 HN GLU 40 7.128 -7.242 0.780 320 HA GLU 40 HA GLU 40 8.911 -5.375 -0.252 321 HB2 GLU 40 HB2 GLU 40 7.504 -7.759 -1.388 322 HB3 GLU 40 HB1 GLU 40 8.671 -6.831 -2.312 323 HG2 GLU 40 HG2 GLU 40 10.400 -7.311 -0.783 324 HG3 GLU 40 HG1 GLU 40 9.292 -7.972 0.383 325 H LEU 41 HN LEU 41 5.473 -5.622 -0.551 326 HA LEU 41 HA LEU 41 5.432 -3.786 -2.796 327 HB2 LEU 41 HB2 LEU 41 3.678 -5.666 -1.999 328 HB3 LEU 41 HB1 LEU 41 2.957 -4.253 -1.251 329 HG LEU 41 HG LEU 41 1.879 -4.331 -3.285 330 HD11 LEU 41 HD11 LEU 41 2.613 -2.139 -3.074 331 HD12 LEU 41 HD12 LEU 41 2.962 -2.585 -4.738 332 HD13 LEU 41 HD13 LEU 41 4.254 -2.547 -3.553 333 HD21 LEU 41 HD21 LEU 41 3.217 -6.151 -4.231 334 HD22 LEU 41 HD22 LEU 41 4.484 -4.995 -4.638 335 HD23 LEU 41 HD23 LEU 41 2.900 -4.877 -5.404 336 H MET 42 HN MET 42 4.303 -3.687 0.582 337 HA MET 42 HA MET 42 3.486 -0.985 0.579 338 HB2 MET 42 HB2 MET 42 4.373 -2.700 2.896 339 HB3 MET 42 HB1 MET 42 3.398 -1.218 3.028 340 HG2 MET 42 HG2 MET 42 2.645 -3.804 1.692 341 HG3 MET 42 HG1 MET 42 1.984 -3.109 3.169 342 HE1 MET 42 HE1 MET 42 -0.446 -3.038 2.641 343 HE2 MET 42 HE2 MET 42 -0.071 -4.026 1.224 344 HE3 MET 42 HE3 MET 42 -1.119 -2.615 1.062 345 H ALA 43 HN ALA 43 6.492 -2.540 0.900 346 HA ALA 43 HA ALA 43 8.164 -0.703 1.970 347 HB1 ALA 43 HB1 ALA 43 8.956 -2.794 1.162 348 HB2 ALA 43 HB2 ALA 43 9.815 -1.526 0.281 349 HB3 ALA 43 HB3 ALA 43 8.489 -2.402 -0.491 350 H TYR 44 HN TYR 44 6.330 -0.460 -1.021 351 HA TYR 44 HA TYR 44 7.663 2.106 -1.636 352 HB2 TYR 44 HB2 TYR 44 7.651 0.649 -3.569 353 HB3 TYR 44 HB1 TYR 44 5.959 0.302 -3.337 354 HD1 TYR 44 HD1 TYR 44 8.341 2.429 -4.946 355 HD2 TYR 44 HD2 TYR 44 4.273 2.204 -3.784 356 HE1 TYR 44 HE1 TYR 44 7.800 4.162 -6.596 357 HE2 TYR 44 HE2 TYR 44 3.707 3.951 -5.414 358 HH TYR 44 HH TYR 44 4.894 5.833 -6.597 359 H GLU 45 HN GLU 45 4.404 0.692 -1.990 360 HA GLU 45 HA GLU 45 2.953 2.942 -2.075 361 HB2 GLU 45 HB2 GLU 45 1.983 0.626 -0.480 362 HB3 GLU 45 HB1 GLU 45 1.071 1.658 -1.574 363 HG2 GLU 45 HG2 GLU 45 3.130 -0.375 -2.289 364 HG3 GLU 45 HG1 GLU 45 1.403 -0.523 -2.553 365 H ASN 46 HN ASN 46 4.291 1.491 0.821 366 HA ASN 46 HA ASN 46 2.893 3.374 2.535 367 HB2 ASN 46 HB2 ASN 46 4.334 0.777 2.988 368 HB3 ASN 46 HB1 ASN 46 4.064 1.897 4.334 369 HD21 ASN 46 HD21 ASN 46 2.584 0.531 5.391 370 HD22 ASN 46 HD22 ASN 46 1.039 0.150 4.743 371 H ALA 47 HN ALA 47 5.897 2.916 1.056 372 HA ALA 47 HA ALA 47 7.638 3.935 3.014 373 HB1 ALA 47 HB1 ALA 47 9.202 4.363 1.213 374 HB2 ALA 47 HB2 ALA 47 7.920 4.135 0.026 375 HB3 ALA 47 HB3 ALA 47 8.449 2.781 1.021 376 H ASN 48 HN ASN 48 8.835 5.973 2.795 377 HA ASN 48 HA ASN 48 7.209 8.247 2.894 378 HB2 ASN 48 HB2 ASN 48 10.117 7.699 2.808 379 HB3 ASN 48 HB1 ASN 48 9.628 9.304 2.273 380 HD21 ASN 48 HD21 ASN 48 10.985 8.118 4.760 381 HD22 ASN 48 HD22 ASN 48 10.114 8.858 6.062 382 HA PRO 49 HA PRO 49 6.081 9.326 -1.218 383 HB2 PRO 49 HB2 PRO 49 7.415 11.919 -0.569 384 HB3 PRO 49 HB1 PRO 49 5.832 11.627 -1.295 385 HG2 PRO 49 HG2 PRO 49 6.100 12.297 1.294 386 HG3 PRO 49 HG1 PRO 49 4.830 11.196 0.733 387 HD2 PRO 49 HD2 PRO 49 7.252 10.612 2.314 388 HD3 PRO 49 HD1 PRO 49 5.749 9.683 2.158 389 H GLU 50 HN GLU 50 9.205 10.618 -0.241 390 HA GLU 50 HA GLU 50 10.463 10.532 -2.747 391 HB2 GLU 50 HB2 GLU 50 11.408 12.066 -1.334 392 HB3 GLU 50 HB1 GLU 50 11.264 11.027 0.075 393 HG2 GLU 50 HG2 GLU 50 13.408 10.620 -0.174 394 HG3 GLU 50 HG1 GLU 50 12.962 9.668 -1.565 395 H CYS 51 HN CYS 51 10.174 8.265 -0.083 396 HA CYS 51 HA CYS 51 12.451 6.737 -0.820 397 HB2 CYS 51 HB2 CYS 51 10.211 6.312 1.164 398 HB3 CYS 51 HB1 CYS 51 11.483 5.123 0.877 399 HG CYS 51 HG CYS 51 13.512 7.116 1.470 400 H GLN 52 HN GLN 52 8.979 6.520 -1.261 401 HA GLN 52 HA GLN 52 9.184 4.030 -2.671 402 HB2 GLN 52 HB2 GLN 52 6.880 4.341 -3.282 403 HB3 GLN 52 HB1 GLN 52 7.060 4.733 -1.580 404 HG2 GLN 52 HG2 GLN 52 7.172 7.140 -2.261 405 HG3 GLN 52 HG1 GLN 52 6.733 6.627 -3.887 406 HE21 GLN 52 HE21 GLN 52 5.162 4.432 -2.789 407 HE22 GLN 52 HE22 GLN 52 3.692 5.107 -2.226 408 H SER 53 HN SER 53 9.267 7.387 -3.304 409 HA SER 53 HA SER 53 9.373 7.273 -6.112 410 HB2 SER 53 HB2 SER 53 10.068 9.258 -4.012 411 HB3 SER 53 HB1 SER 53 10.612 9.552 -5.667 412 HG SER 53 HG SER 53 8.666 10.219 -6.046 413 H ALA 54 HN ALA 54 11.694 6.663 -3.598 414 HA ALA 54 HA ALA 54 13.909 6.498 -5.413 415 HB1 ALA 54 HB1 ALA 54 13.469 5.299 -2.693 416 HB2 ALA 54 HB2 ALA 54 14.286 6.817 -3.057 417 HB3 ALA 54 HB3 ALA 54 15.005 5.289 -3.564 418 H ILE 55 HN ILE 55 11.291 4.532 -4.529 419 HA ILE 55 HA ILE 55 12.565 2.080 -5.334 420 HB ILE 55 HB ILE 55 9.937 2.717 -4.077 421 HG12 ILE 55 HG12 ILE 55 12.023 0.897 -3.001 422 HG13 ILE 55 HG11 ILE 55 12.318 2.639 -2.975 423 HG21 ILE 55 HG21 ILE 55 9.542 0.846 -5.566 424 HG22 ILE 55 HG22 ILE 55 9.557 0.299 -3.889 425 HG23 ILE 55 HG23 ILE 55 10.958 0.017 -4.924 426 HD11 ILE 55 HD11 ILE 55 9.834 1.370 -1.854 427 HD12 ILE 55 HD12 ILE 55 10.439 3.024 -1.624 428 HD13 ILE 55 HD13 ILE 55 11.316 1.656 -0.915 429 H LYS 56 HN LYS 56 10.064 4.216 -6.698 430 HA LYS 56 HA LYS 56 8.584 2.530 -8.188 431 HB2 LYS 56 HB2 LYS 56 9.233 4.597 -10.041 432 HB3 LYS 56 HB1 LYS 56 7.731 4.288 -9.190 433 HG2 LYS 56 HG2 LYS 56 8.150 6.397 -8.485 434 HG3 LYS 56 HG1 LYS 56 9.041 5.513 -7.242 435 HD2 LYS 56 HD2 LYS 56 11.044 6.023 -8.103 436 HD3 LYS 56 HD1 LYS 56 10.457 6.163 -9.759 437 HE2 LYS 56 HE2 LYS 56 10.465 8.206 -7.546 438 HE3 LYS 56 HE1 LYS 56 10.969 8.358 -9.230 439 HZ1 LYS 56 HZ1 LYS 56 8.914 9.553 -8.820 440 HZ2 LYS 56 HZ2 LYS 56 8.146 8.132 -8.332 441 HZ3 LYS 56 HZ3 LYS 56 8.666 8.304 -9.932 442 HA PRO 57 HA PRO 57 11.911 2.029 -11.762 443 HB2 PRO 57 HB2 PRO 57 14.454 1.831 -10.823 444 HB3 PRO 57 HB1 PRO 57 13.767 3.346 -11.424 445 HG2 PRO 57 HG2 PRO 57 13.901 2.339 -8.594 446 HG3 PRO 57 HG1 PRO 57 14.447 3.912 -9.227 447 HD2 PRO 57 HD2 PRO 57 12.098 3.714 -8.048 448 HD3 PRO 57 HD1 PRO 57 12.210 4.647 -9.548 449 H LEU 58 HN LEU 58 12.195 0.802 -8.487 450 HA LEU 58 HA LEU 58 12.957 -1.872 -9.416 451 HB2 LEU 58 HB2 LEU 58 12.504 -1.279 -6.551 452 HB3 LEU 58 HB1 LEU 58 13.710 -2.335 -7.278 453 HG LEU 58 HG LEU 58 13.801 0.686 -7.139 454 HD11 LEU 58 HD11 LEU 58 15.731 0.204 -5.618 455 HD12 LEU 58 HD12 LEU 58 15.222 -1.485 -5.617 456 HD13 LEU 58 HD13 LEU 58 14.147 -0.241 -4.978 457 HD21 LEU 58 HD21 LEU 58 16.085 0.454 -7.998 458 HD22 LEU 58 HD22 LEU 58 14.886 -0.121 -9.157 459 HD23 LEU 58 HD23 LEU 58 15.824 -1.278 -8.212 460 H LYS 59 HN LYS 59 10.442 0.092 -8.447 461 HA LYS 59 HA LYS 59 8.665 -1.555 -7.132 462 HB2 LYS 59 HB2 LYS 59 8.209 0.779 -7.430 463 HB3 LYS 59 HB1 LYS 59 8.177 0.599 -9.175 464 HG2 LYS 59 HG2 LYS 59 5.952 0.635 -8.814 465 HG3 LYS 59 HG1 LYS 59 6.231 -1.080 -8.553 466 HD2 LYS 59 HD2 LYS 59 6.064 1.017 -6.423 467 HD3 LYS 59 HD1 LYS 59 4.824 -0.176 -6.799 468 HE2 LYS 59 HE2 LYS 59 6.861 -1.831 -6.392 469 HE3 LYS 59 HE1 LYS 59 7.406 -0.490 -5.378 470 HZ1 LYS 59 HZ1 LYS 59 5.013 -2.166 -5.119 471 HZ2 LYS 59 HZ2 LYS 59 4.974 -0.588 -4.512 472 HZ3 LYS 59 HZ3 LYS 59 6.122 -1.698 -3.928 473 H GLY 60 HN GLY 60 8.124 -3.550 -7.668 474 HA2 GLY 60 HA3 GLY 60 6.888 -5.079 -9.018 475 HA3 GLY 60 HA2 GLY 60 7.253 -4.088 -10.417 476 H LYS 61 HN LYS 61 10.111 -3.871 -9.604 477 HA LYS 61 HA LYS 61 10.863 -6.462 -10.745 478 HB2 LYS 61 HB2 LYS 61 12.603 -4.021 -10.654 479 HB3 LYS 61 HB1 LYS 61 12.643 -5.373 -11.785 480 HG2 LYS 61 HG2 LYS 61 10.461 -3.351 -11.571 481 HG3 LYS 61 HG1 LYS 61 11.714 -3.379 -12.806 482 HD2 LYS 61 HD2 LYS 61 10.858 -5.304 -13.805 483 HD3 LYS 61 HD1 LYS 61 9.997 -5.781 -12.334 484 HE2 LYS 61 HE2 LYS 61 8.419 -4.052 -12.614 485 HE3 LYS 61 HE1 LYS 61 9.306 -3.380 -13.983 486 HZ1 LYS 61 HZ1 LYS 61 7.440 -4.662 -14.764 487 HZ2 LYS 61 HZ2 LYS 61 7.938 -6.014 -13.883 488 HZ3 LYS 61 HZ3 LYS 61 8.867 -5.464 -15.184 489 H VAL 62 HN VAL 62 11.503 -7.798 -9.380 490 HA VAL 62 HA VAL 62 13.610 -6.996 -7.479 491 HB VAL 62 HB VAL 62 11.659 -7.749 -6.234 492 HG11 VAL 62 HG11 VAL 62 11.849 -10.307 -7.813 493 HG12 VAL 62 HG12 VAL 62 10.549 -9.118 -7.885 494 HG13 VAL 62 HG13 VAL 62 10.811 -10.051 -6.409 495 HG21 VAL 62 HG21 VAL 62 12.665 -9.680 -5.000 496 HG22 VAL 62 HG22 VAL 62 13.738 -8.299 -5.215 497 HG23 VAL 62 HG23 VAL 62 13.929 -9.730 -6.231 498 HA PRO 63 HA PRO 63 16.408 -9.892 -9.616 499 HB2 PRO 63 HB2 PRO 63 17.005 -10.520 -6.758 500 HB3 PRO 63 HB1 PRO 63 18.119 -10.291 -8.092 501 HG2 PRO 63 HG2 PRO 63 17.772 -8.346 -6.336 502 HG3 PRO 63 HG1 PRO 63 17.878 -7.969 -8.063 503 HD2 PRO 63 HD2 PRO 63 15.493 -8.022 -6.283 504 HD3 PRO 63 HD1 PRO 63 15.844 -6.972 -7.670 505 H ALA 64 HN ALA 64 16.250 -12.042 -10.102 506 HA ALA 64 HA ALA 64 13.822 -13.292 -9.578 507 HB1 ALA 64 HB1 ALA 64 14.717 -15.202 -10.783 508 HB2 ALA 64 HB2 ALA 64 16.351 -14.558 -10.617 509 HB3 ALA 64 HB3 ALA 64 15.157 -13.696 -11.589 510 H GLY 65 HN GLY 65 13.299 -13.764 -7.512 511 HA2 GLY 65 HA3 GLY 65 13.118 -15.515 -5.940 512 HA3 GLY 65 HA2 GLY 65 14.755 -16.010 -6.337 513 H SER 66 HN SER 66 15.161 -12.835 -6.050 514 HA SER 66 HA SER 66 16.108 -13.119 -3.304 515 HB2 SER 66 HB2 SER 66 16.434 -10.722 -5.094 516 HB3 SER 66 HB1 SER 66 17.433 -11.210 -3.725 517 HG SER 66 HG SER 66 17.667 -13.229 -5.212 518 H ASP 67 HN ASP 67 16.175 -10.471 -2.693 519 HA ASP 67 HA ASP 67 13.513 -10.185 -1.558 520 HB2 ASP 67 HB2 ASP 67 15.030 -8.565 -0.084 521 HB3 ASP 67 HB1 ASP 67 15.022 -10.291 0.167 522 H VAL 68 HN VAL 68 12.212 -8.503 -2.252 523 HA VAL 68 HA VAL 68 13.455 -6.513 -3.941 524 HB VAL 68 HB VAL 68 11.445 -5.918 -4.689 525 HG11 VAL 68 HG11 VAL 68 9.680 -7.494 -4.541 526 HG12 VAL 68 HG12 VAL 68 10.318 -8.148 -3.033 527 HG13 VAL 68 HG13 VAL 68 11.207 -8.375 -4.536 528 HG21 VAL 68 HG21 VAL 68 9.524 -5.340 -3.279 529 HG22 VAL 68 HG22 VAL 68 11.005 -4.508 -2.796 530 HG23 VAL 68 HG23 VAL 68 10.421 -5.884 -1.860 531 H ILE 69 HN ILE 69 12.441 -6.859 -0.662 532 HA ILE 69 HA ILE 69 12.408 -4.197 0.133 533 HB ILE 69 HB ILE 69 13.147 -6.682 1.653 534 HG12 ILE 69 HG12 ILE 69 10.864 -6.766 1.169 535 HG13 ILE 69 HG11 ILE 69 10.904 -6.029 2.763 536 HG21 ILE 69 HG21 ILE 69 12.845 -5.272 3.724 537 HG22 ILE 69 HG22 ILE 69 12.900 -3.849 2.681 538 HG23 ILE 69 HG23 ILE 69 14.295 -4.921 2.784 539 HD11 ILE 69 HD11 ILE 69 10.540 -4.622 0.148 540 HD12 ILE 69 HD12 ILE 69 10.715 -3.815 1.704 541 HD13 ILE 69 HD13 ILE 69 9.328 -4.875 1.412 542 H SER 70 HN SER 70 15.020 -6.485 0.144 543 HA SER 70 HA SER 70 17.060 -4.980 1.158 544 HB2 SER 70 HB2 SER 70 17.285 -7.346 0.632 545 HB3 SER 70 HB1 SER 70 17.138 -7.016 -1.088 546 HG SER 70 HG SER 70 19.313 -6.763 0.582 547 H GLU 71 HN GLU 71 15.686 -4.839 -2.069 548 HA GLU 71 HA GLU 71 17.650 -3.035 -3.124 549 HB2 GLU 71 HB2 GLU 71 15.003 -3.751 -4.342 550 HB3 GLU 71 HB1 GLU 71 16.494 -3.294 -5.160 551 HG2 GLU 71 HG2 GLU 71 16.611 -5.713 -3.499 552 HG3 GLU 71 HG1 GLU 71 15.617 -5.810 -4.946 553 H TYR 72 HN TYR 72 14.455 -2.981 -1.815 554 HA TYR 72 HA TYR 72 13.780 -0.370 -2.746 555 HB2 TYR 72 HB2 TYR 72 12.553 -2.333 -0.831 556 HB3 TYR 72 HB1 TYR 72 11.919 -0.695 -0.967 557 HD1 TYR 72 HD1 TYR 72 13.278 -2.245 -3.958 558 HD2 TYR 72 HD2 TYR 72 9.758 -1.658 -1.661 559 HE1 TYR 72 HE1 TYR 72 11.915 -2.945 -5.866 560 HE2 TYR 72 HE2 TYR 72 8.381 -2.371 -3.566 561 HH TYR 72 HH TYR 72 9.812 -3.749 -6.429 562 H VAL 73 HN VAL 73 14.960 -1.787 0.231 563 HA VAL 73 HA VAL 73 15.048 0.628 1.705 564 HB VAL 73 HB VAL 73 16.171 -0.422 3.403 565 HG11 VAL 73 HG11 VAL 73 14.123 -1.533 3.209 566 HG12 VAL 73 HG12 VAL 73 15.340 -2.741 3.614 567 HG13 VAL 73 HG13 VAL 73 14.746 -2.606 1.958 568 HG21 VAL 73 HG21 VAL 73 18.094 -1.098 1.842 569 HG22 VAL 73 HG22 VAL 73 17.273 -2.661 1.770 570 HG23 VAL 73 HG23 VAL 73 17.823 -2.016 3.325 571 H LYS 74 HN LYS 74 17.124 -1.074 -0.475 572 HA LYS 74 HA LYS 74 19.458 0.513 -0.147 573 HB2 LYS 74 HB2 LYS 74 19.643 -1.675 -0.982 574 HB3 LYS 74 HB1 LYS 74 18.434 -1.403 -2.222 575 HG2 LYS 74 HG2 LYS 74 20.348 0.450 -2.814 576 HG3 LYS 74 HG1 LYS 74 21.298 -0.912 -2.221 577 HD2 LYS 74 HD2 LYS 74 21.026 -1.158 -4.595 578 HD3 LYS 74 HD1 LYS 74 20.058 -2.391 -3.783 579 HE2 LYS 74 HE2 LYS 74 18.699 -1.502 -5.509 580 HE3 LYS 74 HE1 LYS 74 18.092 -0.830 -3.989 581 HZ1 LYS 74 HZ1 LYS 74 18.241 0.863 -5.709 582 HZ2 LYS 74 HZ2 LYS 74 19.889 0.560 -5.911 583 HZ3 LYS 74 HZ3 LYS 74 19.325 1.207 -4.459 584 H ALA 75 HN ALA 75 16.539 0.696 -2.016 585 HA ALA 75 HA ALA 75 17.315 2.746 -3.814 586 HB1 ALA 75 HB1 ALA 75 14.619 2.040 -2.656 587 HB2 ALA 75 HB2 ALA 75 15.308 1.433 -4.160 588 HB3 ALA 75 HB3 ALA 75 14.879 3.137 -4.015 589 H CYS 76 HN CYS 76 15.927 2.710 -0.593 590 HA CYS 76 HA CYS 76 16.027 5.604 -0.443 591 HB2 CYS 76 HB2 CYS 76 14.863 3.707 1.573 592 HB3 CYS 76 HB1 CYS 76 14.443 5.378 1.261 593 HG CYS 76 HG CYS 76 13.640 2.660 -0.607 594 H ASP 77 HN ASP 77 18.200 3.335 0.002 595 HA ASP 77 HA ASP 77 19.122 3.642 2.625 596 HB2 ASP 77 HB2 ASP 77 19.926 1.788 1.474 597 HB3 ASP 77 HB1 ASP 77 20.389 2.705 0.053 598 H GLY 78 HN GLY 78 19.570 5.603 -0.235 599 HA2 GLY 78 HA3 GLY 78 21.453 7.373 1.058 600 HA3 GLY 78 HA2 GLY 78 20.646 7.649 -0.479 601 H ILE 79 HN ILE 79 18.050 7.006 0.934 602 HA ILE 79 HA ILE 79 17.419 9.706 1.683 603 HB ILE 79 HB ILE 79 15.632 7.276 1.711 604 HG12 ILE 79 HG12 ILE 79 15.979 9.332 -0.480 605 HG13 ILE 79 HG11 ILE 79 16.668 7.708 -0.518 606 HG21 ILE 79 HG21 ILE 79 14.989 10.220 1.642 607 HG22 ILE 79 HG22 ILE 79 14.682 9.104 2.975 608 HG23 ILE 79 HG23 ILE 79 13.810 8.925 1.451 609 HD11 ILE 79 HD11 ILE 79 13.733 8.227 -0.237 610 HD12 ILE 79 HD12 ILE 79 14.540 6.718 -0.667 611 HD13 ILE 79 HD13 ILE 79 14.537 8.074 -1.793 612 H GLY 80 HN GLY 80 16.098 10.059 3.728 613 HA2 GLY 80 HA3 GLY 80 15.730 9.336 6.028 614 HA3 GLY 80 HA2 GLY 80 17.260 8.472 5.920 615 H GLY 81 HN GLY 81 18.152 10.890 4.276 616 HA2 GLY 81 HA3 GLY 81 18.030 13.288 5.556 617 HA3 GLY 81 HA2 GLY 81 19.296 12.410 6.411 618 H ALA 82 HN ALA 82 19.600 14.797 4.845 619 HA ALA 82 HA ALA 82 21.084 15.721 3.416 620 HB1 ALA 82 HB1 ALA 82 22.370 13.005 3.359 621 HB2 ALA 82 HB2 ALA 82 22.681 14.263 4.554 622 HB3 ALA 82 HB3 ALA 82 23.108 14.527 2.863 623 H MET 83 HN MET 83 21.192 12.492 1.941 624 HA MET 83 HA MET 83 21.023 13.521 -0.677 625 HB2 MET 83 HB2 MET 83 20.466 10.721 0.315 626 HB3 MET 83 HB1 MET 83 20.664 11.170 -1.372 627 HG2 MET 83 HG2 MET 83 22.958 11.911 -0.878 628 HG3 MET 83 HG1 MET 83 22.748 11.375 0.787 629 HE1 MET 83 HE1 MET 83 25.193 8.697 -0.736 630 HE2 MET 83 HE2 MET 83 24.969 9.918 0.515 631 HE3 MET 83 HE3 MET 83 25.131 10.404 -1.171 632 H HIS 84 HN HIS 84 18.605 12.454 1.585 633 HA HIS 84 HA HIS 84 16.361 12.235 -0.068 634 HB2 HIS 84 HB2 HIS 84 16.166 11.606 2.244 635 HB3 HIS 84 HB1 HIS 84 16.674 13.196 2.789 636 HD1 HIS 84 HD1 HIS 84 14.689 14.059 4.018 637 HD2 HIS 84 HD2 HIS 84 13.655 12.423 0.342 638 HE1 HIS 84 HE1 HIS 84 12.265 14.590 3.702 639 HE2 HIS 84 HE2 HIS 84 11.666 13.651 1.446 640 H LYS 85 HN LYS 85 18.070 15.085 1.063 641 HA LYS 85 HA LYS 85 15.889 16.839 0.305 642 HB2 LYS 85 HB2 LYS 85 18.679 17.544 1.223 643 HB3 LYS 85 HB1 LYS 85 17.294 18.626 1.146 644 HG2 LYS 85 HG2 LYS 85 17.555 16.215 2.939 645 HG3 LYS 85 HG1 LYS 85 17.715 17.904 3.433 646 HD2 LYS 85 HD2 LYS 85 15.382 18.295 2.768 647 HD3 LYS 85 HD1 LYS 85 15.241 16.600 2.299 648 HE2 LYS 85 HE2 LYS 85 14.295 16.812 4.472 649 HE3 LYS 85 HE1 LYS 85 15.844 15.983 4.644 650 HZ1 LYS 85 HZ1 LYS 85 15.603 17.659 6.341 651 HZ2 LYS 85 HZ2 LYS 85 15.316 18.858 5.186 652 HZ3 LYS 85 HZ3 LYS 85 16.834 18.124 5.280 653 H ALA 86 HN ALA 86 18.690 15.484 -1.080 654 HA ALA 86 HA ALA 86 18.897 17.406 -3.238 655 HB1 ALA 86 HB1 ALA 86 20.675 15.998 -4.062 656 HB2 ALA 86 HB2 ALA 86 20.236 14.724 -2.925 657 HB3 ALA 86 HB3 ALA 86 20.891 16.251 -2.329 658 H MET 87 HN MET 87 17.859 14.088 -2.738 659 HA MET 87 HA MET 87 17.130 13.692 -5.496 660 HB2 MET 87 HB2 MET 87 16.672 11.970 -3.049 661 HB3 MET 87 HB1 MET 87 16.412 11.465 -4.717 662 HG2 MET 87 HG2 MET 87 19.051 12.492 -4.504 663 HG3 MET 87 HG1 MET 87 18.789 11.361 -3.181 664 HE1 MET 87 HE1 MET 87 18.776 11.872 -7.061 665 HE2 MET 87 HE2 MET 87 17.136 11.296 -6.770 666 HE3 MET 87 HE3 MET 87 18.283 10.282 -7.643 667 H LEU 88 HN LEU 88 15.647 14.996 -2.764 668 HA LEU 88 HA LEU 88 13.016 14.312 -2.881 669 HB2 LEU 88 HB2 LEU 88 14.421 16.029 -1.456 670 HB3 LEU 88 HB1 LEU 88 13.712 17.182 -2.567 671 HG LEU 88 HG LEU 88 11.681 17.070 -1.575 672 HD11 LEU 88 HD11 LEU 88 11.212 14.793 -2.338 673 HD12 LEU 88 HD12 LEU 88 10.675 15.021 -0.676 674 HD13 LEU 88 HD13 LEU 88 12.168 14.143 -1.006 675 HD21 LEU 88 HD21 LEU 88 11.852 16.510 0.810 676 HD22 LEU 88 HD22 LEU 88 13.211 17.480 0.243 677 HD23 LEU 88 HD23 LEU 88 13.408 15.744 0.484 678 H MET 89 HN MET 89 14.746 16.559 -4.979 679 HA MET 89 HA MET 89 12.341 17.388 -6.355 680 HB2 MET 89 HB2 MET 89 14.206 18.958 -5.998 681 HB3 MET 89 HB1 MET 89 15.248 17.939 -6.980 682 HG2 MET 89 HG2 MET 89 13.764 18.332 -8.908 683 HG3 MET 89 HG1 MET 89 12.802 19.421 -7.912 684 HE1 MET 89 HE1 MET 89 13.729 21.701 -6.898 685 HE2 MET 89 HE2 MET 89 15.368 22.295 -7.160 686 HE3 MET 89 HE3 MET 89 15.099 20.855 -6.179 687 H ALA 90 HN ALA 90 14.586 14.840 -6.598 688 HA ALA 90 HA ALA 90 14.293 14.562 -9.493 689 HB1 ALA 90 HB1 ALA 90 15.968 12.965 -7.551 690 HB2 ALA 90 HB2 ALA 90 16.532 14.356 -8.482 691 HB3 ALA 90 HB3 ALA 90 16.043 12.879 -9.312 692 H GLN 91 HN GLN 91 13.623 12.770 -6.528 693 HA GLN 91 HA GLN 91 12.376 10.642 -8.105 694 HB2 GLN 91 HB2 GLN 91 13.028 10.776 -5.172 695 HB3 GLN 91 HB1 GLN 91 12.455 9.362 -6.042 696 HG2 GLN 91 HG2 GLN 91 14.472 9.264 -7.321 697 HG3 GLN 91 HG1 GLN 91 15.043 10.772 -6.608 698 HE21 GLN 91 HE21 GLN 91 14.101 10.281 -4.012 699 HE22 GLN 91 HE22 GLN 91 15.038 9.007 -3.351 700 H LEU 92 HN LEU 92 11.702 12.594 -5.211 701 HA LEU 92 HA LEU 92 9.000 11.920 -4.970 702 HB2 LEU 92 HB2 LEU 92 10.543 12.999 -3.286 703 HB3 LEU 92 HB1 LEU 92 10.221 14.512 -4.107 704 HG LEU 92 HG LEU 92 8.830 13.565 -1.977 705 HD11 LEU 92 HD11 LEU 92 7.174 15.292 -2.510 706 HD12 LEU 92 HD12 LEU 92 7.831 15.398 -4.144 707 HD13 LEU 92 HD13 LEU 92 8.826 15.853 -2.762 708 HD21 LEU 92 HD21 LEU 92 7.800 11.755 -3.200 709 HD22 LEU 92 HD22 LEU 92 7.212 12.885 -4.420 710 HD23 LEU 92 HD23 LEU 92 6.587 12.962 -2.774 711 H GLU 93 HN GLU 93 10.433 13.388 -7.486 712 HA GLU 93 HA GLU 93 9.224 15.678 -8.238 713 HB2 GLU 93 HB2 GLU 93 9.451 14.874 -10.600 714 HB3 GLU 93 HB1 GLU 93 10.911 14.695 -9.629 715 HG2 GLU 93 HG2 GLU 93 10.762 12.406 -9.583 716 HG3 GLU 93 HG1 GLU 93 9.021 12.393 -9.856 717 H2 PRO 1 HT1 PRO 1 5.136 -2.847 -13.514 718 H3 PRO 1 HT2 PRO 1 5.361 -1.270 -13.876 719 HA PRO 1 HA PRO 1 6.118 -1.310 -11.844 720 HB2 PRO 1 HB2 PRO 1 3.971 -0.609 -10.408 721 HB3 PRO 1 HB1 PRO 1 4.598 0.435 -11.688 722 HG2 PRO 1 HG2 PRO 1 2.152 -1.180 -11.645 723 HG3 PRO 1 HG1 PRO 1 2.589 0.169 -12.710 724 HD2 PRO 1 HD2 PRO 1 2.783 -2.703 -13.186 725 HD3 PRO 1 HD1 PRO 1 2.976 -1.365 -14.338 726 H SER 2 HN SER 2 4.474 -1.819 -9.437 727 HA SER 2 HA SER 2 4.455 -4.642 -9.161 728 HB2 SER 2 HB2 SER 2 2.926 -2.515 -7.650 729 HB3 SER 2 HB1 SER 2 3.067 -4.193 -7.161 730 HG SER 2 HG SER 2 5.376 -3.857 -7.116 731 H PHE 3 HN PHE 3 2.110 -5.593 -8.476 732 HA PHE 3 HA PHE 3 0.419 -5.283 -10.764 733 HB2 PHE 3 HB2 PHE 3 -1.112 -6.547 -8.858 734 HB3 PHE 3 HB1 PHE 3 -0.060 -7.357 -10.015 735 HD1 PHE 3 HD1 PHE 3 -0.666 -6.466 -6.579 736 HD2 PHE 3 HD2 PHE 3 2.179 -8.119 -9.277 737 HE1 PHE 3 HE1 PHE 3 0.554 -7.460 -4.709 738 HE2 PHE 3 HE2 PHE 3 3.418 -9.093 -7.391 739 HZ PHE 3 HZ PHE 3 2.604 -8.763 -5.093 740 H ASN 4 HN ASN 4 0.128 -4.521 -7.350 741 HA ASN 4 HA ASN 4 -2.533 -3.535 -7.591 742 HB2 ASN 4 HB2 ASN 4 -2.485 -3.413 -5.288 743 HB3 ASN 4 HB1 ASN 4 -1.247 -4.626 -5.589 744 HD21 ASN 4 HD21 ASN 4 0.985 -3.646 -5.943 745 HD22 ASN 4 HD22 ASN 4 1.412 -2.369 -4.872 746 H THR 5 HN THR 5 0.382 -2.099 -8.284 747 HA THR 5 HA THR 5 0.349 0.318 -6.883 748 HB THR 5 HB THR 5 1.577 0.945 -9.191 749 HG1 THR 5 HG1 THR 5 1.098 -1.071 -10.143 750 HG21 THR 5 HG21 THR 5 2.579 1.046 -7.009 751 HG22 THR 5 HG22 THR 5 3.633 0.174 -8.127 752 HG23 THR 5 HG23 THR 5 2.661 -0.715 -6.952 753 H VAL 6 HN VAL 6 -1.938 -0.647 -9.100 754 HA VAL 6 HA VAL 6 -2.566 1.925 -10.142 755 HB VAL 6 HB VAL 6 -4.587 0.990 -10.898 756 HG11 VAL 6 HG11 VAL 6 -2.570 0.172 -11.996 757 HG12 VAL 6 HG12 VAL 6 -3.876 -1.014 -12.057 758 HG13 VAL 6 HG13 VAL 6 -2.548 -1.219 -10.910 759 HG21 VAL 6 HG21 VAL 6 -4.203 -1.337 -9.017 760 HG22 VAL 6 HG22 VAL 6 -5.513 -1.148 -10.186 761 HG23 VAL 6 HG23 VAL 6 -5.381 -0.034 -8.819 762 H ARG 7 HN ARG 7 -3.193 3.564 -8.893 763 HA ARG 7 HA ARG 7 -4.729 2.899 -6.503 764 HB2 ARG 7 HB2 ARG 7 -2.901 5.214 -7.002 765 HB3 ARG 7 HB1 ARG 7 -4.111 5.170 -5.734 766 HG2 ARG 7 HG2 ARG 7 -2.002 4.789 -4.809 767 HG3 ARG 7 HG1 ARG 7 -2.947 3.335 -4.753 768 HD2 ARG 7 HD2 ARG 7 -0.694 2.861 -5.300 769 HD3 ARG 7 HD1 ARG 7 -1.760 2.442 -6.628 770 HE ARG 7 HE ARG 7 -1.069 4.798 -7.473 771 HH11 ARG 7 HH11 ARG 7 1.076 2.607 -5.747 772 HH12 ARG 7 HH12 ARG 7 2.490 3.183 -6.570 773 HH21 ARG 7 HH21 ARG 7 0.796 5.551 -8.510 774 HH22 ARG 7 HH22 ARG 7 2.336 4.839 -8.145 775 H GLN 8 HN GLN 8 -6.388 4.313 -5.936 776 HA GLN 8 HA GLN 8 -8.159 5.222 -7.826 777 HB2 GLN 8 HB2 GLN 8 -7.947 5.041 -5.040 778 HB3 GLN 8 HB1 GLN 8 -8.335 6.725 -5.354 779 HG2 GLN 8 HG2 GLN 8 -10.302 6.092 -6.576 780 HG3 GLN 8 HG1 GLN 8 -9.891 4.385 -6.428 781 HE21 GLN 8 HE21 GLN 8 -12.271 5.773 -5.588 782 HE22 GLN 8 HE22 GLN 8 -12.387 5.539 -3.866 783 H GLY 9 HN GLY 9 -7.754 6.727 -9.323 784 HA2 GLY 9 HA3 GLY 9 -6.110 9.036 -8.826 785 HA3 GLY 9 HA2 GLY 9 -7.088 8.733 -10.256 786 H SER 10 HN SER 10 -7.666 11.013 -10.137 787 HA SER 10 HA SER 10 -8.872 12.282 -7.999 788 HB2 SER 10 HB2 SER 10 -10.017 13.687 -9.805 789 HB3 SER 10 HB1 SER 10 -8.257 13.609 -9.863 790 HG SER 10 HG SER 10 -9.933 11.881 -11.365 791 H LYS 11 HN LYS 11 -10.378 11.353 -6.834 792 HA LYS 11 HA LYS 11 -12.117 10.061 -6.181 793 HB2 LYS 11 HB2 LYS 11 -14.251 10.982 -6.688 794 HB3 LYS 11 HB1 LYS 11 -13.123 12.311 -6.588 795 HG2 LYS 11 HG2 LYS 11 -13.038 12.384 -9.019 796 HG3 LYS 11 HG1 LYS 11 -14.199 11.071 -9.109 797 HD2 LYS 11 HD2 LYS 11 -15.745 12.557 -7.744 798 HD3 LYS 11 HD1 LYS 11 -14.613 13.867 -8.084 799 HE2 LYS 11 HE2 LYS 11 -16.406 13.926 -9.694 800 HE3 LYS 11 HE1 LYS 11 -14.913 13.451 -10.502 801 HZ1 LYS 11 HZ1 LYS 11 -17.047 11.588 -9.608 802 HZ2 LYS 11 HZ2 LYS 11 -15.632 11.153 -10.417 803 HZ3 LYS 11 HZ3 LYS 11 -16.795 12.093 -11.203 804 H GLU 12 HN GLU 12 -10.651 8.622 -8.044 805 HA GLU 12 HA GLU 12 -12.135 7.513 -10.146 806 HB2 GLU 12 HB2 GLU 12 -9.701 7.221 -9.841 807 HB3 GLU 12 HB1 GLU 12 -9.986 6.216 -8.432 808 HG2 GLU 12 HG2 GLU 12 -11.033 4.526 -9.802 809 HG3 GLU 12 HG1 GLU 12 -10.889 5.560 -11.228 810 HA PRO 13 HA PRO 13 -15.379 5.287 -8.056 811 HB2 PRO 13 HB2 PRO 13 -15.001 3.199 -10.090 812 HB3 PRO 13 HB1 PRO 13 -16.444 4.134 -9.711 813 HG2 PRO 13 HG2 PRO 13 -14.959 4.525 -11.949 814 HG3 PRO 13 HG1 PRO 13 -15.904 5.795 -11.167 815 HD2 PRO 13 HD2 PRO 13 -12.984 5.388 -11.228 816 HD3 PRO 13 HD1 PRO 13 -13.911 6.877 -10.992 817 H TYR 14 HN TYR 14 -15.147 4.003 -6.339 818 HA TYR 14 HA TYR 14 -12.544 3.021 -5.898 819 HB2 TYR 14 HB2 TYR 14 -13.809 4.091 -4.108 820 HB3 TYR 14 HB1 TYR 14 -14.954 2.756 -4.113 821 HD1 TYR 14 HD1 TYR 14 -14.001 0.430 -3.737 822 HD2 TYR 14 HD2 TYR 14 -11.917 3.974 -2.745 823 HE1 TYR 14 HE1 TYR 14 -12.604 -0.861 -2.213 824 HE2 TYR 14 HE2 TYR 14 -10.496 2.710 -1.195 825 HH TYR 14 HH TYR 14 -10.178 0.715 -0.221 826 HA PRO 15 HA PRO 15 -14.624 -1.399 -5.593 827 HB2 PRO 15 HB2 PRO 15 -16.756 -1.057 -7.613 828 HB3 PRO 15 HB1 PRO 15 -16.773 -1.971 -6.107 829 HG2 PRO 15 HG2 PRO 15 -18.080 0.340 -6.363 830 HG3 PRO 15 HG1 PRO 15 -17.338 -0.146 -4.843 831 HD2 PRO 15 HD2 PRO 15 -16.447 1.885 -6.821 832 HD3 PRO 15 HD1 PRO 15 -16.249 1.850 -5.065 833 H ASP 16 HN ASP 16 -14.307 0.736 -8.165 834 HA ASP 16 HA ASP 16 -13.537 -1.259 -10.121 835 HB2 ASP 16 HB2 ASP 16 -14.023 1.692 -10.239 836 HB3 ASP 16 HB1 ASP 16 -13.113 0.912 -11.521 837 H PHE 17 HN PHE 17 -12.119 1.435 -8.323 838 HA PHE 17 HA PHE 17 -9.516 1.314 -9.335 839 HB2 PHE 17 HB2 PHE 17 -9.431 3.078 -7.919 840 HB3 PHE 17 HB1 PHE 17 -10.869 2.525 -7.070 841 HD1 PHE 17 HD1 PHE 17 -10.658 1.161 -5.055 842 HD2 PHE 17 HD2 PHE 17 -7.238 2.635 -7.102 843 HE1 PHE 17 HE1 PHE 17 -9.284 0.687 -3.081 844 HE2 PHE 17 HE2 PHE 17 -5.844 2.192 -5.130 845 HZ PHE 17 HZ PHE 17 -6.867 1.196 -3.112 846 H VAL 18 HN VAL 18 -11.136 -0.475 -6.798 847 HA VAL 18 HA VAL 18 -8.780 -1.974 -6.162 848 HB VAL 18 HB VAL 18 -10.154 -1.593 -4.298 849 HG11 VAL 18 HG11 VAL 18 -12.230 -1.064 -5.438 850 HG12 VAL 18 HG12 VAL 18 -12.497 -2.302 -4.200 851 HG13 VAL 18 HG13 VAL 18 -12.415 -2.758 -5.910 852 HG21 VAL 18 HG21 VAL 18 -10.960 -3.890 -3.715 853 HG22 VAL 18 HG22 VAL 18 -9.268 -3.771 -4.207 854 HG23 VAL 18 HG23 VAL 18 -10.482 -4.379 -5.345 855 H ALA 19 HN ALA 19 -11.747 -2.544 -8.012 856 HA ALA 19 HA ALA 19 -11.433 -5.274 -8.481 857 HB1 ALA 19 HB1 ALA 19 -13.428 -3.974 -9.155 858 HB2 ALA 19 HB2 ALA 19 -12.807 -5.002 -10.447 859 HB3 ALA 19 HB3 ALA 19 -12.491 -3.267 -10.471 860 H ARG 20 HN ARG 20 -9.718 -2.574 -9.995 861 HA ARG 20 HA ARG 20 -8.470 -4.436 -11.843 862 HB2 ARG 20 HB2 ARG 20 -7.143 -2.503 -12.630 863 HB3 ARG 20 HB1 ARG 20 -8.872 -2.246 -12.764 864 HG2 ARG 20 HG2 ARG 20 -8.893 -0.627 -11.125 865 HG3 ARG 20 HG1 ARG 20 -7.399 -1.211 -10.383 866 HD2 ARG 20 HD2 ARG 20 -6.091 -0.388 -12.196 867 HD3 ARG 20 HD1 ARG 20 -7.521 -0.020 -13.137 868 HE ARG 20 HE ARG 20 -7.823 1.543 -10.953 869 HH11 ARG 20 HH11 ARG 20 -5.208 1.051 -13.224 870 HH12 ARG 20 HH12 ARG 20 -4.590 2.664 -13.066 871 HH21 ARG 20 HH21 ARG 20 -7.019 3.679 -10.743 872 HH22 ARG 20 HH22 ARG 20 -5.603 4.148 -11.636 873 H LEU 21 HN LEU 21 -7.963 -2.812 -8.866 874 HA LEU 21 HA LEU 21 -5.317 -3.339 -8.299 875 HB2 LEU 21 HB2 LEU 21 -7.243 -2.169 -6.987 876 HB3 LEU 21 HB1 LEU 21 -7.515 -3.747 -6.292 877 HG LEU 21 HG LEU 21 -5.419 -3.690 -5.167 878 HD11 LEU 21 HD11 LEU 21 -4.092 -2.737 -6.956 879 HD12 LEU 21 HD12 LEU 21 -3.831 -1.902 -5.427 880 HD13 LEU 21 HD13 LEU 21 -4.849 -1.169 -6.674 881 HD21 LEU 21 HD21 LEU 21 -5.586 -1.568 -3.900 882 HD22 LEU 21 HD22 LEU 21 -7.108 -2.453 -4.035 883 HD23 LEU 21 HD23 LEU 21 -6.813 -1.041 -5.051 884 H GLN 22 HN GLN 22 -8.180 -5.376 -7.907 885 HA GLN 22 HA GLN 22 -6.798 -7.674 -7.027 886 HB2 GLN 22 HB2 GLN 22 -9.498 -7.646 -8.344 887 HB3 GLN 22 HB1 GLN 22 -8.836 -8.809 -7.193 888 HG2 GLN 22 HG2 GLN 22 -8.816 -6.889 -5.569 889 HG3 GLN 22 HG1 GLN 22 -9.796 -6.026 -6.715 890 HE21 GLN 22 HE21 GLN 22 -11.243 -5.955 -4.934 891 HE22 GLN 22 HE22 GLN 22 -12.332 -7.274 -4.678 892 H ASP 23 HN ASP 23 -8.178 -6.644 -10.072 893 HA ASP 23 HA ASP 23 -7.858 -8.930 -11.571 894 HB2 ASP 23 HB2 ASP 23 -8.868 -6.678 -12.219 895 HB3 ASP 23 HB1 ASP 23 -7.220 -6.217 -12.641 896 H VAL 24 HN VAL 24 -5.460 -6.333 -11.145 897 HA VAL 24 HA VAL 24 -3.609 -7.775 -12.824 898 HB VAL 24 HB VAL 24 -3.673 -5.341 -13.014 899 HG11 VAL 24 HG11 VAL 24 -4.373 -4.812 -10.771 900 HG12 VAL 24 HG12 VAL 24 -2.909 -3.916 -11.180 901 HG13 VAL 24 HG13 VAL 24 -2.814 -5.336 -10.139 902 HG21 VAL 24 HG21 VAL 24 -1.235 -4.817 -12.627 903 HG22 VAL 24 HG22 VAL 24 -1.544 -6.290 -13.556 904 HG23 VAL 24 HG23 VAL 24 -1.098 -6.401 -11.854 905 H ALA 25 HN ALA 25 -4.325 -7.377 -9.480 906 HA ALA 25 HA ALA 25 -1.840 -8.406 -8.480 907 HB1 ALA 25 HB1 ALA 25 -3.054 -8.741 -6.373 908 HB2 ALA 25 HB2 ALA 25 -4.573 -8.372 -7.186 909 HB3 ALA 25 HB3 ALA 25 -3.341 -7.123 -7.013 910 H GLN 26 HN GLN 26 -4.592 -9.551 -10.006 911 HA GLN 26 HA GLN 26 -4.272 -12.294 -9.187 912 HB2 GLN 26 HB2 GLN 26 -6.453 -12.108 -9.596 913 HB3 GLN 26 HB1 GLN 26 -6.205 -10.615 -10.482 914 HG2 GLN 26 HG2 GLN 26 -7.078 -11.866 -12.122 915 HG3 GLN 26 HG1 GLN 26 -5.383 -12.280 -12.348 916 HE21 GLN 26 HE21 GLN 26 -5.248 -13.899 -9.966 917 HE22 GLN 26 HE22 GLN 26 -6.075 -15.365 -10.317 918 H LYS 27 HN LYS 27 -3.681 -10.243 -11.952 919 HA LYS 27 HA LYS 27 -2.770 -12.226 -13.737 920 HB2 LYS 27 HB2 LYS 27 -2.001 -9.303 -13.645 921 HB3 LYS 27 HB1 LYS 27 -1.899 -10.372 -15.047 922 HG2 LYS 27 HG2 LYS 27 -4.409 -9.479 -13.651 923 HG3 LYS 27 HG1 LYS 27 -3.828 -8.931 -15.224 924 HD2 LYS 27 HD2 LYS 27 -4.362 -10.924 -16.256 925 HD3 LYS 27 HD1 LYS 27 -4.302 -11.841 -14.751 926 HE2 LYS 27 HE2 LYS 27 -6.356 -10.961 -14.017 927 HE3 LYS 27 HE1 LYS 27 -6.355 -9.725 -15.267 928 HZ1 LYS 27 HZ1 LYS 27 -7.887 -11.564 -15.750 929 HZ2 LYS 27 HZ2 LYS 27 -6.587 -12.646 -15.757 930 HZ3 LYS 27 HZ3 LYS 27 -6.679 -11.428 -16.927 931 H SER 28 HN SER 28 -1.113 -10.365 -11.247 932 HA SER 28 HA SER 28 1.453 -11.328 -12.279 933 HB2 SER 28 HB2 SER 28 1.175 -8.886 -12.058 934 HB3 SER 28 HB1 SER 28 0.845 -9.098 -10.342 935 HG SER 28 HG SER 28 3.231 -10.112 -11.433 936 H ILE 29 HN ILE 29 -0.836 -11.966 -9.981 937 HA ILE 29 HA ILE 29 1.153 -13.260 -8.234 938 HB ILE 29 HB ILE 29 -1.623 -12.308 -7.560 939 HG12 ILE 29 HG12 ILE 29 1.045 -11.395 -6.487 940 HG13 ILE 29 HG11 ILE 29 0.057 -10.527 -7.665 941 HG21 ILE 29 HG21 ILE 29 -1.191 -14.360 -6.392 942 HG22 ILE 29 HG22 ILE 29 -1.178 -12.993 -5.275 943 HG23 ILE 29 HG23 ILE 29 0.345 -13.727 -5.794 944 HD11 ILE 29 HD11 ILE 29 -0.929 -11.288 -4.946 945 HD12 ILE 29 HD12 ILE 29 -1.666 -10.180 -6.114 946 HD13 ILE 29 HD13 ILE 29 -0.157 -9.739 -5.312 947 H ALA 30 HN ALA 30 1.133 -15.422 -8.221 948 HA ALA 30 HA ALA 30 -0.986 -16.848 -9.611 949 HB1 ALA 30 HB1 ALA 30 1.324 -17.478 -10.041 950 HB2 ALA 30 HB2 ALA 30 0.451 -18.814 -9.292 951 HB3 ALA 30 HB3 ALA 30 1.559 -17.837 -8.331 952 H ASP 31 HN ASP 31 -0.389 -15.773 -6.529 953 HA ASP 31 HA ASP 31 -1.650 -18.045 -5.178 954 HB2 ASP 31 HB2 ASP 31 0.486 -16.944 -4.337 955 HB3 ASP 31 HB1 ASP 31 -0.525 -15.565 -3.929 956 H GLU 32 HN GLU 32 -3.646 -17.925 -4.328 957 HA GLU 32 HA GLU 32 -5.346 -15.715 -5.045 958 HB2 GLU 32 HB2 GLU 32 -7.087 -17.029 -3.868 959 HB3 GLU 32 HB1 GLU 32 -6.200 -18.005 -5.034 960 HG2 GLU 32 HG2 GLU 32 -4.850 -18.948 -3.231 961 HG3 GLU 32 HG1 GLU 32 -5.723 -17.958 -2.063 962 H LYS 33 HN LYS 33 -3.504 -16.636 -2.234 963 HA LYS 33 HA LYS 33 -5.144 -15.101 -0.415 964 HB2 LYS 33 HB2 LYS 33 -2.434 -16.367 0.013 965 HB3 LYS 33 HB1 LYS 33 -3.400 -15.604 1.265 966 HG2 LYS 33 HG2 LYS 33 -4.054 -17.717 1.656 967 HG3 LYS 33 HG1 LYS 33 -5.181 -17.383 0.341 968 HD2 LYS 33 HD2 LYS 33 -4.112 -19.520 -0.028 969 HD3 LYS 33 HD1 LYS 33 -3.574 -18.365 -1.249 970 HE2 LYS 33 HE2 LYS 33 -1.716 -19.711 -0.413 971 HE3 LYS 33 HE1 LYS 33 -1.501 -18.010 -0.020 972 HZ1 LYS 33 HZ1 LYS 33 -2.493 -18.596 2.214 973 HZ2 LYS 33 HZ2 LYS 33 -0.934 -19.177 1.910 974 HZ3 LYS 33 HZ3 LYS 33 -2.266 -20.218 1.794 975 H ALA 34 HN ALA 34 -1.862 -14.916 -1.717 976 HA ALA 34 HA ALA 34 -1.255 -12.342 -0.815 977 HB1 ALA 34 HB1 ALA 34 0.426 -13.841 -1.754 978 HB2 ALA 34 HB2 ALA 34 0.425 -12.295 -2.605 979 HB3 ALA 34 HB3 ALA 34 -0.327 -13.706 -3.343 980 H ARG 35 HN ARG 35 -3.288 -13.436 -3.411 981 HA ARG 35 HA ARG 35 -3.393 -11.010 -4.907 982 HB2 ARG 35 HB2 ARG 35 -4.225 -13.492 -5.445 983 HB3 ARG 35 HB1 ARG 35 -5.733 -12.859 -4.802 984 HG2 ARG 35 HG2 ARG 35 -4.275 -11.366 -6.954 985 HG3 ARG 35 HG1 ARG 35 -5.277 -12.759 -7.354 986 HD2 ARG 35 HD2 ARG 35 -6.184 -10.277 -5.909 987 HD3 ARG 35 HD1 ARG 35 -6.492 -10.670 -7.605 988 HE ARG 35 HE ARG 35 -7.490 -12.403 -5.436 989 HH11 ARG 35 HH11 ARG 35 -8.017 -10.492 -8.318 990 HH12 ARG 35 HH12 ARG 35 -9.690 -10.921 -8.455 991 HH21 ARG 35 HH21 ARG 35 -9.700 -12.965 -5.610 992 HH22 ARG 35 HH22 ARG 35 -10.647 -12.325 -6.918 993 H LYS 36 HN LYS 36 -5.681 -12.537 -2.660 994 HA LYS 36 HA LYS 36 -7.447 -10.398 -2.361 995 HB2 LYS 36 HB2 LYS 36 -6.612 -12.319 -0.200 996 HB3 LYS 36 HB1 LYS 36 -8.103 -11.388 -0.263 997 HG2 LYS 36 HG2 LYS 36 -9.084 -12.790 -1.693 998 HG3 LYS 36 HG1 LYS 36 -7.563 -13.179 -2.532 999 HD2 LYS 36 HD2 LYS 36 -8.297 -15.114 -1.293 1000 HD3 LYS 36 HD1 LYS 36 -6.844 -14.416 -0.538 1001 HE2 LYS 36 HE2 LYS 36 -8.443 -13.131 0.976 1002 HE3 LYS 36 HE1 LYS 36 -9.720 -14.171 0.351 1003 HZ1 LYS 36 HZ1 LYS 36 -8.851 -15.014 2.432 1004 HZ2 LYS 36 HZ2 LYS 36 -7.297 -15.117 1.775 1005 HZ3 LYS 36 HZ3 LYS 36 -8.534 -16.100 1.175 1006 H VAL 37 HN VAL 37 -4.713 -11.329 -0.301 1007 HA VAL 37 HA VAL 37 -5.176 -9.446 1.667 1008 HB VAL 37 HB VAL 37 -2.912 -9.761 2.465 1009 HG11 VAL 37 HG11 VAL 37 -4.397 -11.545 3.000 1010 HG12 VAL 37 HG12 VAL 37 -2.858 -12.273 2.529 1011 HG13 VAL 37 HG13 VAL 37 -4.213 -12.261 1.396 1012 HG21 VAL 37 HG21 VAL 37 -2.412 -10.996 -0.229 1013 HG22 VAL 37 HG22 VAL 37 -1.337 -11.204 1.152 1014 HG23 VAL 37 HG23 VAL 37 -1.616 -9.595 0.488 1015 H ILE 38 HN ILE 38 -3.458 -9.092 -1.388 1016 HA ILE 38 HA ILE 38 -2.593 -6.464 -0.572 1017 HB ILE 38 HB ILE 38 -1.428 -8.216 -2.289 1018 HG12 ILE 38 HG12 ILE 38 -1.092 -5.239 -2.470 1019 HG13 ILE 38 HG11 ILE 38 -0.602 -6.140 -1.042 1020 HG21 ILE 38 HG21 ILE 38 -2.656 -6.058 -4.005 1021 HG22 ILE 38 HG22 ILE 38 -3.143 -7.755 -4.026 1022 HG23 ILE 38 HG23 ILE 38 -1.514 -7.297 -4.531 1023 HD11 ILE 38 HD11 ILE 38 0.558 -6.037 -3.753 1024 HD12 ILE 38 HD12 ILE 38 0.734 -7.525 -2.818 1025 HD13 ILE 38 HD13 ILE 38 1.348 -6.000 -2.185 1026 H VAL 39 HN VAL 39 -5.106 -7.828 -2.657 1027 HA VAL 39 HA VAL 39 -5.863 -5.297 -3.686 1028 HB VAL 39 HB VAL 39 -7.745 -6.218 -4.545 1029 HG11 VAL 39 HG11 VAL 39 -5.817 -7.309 -5.482 1030 HG12 VAL 39 HG12 VAL 39 -7.163 -8.451 -5.413 1031 HG13 VAL 39 HG13 VAL 39 -5.868 -8.547 -4.226 1032 HG21 VAL 39 HG21 VAL 39 -7.764 -8.386 -2.455 1033 HG22 VAL 39 HG22 VAL 39 -8.917 -8.232 -3.783 1034 HG23 VAL 39 HG23 VAL 39 -8.846 -6.997 -2.526 1035 H GLU 40 HN GLU 40 -7.024 -7.185 -0.958 1036 HA GLU 40 HA GLU 40 -8.799 -5.307 0.067 1037 HB2 GLU 40 HB2 GLU 40 -7.413 -7.701 1.205 1038 HB3 GLU 40 HB1 GLU 40 -8.577 -6.765 2.127 1039 HG2 GLU 40 HG2 GLU 40 -10.300 -7.224 0.584 1040 HG3 GLU 40 HG1 GLU 40 -9.193 -7.901 -0.574 1041 H LEU 41 HN LEU 41 -5.364 -5.575 0.376 1042 HA LEU 41 HA LEU 41 -5.316 -3.739 2.622 1043 HB2 LEU 41 HB2 LEU 41 -3.575 -5.632 1.833 1044 HB3 LEU 41 HB1 LEU 41 -2.841 -4.226 1.085 1045 HG LEU 41 HG LEU 41 -1.771 -4.309 3.121 1046 HD11 LEU 41 HD11 LEU 41 -2.488 -2.112 2.906 1047 HD12 LEU 41 HD12 LEU 41 -2.840 -2.554 4.572 1048 HD13 LEU 41 HD13 LEU 41 -4.133 -2.509 3.386 1049 HD21 LEU 41 HD21 LEU 41 -3.121 -6.120 4.065 1050 HD22 LEU 41 HD22 LEU 41 -4.382 -4.954 4.470 1051 HD23 LEU 41 HD23 LEU 41 -2.799 -4.845 5.238 1052 H MET 42 HN MET 42 -4.181 -3.650 -0.754 1053 HA MET 42 HA MET 42 -3.345 -0.953 -0.749 1054 HB2 MET 42 HB2 MET 42 -4.235 -2.662 -3.067 1055 HB3 MET 42 HB1 MET 42 -3.251 -1.188 -3.197 1056 HG2 MET 42 HG2 MET 42 -2.517 -3.778 -1.858 1057 HG3 MET 42 HG1 MET 42 -1.848 -3.088 -3.334 1058 HE1 MET 42 HE1 MET 42 0.579 -3.037 -2.799 1059 HE2 MET 42 HE2 MET 42 0.191 -4.018 -1.380 1060 HE3 MET 42 HE3 MET 42 1.251 -2.616 -1.218 1061 H ALA 43 HN ALA 43 -6.359 -2.488 -1.081 1062 HA ALA 43 HA ALA 43 -8.015 -0.641 -2.152 1063 HB1 ALA 43 HB1 ALA 43 -8.824 -2.727 -1.346 1064 HB2 ALA 43 HB2 ALA 43 -9.677 -1.452 -0.470 1065 HB3 ALA 43 HB3 ALA 43 -8.360 -2.335 0.307 1066 H TYR 44 HN TYR 44 -6.190 -0.411 0.844 1067 HA TYR 44 HA TYR 44 -7.508 2.164 1.453 1068 HB2 TYR 44 HB2 TYR 44 -7.513 0.708 3.386 1069 HB3 TYR 44 HB1 TYR 44 -5.823 0.351 3.159 1070 HD1 TYR 44 HD1 TYR 44 -8.196 2.492 4.763 1071 HD2 TYR 44 HD2 TYR 44 -4.124 2.242 3.610 1072 HE1 TYR 44 HE1 TYR 44 -7.647 4.219 6.416 1073 HE2 TYR 44 HE2 TYR 44 -3.553 3.983 5.242 1074 HH TYR 44 HH TYR 44 -4.751 5.880 6.417 1075 H GLU 45 HN GLU 45 -4.256 0.736 1.830 1076 HA GLU 45 HA GLU 45 -2.794 2.976 1.911 1077 HB2 GLU 45 HB2 GLU 45 -1.825 0.658 0.322 1078 HB3 GLU 45 HB1 GLU 45 -0.917 1.682 1.425 1079 HG2 GLU 45 HG2 GLU 45 -2.990 -0.344 2.118 1080 HG3 GLU 45 HG1 GLU 45 -1.267 -0.502 2.395 1081 H ASN 46 HN ASN 46 -4.126 1.524 -0.991 1082 HA ASN 46 HA ASN 46 -2.717 3.400 -2.705 1083 HB2 ASN 46 HB2 ASN 46 -4.169 0.810 -3.157 1084 HB3 ASN 46 HB1 ASN 46 -3.892 1.927 -4.503 1085 HD21 ASN 46 HD21 ASN 46 -2.420 0.554 -5.557 1086 HD22 ASN 46 HD22 ASN 46 -0.877 0.167 -4.907 1087 H ALA 47 HN ALA 47 -5.730 2.962 -1.232 1088 HA ALA 47 HA ALA 47 -7.456 3.992 -3.199 1089 HB1 ALA 47 HB1 ALA 47 -9.024 4.432 -1.402 1090 HB2 ALA 47 HB2 ALA 47 -7.746 4.195 -0.211 1091 HB3 ALA 47 HB3 ALA 47 -8.283 2.845 -1.209 1092 H ASN 48 HN ASN 48 -8.637 6.039 -2.989 1093 HA ASN 48 HA ASN 48 -7.002 8.306 -3.079 1094 HB2 ASN 48 HB2 ASN 48 -9.914 7.775 -3.000 1095 HB3 ASN 48 HB1 ASN 48 -9.413 9.379 -2.464 1096 HD21 ASN 48 HD21 ASN 48 -10.768 8.188 -4.961 1097 HD22 ASN 48 HD22 ASN 48 -9.888 8.926 -6.260 1098 HA PRO 49 HA PRO 49 -5.877 9.370 1.036 1099 HB2 PRO 49 HB2 PRO 49 -7.193 11.975 0.381 1100 HB3 PRO 49 HB1 PRO 49 -5.615 11.672 1.113 1101 HG2 PRO 49 HG2 PRO 49 -5.866 12.343 -1.476 1102 HG3 PRO 49 HG1 PRO 49 -4.607 11.232 -0.911 1103 HD2 PRO 49 HD2 PRO 49 -7.031 10.667 -2.500 1104 HD3 PRO 49 HD1 PRO 49 -5.533 9.726 -2.342 1105 H GLU 50 HN GLU 50 -8.987 10.697 0.058 1106 HA GLU 50 HA GLU 50 -10.259 10.609 2.553 1107 HB2 GLU 50 HB2 GLU 50 -11.187 12.151 1.136 1108 HB3 GLU 50 HB1 GLU 50 -11.044 11.111 -0.274 1109 HG2 GLU 50 HG2 GLU 50 -13.191 10.716 -0.031 1110 HG3 GLU 50 HG1 GLU 50 -12.754 9.762 1.361 1111 H CYS 51 HN CYS 51 -9.970 8.341 -0.107 1112 HA CYS 51 HA CYS 51 -12.264 6.828 0.619 1113 HB2 CYS 51 HB2 CYS 51 -10.020 6.386 -1.358 1114 HB3 CYS 51 HB1 CYS 51 -11.303 5.207 -1.075 1115 HG CYS 51 HG CYS 51 -13.318 7.207 -1.675 1116 H GLN 52 HN GLN 52 -8.796 6.588 1.072 1117 HA GLN 52 HA GLN 52 -9.021 4.099 2.484 1118 HB2 GLN 52 HB2 GLN 52 -6.715 4.394 3.099 1119 HB3 GLN 52 HB1 GLN 52 -6.891 4.789 1.396 1120 HG2 GLN 52 HG2 GLN 52 -6.982 7.195 2.076 1121 HG3 GLN 52 HG1 GLN 52 -6.554 6.681 3.705 1122 HE21 GLN 52 HE21 GLN 52 -5.000 4.470 2.608 1123 HE22 GLN 52 HE22 GLN 52 -3.523 5.131 2.047 1124 H SER 53 HN SER 53 -9.087 7.456 3.114 1125 HA SER 53 HA SER 53 -9.204 7.336 5.922 1126 HB2 SER 53 HB2 SER 53 -9.850 9.338 3.827 1127 HB3 SER 53 HB1 SER 53 -10.422 9.630 5.473 1128 HG SER 53 HG SER 53 -8.477 10.316 5.848 1129 H ALA 54 HN ALA 54 -11.515 6.751 3.400 1130 HA ALA 54 HA ALA 54 -13.740 6.601 5.206 1131 HB1 ALA 54 HB1 ALA 54 -13.296 5.396 2.490 1132 HB2 ALA 54 HB2 ALA 54 -14.104 6.920 2.848 1133 HB3 ALA 54 HB3 ALA 54 -14.836 5.397 3.354 1134 H ILE 55 HN ILE 55 -11.130 4.618 4.335 1135 HA ILE 55 HA ILE 55 -12.423 2.175 5.137 1136 HB ILE 55 HB ILE 55 -9.786 2.793 3.887 1137 HG12 ILE 55 HG12 ILE 55 -11.882 0.985 2.803 1138 HG13 ILE 55 HG11 ILE 55 -12.162 2.733 2.775 1139 HG21 ILE 55 HG21 ILE 55 -9.407 0.922 5.378 1140 HG22 ILE 55 HG22 ILE 55 -9.423 0.371 3.701 1141 HG23 ILE 55 HG23 ILE 55 -10.827 0.100 4.732 1142 HD11 ILE 55 HD11 ILE 55 -9.685 1.443 1.665 1143 HD12 ILE 55 HD12 ILE 55 -10.277 3.101 1.431 1144 HD13 ILE 55 HD13 ILE 55 -11.160 1.738 0.720 1145 H LYS 56 HN LYS 56 -9.910 4.293 6.508 1146 HA LYS 56 HA LYS 56 -8.448 2.597 8.002 1147 HB2 LYS 56 HB2 LYS 56 -9.086 4.668 9.854 1148 HB3 LYS 56 HB1 LYS 56 -7.585 4.349 9.008 1149 HG2 LYS 56 HG2 LYS 56 -7.989 6.463 8.304 1150 HG3 LYS 56 HG1 LYS 56 -8.878 5.584 7.056 1151 HD2 LYS 56 HD2 LYS 56 -10.883 6.108 7.903 1152 HD3 LYS 56 HD1 LYS 56 -10.307 6.246 9.564 1153 HE2 LYS 56 HE2 LYS 56 -10.294 8.287 7.351 1154 HE3 LYS 56 HE1 LYS 56 -10.791 8.447 9.039 1155 HZ1 LYS 56 HZ1 LYS 56 -8.723 9.623 8.615 1156 HZ2 LYS 56 HZ2 LYS 56 -7.974 8.190 8.126 1157 HZ3 LYS 56 HZ3 LYS 56 -8.485 8.373 9.728 1158 HA PRO 57 HA PRO 57 -11.790 2.121 11.563 1159 HB2 PRO 57 HB2 PRO 57 -14.333 1.937 10.618 1160 HB3 PRO 57 HB1 PRO 57 -13.636 3.449 11.221 1161 HG2 PRO 57 HG2 PRO 57 -13.769 2.443 8.390 1162 HG3 PRO 57 HG1 PRO 57 -14.304 4.020 9.023 1163 HD2 PRO 57 HD2 PRO 57 -11.954 3.806 7.849 1164 HD3 PRO 57 HD1 PRO 57 -12.064 4.737 9.350 1165 H LEU 58 HN LEU 58 -12.069 0.895 8.290 1166 HA LEU 58 HA LEU 58 -12.851 -1.776 9.214 1167 HB2 LEU 58 HB2 LEU 58 -12.385 -1.181 6.352 1168 HB3 LEU 58 HB1 LEU 58 -13.599 -2.229 7.073 1169 HG LEU 58 HG LEU 58 -13.670 0.792 6.931 1170 HD11 LEU 58 HD11 LEU 58 -15.603 0.318 5.408 1171 HD12 LEU 58 HD12 LEU 58 -15.100 -1.374 5.412 1172 HD13 LEU 58 HD13 LEU 58 -14.020 -0.136 4.772 1173 HD21 LEU 58 HD21 LEU 58 -15.960 0.578 7.784 1174 HD22 LEU 58 HD22 LEU 58 -14.767 0.002 8.949 1175 HD23 LEU 58 HD23 LEU 58 -15.708 -1.154 8.007 1176 H LYS 59 HN LYS 59 -10.319 0.173 8.260 1177 HA LYS 59 HA LYS 59 -8.549 -1.487 6.949 1178 HB2 LYS 59 HB2 LYS 59 -8.079 0.845 7.241 1179 HB3 LYS 59 HB1 LYS 59 -8.057 0.671 8.987 1180 HG2 LYS 59 HG2 LYS 59 -5.829 0.689 8.638 1181 HG3 LYS 59 HG1 LYS 59 -6.120 -1.023 8.376 1182 HD2 LYS 59 HD2 LYS 59 -5.927 1.072 6.247 1183 HD3 LYS 59 HD1 LYS 59 -4.696 -0.128 6.630 1184 HE2 LYS 59 HE2 LYS 59 -6.742 -1.770 6.215 1185 HE3 LYS 59 HE1 LYS 59 -7.275 -0.426 5.199 1186 HZ1 LYS 59 HZ1 LYS 59 -4.899 -2.124 4.948 1187 HZ2 LYS 59 HZ2 LYS 59 -4.838 -0.546 4.341 1188 HZ3 LYS 59 HZ3 LYS 59 -5.997 -1.642 3.753 1189 H GLY 60 HN GLY 60 -8.022 -3.480 7.491 1190 HA2 GLY 60 HA3 GLY 60 -6.802 -5.017 8.846 1191 HA3 GLY 60 HA2 GLY 60 -7.170 -4.025 10.246 1192 H LYS 61 HN LYS 61 -10.023 -3.788 9.421 1193 HA LYS 61 HA LYS 61 -10.790 -6.380 10.557 1194 HB2 LYS 61 HB2 LYS 61 -12.518 -3.928 10.460 1195 HB3 LYS 61 HB1 LYS 61 -12.570 -5.280 11.592 1196 HG2 LYS 61 HG2 LYS 61 -10.377 -3.270 11.381 1197 HG3 LYS 61 HG1 LYS 61 -11.633 -3.290 12.615 1198 HD2 LYS 61 HD2 LYS 61 -10.790 -5.221 13.613 1199 HD3 LYS 61 HD1 LYS 61 -9.929 -5.704 12.144 1200 HE2 LYS 61 HE2 LYS 61 -8.339 -3.985 12.428 1201 HE3 LYS 61 HE1 LYS 61 -9.221 -3.308 13.797 1202 HZ1 LYS 61 HZ1 LYS 61 -7.367 -4.604 14.581 1203 HZ2 LYS 61 HZ2 LYS 61 -7.869 -5.953 13.696 1204 HZ3 LYS 61 HZ3 LYS 61 -8.798 -5.401 14.995 1205 H VAL 62 HN VAL 62 -11.439 -7.715 9.190 1206 HA VAL 62 HA VAL 62 -13.535 -6.894 7.284 1207 HB VAL 62 HB VAL 62 -11.586 -7.658 6.040 1208 HG11 VAL 62 HG11 VAL 62 -11.795 -10.215 7.617 1209 HG12 VAL 62 HG12 VAL 62 -10.489 -9.033 7.685 1210 HG13 VAL 62 HG13 VAL 62 -10.756 -9.968 6.212 1211 HG21 VAL 62 HG21 VAL 62 -12.598 -9.583 4.800 1212 HG22 VAL 62 HG22 VAL 62 -13.665 -8.197 5.015 1213 HG23 VAL 62 HG23 VAL 62 -13.867 -9.627 6.027 1214 HA PRO 63 HA PRO 63 -16.360 -9.771 9.403 1215 HB2 PRO 63 HB2 PRO 63 -16.947 -10.399 6.541 1216 HB3 PRO 63 HB1 PRO 63 -18.066 -10.162 7.871 1217 HG2 PRO 63 HG2 PRO 63 -17.698 -8.224 6.110 1218 HG3 PRO 63 HG1 PRO 63 -17.812 -7.840 7.838 1219 HD2 PRO 63 HD2 PRO 63 -15.416 -7.912 6.072 1220 HD3 PRO 63 HD1 PRO 63 -15.767 -6.860 7.456 1221 H ALA 64 HN ALA 64 -16.223 -11.923 9.893 1222 HA ALA 64 HA ALA 64 -13.798 -13.192 9.383 1223 HB1 ALA 64 HB1 ALA 64 -14.717 -15.096 10.581 1224 HB2 ALA 64 HB2 ALA 64 -16.343 -14.437 10.409 1225 HB3 ALA 64 HB3 ALA 64 -15.146 -13.589 11.387 1226 H GLY 65 HN GLY 65 -13.269 -13.666 7.316 1227 HA2 GLY 65 HA3 GLY 65 -13.095 -15.420 5.749 1228 HA3 GLY 65 HA2 GLY 65 -14.737 -15.901 6.138 1229 H SER 66 HN SER 66 -15.119 -12.727 5.849 1230 HA SER 66 HA SER 66 -16.058 -13.002 3.099 1231 HB2 SER 66 HB2 SER 66 -16.372 -10.600 4.883 1232 HB3 SER 66 HB1 SER 66 -17.379 -11.092 3.521 1233 HG SER 66 HG SER 66 -17.662 -13.093 4.983 1234 H ASP 67 HN ASP 67 -16.105 -10.362 2.488 1235 HA ASP 67 HA ASP 67 -13.437 -10.088 1.361 1236 HB2 ASP 67 HB2 ASP 67 -14.946 -8.461 -0.113 1237 HB3 ASP 67 HB1 ASP 67 -14.942 -10.187 -0.365 1238 H VAL 68 HN VAL 68 -12.131 -8.414 2.057 1239 HA VAL 68 HA VAL 68 -13.365 -6.414 3.739 1240 HB VAL 68 HB VAL 68 -11.355 -5.833 4.494 1241 HG11 VAL 68 HG11 VAL 68 -9.599 -7.421 4.356 1242 HG12 VAL 68 HG12 VAL 68 -10.236 -8.072 2.847 1243 HG13 VAL 68 HG13 VAL 68 -11.132 -8.290 4.347 1244 HG21 VAL 68 HG21 VAL 68 -9.423 -5.271 3.093 1245 HG22 VAL 68 HG22 VAL 68 -10.895 -4.427 2.605 1246 HG23 VAL 68 HG23 VAL 68 -10.319 -5.807 1.670 1247 H ILE 69 HN ILE 69 -12.343 -6.769 0.467 1248 HA ILE 69 HA ILE 69 -12.289 -4.107 -0.329 1249 HB ILE 69 HB ILE 69 -13.039 -6.589 -1.852 1250 HG12 ILE 69 HG12 ILE 69 -10.758 -6.688 -1.362 1251 HG13 ILE 69 HG11 ILE 69 -10.787 -5.951 -2.953 1252 HG21 ILE 69 HG21 ILE 69 -12.723 -5.180 -3.920 1253 HG22 ILE 69 HG22 ILE 69 -12.767 -3.756 -2.877 1254 HG23 ILE 69 HG23 ILE 69 -14.171 -4.814 -2.982 1255 HD11 ILE 69 HD11 ILE 69 -10.425 -4.544 -0.339 1256 HD12 ILE 69 HD12 ILE 69 -10.589 -3.739 -1.897 1257 HD13 ILE 69 HD13 ILE 69 -9.211 -4.806 -1.599 1258 H SER 70 HN SER 70 -14.915 -6.379 -0.352 1259 HA SER 70 HA SER 70 -16.946 -4.867 -1.368 1260 HB2 SER 70 HB2 SER 70 -17.186 -7.230 -0.838 1261 HB3 SER 70 HB1 SER 70 -17.032 -6.898 0.880 1262 HG SER 70 HG SER 70 -19.206 -6.598 -0.797 1263 H GLU 71 HN GLU 71 -15.578 -4.731 1.864 1264 HA GLU 71 HA GLU 71 -17.533 -2.910 2.908 1265 HB2 GLU 71 HB2 GLU 71 -14.897 -3.644 4.134 1266 HB3 GLU 71 HB1 GLU 71 -16.385 -3.173 4.946 1267 HG2 GLU 71 HG2 GLU 71 -16.505 -5.595 3.286 1268 HG3 GLU 71 HG1 GLU 71 -15.535 -5.694 4.748 1269 H TYR 72 HN TYR 72 -14.334 -2.877 1.610 1270 HA TYR 72 HA TYR 72 -13.648 -0.271 2.545 1271 HB2 TYR 72 HB2 TYR 72 -12.423 -2.239 0.634 1272 HB3 TYR 72 HB1 TYR 72 -11.782 -0.606 0.773 1273 HD1 TYR 72 HD1 TYR 72 -13.161 -2.146 3.757 1274 HD2 TYR 72 HD2 TYR 72 -9.631 -1.583 1.472 1275 HE1 TYR 72 HE1 TYR 72 -11.809 -2.860 5.669 1276 HE2 TYR 72 HE2 TYR 72 -8.265 -2.309 3.377 1277 HH TYR 72 HH TYR 72 -9.736 -3.652 6.260 1278 H VAL 73 HN VAL 73 -14.822 -1.681 -0.437 1279 HA VAL 73 HA VAL 73 -14.891 0.734 -1.913 1280 HB VAL 73 HB VAL 73 -16.017 -0.310 -3.614 1281 HG11 VAL 73 HG11 VAL 73 -13.977 -1.435 -3.413 1282 HG12 VAL 73 HG12 VAL 73 -15.200 -2.634 -3.822 1283 HG13 VAL 73 HG13 VAL 73 -14.611 -2.503 -2.164 1284 HG21 VAL 73 HG21 VAL 73 -17.950 -0.975 -2.058 1285 HG22 VAL 73 HG22 VAL 73 -17.136 -2.543 -1.983 1286 HG23 VAL 73 HG23 VAL 73 -17.678 -1.895 -3.539 1287 H LYS 74 HN LYS 74 -16.983 -0.953 0.263 1288 HA LYS 74 HA LYS 74 -19.307 0.648 -0.076 1289 HB2 LYS 74 HB2 LYS 74 -19.506 -1.539 0.755 1290 HB3 LYS 74 HB1 LYS 74 -18.301 -1.276 2.000 1291 HG2 LYS 74 HG2 LYS 74 -20.207 0.587 2.585 1292 HG3 LYS 74 HG1 LYS 74 -21.162 -0.770 1.990 1293 HD2 LYS 74 HD2 LYS 74 -20.901 -1.016 4.367 1294 HD3 LYS 74 HD1 LYS 74 -19.937 -2.254 3.561 1295 HE2 LYS 74 HE2 LYS 74 -18.579 -1.373 5.292 1296 HE3 LYS 74 HE1 LYS 74 -17.964 -0.700 3.775 1297 HZ1 LYS 74 HZ1 LYS 74 -18.118 0.994 5.497 1298 HZ2 LYS 74 HZ2 LYS 74 -19.768 0.693 5.689 1299 HZ3 LYS 74 HZ3 LYS 74 -19.194 1.338 4.240 1300 H ALA 75 HN ALA 75 -16.394 0.816 1.801 1301 HA ALA 75 HA ALA 75 -17.164 2.869 3.597 1302 HB1 ALA 75 HB1 ALA 75 -14.469 2.147 2.450 1303 HB2 ALA 75 HB2 ALA 75 -15.168 1.547 3.952 1304 HB3 ALA 75 HB3 ALA 75 -14.728 3.248 3.806 1305 H CYS 76 HN CYS 76 -15.764 2.824 0.383 1306 HA CYS 76 HA CYS 76 -15.847 5.720 0.230 1307 HB2 CYS 76 HB2 CYS 76 -14.688 3.812 -1.779 1308 HB3 CYS 76 HB1 CYS 76 -14.258 5.481 -1.470 1309 HG CYS 76 HG CYS 76 -13.475 2.759 0.401 1310 H ASP 77 HN ASP 77 -18.028 3.458 -0.227 1311 HA ASP 77 HA ASP 77 -18.939 3.772 -2.850 1312 HB2 ASP 77 HB2 ASP 77 -19.766 1.924 -1.706 1313 HB3 ASP 77 HB1 ASP 77 -20.224 2.843 -0.285 1314 H GLY 78 HN GLY 78 -19.394 5.733 0.012 1315 HA2 GLY 78 HA3 GLY 78 -21.262 7.515 -1.288 1316 HA3 GLY 78 HA2 GLY 78 -20.456 7.787 0.251 1317 H ILE 79 HN ILE 79 -17.860 7.130 -1.158 1318 HA ILE 79 HA ILE 79 -17.211 9.827 -1.902 1319 HB ILE 79 HB ILE 79 -15.437 7.387 -1.922 1320 HG12 ILE 79 HG12 ILE 79 -15.776 9.447 0.266 1321 HG13 ILE 79 HG11 ILE 79 -16.475 7.828 0.303 1322 HG21 ILE 79 HG21 ILE 79 -14.770 10.326 -1.855 1323 HG22 ILE 79 HG22 ILE 79 -14.466 9.208 -3.184 1324 HG23 ILE 79 HG23 ILE 79 -13.602 9.023 -1.658 1325 HD11 ILE 79 HD11 ILE 79 -13.537 8.327 0.030 1326 HD12 ILE 79 HD12 ILE 79 -14.353 6.823 0.458 1327 HD13 ILE 79 HD13 ILE 79 -14.344 8.179 1.583 1328 H GLY 80 HN GLY 80 -15.879 10.170 -3.938 1329 HA2 GLY 80 HA3 GLY 80 -15.501 9.448 -6.236 1330 HA3 GLY 80 HA2 GLY 80 -17.035 8.589 -6.138 1331 H GLY 81 HN GLY 81 -17.922 11.016 -4.497 1332 HA2 GLY 81 HA3 GLY 81 -17.782 13.414 -5.779 1333 HA3 GLY 81 HA2 GLY 81 -19.049 12.543 -6.640 1334 H ALA 82 HN ALA 82 -19.350 14.927 -5.080 1335 HA ALA 82 HA ALA 82 -20.827 15.866 -3.651 1336 HB1 ALA 82 HB1 ALA 82 -22.124 13.154 -3.593 1337 HB2 ALA 82 HB2 ALA 82 -22.426 14.412 -4.790 1338 HB3 ALA 82 HB3 ALA 82 -22.856 14.681 -3.101 1339 H MET 83 HN MET 83 -20.960 12.642 -2.172 1340 HA MET 83 HA MET 83 -20.791 13.668 0.444 1341 HB2 MET 83 HB2 MET 83 -20.247 10.865 -0.547 1342 HB3 MET 83 HB1 MET 83 -20.450 11.315 1.141 1343 HG2 MET 83 HG2 MET 83 -22.736 12.067 0.642 1344 HG3 MET 83 HG1 MET 83 -22.523 11.543 -1.026 1345 HE1 MET 83 HE1 MET 83 -24.993 8.878 0.494 1346 HE2 MET 83 HE2 MET 83 -24.766 10.103 -0.754 1347 HE3 MET 83 HE3 MET 83 -24.912 10.584 0.936 1348 H HIS 84 HN HIS 84 -18.373 12.584 -1.810 1349 HA HIS 84 HA HIS 84 -16.136 12.352 -0.147 1350 HB2 HIS 84 HB2 HIS 84 -15.938 11.719 -2.458 1351 HB3 HIS 84 HB1 HIS 84 -16.433 13.313 -3.007 1352 HD1 HIS 84 HD1 HIS 84 -14.436 14.162 -4.223 1353 HD2 HIS 84 HD2 HIS 84 -13.433 12.518 -0.544 1354 HE1 HIS 84 HE1 HIS 84 -12.007 14.661 -3.902 1355 HE2 HIS 84 HE2 HIS 84 -11.424 13.711 -1.645 1356 H LYS 85 HN LYS 85 -17.821 15.213 -1.291 1357 HA LYS 85 HA LYS 85 -15.634 16.953 -0.518 1358 HB2 LYS 85 HB2 LYS 85 -18.416 17.675 -1.451 1359 HB3 LYS 85 HB1 LYS 85 -17.024 18.748 -1.367 1360 HG2 LYS 85 HG2 LYS 85 -17.293 16.340 -3.163 1361 HG3 LYS 85 HG1 LYS 85 -17.437 18.030 -3.657 1362 HD2 LYS 85 HD2 LYS 85 -15.103 18.400 -2.985 1363 HD3 LYS 85 HD1 LYS 85 -14.980 16.705 -2.511 1364 HE2 LYS 85 HE2 LYS 85 -14.020 16.905 -4.680 1365 HE3 LYS 85 HE1 LYS 85 -15.573 16.089 -4.859 1366 HZ1 LYS 85 HZ1 LYS 85 -15.308 17.760 -6.560 1367 HZ2 LYS 85 HZ2 LYS 85 -15.025 18.960 -5.407 1368 HZ3 LYS 85 HZ3 LYS 85 -16.544 18.229 -5.509 1369 H ALA 86 HN ALA 86 -18.453 15.614 0.854 1370 HA ALA 86 HA ALA 86 -18.653 17.540 3.009 1371 HB1 ALA 86 HB1 ALA 86 -20.442 16.143 3.833 1372 HB2 ALA 86 HB2 ALA 86 -20.008 14.864 2.699 1373 HB3 ALA 86 HB3 ALA 86 -20.653 16.394 2.100 1374 H MET 87 HN MET 87 -17.641 14.211 2.522 1375 HA MET 87 HA MET 87 -16.917 13.816 5.278 1376 HB2 MET 87 HB2 MET 87 -16.463 12.090 2.832 1377 HB3 MET 87 HB1 MET 87 -16.211 11.585 4.502 1378 HG2 MET 87 HG2 MET 87 -18.842 12.627 4.282 1379 HG3 MET 87 HG1 MET 87 -18.585 11.494 2.959 1380 HE1 MET 87 HE1 MET 87 -18.571 12.012 6.835 1381 HE2 MET 87 HE2 MET 87 -16.934 11.423 6.547 1382 HE3 MET 87 HE3 MET 87 -18.091 10.421 7.421 1383 H LEU 88 HN LEU 88 -15.414 15.108 2.550 1384 HA LEU 88 HA LEU 88 -12.787 14.404 2.671 1385 HB2 LEU 88 HB2 LEU 88 -14.174 16.135 1.245 1386 HB3 LEU 88 HB1 LEU 88 -13.462 17.280 2.360 1387 HG LEU 88 HG LEU 88 -11.426 17.157 1.375 1388 HD11 LEU 88 HD11 LEU 88 -10.974 14.876 2.135 1389 HD12 LEU 88 HD12 LEU 88 -10.436 15.098 0.472 1390 HD13 LEU 88 HD13 LEU 88 -11.936 14.233 0.803 1391 HD21 LEU 88 HD21 LEU 88 -11.594 16.602 -1.012 1392 HD22 LEU 88 HD22 LEU 88 -12.952 17.580 -0.448 1393 HD23 LEU 88 HD23 LEU 88 -13.154 15.844 -0.692 1394 H MET 89 HN MET 89 -14.509 16.664 4.763 1395 HA MET 89 HA MET 89 -12.103 17.477 6.149 1396 HB2 MET 89 HB2 MET 89 -13.960 19.057 5.786 1397 HB3 MET 89 HB1 MET 89 -15.010 18.045 6.766 1398 HG2 MET 89 HG2 MET 89 -13.526 18.435 8.698 1399 HG3 MET 89 HG1 MET 89 -12.556 19.517 7.703 1400 HE1 MET 89 HE1 MET 89 -13.463 21.802 6.685 1401 HE2 MET 89 HE2 MET 89 -15.101 22.405 6.939 1402 HE3 MET 89 HE3 MET 89 -14.837 20.965 5.960 1403 H ALA 90 HN ALA 90 -14.373 14.949 6.387 1404 HA ALA 90 HA ALA 90 -14.085 14.661 9.280 1405 HB1 ALA 90 HB1 ALA 90 -15.765 13.077 7.333 1406 HB2 ALA 90 HB2 ALA 90 -16.323 14.472 8.262 1407 HB3 ALA 90 HB3 ALA 90 -15.845 12.994 9.093 1408 H GLN 91 HN GLN 91 -13.420 12.870 6.314 1409 HA GLN 91 HA GLN 91 -12.194 10.738 7.901 1410 HB2 GLN 91 HB2 GLN 91 -12.829 10.872 4.965 1411 HB3 GLN 91 HB1 GLN 91 -12.268 9.455 5.838 1412 HG2 GLN 91 HG2 GLN 91 -14.289 9.371 7.109 1413 HG3 GLN 91 HG1 GLN 91 -14.848 10.883 6.396 1414 HE21 GLN 91 HE21 GLN 91 -13.899 10.382 3.803 1415 HE22 GLN 91 HE22 GLN 91 -14.845 9.115 3.140 1416 H LEU 92 HN LEU 92 -11.490 12.687 5.011 1417 HA LEU 92 HA LEU 92 -8.792 11.987 4.780 1418 HB2 LEU 92 HB2 LEU 92 -10.322 13.077 3.090 1419 HB3 LEU 92 HB1 LEU 92 -9.995 14.589 3.911 1420 HG LEU 92 HG LEU 92 -8.604 13.635 1.786 1421 HD11 LEU 92 HD11 LEU 92 -6.935 15.352 2.326 1422 HD12 LEU 92 HD12 LEU 92 -7.598 15.461 3.957 1423 HD13 LEU 92 HD13 LEU 92 -8.586 15.925 2.571 1424 HD21 LEU 92 HD21 LEU 92 -7.592 11.815 3.005 1425 HD22 LEU 92 HD22 LEU 92 -7.001 12.937 4.233 1426 HD23 LEU 92 HD23 LEU 92 -6.367 13.015 2.590 1427 H GLU 93 HN GLU 93 -10.226 13.466 7.286 1428 HA GLU 93 HA GLU 93 -9.009 15.750 8.044 1429 HB2 GLU 93 HB2 GLU 93 -9.245 14.947 10.405 1430 HB3 GLU 93 HB1 GLU 93 -10.704 14.781 9.430 1431 HG2 GLU 93 HG2 GLU 93 -10.571 12.489 9.377 1432 HG3 GLU 93 HG1 GLU 93 -8.833 12.465 9.663 Start of MODEL 17 1 H2 PRO 1 HT1 PRO 1 -5.216 -3.802 13.560 2 H3 PRO 1 HT2 PRO 1 -5.544 -2.263 14.006 3 HA PRO 1 HA PRO 1 -6.353 -2.263 11.992 4 HB2 PRO 1 HB2 PRO 1 -4.322 -1.324 10.540 5 HB3 PRO 1 HB1 PRO 1 -4.954 -0.404 11.910 6 HG2 PRO 1 HG2 PRO 1 -2.429 -1.893 11.664 7 HG3 PRO 1 HG1 PRO 1 -2.867 -0.598 12.796 8 HD2 PRO 1 HD2 PRO 1 -2.890 -3.477 13.207 9 HD3 PRO 1 HD1 PRO 1 -3.149 -2.186 14.398 10 H SER 2 HN SER 2 -4.679 -2.530 9.537 11 HA SER 2 HA SER 2 -4.523 -5.326 9.103 12 HB2 SER 2 HB2 SER 2 -3.133 -3.029 7.727 13 HB3 SER 2 HB1 SER 2 -3.089 -4.689 7.164 14 HG SER 2 HG SER 2 -5.366 -4.628 6.993 15 H PHE 3 HN PHE 3 -2.185 -6.127 8.349 16 HA PHE 3 HA PHE 3 -0.485 -5.889 10.638 17 HB2 PHE 3 HB2 PHE 3 1.051 -7.008 8.669 18 HB3 PHE 3 HB1 PHE 3 0.047 -7.903 9.811 19 HD1 PHE 3 HD1 PHE 3 0.604 -6.867 6.400 20 HD2 PHE 3 HD2 PHE 3 -2.162 -8.763 9.042 21 HE1 PHE 3 HE1 PHE 3 -0.547 -7.870 4.515 22 HE2 PHE 3 HE2 PHE 3 -3.343 -9.733 7.119 23 HZ PHE 3 HZ PHE 3 -2.533 -9.288 4.836 24 H ASN 4 HN ASN 4 -0.318 -4.873 7.264 25 HA ASN 4 HA ASN 4 2.374 -3.899 7.667 26 HB2 ASN 4 HB2 ASN 4 2.345 -3.571 5.237 27 HB3 ASN 4 HB1 ASN 4 1.857 -5.206 5.683 28 HD21 ASN 4 HD21 ASN 4 0.633 -2.032 4.754 29 HD22 ASN 4 HD22 ASN 4 -0.845 -2.617 4.062 30 H THR 5 HN THR 5 -0.425 -2.463 8.360 31 HA THR 5 HA THR 5 -0.420 -0.116 6.776 32 HB THR 5 HB THR 5 -1.690 0.793 8.857 33 HG1 THR 5 HG1 THR 5 -1.296 -0.623 10.451 34 HG21 THR 5 HG21 THR 5 -3.659 -0.717 8.205 35 HG22 THR 5 HG22 THR 5 -2.539 -1.412 7.031 36 HG23 THR 5 HG23 THR 5 -2.933 0.304 6.963 37 H VAL 6 HN VAL 6 1.829 -1.146 9.021 38 HA VAL 6 HA VAL 6 2.491 1.387 10.139 39 HB VAL 6 HB VAL 6 4.334 0.348 11.141 40 HG11 VAL 6 HG11 VAL 6 3.517 -1.755 12.061 41 HG12 VAL 6 HG12 VAL 6 2.300 -1.840 10.787 42 HG13 VAL 6 HG13 VAL 6 2.237 -0.543 11.983 43 HG21 VAL 6 HG21 VAL 6 5.452 -1.627 10.391 44 HG22 VAL 6 HG22 VAL 6 5.279 -0.536 9.005 45 HG23 VAL 6 HG23 VAL 6 4.203 -1.928 9.175 46 H ARG 7 HN ARG 7 3.798 2.954 9.245 47 HA ARG 7 HA ARG 7 5.565 2.145 7.143 48 HB2 ARG 7 HB2 ARG 7 4.600 3.862 5.547 49 HB3 ARG 7 HB1 ARG 7 3.857 2.302 5.741 50 HG2 ARG 7 HG2 ARG 7 2.532 3.982 7.520 51 HG3 ARG 7 HG1 ARG 7 2.697 4.864 5.996 52 HD2 ARG 7 HD2 ARG 7 1.888 2.808 4.832 53 HD3 ARG 7 HD1 ARG 7 1.498 2.122 6.397 54 HE ARG 7 HE ARG 7 -0.136 3.767 4.887 55 HH11 ARG 7 HH11 ARG 7 0.979 3.742 8.222 56 HH12 ARG 7 HH12 ARG 7 -0.381 4.645 8.799 57 HH21 ARG 7 HH21 ARG 7 -1.919 4.919 5.674 58 HH22 ARG 7 HH22 ARG 7 -2.038 5.287 7.363 59 H GLN 8 HN GLN 8 6.852 3.707 6.256 60 HA GLN 8 HA GLN 8 8.459 5.041 7.922 61 HB2 GLN 8 HB2 GLN 8 8.136 4.759 5.137 62 HB3 GLN 8 HB1 GLN 8 8.391 6.477 5.426 63 HG2 GLN 8 HG2 GLN 8 10.433 5.970 6.655 64 HG3 GLN 8 HG1 GLN 8 10.177 4.249 6.380 65 HE21 GLN 8 HE21 GLN 8 12.405 5.921 5.606 66 HE22 GLN 8 HE22 GLN 8 12.509 5.826 3.871 67 H GLY 9 HN GLY 9 8.051 6.547 9.357 68 HA2 GLY 9 HA3 GLY 9 6.205 8.723 8.835 69 HA3 GLY 9 HA2 GLY 9 7.147 8.466 10.296 70 H SER 10 HN SER 10 7.897 10.599 10.411 71 HA SER 10 HA SER 10 8.949 12.096 8.315 72 HB2 SER 10 HB2 SER 10 9.772 12.192 11.227 73 HB3 SER 10 HB1 SER 10 9.982 13.480 10.041 74 HG SER 10 HG SER 10 7.433 12.795 9.988 75 H LYS 11 HN LYS 11 10.357 11.148 6.977 76 HA LYS 11 HA LYS 11 12.045 9.851 6.185 77 HB2 LYS 11 HB2 LYS 11 14.217 10.764 6.564 78 HB3 LYS 11 HB1 LYS 11 13.084 12.086 6.483 79 HG2 LYS 11 HG2 LYS 11 13.160 12.370 8.834 80 HG3 LYS 11 HG1 LYS 11 14.104 10.907 9.055 81 HD2 LYS 11 HD2 LYS 11 15.930 11.969 7.747 82 HD3 LYS 11 HD1 LYS 11 14.980 13.456 7.704 83 HE2 LYS 11 HE2 LYS 11 15.006 13.552 10.143 84 HE3 LYS 11 HE1 LYS 11 15.928 12.052 10.198 85 HZ1 LYS 11 HZ1 LYS 11 16.853 14.595 8.980 86 HZ2 LYS 11 HZ2 LYS 11 17.736 13.157 9.051 87 HZ3 LYS 11 HZ3 LYS 11 17.349 13.981 10.474 88 H GLU 12 HN GLU 12 10.748 8.455 8.186 89 HA GLU 12 HA GLU 12 12.305 7.373 10.221 90 HB2 GLU 12 HB2 GLU 12 9.895 7.034 10.010 91 HB3 GLU 12 HB1 GLU 12 10.128 6.101 8.546 92 HG2 GLU 12 HG2 GLU 12 11.249 4.356 9.812 93 HG3 GLU 12 HG1 GLU 12 11.072 5.308 11.287 94 HA PRO 13 HA PRO 13 15.550 5.083 8.179 95 HB2 PRO 13 HB2 PRO 13 14.947 3.014 10.214 96 HB3 PRO 13 HB1 PRO 13 16.491 3.767 9.816 97 HG2 PRO 13 HG2 PRO 13 15.145 4.399 12.047 98 HG3 PRO 13 HG1 PRO 13 16.088 5.592 11.149 99 HD2 PRO 13 HD2 PRO 13 13.151 5.250 11.325 100 HD3 PRO 13 HD1 PRO 13 14.102 6.720 11.060 101 H TYR 14 HN TYR 14 15.295 3.863 6.402 102 HA TYR 14 HA TYR 14 12.665 2.937 5.931 103 HB2 TYR 14 HB2 TYR 14 13.898 4.095 4.181 104 HB3 TYR 14 HB1 TYR 14 15.068 2.782 4.115 105 HD1 TYR 14 HD1 TYR 14 14.086 0.445 3.702 106 HD2 TYR 14 HD2 TYR 14 12.070 4.035 2.721 107 HE1 TYR 14 HE1 TYR 14 12.703 -0.804 2.136 108 HE2 TYR 14 HE2 TYR 14 10.655 2.807 1.130 109 HH TYR 14 HH TYR 14 10.302 0.824 0.137 110 HA PRO 15 HA PRO 15 14.762 -1.462 5.409 111 HB2 PRO 15 HB2 PRO 15 16.894 -1.230 7.436 112 HB3 PRO 15 HB1 PRO 15 16.920 -2.034 5.868 113 HG2 PRO 15 HG2 PRO 15 18.206 0.276 6.308 114 HG3 PRO 15 HG1 PRO 15 17.500 -0.128 4.748 115 HD2 PRO 15 HD2 PRO 15 16.545 1.776 6.817 116 HD3 PRO 15 HD1 PRO 15 16.361 1.828 5.059 117 H ASP 16 HN ASP 16 14.477 0.532 8.097 118 HA ASP 16 HA ASP 16 13.729 -1.563 9.950 119 HB2 ASP 16 HB2 ASP 16 14.441 1.304 10.172 120 HB3 ASP 16 HB1 ASP 16 13.288 0.703 11.355 121 H PHE 17 HN PHE 17 12.326 1.219 8.291 122 HA PHE 17 HA PHE 17 9.733 1.083 9.302 123 HB2 PHE 17 HB2 PHE 17 9.608 2.863 7.897 124 HB3 PHE 17 HB1 PHE 17 11.071 2.352 7.065 125 HD1 PHE 17 HD1 PHE 17 10.983 1.401 4.925 126 HD2 PHE 17 HD2 PHE 17 7.402 1.922 7.148 127 HE1 PHE 17 HE1 PHE 17 9.671 0.827 2.933 128 HE2 PHE 17 HE2 PHE 17 6.075 1.363 5.155 129 HZ PHE 17 HZ PHE 17 7.209 0.814 3.044 130 H VAL 18 HN VAL 18 11.298 -0.642 6.665 131 HA VAL 18 HA VAL 18 8.939 -2.129 6.056 132 HB VAL 18 HB VAL 18 10.270 -1.728 4.167 133 HG11 VAL 18 HG11 VAL 18 12.604 -2.286 3.990 134 HG12 VAL 18 HG12 VAL 18 12.583 -3.005 5.610 135 HG13 VAL 18 HG13 VAL 18 12.372 -1.262 5.419 136 HG21 VAL 18 HG21 VAL 18 10.672 -4.535 5.156 137 HG22 VAL 18 HG22 VAL 18 11.011 -4.008 3.501 138 HG23 VAL 18 HG23 VAL 18 9.364 -3.930 4.131 139 H ALA 19 HN ALA 19 11.913 -2.737 7.859 140 HA ALA 19 HA ALA 19 11.627 -5.467 8.298 141 HB1 ALA 19 HB1 ALA 19 12.966 -5.185 10.293 142 HB2 ALA 19 HB2 ALA 19 12.632 -3.455 10.308 143 HB3 ALA 19 HB3 ALA 19 13.592 -4.154 9.006 144 H ARG 20 HN ARG 20 9.890 -2.804 9.861 145 HA ARG 20 HA ARG 20 8.626 -4.697 11.662 146 HB2 ARG 20 HB2 ARG 20 7.328 -2.791 12.510 147 HB3 ARG 20 HB1 ARG 20 9.055 -2.497 12.592 148 HG2 ARG 20 HG2 ARG 20 8.989 -0.879 10.949 149 HG3 ARG 20 HG1 ARG 20 7.474 -1.483 10.271 150 HD2 ARG 20 HD2 ARG 20 6.221 -0.647 12.102 151 HD3 ARG 20 HD1 ARG 20 7.673 -0.311 13.028 152 HE ARG 20 HE ARG 20 8.014 1.291 10.915 153 HH11 ARG 20 HH11 ARG 20 5.236 0.763 12.989 154 HH12 ARG 20 HH12 ARG 20 4.643 2.384 12.813 155 HH21 ARG 20 HH21 ARG 20 7.251 3.426 10.714 156 HH22 ARG 20 HH22 ARG 20 5.778 3.887 11.518 157 H LEU 21 HN LEU 21 8.115 -3.030 8.686 158 HA LEU 21 HA LEU 21 5.461 -3.550 8.156 159 HB2 LEU 21 HB2 LEU 21 7.390 -2.447 6.754 160 HB3 LEU 21 HB1 LEU 21 7.576 -4.055 6.056 161 HG LEU 21 HG LEU 21 5.545 -3.922 4.946 162 HD11 LEU 21 HD11 LEU 21 4.798 -1.701 6.835 163 HD12 LEU 21 HD12 LEU 21 4.072 -3.308 6.733 164 HD13 LEU 21 HD13 LEU 21 3.848 -2.153 5.418 165 HD21 LEU 21 HD21 LEU 21 7.141 -2.424 3.969 166 HD22 LEU 21 HD22 LEU 21 6.661 -1.137 5.075 167 HD23 LEU 21 HD23 LEU 21 5.531 -1.712 3.852 168 H GLN 22 HN GLN 22 8.307 -5.534 7.658 169 HA GLN 22 HA GLN 22 6.964 -7.849 6.867 170 HB2 GLN 22 HB2 GLN 22 9.654 -7.777 8.207 171 HB3 GLN 22 HB1 GLN 22 9.009 -8.960 7.060 172 HG2 GLN 22 HG2 GLN 22 8.882 -7.017 5.467 173 HG3 GLN 22 HG1 GLN 22 9.949 -6.181 6.569 174 HE21 GLN 22 HE21 GLN 22 11.451 -6.110 4.817 175 HE22 GLN 22 HE22 GLN 22 12.448 -7.476 4.482 176 H ASP 23 HN ASP 23 8.391 -6.857 9.942 177 HA ASP 23 HA ASP 23 7.995 -9.125 11.415 178 HB2 ASP 23 HB2 ASP 23 9.044 -6.976 12.161 179 HB3 ASP 23 HB1 ASP 23 7.410 -6.380 12.440 180 H VAL 24 HN VAL 24 5.536 -6.562 10.983 181 HA VAL 24 HA VAL 24 3.825 -7.951 12.851 182 HB VAL 24 HB VAL 24 3.842 -5.540 13.002 183 HG11 VAL 24 HG11 VAL 24 3.036 -4.136 11.156 184 HG12 VAL 24 HG12 VAL 24 2.944 -5.573 10.136 185 HG13 VAL 24 HG13 VAL 24 4.504 -5.021 10.744 186 HG21 VAL 24 HG21 VAL 24 1.258 -6.609 11.868 187 HG22 VAL 24 HG22 VAL 24 1.398 -5.029 12.642 188 HG23 VAL 24 HG23 VAL 24 1.714 -6.501 13.568 189 H ALA 25 HN ALA 25 4.178 -7.539 9.427 190 HA ALA 25 HA ALA 25 1.591 -8.723 8.843 191 HB1 ALA 25 HB1 ALA 25 3.913 -8.343 6.993 192 HB2 ALA 25 HB2 ALA 25 2.732 -7.077 7.372 193 HB3 ALA 25 HB3 ALA 25 2.209 -8.566 6.584 194 H GLN 26 HN GLN 26 4.739 -9.653 9.690 195 HA GLN 26 HA GLN 26 4.531 -12.370 8.783 196 HB2 GLN 26 HB2 GLN 26 6.716 -12.118 9.200 197 HB3 GLN 26 HB1 GLN 26 6.396 -10.639 10.090 198 HG2 GLN 26 HG2 GLN 26 7.381 -11.846 11.726 199 HG3 GLN 26 HG1 GLN 26 5.712 -12.347 11.984 200 HE21 GLN 26 HE21 GLN 26 5.704 -13.945 9.543 201 HE22 GLN 26 HE22 GLN 26 6.595 -15.369 9.901 202 H LYS 27 HN LYS 27 3.909 -10.533 11.663 203 HA LYS 27 HA LYS 27 3.170 -12.619 13.394 204 HB2 LYS 27 HB2 LYS 27 2.136 -9.778 13.344 205 HB3 LYS 27 HB1 LYS 27 2.124 -10.873 14.731 206 HG2 LYS 27 HG2 LYS 27 4.561 -9.771 13.352 207 HG3 LYS 27 HG1 LYS 27 3.919 -9.256 14.915 208 HD2 LYS 27 HD2 LYS 27 4.587 -11.211 15.966 209 HD3 LYS 27 HD1 LYS 27 4.650 -12.118 14.457 210 HE2 LYS 27 HE2 LYS 27 6.654 -11.130 13.804 211 HE3 LYS 27 HE1 LYS 27 6.483 -9.812 14.959 212 HZ1 LYS 27 HZ1 LYS 27 7.042 -12.656 15.615 213 HZ2 LYS 27 HZ2 LYS 27 6.838 -11.420 16.753 214 HZ3 LYS 27 HZ3 LYS 27 8.151 -11.381 15.691 215 H SER 28 HN SER 28 1.365 -10.897 10.922 216 HA SER 28 HA SER 28 -1.092 -12.149 11.893 217 HB2 SER 28 HB2 SER 28 -1.083 -9.685 11.763 218 HB3 SER 28 HB1 SER 28 -0.734 -9.790 10.041 219 HG SER 28 HG SER 28 -2.953 -11.209 10.929 220 H ILE 29 HN ILE 29 1.257 -12.320 9.494 221 HA ILE 29 HA ILE 29 -0.578 -13.824 7.742 222 HB ILE 29 HB ILE 29 2.094 -12.592 7.077 223 HG12 ILE 29 HG12 ILE 29 -0.634 -11.900 5.996 224 HG13 ILE 29 HG11 ILE 29 0.208 -11.013 7.268 225 HG21 ILE 29 HG21 ILE 29 0.230 -14.135 5.297 226 HG22 ILE 29 HG22 ILE 29 1.833 -14.636 5.842 227 HG23 ILE 29 HG23 ILE 29 1.662 -13.243 4.770 228 HD11 ILE 29 HD11 ILE 29 0.402 -10.132 4.901 229 HD12 ILE 29 HD12 ILE 29 1.491 -11.505 4.631 230 HD13 ILE 29 HD13 ILE 29 1.871 -10.289 5.868 231 H ALA 30 HN ALA 30 -0.432 -15.948 8.016 232 HA ALA 30 HA ALA 30 1.964 -17.169 9.091 233 HB1 ALA 30 HB1 ALA 30 -0.616 -18.412 8.150 234 HB2 ALA 30 HB2 ALA 30 -0.230 -17.961 9.810 235 HB3 ALA 30 HB3 ALA 30 0.678 -19.243 9.011 236 H ASP 31 HN ASP 31 1.111 -16.065 6.156 237 HA ASP 31 HA ASP 31 2.210 -18.302 4.608 238 HB2 ASP 31 HB2 ASP 31 0.025 -17.106 4.014 239 HB3 ASP 31 HB1 ASP 31 1.048 -15.761 3.534 240 H GLU 32 HN GLU 32 4.183 -18.200 3.720 241 HA GLU 32 HA GLU 32 5.899 -15.991 4.367 242 HB2 GLU 32 HB2 GLU 32 7.609 -17.284 3.137 243 HB3 GLU 32 HB1 GLU 32 6.779 -18.258 4.343 244 HG2 GLU 32 HG2 GLU 32 5.364 -19.211 2.577 245 HG3 GLU 32 HG1 GLU 32 6.246 -18.262 1.382 246 H LYS 33 HN LYS 33 3.886 -16.808 1.682 247 HA LYS 33 HA LYS 33 5.483 -15.312 -0.233 248 HB2 LYS 33 HB2 LYS 33 2.736 -16.544 -0.537 249 HB3 LYS 33 HB1 LYS 33 3.668 -15.813 -1.834 250 HG2 LYS 33 HG2 LYS 33 4.213 -17.967 -2.227 251 HG3 LYS 33 HG1 LYS 33 5.444 -17.625 -1.009 252 HD2 LYS 33 HD2 LYS 33 4.351 -19.728 -0.509 253 HD3 LYS 33 HD1 LYS 33 3.961 -18.530 0.724 254 HE2 LYS 33 HE2 LYS 33 2.007 -19.864 0.057 255 HE3 LYS 33 HE1 LYS 33 1.792 -18.151 -0.270 256 HZ1 LYS 33 HZ1 LYS 33 2.504 -18.671 -2.603 257 HZ2 LYS 33 HZ2 LYS 33 1.002 -19.297 -2.142 258 HZ3 LYS 33 HZ3 LYS 33 2.360 -20.311 -2.212 259 H ALA 34 HN ALA 34 2.251 -15.144 1.189 260 HA ALA 34 HA ALA 34 1.627 -12.564 0.310 261 HB1 ALA 34 HB1 ALA 34 0.709 -13.905 2.851 262 HB2 ALA 34 HB2 ALA 34 -0.016 -14.127 1.260 263 HB3 ALA 34 HB3 ALA 34 -0.073 -12.548 2.043 264 H ARG 35 HN ARG 35 3.758 -13.647 2.835 265 HA ARG 35 HA ARG 35 3.761 -11.169 4.230 266 HB2 ARG 35 HB2 ARG 35 4.602 -13.644 4.946 267 HB3 ARG 35 HB1 ARG 35 6.135 -12.899 4.516 268 HG2 ARG 35 HG2 ARG 35 4.238 -11.546 6.439 269 HG3 ARG 35 HG1 ARG 35 5.372 -12.773 6.977 270 HD2 ARG 35 HD2 ARG 35 6.905 -11.216 7.157 271 HD3 ARG 35 HD1 ARG 35 6.858 -10.987 5.416 272 HE ARG 35 HE ARG 35 6.232 -9.110 7.255 273 HH11 ARG 35 HH11 ARG 35 3.787 -10.469 5.426 274 HH12 ARG 35 HH12 ARG 35 3.426 -9.089 4.459 275 HH21 ARG 35 HH21 ARG 35 5.747 -7.086 6.154 276 HH22 ARG 35 HH22 ARG 35 4.540 -7.106 4.918 277 H LYS 36 HN LYS 36 6.160 -12.730 2.087 278 HA LYS 36 HA LYS 36 7.874 -10.562 1.794 279 HB2 LYS 36 HB2 LYS 36 7.012 -12.392 -0.434 280 HB3 LYS 36 HB1 LYS 36 8.496 -11.451 -0.354 281 HG2 LYS 36 HG2 LYS 36 9.515 -12.910 0.987 282 HG3 LYS 36 HG1 LYS 36 8.015 -13.341 1.839 283 HD2 LYS 36 HD2 LYS 36 8.729 -15.215 0.501 284 HD3 LYS 36 HD1 LYS 36 7.251 -14.496 -0.185 285 HE2 LYS 36 HE2 LYS 36 8.872 -13.111 -1.659 286 HE3 LYS 36 HE1 LYS 36 10.102 -14.267 -1.151 287 HZ1 LYS 36 HZ1 LYS 36 7.575 -15.016 -2.510 288 HZ2 LYS 36 HZ2 LYS 36 8.832 -16.063 -2.088 289 HZ3 LYS 36 HZ3 LYS 36 9.079 -14.880 -3.269 290 H VAL 37 HN VAL 37 5.085 -11.439 -0.218 291 HA VAL 37 HA VAL 37 5.450 -9.425 -2.074 292 HB VAL 37 HB VAL 37 3.211 -9.785 -2.866 293 HG11 VAL 37 HG11 VAL 37 4.517 -12.316 -1.871 294 HG12 VAL 37 HG12 VAL 37 4.756 -11.523 -3.434 295 HG13 VAL 37 HG13 VAL 37 3.204 -12.272 -3.052 296 HG21 VAL 37 HG21 VAL 37 1.928 -9.703 -0.863 297 HG22 VAL 37 HG22 VAL 37 2.727 -11.135 -0.225 298 HG23 VAL 37 HG23 VAL 37 1.648 -11.276 -1.612 299 H ILE 38 HN ILE 38 3.776 -9.301 1.043 300 HA ILE 38 HA ILE 38 2.934 -6.606 0.425 301 HB ILE 38 HB ILE 38 1.823 -8.498 2.123 302 HG12 ILE 38 HG12 ILE 38 1.249 -5.556 2.261 303 HG13 ILE 38 HG11 ILE 38 0.911 -6.468 0.792 304 HG21 ILE 38 HG21 ILE 38 1.894 -7.689 4.335 305 HG22 ILE 38 HG22 ILE 38 2.654 -6.177 3.833 306 HG23 ILE 38 HG23 ILE 38 3.578 -7.678 3.791 307 HD11 ILE 38 HD11 ILE 38 -0.432 -7.977 2.455 308 HD12 ILE 38 HD12 ILE 38 -1.108 -6.469 1.839 309 HD13 ILE 38 HD13 ILE 38 -0.397 -6.514 3.444 310 H VAL 39 HN VAL 39 5.495 -8.113 2.469 311 HA VAL 39 HA VAL 39 6.433 -5.684 3.462 312 HB VAL 39 HB VAL 39 8.513 -6.552 3.905 313 HG11 VAL 39 HG11 VAL 39 6.947 -9.089 3.518 314 HG12 VAL 39 HG12 VAL 39 6.853 -8.014 4.912 315 HG13 VAL 39 HG13 VAL 39 8.353 -8.872 4.559 316 HG21 VAL 39 HG21 VAL 39 9.241 -6.996 1.602 317 HG22 VAL 39 HG22 VAL 39 8.375 -8.534 1.642 318 HG23 VAL 39 HG23 VAL 39 9.735 -8.256 2.732 319 H GLU 40 HN GLU 40 7.358 -7.268 0.453 320 HA GLU 40 HA GLU 40 8.986 -5.290 -0.546 321 HB2 GLU 40 HB2 GLU 40 7.446 -7.503 -1.865 322 HB3 GLU 40 HB1 GLU 40 8.653 -6.549 -2.693 323 HG2 GLU 40 HG2 GLU 40 10.380 -7.384 -1.427 324 HG3 GLU 40 HG1 GLU 40 9.334 -7.892 -0.125 325 H LEU 41 HN LEU 41 5.519 -5.662 -0.759 326 HA LEU 41 HA LEU 41 5.336 -3.629 -2.800 327 HB2 LEU 41 HB2 LEU 41 3.654 -5.673 -1.933 328 HB3 LEU 41 HB1 LEU 41 2.823 -4.183 -1.527 329 HG LEU 41 HG LEU 41 2.047 -4.674 -3.662 330 HD11 LEU 41 HD11 LEU 41 2.733 -2.897 -4.992 331 HD12 LEU 41 HD12 LEU 41 4.382 -2.944 -4.375 332 HD13 LEU 41 HD13 LEU 41 3.073 -2.366 -3.348 333 HD21 LEU 41 HD21 LEU 41 3.546 -6.493 -4.186 334 HD22 LEU 41 HD22 LEU 41 4.878 -5.363 -4.425 335 HD23 LEU 41 HD23 LEU 41 3.503 -5.351 -5.530 336 H MET 42 HN MET 42 4.414 -3.877 0.647 337 HA MET 42 HA MET 42 3.382 -1.223 0.749 338 HB2 MET 42 HB2 MET 42 4.325 -3.010 2.990 339 HB3 MET 42 HB1 MET 42 3.435 -1.498 3.207 340 HG2 MET 42 HG2 MET 42 2.500 -4.046 1.921 341 HG3 MET 42 HG1 MET 42 1.896 -3.277 3.381 342 HE1 MET 42 HE1 MET 42 -1.132 -2.945 0.976 343 HE2 MET 42 HE2 MET 42 -0.551 -3.548 2.533 344 HE3 MET 42 HE3 MET 42 0.006 -4.292 1.031 345 H ALA 43 HN ALA 43 6.484 -2.617 0.933 346 HA ALA 43 HA ALA 43 8.041 -0.700 2.120 347 HB1 ALA 43 HB1 ALA 43 9.004 -2.706 1.313 348 HB2 ALA 43 HB2 ALA 43 9.770 -1.374 0.441 349 HB3 ALA 43 HB3 ALA 43 8.522 -2.348 -0.343 350 H TYR 44 HN TYR 44 6.293 -0.568 -0.900 351 HA TYR 44 HA TYR 44 7.384 2.114 -1.467 352 HB2 TYR 44 HB2 TYR 44 7.507 0.634 -3.382 353 HB3 TYR 44 HB1 TYR 44 5.835 0.160 -3.145 354 HD1 TYR 44 HD1 TYR 44 8.056 2.575 -4.700 355 HD2 TYR 44 HD2 TYR 44 4.005 1.772 -3.709 356 HE1 TYR 44 HE1 TYR 44 7.341 4.233 -6.357 357 HE2 TYR 44 HE2 TYR 44 3.269 3.443 -5.352 358 HH TYR 44 HH TYR 44 5.151 4.606 -7.755 359 H GLU 45 HN GLU 45 4.315 0.402 -1.910 360 HA GLU 45 HA GLU 45 2.629 2.497 -2.041 361 HB2 GLU 45 HB2 GLU 45 2.030 -0.113 -0.681 362 HB3 GLU 45 HB1 GLU 45 0.876 0.938 -1.488 363 HG2 GLU 45 HG2 GLU 45 3.165 -0.451 -2.858 364 HG3 GLU 45 HG1 GLU 45 1.527 -1.078 -2.799 365 H ASN 46 HN ASN 46 4.115 1.293 0.907 366 HA ASN 46 HA ASN 46 2.321 2.989 2.455 367 HB2 ASN 46 HB2 ASN 46 3.827 0.470 3.030 368 HB3 ASN 46 HB1 ASN 46 3.468 1.575 4.346 369 HD21 ASN 46 HD21 ASN 46 1.978 0.308 5.395 370 HD22 ASN 46 HD22 ASN 46 0.443 -0.073 4.729 371 H ALA 47 HN ALA 47 5.563 2.667 1.359 372 HA ALA 47 HA ALA 47 7.003 3.770 3.485 373 HB1 ALA 47 HB1 ALA 47 8.132 2.672 1.660 374 HB2 ALA 47 HB2 ALA 47 8.729 4.328 1.823 375 HB3 ALA 47 HB3 ALA 47 7.592 3.922 0.540 376 H ASN 48 HN ASN 48 8.358 5.815 3.072 377 HA ASN 48 HA ASN 48 6.713 8.077 3.260 378 HB2 ASN 48 HB2 ASN 48 9.615 7.551 3.089 379 HB3 ASN 48 HB1 ASN 48 9.108 9.139 2.521 380 HD21 ASN 48 HD21 ASN 48 10.556 8.054 4.986 381 HD22 ASN 48 HD22 ASN 48 9.729 8.822 6.296 382 HA PRO 49 HA PRO 49 5.368 8.988 -0.815 383 HB2 PRO 49 HB2 PRO 49 6.447 11.706 -0.214 384 HB3 PRO 49 HB1 PRO 49 4.868 11.245 -0.853 385 HG2 PRO 49 HG2 PRO 49 5.218 11.956 1.724 386 HG3 PRO 49 HG1 PRO 49 4.019 10.751 1.226 387 HD2 PRO 49 HD2 PRO 49 6.558 10.376 2.686 388 HD3 PRO 49 HD1 PRO 49 5.134 9.318 2.593 389 H GLU 50 HN GLU 50 8.403 10.540 0.078 390 HA GLU 50 HA GLU 50 9.535 10.613 -2.490 391 HB2 GLU 50 HB2 GLU 50 10.389 12.221 -1.103 392 HB3 GLU 50 HB1 GLU 50 10.406 11.166 0.301 393 HG2 GLU 50 HG2 GLU 50 12.574 11.014 -0.037 394 HG3 GLU 50 HG1 GLU 50 12.173 9.983 -1.387 395 H CYS 51 HN CYS 51 9.580 8.312 0.162 396 HA CYS 51 HA CYS 51 11.974 7.042 -0.695 397 HB2 CYS 51 HB2 CYS 51 9.897 6.286 1.370 398 HB3 CYS 51 HB1 CYS 51 11.382 5.384 1.061 399 HG CYS 51 HG CYS 51 13.092 7.089 2.150 400 H GLN 52 HN GLN 52 8.539 6.496 -0.979 401 HA GLN 52 HA GLN 52 8.848 4.034 -2.415 402 HB2 GLN 52 HB2 GLN 52 6.514 4.194 -2.900 403 HB3 GLN 52 HB1 GLN 52 6.736 4.698 -1.231 404 HG2 GLN 52 HG2 GLN 52 6.661 7.047 -1.992 405 HG3 GLN 52 HG1 GLN 52 6.298 6.475 -3.614 406 HE21 GLN 52 HE21 GLN 52 4.785 4.229 -2.520 407 HE22 GLN 52 HE22 GLN 52 3.272 4.866 -2.033 408 H SER 53 HN SER 53 8.713 7.391 -3.023 409 HA SER 53 HA SER 53 8.675 7.300 -5.842 410 HB2 SER 53 HB2 SER 53 9.387 9.322 -3.774 411 HB3 SER 53 HB1 SER 53 9.674 9.669 -5.484 412 HG SER 53 HG SER 53 7.263 9.296 -4.090 413 H ALA 54 HN ALA 54 11.156 6.895 -3.449 414 HA ALA 54 HA ALA 54 13.282 6.910 -5.392 415 HB1 ALA 54 HB1 ALA 54 14.480 5.655 -3.511 416 HB2 ALA 54 HB2 ALA 54 13.018 5.972 -2.564 417 HB3 ALA 54 HB3 ALA 54 13.968 7.312 -3.205 418 H ILE 55 HN ILE 55 10.886 4.765 -4.352 419 HA ILE 55 HA ILE 55 12.276 2.390 -5.190 420 HB ILE 55 HB ILE 55 9.644 2.884 -3.876 421 HG12 ILE 55 HG12 ILE 55 11.895 1.237 -2.829 422 HG13 ILE 55 HG11 ILE 55 12.028 3.002 -2.807 423 HG21 ILE 55 HG21 ILE 55 9.447 0.439 -3.634 424 HG22 ILE 55 HG22 ILE 55 10.817 0.249 -4.727 425 HG23 ILE 55 HG23 ILE 55 9.319 0.972 -5.309 426 HD11 ILE 55 HD11 ILE 55 11.171 1.964 -0.725 427 HD12 ILE 55 HD12 ILE 55 9.713 1.495 -1.626 428 HD13 ILE 55 HD13 ILE 55 10.131 3.205 -1.432 429 H LYS 56 HN LYS 56 9.613 4.372 -6.489 430 HA LYS 56 HA LYS 56 8.199 2.562 -7.918 431 HB2 LYS 56 HB2 LYS 56 8.622 4.694 -9.777 432 HB3 LYS 56 HB1 LYS 56 7.178 4.254 -8.892 433 HG2 LYS 56 HG2 LYS 56 7.392 6.343 -8.100 434 HG3 LYS 56 HG1 LYS 56 8.521 5.575 -6.978 435 HD2 LYS 56 HD2 LYS 56 10.345 6.325 -8.069 436 HD3 LYS 56 HD1 LYS 56 9.527 6.485 -9.623 437 HE2 LYS 56 HE2 LYS 56 9.559 8.385 -7.275 438 HE3 LYS 56 HE1 LYS 56 9.887 8.697 -8.979 439 HZ1 LYS 56 HZ1 LYS 56 7.551 8.423 -9.482 440 HZ2 LYS 56 HZ2 LYS 56 7.764 9.616 -8.302 441 HZ3 LYS 56 HZ3 LYS 56 7.208 8.083 -7.860 442 HA PRO 57 HA PRO 57 11.454 2.418 -11.608 443 HB2 PRO 57 HB2 PRO 57 14.030 2.466 -10.744 444 HB3 PRO 57 HB1 PRO 57 13.178 3.918 -11.297 445 HG2 PRO 57 HG2 PRO 57 13.474 2.871 -8.492 446 HG3 PRO 57 HG1 PRO 57 13.870 4.498 -9.102 447 HD2 PRO 57 HD2 PRO 57 11.573 4.092 -7.886 448 HD3 PRO 57 HD1 PRO 57 11.569 5.029 -9.389 449 H LEU 58 HN LEU 58 11.971 1.211 -8.354 450 HA LEU 58 HA LEU 58 12.951 -1.373 -9.332 451 HB2 LEU 58 HB2 LEU 58 12.470 -0.893 -6.454 452 HB3 LEU 58 HB1 LEU 58 13.775 -1.789 -7.219 453 HG LEU 58 HG LEU 58 13.548 1.220 -7.031 454 HD11 LEU 58 HD11 LEU 58 15.218 -0.776 -5.513 455 HD12 LEU 58 HD12 LEU 58 13.925 0.233 -4.868 456 HD13 LEU 58 HD13 LEU 58 15.423 0.972 -5.436 457 HD21 LEU 58 HD21 LEU 58 15.875 1.215 -7.816 458 HD22 LEU 58 HD22 LEU 58 14.767 0.554 -9.017 459 HD23 LEU 58 HD23 LEU 58 15.781 -0.529 -8.061 460 H LYS 59 HN LYS 59 10.231 0.305 -8.297 461 HA LYS 59 HA LYS 59 8.717 -1.576 -6.953 462 HB2 LYS 59 HB2 LYS 59 7.961 0.701 -7.190 463 HB3 LYS 59 HB1 LYS 59 7.809 0.503 -8.928 464 HG2 LYS 59 HG2 LYS 59 5.645 0.162 -8.432 465 HG3 LYS 59 HG1 LYS 59 6.214 -1.468 -8.103 466 HD2 LYS 59 HD2 LYS 59 5.850 0.712 -6.081 467 HD3 LYS 59 HD1 LYS 59 4.779 -0.678 -6.301 468 HE2 LYS 59 HE2 LYS 59 7.682 -0.759 -5.469 469 HE3 LYS 59 HE1 LYS 59 6.302 -1.001 -4.413 470 HZ1 LYS 59 HZ1 LYS 59 5.720 -2.968 -5.694 471 HZ2 LYS 59 HZ2 LYS 59 7.277 -3.097 -5.041 472 HZ3 LYS 59 HZ3 LYS 59 7.071 -2.739 -6.675 473 H GLY 60 HN GLY 60 8.434 -3.606 -7.508 474 HA2 GLY 60 HA3 GLY 60 7.267 -5.260 -8.722 475 HA3 GLY 60 HA2 GLY 60 7.252 -4.191 -10.119 476 H LYS 61 HN LYS 61 10.205 -3.643 -9.481 477 HA LYS 61 HA LYS 61 11.201 -5.985 -10.954 478 HB2 LYS 61 HB2 LYS 61 12.880 -3.560 -10.602 479 HB3 LYS 61 HB1 LYS 61 12.665 -4.575 -12.018 480 HG2 LYS 61 HG2 LYS 61 10.661 -2.572 -11.033 481 HG3 LYS 61 HG1 LYS 61 11.830 -2.270 -12.306 482 HD2 LYS 61 HD2 LYS 61 9.717 -4.416 -12.370 483 HD3 LYS 61 HD1 LYS 61 9.585 -2.846 -13.161 484 HE2 LYS 61 HE2 LYS 61 11.549 -3.353 -14.503 485 HE3 LYS 61 HE1 LYS 61 11.696 -4.918 -13.709 486 HZ1 LYS 61 HZ1 LYS 61 9.534 -5.530 -14.600 487 HZ2 LYS 61 HZ2 LYS 61 10.605 -5.128 -15.845 488 HZ3 LYS 61 HZ3 LYS 61 9.405 -4.032 -15.375 489 H VAL 62 HN VAL 62 12.077 -7.432 -9.583 490 HA VAL 62 HA VAL 62 14.051 -6.378 -7.673 491 HB VAL 62 HB VAL 62 12.224 -7.404 -6.440 492 HG11 VAL 62 HG11 VAL 62 12.777 -9.912 -8.014 493 HG12 VAL 62 HG12 VAL 62 11.332 -8.905 -8.121 494 HG13 VAL 62 HG13 VAL 62 11.687 -9.784 -6.631 495 HG21 VAL 62 HG21 VAL 62 13.488 -9.132 -5.192 496 HG22 VAL 62 HG22 VAL 62 14.402 -7.651 -5.476 497 HG23 VAL 62 HG23 VAL 62 14.721 -9.085 -6.453 498 HA PRO 63 HA PRO 63 17.221 -8.647 -9.958 499 HB2 PRO 63 HB2 PRO 63 18.088 -9.208 -7.165 500 HB3 PRO 63 HB1 PRO 63 19.046 -8.687 -8.538 501 HG2 PRO 63 HG2 PRO 63 18.360 -6.959 -6.646 502 HG3 PRO 63 HG1 PRO 63 18.368 -6.478 -8.350 503 HD2 PRO 63 HD2 PRO 63 16.070 -7.040 -6.557 504 HD3 PRO 63 HD1 PRO 63 16.184 -5.932 -7.936 505 H ALA 64 HN ALA 64 17.394 -10.744 -10.544 506 HA ALA 64 HA ALA 64 15.387 -12.541 -9.786 507 HB1 ALA 64 HB1 ALA 64 16.537 -14.157 -11.201 508 HB2 ALA 64 HB2 ALA 64 17.962 -13.119 -11.241 509 HB3 ALA 64 HB3 ALA 64 16.456 -12.578 -11.980 510 H GLY 65 HN GLY 65 15.305 -13.157 -7.692 511 HA2 GLY 65 HA3 GLY 65 15.882 -15.021 -6.279 512 HA3 GLY 65 HA2 GLY 65 17.558 -14.806 -6.758 513 H SER 66 HN SER 66 16.847 -11.754 -6.381 514 HA SER 66 HA SER 66 17.820 -11.751 -3.639 515 HB2 SER 66 HB2 SER 66 17.411 -9.418 -5.519 516 HB3 SER 66 HB1 SER 66 18.320 -9.412 -4.007 517 HG SER 66 HG SER 66 19.386 -11.339 -5.341 518 H ASP 67 HN ASP 67 17.036 -9.818 -2.333 519 HA ASP 67 HA ASP 67 14.166 -10.035 -1.914 520 HB2 ASP 67 HB2 ASP 67 15.979 -10.042 -0.110 521 HB3 ASP 67 HB1 ASP 67 16.217 -8.350 -0.477 522 H VAL 68 HN VAL 68 12.677 -8.280 -2.334 523 HA VAL 68 HA VAL 68 13.844 -6.192 -3.970 524 HB VAL 68 HB VAL 68 11.839 -5.714 -4.782 525 HG11 VAL 68 HG11 VAL 68 10.893 -8.089 -3.208 526 HG12 VAL 68 HG12 VAL 68 11.721 -8.144 -4.761 527 HG13 VAL 68 HG13 VAL 68 10.126 -7.403 -4.640 528 HG21 VAL 68 HG21 VAL 68 11.187 -4.327 -2.977 529 HG22 VAL 68 HG22 VAL 68 10.799 -5.714 -1.961 530 HG23 VAL 68 HG23 VAL 68 9.806 -5.352 -3.377 531 H ILE 69 HN ILE 69 12.779 -6.644 -0.719 532 HA ILE 69 HA ILE 69 12.520 -3.989 0.052 533 HB ILE 69 HB ILE 69 13.353 -6.410 1.619 534 HG12 ILE 69 HG12 ILE 69 11.096 -6.655 1.099 535 HG13 ILE 69 HG11 ILE 69 11.043 -5.874 2.666 536 HG21 ILE 69 HG21 ILE 69 14.356 -4.559 2.754 537 HG22 ILE 69 HG22 ILE 69 12.917 -5.020 3.667 538 HG23 ILE 69 HG23 ILE 69 12.884 -3.601 2.622 539 HD11 ILE 69 HD11 ILE 69 10.699 -3.715 1.570 540 HD12 ILE 69 HD12 ILE 69 9.425 -4.885 1.207 541 HD13 ILE 69 HD13 ILE 69 10.680 -4.538 0.009 542 H SER 70 HN SER 70 15.261 -6.132 0.175 543 HA SER 70 HA SER 70 17.257 -4.575 1.145 544 HB2 SER 70 HB2 SER 70 17.600 -6.889 0.483 545 HB3 SER 70 HB1 SER 70 17.378 -6.481 -1.214 546 HG SER 70 HG SER 70 19.465 -6.230 -1.202 547 H GLU 71 HN GLU 71 15.847 -4.369 -2.085 548 HA GLU 71 HA GLU 71 17.746 -2.390 -2.995 549 HB2 GLU 71 HB2 GLU 71 15.230 -3.234 -4.395 550 HB3 GLU 71 HB1 GLU 71 16.759 -2.713 -5.097 551 HG2 GLU 71 HG2 GLU 71 16.795 -5.148 -3.437 552 HG3 GLU 71 HG1 GLU 71 16.002 -5.255 -5.000 553 H TYR 72 HN TYR 72 14.553 -2.575 -1.729 554 HA TYR 72 HA TYR 72 13.718 0.014 -2.600 555 HB2 TYR 72 HB2 TYR 72 12.610 -2.056 -0.721 556 HB3 TYR 72 HB1 TYR 72 11.874 -0.465 -0.856 557 HD1 TYR 72 HD1 TYR 72 13.345 -1.829 -3.862 558 HD2 TYR 72 HD2 TYR 72 9.802 -1.622 -1.541 559 HE1 TYR 72 HE1 TYR 72 12.039 -2.604 -5.782 560 HE2 TYR 72 HE2 TYR 72 8.487 -2.413 -3.458 561 HH TYR 72 HH TYR 72 10.022 -3.615 -6.335 562 H VAL 73 HN VAL 73 15.024 -1.431 0.302 563 HA VAL 73 HA VAL 73 15.059 0.960 1.839 564 HB VAL 73 HB VAL 73 16.280 -0.097 3.469 565 HG11 VAL 73 HG11 VAL 73 15.538 -2.425 3.691 566 HG12 VAL 73 HG12 VAL 73 14.962 -2.365 2.026 567 HG13 VAL 73 HG13 VAL 73 14.246 -1.315 3.245 568 HG21 VAL 73 HG21 VAL 73 17.425 -2.214 1.698 569 HG22 VAL 73 HG22 VAL 73 17.998 -1.631 3.270 570 HG23 VAL 73 HG23 VAL 73 18.177 -0.625 1.829 571 H LYS 74 HN LYS 74 17.096 -0.588 -0.486 572 HA LYS 74 HA LYS 74 19.386 1.065 -0.317 573 HB2 LYS 74 HB2 LYS 74 18.809 -1.190 -1.617 574 HB3 LYS 74 HB1 LYS 74 18.446 -0.057 -2.905 575 HG2 LYS 74 HG2 LYS 74 20.603 -0.358 -3.426 576 HG3 LYS 74 HG1 LYS 74 20.864 0.853 -2.170 577 HD2 LYS 74 HD2 LYS 74 20.833 -2.115 -1.664 578 HD3 LYS 74 HD1 LYS 74 22.305 -1.194 -1.985 579 HE2 LYS 74 HE2 LYS 74 21.778 0.229 -0.022 580 HE3 LYS 74 HE1 LYS 74 20.393 -0.808 0.315 581 HZ1 LYS 74 HZ1 LYS 74 21.902 -2.674 0.585 582 HZ2 LYS 74 HZ2 LYS 74 22.295 -1.426 1.655 583 HZ3 LYS 74 HZ3 LYS 74 23.230 -1.676 0.270 584 H ALA 75 HN ALA 75 16.307 1.249 -1.915 585 HA ALA 75 HA ALA 75 16.783 3.432 -3.630 586 HB1 ALA 75 HB1 ALA 75 14.828 1.989 -3.818 587 HB2 ALA 75 HB2 ALA 75 14.343 3.675 -3.651 588 HB3 ALA 75 HB3 ALA 75 14.228 2.580 -2.270 589 H CYS 76 HN CYS 76 15.623 3.241 -0.299 590 HA CYS 76 HA CYS 76 15.754 6.155 -0.080 591 HB2 CYS 76 HB2 CYS 76 13.785 5.219 0.823 592 HB3 CYS 76 HB1 CYS 76 14.668 4.011 1.743 593 HG CYS 76 HG CYS 76 15.802 5.968 3.472 594 H ASP 77 HN ASP 77 17.921 3.785 0.081 595 HA ASP 77 HA ASP 77 19.330 4.202 2.455 596 HB2 ASP 77 HB2 ASP 77 19.902 2.321 1.160 597 HB3 ASP 77 HB1 ASP 77 20.174 3.271 -0.294 598 H GLY 78 HN GLY 78 19.095 6.071 -0.437 599 HA2 GLY 78 HA3 GLY 78 21.191 7.896 0.431 600 HA3 GLY 78 HA2 GLY 78 20.272 8.000 -1.062 601 H ILE 79 HN ILE 79 17.705 7.628 0.533 602 HA ILE 79 HA ILE 79 17.049 10.356 0.501 603 HB ILE 79 HB ILE 79 15.603 7.958 1.583 604 HG12 ILE 79 HG12 ILE 79 15.273 9.619 -0.917 605 HG13 ILE 79 HG11 ILE 79 15.995 8.014 -0.831 606 HG21 ILE 79 HG21 ILE 79 13.621 9.193 1.849 607 HG22 ILE 79 HG22 ILE 79 14.311 10.615 1.064 608 HG23 ILE 79 HG23 ILE 79 14.871 10.134 2.671 609 HD11 ILE 79 HD11 ILE 79 13.620 8.144 -1.631 610 HD12 ILE 79 HD12 ILE 79 13.181 8.575 0.018 611 HD13 ILE 79 HD13 ILE 79 13.937 7.016 -0.317 612 H GLY 80 HN GLY 80 16.256 8.503 3.374 613 HA2 GLY 80 HA3 GLY 80 16.096 9.284 5.561 614 HA3 GLY 80 HA2 GLY 80 17.830 9.130 5.369 615 H GLY 81 HN GLY 81 15.448 11.575 4.293 616 HA2 GLY 81 HA3 GLY 81 15.188 13.757 5.036 617 HA3 GLY 81 HA2 GLY 81 16.470 13.479 6.199 618 H ALA 82 HN ALA 82 18.680 13.052 4.893 619 HA ALA 82 HA ALA 82 19.467 15.607 4.137 620 HB1 ALA 82 HB1 ALA 82 20.871 13.034 3.470 621 HB2 ALA 82 HB2 ALA 82 20.953 13.862 5.024 622 HB3 ALA 82 HB3 ALA 82 21.593 14.640 3.576 623 H MET 83 HN MET 83 19.604 12.808 1.903 624 HA MET 83 HA MET 83 19.591 14.553 -0.375 625 HB2 MET 83 HB2 MET 83 19.222 11.554 -0.236 626 HB3 MET 83 HB1 MET 83 19.467 12.478 -1.710 627 HG2 MET 83 HG2 MET 83 21.673 13.168 -0.899 628 HG3 MET 83 HG1 MET 83 21.425 12.210 0.559 629 HE1 MET 83 HE1 MET 83 23.653 10.858 0.205 630 HE2 MET 83 HE2 MET 83 23.998 11.836 -1.223 631 HE3 MET 83 HE3 MET 83 24.098 10.077 -1.311 632 H HIS 84 HN HIS 84 17.235 13.217 1.623 633 HA HIS 84 HA HIS 84 15.025 12.914 -0.063 634 HB2 HIS 84 HB2 HIS 84 14.878 12.164 2.206 635 HB3 HIS 84 HB1 HIS 84 15.292 13.748 2.828 636 HD1 HIS 84 HD1 HIS 84 13.303 14.387 4.131 637 HD2 HIS 84 HD2 HIS 84 12.283 12.914 0.391 638 HE1 HIS 84 HE1 HIS 84 10.837 14.735 3.930 639 HE2 HIS 84 HE2 HIS 84 10.204 13.629 1.754 640 H LYS 85 HN LYS 85 16.492 15.813 1.300 641 HA LYS 85 HA LYS 85 14.253 17.454 0.486 642 HB2 LYS 85 HB2 LYS 85 16.968 18.342 1.469 643 HB3 LYS 85 HB1 LYS 85 15.493 19.298 1.424 644 HG2 LYS 85 HG2 LYS 85 15.959 16.853 3.127 645 HG3 LYS 85 HG1 LYS 85 15.985 18.529 3.687 646 HD2 LYS 85 HD2 LYS 85 13.628 18.756 3.095 647 HD3 LYS 85 HD1 LYS 85 13.613 17.100 2.482 648 HE2 LYS 85 HE2 LYS 85 12.695 17.006 4.665 649 HE3 LYS 85 HE1 LYS 85 14.337 16.361 4.783 650 HZ1 LYS 85 HZ1 LYS 85 15.069 18.532 5.596 651 HZ2 LYS 85 HZ2 LYS 85 13.877 17.873 6.595 652 HZ3 LYS 85 HZ3 LYS 85 13.485 19.115 5.517 653 H ALA 86 HN ALA 86 17.057 16.217 -0.928 654 HA ALA 86 HA ALA 86 17.252 18.211 -3.016 655 HB1 ALA 86 HB1 ALA 86 18.636 15.560 -2.693 656 HB2 ALA 86 HB2 ALA 86 19.282 17.133 -2.221 657 HB3 ALA 86 HB3 ALA 86 19.005 16.769 -3.925 658 H MET 87 HN MET 87 16.240 14.902 -2.620 659 HA MET 87 HA MET 87 15.536 14.619 -5.410 660 HB2 MET 87 HB2 MET 87 15.413 12.720 -3.064 661 HB3 MET 87 HB1 MET 87 15.117 12.277 -4.749 662 HG2 MET 87 HG2 MET 87 17.650 13.662 -4.083 663 HG3 MET 87 HG1 MET 87 17.485 11.980 -3.625 664 HE1 MET 87 HE1 MET 87 19.733 13.119 -5.583 665 HE2 MET 87 HE2 MET 87 19.746 11.889 -6.846 666 HE3 MET 87 HE3 MET 87 19.616 11.413 -5.154 667 H LEU 88 HN LEU 88 13.979 15.578 -2.579 668 HA LEU 88 HA LEU 88 11.473 14.555 -2.620 669 HB2 LEU 88 HB2 LEU 88 12.644 16.356 -1.172 670 HB3 LEU 88 HB1 LEU 88 11.898 17.490 -2.274 671 HG LEU 88 HG LEU 88 9.841 17.219 -1.366 672 HD11 LEU 88 HD11 LEU 88 10.543 14.351 -0.718 673 HD12 LEU 88 HD12 LEU 88 9.574 14.892 -2.090 674 HD13 LEU 88 HD13 LEU 88 8.976 15.115 -0.447 675 HD21 LEU 88 HD21 LEU 88 11.658 16.105 0.734 676 HD22 LEU 88 HD22 LEU 88 10.021 16.696 1.039 677 HD23 LEU 88 HD23 LEU 88 11.271 17.804 0.466 678 H MET 89 HN MET 89 12.734 17.129 -4.707 679 HA MET 89 HA MET 89 10.163 17.573 -5.954 680 HB2 MET 89 HB2 MET 89 11.754 19.426 -5.609 681 HB3 MET 89 HB1 MET 89 12.900 18.636 -6.681 682 HG2 MET 89 HG2 MET 89 11.305 18.856 -8.529 683 HG3 MET 89 HG1 MET 89 10.182 19.680 -7.449 684 HE1 MET 89 HE1 MET 89 13.645 19.833 -9.263 685 HE2 MET 89 HE2 MET 89 14.121 20.049 -7.579 686 HE3 MET 89 HE3 MET 89 14.280 21.385 -8.718 687 H ALA 90 HN ALA 90 12.804 15.464 -6.406 688 HA ALA 90 HA ALA 90 12.396 15.199 -9.286 689 HB1 ALA 90 HB1 ALA 90 14.688 15.292 -8.327 690 HB2 ALA 90 HB2 ALA 90 14.381 13.822 -9.253 691 HB3 ALA 90 HB3 ALA 90 14.361 13.771 -7.487 692 H GLN 91 HN GLN 91 12.350 13.142 -6.399 693 HA GLN 91 HA GLN 91 11.310 10.935 -7.979 694 HB2 GLN 91 HB2 GLN 91 12.005 11.120 -5.061 695 HB3 GLN 91 HB1 GLN 91 11.570 9.649 -5.916 696 HG2 GLN 91 HG2 GLN 91 13.550 9.793 -7.263 697 HG3 GLN 91 HG1 GLN 91 13.967 11.347 -6.540 698 HE21 GLN 91 HE21 GLN 91 13.108 10.688 -3.937 699 HE22 GLN 91 HE22 GLN 91 14.214 9.532 -3.307 700 H LEU 92 HN LEU 92 10.398 12.506 -4.901 701 HA LEU 92 HA LEU 92 7.841 11.523 -4.664 702 HB2 LEU 92 HB2 LEU 92 9.065 12.891 -2.999 703 HB3 LEU 92 HB1 LEU 92 8.695 14.310 -3.956 704 HG LEU 92 HG LEU 92 7.229 13.534 -1.873 705 HD11 LEU 92 HD11 LEU 92 6.164 14.791 -4.389 706 HD12 LEU 92 HD12 LEU 92 6.939 15.624 -3.043 707 HD13 LEU 92 HD13 LEU 92 5.373 14.848 -2.815 708 HD21 LEU 92 HD21 LEU 92 5.178 12.446 -2.618 709 HD22 LEU 92 HD22 LEU 92 6.582 11.399 -2.826 710 HD23 LEU 92 HD23 LEU 92 5.881 12.224 -4.220 711 H GLU 93 HN GLU 93 9.158 14.008 -6.660 712 HA GLU 93 HA GLU 93 8.107 15.767 -7.808 713 HB2 GLU 93 HB2 GLU 93 7.441 14.697 -10.032 714 HB3 GLU 93 HB1 GLU 93 9.086 14.454 -9.450 715 HG2 GLU 93 HG2 GLU 93 8.722 12.229 -8.960 716 HG3 GLU 93 HG1 GLU 93 6.974 12.412 -8.865 717 H2 PRO 1 HT1 PRO 1 5.295 -3.852 -13.798 718 H3 PRO 1 HT2 PRO 1 5.627 -2.313 -14.248 719 HA PRO 1 HA PRO 1 6.453 -2.316 -12.238 720 HB2 PRO 1 HB2 PRO 1 4.439 -1.355 -10.778 721 HB3 PRO 1 HB1 PRO 1 5.068 -0.446 -12.157 722 HG2 PRO 1 HG2 PRO 1 2.535 -1.919 -11.886 723 HG3 PRO 1 HG1 PRO 1 2.973 -0.631 -13.026 724 HD2 PRO 1 HD2 PRO 1 2.974 -3.513 -13.424 725 HD3 PRO 1 HD1 PRO 1 3.231 -2.227 -14.622 726 H SER 2 HN SER 2 4.793 -2.564 -9.772 727 HA SER 2 HA SER 2 4.617 -5.360 -9.325 728 HB2 SER 2 HB2 SER 2 3.250 -3.049 -7.949 729 HB3 SER 2 HB1 SER 2 3.201 -4.706 -7.381 730 HG SER 2 HG SER 2 5.483 -4.652 -7.225 731 H PHE 3 HN PHE 3 2.279 -6.144 -8.566 732 HA PHE 3 HA PHE 3 0.573 -5.900 -10.848 733 HB2 PHE 3 HB2 PHE 3 -0.962 -7.006 -8.870 734 HB3 PHE 3 HB1 PHE 3 0.033 -7.910 -10.014 735 HD1 PHE 3 HD1 PHE 3 -0.506 -6.863 -6.602 736 HD2 PHE 3 HD2 PHE 3 2.240 -8.777 -9.251 737 HE1 PHE 3 HE1 PHE 3 0.647 -7.869 -4.719 738 HE2 PHE 3 HE2 PHE 3 3.422 -9.750 -7.330 739 HZ PHE 3 HZ PHE 3 2.624 -9.296 -5.046 740 H ASN 4 HN ASN 4 0.425 -4.875 -7.477 741 HA ASN 4 HA ASN 4 -2.263 -3.888 -7.867 742 HB2 ASN 4 HB2 ASN 4 -2.222 -3.557 -5.441 743 HB3 ASN 4 HB1 ASN 4 -1.743 -5.193 -5.884 744 HD21 ASN 4 HD21 ASN 4 -0.499 -2.023 -4.967 745 HD22 ASN 4 HD22 ASN 4 0.978 -2.611 -4.280 746 H THR 5 HN THR 5 0.541 -2.468 -8.580 747 HA THR 5 HA THR 5 0.556 -0.120 -6.995 748 HB THR 5 HB THR 5 1.823 0.780 -9.084 749 HG1 THR 5 HG1 THR 5 1.398 -0.649 -10.665 750 HG21 THR 5 HG21 THR 5 3.791 -0.732 -8.435 751 HG22 THR 5 HG22 THR 5 2.672 -1.422 -7.256 752 HG23 THR 5 HG23 THR 5 3.073 0.292 -7.194 753 H VAL 6 HN VAL 6 -1.709 -1.138 -9.237 754 HA VAL 6 HA VAL 6 -2.363 1.397 -10.353 755 HB VAL 6 HB VAL 6 -4.216 0.365 -11.345 756 HG11 VAL 6 HG11 VAL 6 -3.413 -1.745 -12.263 757 HG12 VAL 6 HG12 VAL 6 -2.193 -1.833 -10.993 758 HG13 VAL 6 HG13 VAL 6 -2.127 -0.541 -12.193 759 HG21 VAL 6 HG21 VAL 6 -5.342 -1.604 -10.585 760 HG22 VAL 6 HG22 VAL 6 -5.158 -0.513 -9.203 761 HG23 VAL 6 HG23 VAL 6 -4.088 -1.909 -9.375 762 H ARG 7 HN ARG 7 -3.673 2.969 -9.467 763 HA ARG 7 HA ARG 7 -5.420 2.175 -7.346 764 HB2 ARG 7 HB2 ARG 7 -4.439 3.890 -5.759 765 HB3 ARG 7 HB1 ARG 7 -3.705 2.325 -5.953 766 HG2 ARG 7 HG2 ARG 7 -2.380 3.993 -7.743 767 HG3 ARG 7 HG1 ARG 7 -2.535 4.883 -6.222 768 HD2 ARG 7 HD2 ARG 7 -1.729 2.826 -5.051 769 HD3 ARG 7 HD1 ARG 7 -1.347 2.133 -6.617 770 HE ARG 7 HE ARG 7 0.294 3.780 -5.119 771 HH11 ARG 7 HH11 ARG 7 -0.820 3.741 -8.452 772 HH12 ARG 7 HH12 ARG 7 0.542 4.633 -9.040 773 HH21 ARG 7 HH21 ARG 7 2.080 4.917 -5.908 774 HH22 ARG 7 HH22 ARG 7 2.196 5.291 -7.595 775 H GLN 8 HN GLN 8 -6.699 3.745 -6.453 776 HA GLN 8 HA GLN 8 -8.308 5.080 -8.118 777 HB2 GLN 8 HB2 GLN 8 -7.974 4.806 -5.334 778 HB3 GLN 8 HB1 GLN 8 -8.219 6.523 -5.629 779 HG2 GLN 8 HG2 GLN 8 -10.268 6.026 -6.848 780 HG3 GLN 8 HG1 GLN 8 -10.022 4.303 -6.568 781 HE21 GLN 8 HE21 GLN 8 -12.238 5.989 -5.792 782 HE22 GLN 8 HE22 GLN 8 -12.336 5.901 -4.054 783 H GLY 9 HN GLY 9 -7.904 6.587 -9.555 784 HA2 GLY 9 HA3 GLY 9 -6.038 8.749 -9.048 785 HA3 GLY 9 HA2 GLY 9 -6.984 8.494 -10.505 786 H SER 10 HN SER 10 -7.714 10.633 -10.625 787 HA SER 10 HA SER 10 -8.757 12.146 -8.535 788 HB2 SER 10 HB2 SER 10 -9.592 12.230 -11.444 789 HB3 SER 10 HB1 SER 10 -9.783 13.528 -10.266 790 HG SER 10 HG SER 10 -7.242 12.807 -10.221 791 H LYS 11 HN LYS 11 -10.166 11.213 -7.187 792 HA LYS 11 HA LYS 11 -11.855 9.920 -6.381 793 HB2 LYS 11 HB2 LYS 11 -14.025 10.842 -6.751 794 HB3 LYS 11 HB1 LYS 11 -12.886 12.161 -6.680 795 HG2 LYS 11 HG2 LYS 11 -12.970 12.434 -9.031 796 HG3 LYS 11 HG1 LYS 11 -13.923 10.974 -9.241 797 HD2 LYS 11 HD2 LYS 11 -15.737 12.054 -7.929 798 HD3 LYS 11 HD1 LYS 11 -14.779 13.536 -7.902 799 HE2 LYS 11 HE2 LYS 11 -14.823 13.621 -10.338 800 HE3 LYS 11 HE1 LYS 11 -15.743 12.120 -10.383 801 HZ1 LYS 11 HZ1 LYS 11 -16.661 14.672 -9.178 802 HZ2 LYS 11 HZ2 LYS 11 -17.547 13.232 -9.225 803 HZ3 LYS 11 HZ3 LYS 11 -17.171 14.040 -10.662 804 H GLU 12 HN GLU 12 -10.578 8.510 -8.380 805 HA GLU 12 HA GLU 12 -12.149 7.434 -10.409 806 HB2 GLU 12 HB2 GLU 12 -9.738 7.084 -10.206 807 HB3 GLU 12 HB1 GLU 12 -9.971 6.155 -8.739 808 HG2 GLU 12 HG2 GLU 12 -11.093 4.408 -9.997 809 HG3 GLU 12 HG1 GLU 12 -10.925 5.357 -11.474 810 HA PRO 13 HA PRO 13 -15.397 5.163 -8.348 811 HB2 PRO 13 HB2 PRO 13 -14.816 3.089 -10.383 812 HB3 PRO 13 HB1 PRO 13 -16.353 3.849 -9.977 813 HG2 PRO 13 HG2 PRO 13 -15.018 4.472 -12.216 814 HG3 PRO 13 HG1 PRO 13 -15.952 5.672 -11.313 815 HD2 PRO 13 HD2 PRO 13 -13.016 5.315 -11.507 816 HD3 PRO 13 HD1 PRO 13 -13.958 6.788 -11.236 817 H TYR 14 HN TYR 14 -15.131 3.958 -6.565 818 HA TYR 14 HA TYR 14 -12.511 3.008 -6.108 819 HB2 TYR 14 HB2 TYR 14 -13.728 4.180 -4.353 820 HB3 TYR 14 HB1 TYR 14 -14.905 2.873 -4.281 821 HD1 TYR 14 HD1 TYR 14 -13.937 0.531 -3.867 822 HD2 TYR 14 HD2 TYR 14 -11.894 4.111 -2.902 823 HE1 TYR 14 HE1 TYR 14 -12.556 -0.724 -2.303 824 HE2 TYR 14 HE2 TYR 14 -10.482 2.879 -1.313 825 HH TYR 14 HH TYR 14 -10.139 0.896 -0.318 826 HA PRO 15 HA PRO 15 -14.633 -1.375 -5.563 827 HB2 PRO 15 HB2 PRO 15 -16.769 -1.136 -7.583 828 HB3 PRO 15 HB1 PRO 15 -16.795 -1.937 -6.015 829 HG2 PRO 15 HG2 PRO 15 -18.068 0.381 -6.455 830 HG3 PRO 15 HG1 PRO 15 -17.364 -0.028 -4.896 831 HD2 PRO 15 HD2 PRO 15 -16.402 1.875 -6.962 832 HD3 PRO 15 HD1 PRO 15 -16.214 1.923 -5.204 833 H ASP 16 HN ASP 16 -14.347 0.613 -8.256 834 HA ASP 16 HA ASP 16 -13.618 -1.491 -10.107 835 HB2 ASP 16 HB2 ASP 16 -14.326 1.373 -10.338 836 HB3 ASP 16 HB1 ASP 16 -13.166 0.773 -11.516 837 H PHE 17 HN PHE 17 -12.190 1.278 -8.458 838 HA PHE 17 HA PHE 17 -9.601 1.126 -9.486 839 HB2 PHE 17 HB2 PHE 17 -9.458 2.911 -8.087 840 HB3 PHE 17 HB1 PHE 17 -10.925 2.414 -7.250 841 HD1 PHE 17 HD1 PHE 17 -10.836 1.466 -5.103 842 HD2 PHE 17 HD2 PHE 17 -7.262 1.961 -7.343 843 HE1 PHE 17 HE1 PHE 17 -9.518 0.890 -3.116 844 HE2 PHE 17 HE2 PHE 17 -5.930 1.401 -5.355 845 HZ PHE 17 HZ PHE 17 -7.057 0.864 -3.238 846 H VAL 18 HN VAL 18 -11.167 -0.580 -6.840 847 HA VAL 18 HA VAL 18 -8.814 -2.080 -6.236 848 HB VAL 18 HB VAL 18 -10.134 -1.666 -4.343 849 HG11 VAL 18 HG11 VAL 18 -12.471 -2.208 -4.153 850 HG12 VAL 18 HG12 VAL 18 -12.464 -2.933 -5.770 851 HG13 VAL 18 HG13 VAL 18 -12.240 -1.190 -5.586 852 HG21 VAL 18 HG21 VAL 18 -10.562 -4.473 -5.321 853 HG22 VAL 18 HG22 VAL 18 -10.885 -3.940 -3.666 854 HG23 VAL 18 HG23 VAL 18 -9.241 -3.874 -4.309 855 H ALA 19 HN ALA 19 -11.798 -2.675 -8.024 856 HA ALA 19 HA ALA 19 -11.530 -5.407 -8.459 857 HB1 ALA 19 HB1 ALA 19 -12.874 -5.123 -10.452 858 HB2 ALA 19 HB2 ALA 19 -12.535 -3.393 -10.470 859 HB3 ALA 19 HB3 ALA 19 -13.493 -4.090 -9.164 860 H ARG 20 HN ARG 20 -9.781 -2.758 -10.034 861 HA ARG 20 HA ARG 20 -8.539 -4.663 -11.834 862 HB2 ARG 20 HB2 ARG 20 -7.233 -2.766 -12.694 863 HB3 ARG 20 HB1 ARG 20 -8.959 -2.465 -12.771 864 HG2 ARG 20 HG2 ARG 20 -8.882 -0.842 -11.136 865 HG3 ARG 20 HG1 ARG 20 -7.368 -1.451 -10.459 866 HD2 ARG 20 HD2 ARG 20 -6.115 -0.629 -12.298 867 HD3 ARG 20 HD1 ARG 20 -7.567 -0.287 -13.219 868 HE ARG 20 HE ARG 20 -7.889 1.320 -11.110 869 HH11 ARG 20 HH11 ARG 20 -5.119 0.769 -13.188 870 HH12 ARG 20 HH12 ARG 20 -4.523 2.388 -13.027 871 HH21 ARG 20 HH21 ARG 20 -7.119 3.447 -10.917 872 HH22 ARG 20 HH22 ARG 20 -5.650 3.902 -11.729 873 H LEU 21 HN LEU 21 -8.006 -2.991 -8.867 874 HA LEU 21 HA LEU 21 -5.353 -3.524 -8.347 875 HB2 LEU 21 HB2 LEU 21 -7.269 -2.407 -6.939 876 HB3 LEU 21 HB1 LEU 21 -7.461 -4.012 -6.237 877 HG LEU 21 HG LEU 21 -5.424 -3.885 -5.132 878 HD11 LEU 21 HD11 LEU 21 -4.673 -1.674 -7.031 879 HD12 LEU 21 HD12 LEU 21 -3.955 -3.284 -6.929 880 HD13 LEU 21 HD13 LEU 21 -3.719 -2.127 -5.616 881 HD21 LEU 21 HD21 LEU 21 -7.010 -2.377 -4.156 882 HD22 LEU 21 HD22 LEU 21 -6.526 -1.096 -5.268 883 HD23 LEU 21 HD23 LEU 21 -5.395 -1.673 -4.046 884 H GLN 22 HN GLN 22 -8.207 -5.491 -7.831 885 HA GLN 22 HA GLN 22 -6.874 -7.811 -7.037 886 HB2 GLN 22 HB2 GLN 22 -9.571 -7.727 -8.368 887 HB3 GLN 22 HB1 GLN 22 -8.927 -8.911 -7.221 888 HG2 GLN 22 HG2 GLN 22 -8.781 -6.964 -5.634 889 HG3 GLN 22 HG1 GLN 22 -9.846 -6.124 -6.733 890 HE21 GLN 22 HE21 GLN 22 -11.345 -6.035 -4.974 891 HE22 GLN 22 HE22 GLN 22 -12.347 -7.398 -4.629 892 H ASP 23 HN ASP 23 -8.307 -6.819 -10.106 893 HA ASP 23 HA ASP 23 -7.925 -9.087 -11.578 894 HB2 ASP 23 HB2 ASP 23 -8.965 -6.938 -12.326 895 HB3 ASP 23 HB1 ASP 23 -7.329 -6.350 -12.615 896 H VAL 24 HN VAL 24 -5.451 -6.541 -11.162 897 HA VAL 24 HA VAL 24 -3.758 -7.944 -13.034 898 HB VAL 24 HB VAL 24 -3.764 -5.535 -13.194 899 HG11 VAL 24 HG11 VAL 24 -2.940 -4.129 -11.357 900 HG12 VAL 24 HG12 VAL 24 -2.855 -5.562 -10.332 901 HG13 VAL 24 HG13 VAL 24 -4.413 -5.001 -10.936 902 HG21 VAL 24 HG21 VAL 24 -1.181 -6.615 -12.071 903 HG22 VAL 24 HG22 VAL 24 -1.316 -5.033 -12.843 904 HG23 VAL 24 HG23 VAL 24 -1.645 -6.502 -13.769 905 H ALA 25 HN ALA 25 -4.092 -7.522 -9.612 906 HA ALA 25 HA ALA 25 -1.511 -8.720 -9.036 907 HB1 ALA 25 HB1 ALA 25 -3.826 -8.319 -7.180 908 HB2 ALA 25 HB2 ALA 25 -2.638 -7.061 -7.565 909 HB3 ALA 25 HB3 ALA 25 -2.123 -8.550 -6.772 910 H GLN 26 HN GLN 26 -4.667 -9.638 -9.867 911 HA GLN 26 HA GLN 26 -4.468 -12.353 -8.955 912 HB2 GLN 26 HB2 GLN 26 -6.654 -12.087 -9.359 913 HB3 GLN 26 HB1 GLN 26 -6.330 -10.614 -10.257 914 HG2 GLN 26 HG2 GLN 26 -7.333 -11.819 -11.883 915 HG3 GLN 26 HG1 GLN 26 -5.669 -12.334 -12.150 916 HE21 GLN 26 HE21 GLN 26 -5.650 -13.924 -9.706 917 HE22 GLN 26 HE22 GLN 26 -6.548 -15.346 -10.056 918 H LYS 27 HN LYS 27 -3.847 -10.524 -11.838 919 HA LYS 27 HA LYS 27 -3.126 -12.619 -13.571 920 HB2 LYS 27 HB2 LYS 27 -2.083 -9.780 -13.536 921 HB3 LYS 27 HB1 LYS 27 -2.082 -10.882 -14.919 922 HG2 LYS 27 HG2 LYS 27 -4.508 -9.765 -13.531 923 HG3 LYS 27 HG1 LYS 27 -3.871 -9.255 -15.098 924 HD2 LYS 27 HD2 LYS 27 -4.555 -11.208 -16.144 925 HD3 LYS 27 HD1 LYS 27 -4.615 -12.115 -14.634 926 HE2 LYS 27 HE2 LYS 27 -6.610 -11.118 -13.971 927 HE3 LYS 27 HE1 LYS 27 -6.437 -9.798 -15.123 928 HZ1 LYS 27 HZ1 LYS 27 -7.018 -12.634 -15.787 929 HZ2 LYS 27 HZ2 LYS 27 -6.811 -11.398 -16.919 930 HZ3 LYS 27 HZ3 LYS 27 -8.119 -11.352 -15.852 931 H SER 28 HN SER 28 -1.313 -10.902 -11.106 932 HA SER 28 HA SER 28 1.138 -12.162 -12.081 933 HB2 SER 28 HB2 SER 28 1.150 -9.702 -11.960 934 HB3 SER 28 HB1 SER 28 0.796 -9.798 -10.238 935 HG SER 28 HG SER 28 3.017 -11.206 -11.186 936 H ILE 29 HN ILE 29 -1.202 -12.328 -9.679 937 HA ILE 29 HA ILE 29 0.634 -13.830 -7.930 938 HB ILE 29 HB ILE 29 -2.027 -12.583 -7.258 939 HG12 ILE 29 HG12 ILE 29 0.708 -11.900 -6.190 940 HG13 ILE 29 HG11 ILE 29 -0.135 -11.014 -7.460 941 HG21 ILE 29 HG21 ILE 29 -0.164 -14.133 -5.484 942 HG22 ILE 29 HG22 ILE 29 -1.775 -14.622 -6.017 943 HG23 ILE 29 HG23 ILE 29 -1.586 -13.229 -4.950 944 HD11 ILE 29 HD11 ILE 29 -0.314 -10.125 -5.093 945 HD12 ILE 29 HD12 ILE 29 -1.413 -11.490 -4.818 946 HD13 ILE 29 HD13 ILE 29 -1.786 -10.274 -6.056 947 H ALA 30 HN ALA 30 0.483 -15.957 -8.224 948 HA ALA 30 HA ALA 30 -1.928 -17.169 -9.263 949 HB1 ALA 30 HB1 ALA 30 0.649 -18.418 -8.330 950 HB2 ALA 30 HB2 ALA 30 0.259 -17.972 -9.990 951 HB3 ALA 30 HB3 ALA 30 -0.650 -19.250 -9.182 952 H ASP 31 HN ASP 31 -1.075 -16.054 -6.340 953 HA ASP 31 HA ASP 31 -2.161 -18.278 -4.771 954 HB2 ASP 31 HB2 ASP 31 0.030 -17.084 -4.198 955 HB3 ASP 31 HB1 ASP 31 -0.989 -15.735 -3.716 956 H GLU 32 HN GLU 32 -4.135 -18.170 -3.885 957 HA GLU 32 HA GLU 32 -5.844 -15.952 -4.522 958 HB2 GLU 32 HB2 GLU 32 -7.555 -17.233 -3.276 959 HB3 GLU 32 HB1 GLU 32 -6.737 -18.213 -4.486 960 HG2 GLU 32 HG2 GLU 32 -5.319 -19.178 -2.732 961 HG3 GLU 32 HG1 GLU 32 -6.175 -18.213 -1.530 962 H LYS 33 HN LYS 33 -3.820 -16.775 -1.844 963 HA LYS 33 HA LYS 33 -5.400 -15.267 0.074 964 HB2 LYS 33 HB2 LYS 33 -2.659 -16.512 0.364 965 HB3 LYS 33 HB1 LYS 33 -3.578 -15.773 1.664 966 HG2 LYS 33 HG2 LYS 33 -4.137 -17.920 2.066 967 HG3 LYS 33 HG1 LYS 33 -5.368 -17.575 0.851 968 HD2 LYS 33 HD2 LYS 33 -4.291 -19.689 0.359 969 HD3 LYS 33 HD1 LYS 33 -3.896 -18.499 -0.882 970 HE2 LYS 33 HE2 LYS 33 -1.949 -19.848 -0.206 971 HE3 LYS 33 HE1 LYS 33 -1.722 -18.130 0.097 972 HZ1 LYS 33 HZ1 LYS 33 -2.438 -18.615 2.440 973 HZ2 LYS 33 HZ2 LYS 33 -0.937 -19.251 1.988 974 HZ3 LYS 33 HZ3 LYS 33 -2.296 -20.261 2.070 975 H ALA 34 HN ALA 34 -2.173 -15.118 -1.358 976 HA ALA 34 HA ALA 34 -1.533 -12.539 -0.491 977 HB1 ALA 34 HB1 ALA 34 -0.632 -13.890 -3.033 978 HB2 ALA 34 HB2 ALA 34 0.099 -14.112 -1.444 979 HB3 ALA 34 HB3 ALA 34 0.159 -12.535 -2.232 980 H ARG 35 HN ARG 35 -3.683 -13.614 -3.003 981 HA ARG 35 HA ARG 35 -3.676 -11.139 -4.404 982 HB2 ARG 35 HB2 ARG 35 -4.532 -13.610 -5.113 983 HB3 ARG 35 HB1 ARG 35 -6.061 -12.854 -4.680 984 HG2 ARG 35 HG2 ARG 35 -4.159 -11.513 -6.608 985 HG3 ARG 35 HG1 ARG 35 -5.299 -12.736 -7.142 986 HD2 ARG 35 HD2 ARG 35 -6.825 -11.177 -7.322 987 HD3 ARG 35 HD1 ARG 35 -6.777 -10.946 -5.581 988 HE ARG 35 HE ARG 35 -6.151 -9.073 -7.424 989 HH11 ARG 35 HH11 ARG 35 -3.706 -10.441 -5.603 990 HH12 ARG 35 HH12 ARG 35 -3.330 -9.061 -4.644 991 HH21 ARG 35 HH21 ARG 35 -5.647 -7.050 -6.333 992 HH22 ARG 35 HH22 ARG 35 -4.437 -7.071 -5.102 993 H LYS 36 HN LYS 36 -6.073 -12.686 -2.247 994 HA LYS 36 HA LYS 36 -7.777 -10.508 -1.956 995 HB2 LYS 36 HB2 LYS 36 -6.916 -12.339 0.270 996 HB3 LYS 36 HB1 LYS 36 -8.394 -11.386 0.197 997 HG2 LYS 36 HG2 LYS 36 -9.432 -12.842 -1.137 998 HG3 LYS 36 HG1 LYS 36 -7.938 -13.285 -1.995 999 HD2 LYS 36 HD2 LYS 36 -8.657 -15.152 -0.649 1000 HD3 LYS 36 HD1 LYS 36 -7.172 -14.439 0.029 1001 HE2 LYS 36 HE2 LYS 36 -8.776 -13.043 1.509 1002 HE3 LYS 36 HE1 LYS 36 -10.016 -14.194 1.009 1003 HZ1 LYS 36 HZ1 LYS 36 -7.485 -14.953 2.359 1004 HZ2 LYS 36 HZ2 LYS 36 -8.747 -15.996 1.937 1005 HZ3 LYS 36 HZ3 LYS 36 -8.986 -14.816 3.120 1006 H VAL 37 HN VAL 37 -4.988 -11.394 0.050 1007 HA VAL 37 HA VAL 37 -5.334 -9.371 1.897 1008 HB VAL 37 HB VAL 37 -3.096 -9.743 2.683 1009 HG11 VAL 37 HG11 VAL 37 -4.415 -12.270 1.701 1010 HG12 VAL 37 HG12 VAL 37 -4.643 -11.471 3.261 1011 HG13 VAL 37 HG13 VAL 37 -3.096 -12.229 2.874 1012 HG21 VAL 37 HG21 VAL 37 -1.814 -9.671 0.677 1013 HG22 VAL 37 HG22 VAL 37 -2.622 -11.103 0.042 1014 HG23 VAL 37 HG23 VAL 37 -1.539 -11.244 1.428 1015 H ILE 38 HN ILE 38 -3.671 -9.263 -1.227 1016 HA ILE 38 HA ILE 38 -2.811 -6.573 -0.618 1017 HB ILE 38 HB ILE 38 -1.719 -8.475 -2.315 1018 HG12 ILE 38 HG12 ILE 38 -1.125 -5.539 -2.463 1019 HG13 ILE 38 HG11 ILE 38 -0.787 -6.447 -0.992 1020 HG21 ILE 38 HG21 ILE 38 -1.795 -7.670 -4.528 1021 HG22 ILE 38 HG22 ILE 38 -2.543 -6.152 -4.026 1022 HG23 ILE 38 HG23 ILE 38 -3.476 -7.647 -3.977 1023 HD11 ILE 38 HD11 ILE 38 0.542 -7.968 -2.656 1024 HD12 ILE 38 HD12 ILE 38 1.227 -6.462 -2.046 1025 HD13 ILE 38 HD13 ILE 38 0.511 -6.507 -3.649 1026 H VAL 39 HN VAL 39 -5.388 -8.069 -2.646 1027 HA VAL 39 HA VAL 39 -6.314 -5.638 -3.643 1028 HB VAL 39 HB VAL 39 -8.401 -6.496 -4.074 1029 HG11 VAL 39 HG11 VAL 39 -6.846 -9.040 -3.690 1030 HG12 VAL 39 HG12 VAL 39 -6.757 -7.969 -5.086 1031 HG13 VAL 39 HG13 VAL 39 -8.258 -8.819 -4.722 1032 HG21 VAL 39 HG21 VAL 39 -9.120 -6.932 -1.765 1033 HG22 VAL 39 HG22 VAL 39 -8.265 -8.476 -1.810 1034 HG23 VAL 39 HG23 VAL 39 -9.629 -8.188 -2.892 1035 H GLU 40 HN GLU 40 -7.235 -7.211 -0.628 1036 HA GLU 40 HA GLU 40 -8.851 -5.224 0.374 1037 HB2 GLU 40 HB2 GLU 40 -7.319 -7.442 1.694 1038 HB3 GLU 40 HB1 GLU 40 -8.518 -6.479 2.523 1039 HG2 GLU 40 HG2 GLU 40 -10.253 -7.311 1.269 1040 HG3 GLU 40 HG1 GLU 40 -9.218 -7.820 -0.040 1041 H LEU 41 HN LEU 41 -5.386 -5.614 0.577 1042 HA LEU 41 HA LEU 41 -5.183 -3.576 2.610 1043 HB2 LEU 41 HB2 LEU 41 -3.519 -5.631 1.739 1044 HB3 LEU 41 HB1 LEU 41 -2.681 -4.147 1.328 1045 HG LEU 41 HG LEU 41 -1.900 -4.637 3.459 1046 HD11 LEU 41 HD11 LEU 41 -2.572 -2.853 4.787 1047 HD12 LEU 41 HD12 LEU 41 -4.222 -2.895 4.177 1048 HD13 LEU 41 HD13 LEU 41 -2.913 -2.325 3.143 1049 HD21 LEU 41 HD21 LEU 41 -3.406 -6.449 3.993 1050 HD22 LEU 41 HD22 LEU 41 -4.730 -5.311 4.237 1051 HD23 LEU 41 HD23 LEU 41 -3.349 -5.303 5.334 1052 H MET 42 HN MET 42 -4.276 -3.836 -0.840 1053 HA MET 42 HA MET 42 -3.231 -1.189 -0.954 1054 HB2 MET 42 HB2 MET 42 -4.191 -2.977 -3.187 1055 HB3 MET 42 HB1 MET 42 -3.294 -1.470 -3.412 1056 HG2 MET 42 HG2 MET 42 -2.368 -4.020 -2.120 1057 HG3 MET 42 HG1 MET 42 -1.766 -3.258 -3.586 1058 HE1 MET 42 HE1 MET 42 1.277 -2.936 -1.199 1059 HE2 MET 42 HE2 MET 42 0.682 -3.541 -2.749 1060 HE3 MET 42 HE3 MET 42 0.131 -4.276 -1.240 1061 H ALA 43 HN ALA 43 -6.339 -2.566 -1.121 1062 HA ALA 43 HA ALA 43 -7.893 -0.644 -2.307 1063 HB1 ALA 43 HB1 ALA 43 -8.862 -2.642 -1.489 1064 HB2 ALA 43 HB2 ALA 43 -9.617 -1.304 -0.617 1065 HB3 ALA 43 HB3 ALA 43 -8.371 -2.282 0.164 1066 H TYR 44 HN TYR 44 -6.132 -0.516 0.708 1067 HA TYR 44 HA TYR 44 -7.210 2.174 1.273 1068 HB2 TYR 44 HB2 TYR 44 -7.331 0.700 3.192 1069 HB3 TYR 44 HB1 TYR 44 -5.662 0.216 2.947 1070 HD1 TYR 44 HD1 TYR 44 -7.861 2.648 4.506 1071 HD2 TYR 44 HD2 TYR 44 -3.819 1.821 3.502 1072 HE1 TYR 44 HE1 TYR 44 -7.132 4.306 6.154 1073 HE2 TYR 44 HE2 TYR 44 -3.070 3.491 5.137 1074 HH TYR 44 HH TYR 44 -4.936 4.673 7.541 1075 H GLU 45 HN GLU 45 -4.151 0.447 1.701 1076 HA GLU 45 HA GLU 45 -2.449 2.531 1.824 1077 HB2 GLU 45 HB2 GLU 45 -1.874 -0.085 0.467 1078 HB3 GLU 45 HB1 GLU 45 -0.709 0.960 1.263 1079 HG2 GLU 45 HG2 GLU 45 -3.000 -0.409 2.653 1080 HG3 GLU 45 HG1 GLU 45 -1.365 -1.044 2.587 1081 H ASN 46 HN ASN 46 -3.953 1.331 -1.115 1082 HA ASN 46 HA ASN 46 -2.156 3.013 -2.673 1083 HB2 ASN 46 HB2 ASN 46 -3.674 0.499 -3.238 1084 HB3 ASN 46 HB1 ASN 46 -3.314 1.600 -4.558 1085 HD21 ASN 46 HD21 ASN 46 -1.827 0.328 -5.610 1086 HD22 ASN 46 HD22 ASN 46 -0.297 -0.067 -4.944 1087 H ALA 47 HN ALA 47 -5.396 2.709 -1.564 1088 HA ALA 47 HA ALA 47 -6.838 3.815 -3.687 1089 HB1 ALA 47 HB1 ALA 47 -7.962 2.729 -1.856 1090 HB2 ALA 47 HB2 ALA 47 -8.553 4.387 -2.021 1091 HB3 ALA 47 HB3 ALA 47 -7.411 3.979 -0.742 1092 H ASN 48 HN ASN 48 -8.182 5.869 -3.270 1093 HA ASN 48 HA ASN 48 -6.523 8.120 -3.475 1094 HB2 ASN 48 HB2 ASN 48 -9.424 7.607 -3.296 1095 HB3 ASN 48 HB1 ASN 48 -8.913 9.192 -2.724 1096 HD21 ASN 48 HD21 ASN 48 -10.371 8.118 -5.184 1097 HD22 ASN 48 HD22 ASN 48 -9.543 8.875 -6.500 1098 HA PRO 49 HA PRO 49 -5.155 9.037 0.593 1099 HB2 PRO 49 HB2 PRO 49 -6.224 11.759 -0.012 1100 HB3 PRO 49 HB1 PRO 49 -4.644 11.293 0.623 1101 HG2 PRO 49 HG2 PRO 49 -5.001 11.995 -1.955 1102 HG3 PRO 49 HG1 PRO 49 -3.804 10.790 -1.457 1103 HD2 PRO 49 HD2 PRO 49 -6.346 10.416 -2.911 1104 HD3 PRO 49 HD1 PRO 49 -4.927 9.352 -2.813 1105 H GLU 50 HN GLU 50 -8.187 10.595 -0.296 1106 HA GLU 50 HA GLU 50 -9.306 10.686 2.280 1107 HB2 GLU 50 HB2 GLU 50 -10.158 12.296 0.894 1108 HB3 GLU 50 HB1 GLU 50 -10.185 11.240 -0.508 1109 HG2 GLU 50 HG2 GLU 50 -12.354 11.100 -0.159 1110 HG3 GLU 50 HG1 GLU 50 -11.952 10.070 1.190 1111 H CYS 51 HN CYS 51 -9.379 8.381 -0.367 1112 HA CYS 51 HA CYS 51 -11.776 7.124 0.504 1113 HB2 CYS 51 HB2 CYS 51 -9.711 6.352 -1.566 1114 HB3 CYS 51 HB1 CYS 51 -11.200 5.459 -1.250 1115 HG CYS 51 HG CYS 51 -12.902 7.170 -2.341 1116 H GLN 52 HN GLN 52 -8.344 6.562 0.777 1117 HA GLN 52 HA GLN 52 -8.655 4.106 2.219 1118 HB2 GLN 52 HB2 GLN 52 -6.318 4.257 2.696 1119 HB3 GLN 52 HB1 GLN 52 -6.544 4.755 1.027 1120 HG2 GLN 52 HG2 GLN 52 -6.450 7.107 1.781 1121 HG3 GLN 52 HG1 GLN 52 -6.081 6.538 3.402 1122 HE21 GLN 52 HE21 GLN 52 -4.591 4.280 2.315 1123 HE22 GLN 52 HE22 GLN 52 -3.079 4.898 1.803 1124 H SER 53 HN SER 53 -8.502 7.464 2.821 1125 HA SER 53 HA SER 53 -8.450 7.379 5.638 1126 HB2 SER 53 HB2 SER 53 -9.167 9.400 3.569 1127 HB3 SER 53 HB1 SER 53 -9.437 9.753 5.281 1128 HG SER 53 HG SER 53 -7.044 9.364 3.864 1129 H ALA 54 HN ALA 54 -10.946 6.979 3.258 1130 HA ALA 54 HA ALA 54 -13.062 7.012 5.208 1131 HB1 ALA 54 HB1 ALA 54 -14.276 5.758 3.337 1132 HB2 ALA 54 HB2 ALA 54 -12.816 6.064 2.383 1133 HB3 ALA 54 HB3 ALA 54 -13.756 7.412 3.024 1134 H ILE 55 HN ILE 55 -10.681 4.854 4.166 1135 HA ILE 55 HA ILE 55 -12.082 2.487 5.015 1136 HB ILE 55 HB ILE 55 -9.453 2.962 3.686 1137 HG12 ILE 55 HG12 ILE 55 -11.716 1.325 2.654 1138 HG13 ILE 55 HG11 ILE 55 -11.842 3.091 2.628 1139 HG21 ILE 55 HG21 ILE 55 -9.272 0.517 3.448 1140 HG22 ILE 55 HG22 ILE 55 -10.637 0.336 4.548 1141 HG23 ILE 55 HG23 ILE 55 -9.132 1.052 5.122 1142 HD11 ILE 55 HD11 ILE 55 -10.998 2.043 0.545 1143 HD12 ILE 55 HD12 ILE 55 -9.539 1.569 1.441 1144 HD13 ILE 55 HD13 ILE 55 -9.949 3.281 1.244 1145 H LYS 56 HN LYS 56 -9.405 4.459 6.299 1146 HA LYS 56 HA LYS 56 -7.992 2.645 7.724 1147 HB2 LYS 56 HB2 LYS 56 -8.397 4.784 9.579 1148 HB3 LYS 56 HB1 LYS 56 -6.959 4.335 8.689 1149 HG2 LYS 56 HG2 LYS 56 -7.169 6.421 7.891 1150 HG3 LYS 56 HG1 LYS 56 -8.307 5.655 6.777 1151 HD2 LYS 56 HD2 LYS 56 -10.122 6.421 7.872 1152 HD3 LYS 56 HD1 LYS 56 -9.297 6.575 9.424 1153 HE2 LYS 56 HE2 LYS 56 -9.323 8.475 7.074 1154 HE3 LYS 56 HE1 LYS 56 -9.643 8.792 8.780 1155 HZ1 LYS 56 HZ1 LYS 56 -7.306 8.497 9.275 1156 HZ2 LYS 56 HZ2 LYS 56 -7.511 9.691 8.092 1157 HZ3 LYS 56 HZ3 LYS 56 -6.972 8.150 7.652 1158 HA PRO 57 HA PRO 57 -11.234 2.522 11.426 1159 HB2 PRO 57 HB2 PRO 57 -13.813 2.584 10.576 1160 HB3 PRO 57 HB1 PRO 57 -12.951 4.032 11.122 1161 HG2 PRO 57 HG2 PRO 57 -13.267 2.982 8.320 1162 HG3 PRO 57 HG1 PRO 57 -13.650 4.612 8.930 1163 HD2 PRO 57 HD2 PRO 57 -11.362 4.188 7.700 1164 HD3 PRO 57 HD1 PRO 57 -11.342 5.131 9.200 1165 H LEU 58 HN LEU 58 -11.777 1.316 8.177 1166 HA LEU 58 HA LEU 58 -12.760 -1.264 9.164 1167 HB2 LEU 58 HB2 LEU 58 -12.287 -0.792 6.284 1168 HB3 LEU 58 HB1 LEU 58 -13.594 -1.680 7.056 1169 HG LEU 58 HG LEU 58 -13.355 1.328 6.860 1170 HD11 LEU 58 HD11 LEU 58 -15.042 -0.664 5.358 1171 HD12 LEU 58 HD12 LEU 58 -13.747 0.336 4.702 1172 HD13 LEU 58 HD13 LEU 58 -15.239 1.085 5.278 1173 HD21 LEU 58 HD21 LEU 58 -15.678 1.330 7.659 1174 HD22 LEU 58 HD22 LEU 58 -14.566 0.667 8.855 1175 HD23 LEU 58 HD23 LEU 58 -15.587 -0.415 7.905 1176 H LYS 59 HN LYS 59 -10.036 0.399 8.115 1177 HA LYS 59 HA LYS 59 -8.536 -1.494 6.773 1178 HB2 LYS 59 HB2 LYS 59 -7.769 0.783 7.001 1179 HB3 LYS 59 HB1 LYS 59 -7.610 0.587 8.738 1180 HG2 LYS 59 HG2 LYS 59 -5.452 0.232 8.232 1181 HG3 LYS 59 HG1 LYS 59 -6.033 -1.396 7.910 1182 HD2 LYS 59 HD2 LYS 59 -5.669 0.776 5.880 1183 HD3 LYS 59 HD1 LYS 59 -4.605 -0.617 6.099 1184 HE2 LYS 59 HE2 LYS 59 -7.512 -0.686 5.280 1185 HE3 LYS 59 HE1 LYS 59 -6.135 -0.938 4.220 1186 HZ1 LYS 59 HZ1 LYS 59 -5.557 -2.904 5.502 1187 HZ2 LYS 59 HZ2 LYS 59 -7.117 -3.027 4.853 1188 HZ3 LYS 59 HZ3 LYS 59 -6.905 -2.667 6.487 1189 H GLY 60 HN GLY 60 -8.268 -3.522 7.333 1190 HA2 GLY 60 HA3 GLY 60 -7.104 -5.183 8.539 1191 HA3 GLY 60 HA2 GLY 60 -7.072 -4.112 9.935 1192 H LYS 61 HN LYS 61 -10.023 -3.548 9.314 1193 HA LYS 61 HA LYS 61 -11.030 -5.883 10.791 1194 HB2 LYS 61 HB2 LYS 61 -12.695 -3.449 10.444 1195 HB3 LYS 61 HB1 LYS 61 -12.477 -4.461 11.861 1196 HG2 LYS 61 HG2 LYS 61 -10.469 -2.470 10.861 1197 HG3 LYS 61 HG1 LYS 61 -11.630 -2.161 12.139 1198 HD2 LYS 61 HD2 LYS 61 -9.527 -4.318 12.200 1199 HD3 LYS 61 HD1 LYS 61 -9.383 -2.745 12.989 1200 HE2 LYS 61 HE2 LYS 61 -11.338 -3.239 14.344 1201 HE3 LYS 61 HE1 LYS 61 -11.511 -4.799 13.545 1202 HZ1 LYS 61 HZ1 LYS 61 -9.352 -5.441 14.422 1203 HZ2 LYS 61 HZ2 LYS 61 -10.411 -5.027 15.674 1204 HZ3 LYS 61 HZ3 LYS 61 -9.201 -3.947 15.199 1205 H VAL 62 HN VAL 62 -11.915 -7.325 9.424 1206 HA VAL 62 HA VAL 62 -13.892 -6.265 7.528 1207 HB VAL 62 HB VAL 62 -12.077 -7.303 6.286 1208 HG11 VAL 62 HG11 VAL 62 -12.634 -9.807 7.867 1209 HG12 VAL 62 HG12 VAL 62 -11.182 -8.810 7.961 1210 HG13 VAL 62 HG13 VAL 62 -11.554 -9.689 6.475 1211 HG21 VAL 62 HG21 VAL 62 -13.358 -9.030 5.050 1212 HG22 VAL 62 HG22 VAL 62 -14.261 -7.542 5.333 1213 HG23 VAL 62 HG23 VAL 62 -14.583 -8.970 6.316 1214 HA PRO 63 HA PRO 63 -17.063 -8.512 9.837 1215 HB2 PRO 63 HB2 PRO 63 -17.943 -9.072 7.045 1216 HB3 PRO 63 HB1 PRO 63 -18.893 -8.545 8.419 1217 HG2 PRO 63 HG2 PRO 63 -18.207 -6.822 6.524 1218 HG3 PRO 63 HG1 PRO 63 -18.203 -6.340 8.228 1219 HD2 PRO 63 HD2 PRO 63 -15.918 -6.922 6.424 1220 HD3 PRO 63 HD1 PRO 63 -16.017 -5.807 7.799 1221 H ALA 64 HN ALA 64 -17.242 -10.607 10.426 1222 HA ALA 64 HA ALA 64 -15.244 -12.409 9.656 1223 HB1 ALA 64 HB1 ALA 64 -16.394 -14.023 11.078 1224 HB2 ALA 64 HB2 ALA 64 -17.813 -12.977 11.127 1225 HB3 ALA 64 HB3 ALA 64 -16.297 -12.445 11.856 1226 H GLY 65 HN GLY 65 -15.172 -13.034 7.570 1227 HA2 GLY 65 HA3 GLY 65 -15.768 -14.899 6.161 1228 HA3 GLY 65 HA2 GLY 65 -17.439 -14.674 6.650 1229 H SER 66 HN SER 66 -16.716 -11.626 6.261 1230 HA SER 66 HA SER 66 -17.714 -11.630 3.523 1231 HB2 SER 66 HB2 SER 66 -17.280 -9.292 5.392 1232 HB3 SER 66 HB1 SER 66 -18.191 -9.283 3.882 1233 HG SER 66 HG SER 66 -19.279 -11.190 5.234 1234 H ASP 67 HN ASP 67 -16.924 -9.708 2.204 1235 HA ASP 67 HA ASP 67 -14.056 -9.934 1.780 1236 HB2 ASP 67 HB2 ASP 67 -15.875 -9.932 -0.019 1237 HB3 ASP 67 HB1 ASP 67 -16.088 -8.234 0.335 1238 H VAL 68 HN VAL 68 -12.554 -8.188 2.185 1239 HA VAL 68 HA VAL 68 -13.701 -6.089 3.822 1240 HB VAL 68 HB VAL 68 -11.688 -5.621 4.623 1241 HG11 VAL 68 HG11 VAL 68 -10.762 -8.006 3.051 1242 HG12 VAL 68 HG12 VAL 68 -11.586 -8.051 4.605 1243 HG13 VAL 68 HG13 VAL 68 -9.987 -7.321 4.479 1244 HG21 VAL 68 HG21 VAL 68 -11.041 -4.243 2.811 1245 HG22 VAL 68 HG22 VAL 68 -10.662 -5.633 1.797 1246 HG23 VAL 68 HG23 VAL 68 -9.662 -5.272 3.207 1247 H ILE 69 HN ILE 69 -12.654 -6.557 0.567 1248 HA ILE 69 HA ILE 69 -12.379 -3.907 -0.213 1249 HB ILE 69 HB ILE 69 -13.231 -6.328 -1.771 1250 HG12 ILE 69 HG12 ILE 69 -10.975 -6.581 -1.258 1251 HG13 ILE 69 HG11 ILE 69 -10.925 -5.804 -2.827 1252 HG21 ILE 69 HG21 ILE 69 -14.232 -4.476 -2.909 1253 HG22 ILE 69 HG22 ILE 69 -12.799 -4.949 -3.825 1254 HG23 ILE 69 HG23 ILE 69 -12.754 -3.525 -2.787 1255 HD11 ILE 69 HD11 ILE 69 -10.568 -3.644 -1.736 1256 HD12 ILE 69 HD12 ILE 69 -9.297 -4.819 -1.379 1257 HD13 ILE 69 HD13 ILE 69 -10.543 -4.466 -0.175 1258 H SER 70 HN SER 70 -15.134 -6.031 -0.322 1259 HA SER 70 HA SER 70 -17.123 -4.466 -1.287 1260 HB2 SER 70 HB2 SER 70 -17.485 -6.774 -0.618 1261 HB3 SER 70 HB1 SER 70 -17.236 -6.368 1.075 1262 HG SER 70 HG SER 70 -19.333 -6.160 1.052 1263 H GLU 71 HN GLU 71 -15.701 -4.259 1.935 1264 HA GLU 71 HA GLU 71 -17.585 -2.268 2.851 1265 HB2 GLU 71 HB2 GLU 71 -15.067 -3.128 4.239 1266 HB3 GLU 71 HB1 GLU 71 -16.586 -2.593 4.949 1267 HG2 GLU 71 HG2 GLU 71 -16.658 -5.031 3.296 1268 HG3 GLU 71 HG1 GLU 71 -15.849 -5.142 4.849 1269 H TYR 72 HN TYR 72 -14.399 -2.474 1.570 1270 HA TYR 72 HA TYR 72 -13.546 0.112 2.435 1271 HB2 TYR 72 HB2 TYR 72 -12.457 -1.968 0.557 1272 HB3 TYR 72 HB1 TYR 72 -11.711 -0.382 0.684 1273 HD1 TYR 72 HD1 TYR 72 -13.180 -1.733 3.698 1274 HD2 TYR 72 HD2 TYR 72 -9.643 -1.548 1.365 1275 HE1 TYR 72 HE1 TYR 72 -11.872 -2.508 5.617 1276 HE2 TYR 72 HE2 TYR 72 -8.325 -2.341 3.282 1277 HH TYR 72 HH TYR 72 -9.863 -3.521 6.171 1278 H VAL 73 HN VAL 73 -14.874 -1.331 -0.457 1279 HA VAL 73 HA VAL 73 -14.902 1.056 -2.000 1280 HB VAL 73 HB VAL 73 -16.133 -0.000 -3.622 1281 HG11 VAL 73 HG11 VAL 73 -15.406 -2.334 -3.841 1282 HG12 VAL 73 HG12 VAL 73 -14.821 -2.272 -2.179 1283 HG13 VAL 73 HG13 VAL 73 -14.107 -1.229 -3.404 1284 HG21 VAL 73 HG21 VAL 73 -17.283 -2.106 -1.841 1285 HG22 VAL 73 HG22 VAL 73 -17.857 -1.526 -3.414 1286 HG23 VAL 73 HG23 VAL 73 -18.028 -0.512 -1.976 1287 H LYS 74 HN LYS 74 -16.940 -0.477 0.336 1288 HA LYS 74 HA LYS 74 -19.220 1.190 0.173 1289 HB2 LYS 74 HB2 LYS 74 -18.652 -1.068 1.471 1290 HB3 LYS 74 HB1 LYS 74 -18.276 0.062 2.758 1291 HG2 LYS 74 HG2 LYS 74 -20.433 -0.223 3.289 1292 HG3 LYS 74 HG1 LYS 74 -20.692 0.988 2.031 1293 HD2 LYS 74 HD2 LYS 74 -20.683 -1.980 1.534 1294 HD3 LYS 74 HD1 LYS 74 -22.145 -1.047 1.857 1295 HE2 LYS 74 HE2 LYS 74 -21.617 0.367 -0.112 1296 HE3 LYS 74 HE1 LYS 74 -20.241 -0.680 -0.453 1297 HZ1 LYS 74 HZ1 LYS 74 -21.761 -2.533 -0.726 1298 HZ2 LYS 74 HZ2 LYS 74 -22.158 -1.277 -1.783 1299 HZ3 LYS 74 HZ3 LYS 74 -23.083 -1.531 -0.394 1300 H ALA 75 HN ALA 75 -16.134 1.358 1.757 1301 HA ALA 75 HA ALA 75 -16.585 3.544 3.470 1302 HB1 ALA 75 HB1 ALA 75 -14.638 2.092 3.650 1303 HB2 ALA 75 HB2 ALA 75 -14.145 3.775 3.477 1304 HB3 ALA 75 HB3 ALA 75 -14.043 2.679 2.098 1305 H CYS 76 HN CYS 76 -15.442 3.343 0.134 1306 HA CYS 76 HA CYS 76 -15.561 6.257 -0.091 1307 HB2 CYS 76 HB2 CYS 76 -13.599 5.305 -0.997 1308 HB3 CYS 76 HB1 CYS 76 -14.495 4.106 -1.919 1309 HG CYS 76 HG CYS 76 -15.603 6.049 -3.659 1310 H ASP 77 HN ASP 77 -17.735 3.887 -0.249 1311 HA ASP 77 HA ASP 77 -19.149 4.307 -2.616 1312 HB2 ASP 77 HB2 ASP 77 -19.744 2.440 -1.313 1313 HB3 ASP 77 HB1 ASP 77 -19.984 3.394 0.143 1314 H GLY 78 HN GLY 78 -18.900 6.183 0.280 1315 HA2 GLY 78 HA3 GLY 78 -20.988 8.019 -0.585 1316 HA3 GLY 78 HA2 GLY 78 -20.066 8.120 0.907 1317 H ILE 79 HN ILE 79 -17.506 7.733 -0.706 1318 HA ILE 79 HA ILE 79 -16.836 10.459 -0.677 1319 HB ILE 79 HB ILE 79 -15.406 8.053 -1.760 1320 HG12 ILE 79 HG12 ILE 79 -15.056 9.722 0.733 1321 HG13 ILE 79 HG11 ILE 79 -15.788 8.121 0.656 1322 HG21 ILE 79 HG21 ILE 79 -13.421 9.279 -2.042 1323 HG22 ILE 79 HG22 ILE 79 -14.098 10.706 -1.255 1324 HG23 ILE 79 HG23 ILE 79 -14.670 10.224 -2.857 1325 HD11 ILE 79 HD11 ILE 79 -13.411 8.241 1.447 1326 HD12 ILE 79 HD12 ILE 79 -12.975 8.665 -0.207 1327 HD13 ILE 79 HD13 ILE 79 -13.737 7.111 0.136 1328 H GLY 80 HN GLY 80 -16.073 8.594 -3.552 1329 HA2 GLY 80 HA3 GLY 80 -15.917 9.374 -5.742 1330 HA3 GLY 80 HA2 GLY 80 -17.650 9.225 -5.541 1331 H GLY 81 HN GLY 81 -15.252 11.658 -4.480 1332 HA2 GLY 81 HA3 GLY 81 -14.976 13.836 -5.226 1333 HA3 GLY 81 HA2 GLY 81 -16.260 13.566 -6.387 1334 H ALA 82 HN ALA 82 -18.471 13.151 -5.067 1335 HA ALA 82 HA ALA 82 -19.238 15.716 -4.319 1336 HB1 ALA 82 HB1 ALA 82 -20.654 13.151 -3.646 1337 HB2 ALA 82 HB2 ALA 82 -20.735 13.979 -5.199 1338 HB3 ALA 82 HB3 ALA 82 -21.367 14.761 -3.752 1339 H MET 83 HN MET 83 -19.375 12.924 -2.077 1340 HA MET 83 HA MET 83 -19.350 14.678 0.196 1341 HB2 MET 83 HB2 MET 83 -18.999 11.676 0.063 1342 HB3 MET 83 HB1 MET 83 -19.230 12.605 1.537 1343 HG2 MET 83 HG2 MET 83 -21.436 13.307 0.734 1344 HG3 MET 83 HG1 MET 83 -21.203 12.339 -0.721 1345 HE1 MET 83 HE1 MET 83 -23.429 11.003 -0.356 1346 HE2 MET 83 HE2 MET 83 -23.768 11.983 1.070 1347 HE3 MET 83 HE3 MET 83 -23.875 10.226 1.162 1348 H HIS 84 HN HIS 84 -17.012 13.324 -1.807 1349 HA HIS 84 HA HIS 84 -14.796 13.012 -0.129 1350 HB2 HIS 84 HB2 HIS 84 -14.663 12.256 -2.398 1351 HB3 HIS 84 HB1 HIS 84 -15.071 13.841 -3.022 1352 HD1 HIS 84 HD1 HIS 84 -13.087 14.460 -4.344 1353 HD2 HIS 84 HD2 HIS 84 -12.053 13.001 -0.598 1354 HE1 HIS 84 HE1 HIS 84 -10.618 14.802 -4.154 1355 HE2 HIS 84 HE2 HIS 84 -9.978 13.735 -1.961 1356 H LYS 85 HN LYS 85 -16.251 15.914 -1.496 1357 HA LYS 85 HA LYS 85 -14.004 17.548 -0.690 1358 HB2 LYS 85 HB2 LYS 85 -16.721 18.444 -1.667 1359 HB3 LYS 85 HB1 LYS 85 -15.242 19.394 -1.629 1360 HG2 LYS 85 HG2 LYS 85 -15.724 16.949 -3.326 1361 HG3 LYS 85 HG1 LYS 85 -15.741 18.624 -3.887 1362 HD2 LYS 85 HD2 LYS 85 -13.382 18.837 -3.302 1363 HD3 LYS 85 HD1 LYS 85 -13.375 17.182 -2.689 1364 HE2 LYS 85 HE2 LYS 85 -12.463 17.084 -4.872 1365 HE3 LYS 85 HE1 LYS 85 -14.107 16.448 -4.988 1366 HZ1 LYS 85 HZ1 LYS 85 -14.829 18.619 -5.803 1367 HZ2 LYS 85 HZ2 LYS 85 -13.635 17.960 -6.801 1368 HZ3 LYS 85 HZ3 LYS 85 -13.243 19.199 -5.719 1369 H ALA 86 HN ALA 86 -16.807 16.322 0.735 1370 HA ALA 86 HA ALA 86 -16.987 18.326 2.814 1371 HB1 ALA 86 HB1 ALA 86 -18.382 15.679 2.514 1372 HB2 ALA 86 HB2 ALA 86 -19.027 17.252 2.038 1373 HB3 ALA 86 HB3 ALA 86 -18.740 16.895 3.741 1374 H MET 87 HN MET 87 -15.989 15.011 2.428 1375 HA MET 87 HA MET 87 -15.275 14.734 5.217 1376 HB2 MET 87 HB2 MET 87 -15.174 12.828 2.875 1377 HB3 MET 87 HB1 MET 87 -14.873 12.388 4.561 1378 HG2 MET 87 HG2 MET 87 -17.403 13.783 3.899 1379 HG3 MET 87 HG1 MET 87 -17.248 12.098 3.449 1380 HE1 MET 87 HE1 MET 87 -19.487 13.255 5.417 1381 HE2 MET 87 HE2 MET 87 -19.497 12.023 6.678 1382 HE3 MET 87 HE3 MET 87 -19.376 11.549 4.983 1383 H LEU 88 HN LEU 88 -13.726 15.672 2.374 1384 HA LEU 88 HA LEU 88 -11.225 14.641 2.409 1385 HB2 LEU 88 HB2 LEU 88 -12.390 16.443 0.960 1386 HB3 LEU 88 HB1 LEU 88 -11.636 17.577 2.058 1387 HG LEU 88 HG LEU 88 -9.582 17.293 1.143 1388 HD11 LEU 88 HD11 LEU 88 -10.300 14.428 0.503 1389 HD12 LEU 88 HD12 LEU 88 -9.323 14.966 1.870 1390 HD13 LEU 88 HD13 LEU 88 -8.732 15.184 0.225 1391 HD21 LEU 88 HD21 LEU 88 -11.415 16.185 -0.946 1392 HD22 LEU 88 HD22 LEU 88 -9.775 16.761 -1.261 1393 HD23 LEU 88 HD23 LEU 88 -11.013 17.881 -0.686 1394 H MET 89 HN MET 89 -12.466 17.219 4.500 1395 HA MET 89 HA MET 89 -9.886 17.659 5.726 1396 HB2 MET 89 HB2 MET 89 -11.472 19.519 5.388 1397 HB3 MET 89 HB1 MET 89 -12.612 18.735 6.470 1398 HG2 MET 89 HG2 MET 89 -11.008 18.952 8.306 1399 HG3 MET 89 HG1 MET 89 -9.886 19.766 7.218 1400 HE1 MET 89 HE1 MET 89 -13.345 19.947 9.044 1401 HE2 MET 89 HE2 MET 89 -13.824 20.163 7.360 1402 HE3 MET 89 HE3 MET 89 -13.971 21.502 8.496 1403 H ALA 90 HN ALA 90 -12.536 15.568 6.199 1404 HA ALA 90 HA ALA 90 -12.118 15.307 9.077 1405 HB1 ALA 90 HB1 ALA 90 -14.416 15.407 8.131 1406 HB2 ALA 90 HB2 ALA 90 -14.110 13.940 9.060 1407 HB3 ALA 90 HB3 ALA 90 -14.100 13.883 7.294 1408 H GLN 91 HN GLN 91 -12.087 13.246 6.193 1409 HA GLN 91 HA GLN 91 -11.061 11.033 7.777 1410 HB2 GLN 91 HB2 GLN 91 -11.764 11.217 4.860 1411 HB3 GLN 91 HB1 GLN 91 -11.334 9.746 5.716 1412 HG2 GLN 91 HG2 GLN 91 -13.305 9.903 7.073 1413 HG3 GLN 91 HG1 GLN 91 -13.718 11.457 6.346 1414 HE21 GLN 91 HE21 GLN 91 -12.875 10.786 3.741 1415 HE22 GLN 91 HE22 GLN 91 -13.988 9.630 3.119 1416 H LEU 92 HN LEU 92 -10.152 12.590 4.690 1417 HA LEU 92 HA LEU 92 -7.600 11.593 4.446 1418 HB2 LEU 92 HB2 LEU 92 -8.825 12.966 2.783 1419 HB3 LEU 92 HB1 LEU 92 -8.442 14.386 3.736 1420 HG LEU 92 HG LEU 92 -6.990 13.595 1.647 1421 HD11 LEU 92 HD11 LEU 92 -5.900 14.853 4.154 1422 HD12 LEU 92 HD12 LEU 92 -6.684 15.689 2.813 1423 HD13 LEU 92 HD13 LEU 92 -5.123 14.906 2.572 1424 HD21 LEU 92 HD21 LEU 92 -4.943 12.497 2.381 1425 HD22 LEU 92 HD22 LEU 92 -6.350 11.459 2.606 1426 HD23 LEU 92 HD23 LEU 92 -5.634 12.287 3.990 1427 H GLU 93 HN GLU 93 -8.893 14.097 6.435 1428 HA GLU 93 HA GLU 93 -7.830 15.849 7.577 1429 HB2 GLU 93 HB2 GLU 93 -7.161 14.781 9.800 1430 HB3 GLU 93 HB1 GLU 93 -8.810 14.549 9.224 1431 HG2 GLU 93 HG2 GLU 93 -8.465 12.319 8.747 1432 HG3 GLU 93 HG1 GLU 93 -6.717 12.489 8.636 Start of MODEL 18 1 H2 PRO 1 HT1 PRO 1 -5.358 -3.932 13.174 2 H3 PRO 1 HT2 PRO 1 -5.815 -2.444 13.676 3 HA PRO 1 HA PRO 1 -6.555 -2.388 11.644 4 HB2 PRO 1 HB2 PRO 1 -4.526 -1.302 10.280 5 HB3 PRO 1 HB1 PRO 1 -5.270 -0.455 11.642 6 HG2 PRO 1 HG2 PRO 1 -2.647 -1.767 11.471 7 HG3 PRO 1 HG1 PRO 1 -3.222 -0.545 12.620 8 HD2 PRO 1 HD2 PRO 1 -3.058 -3.429 12.938 9 HD3 PRO 1 HD1 PRO 1 -3.454 -2.200 14.155 10 H SER 2 HN SER 2 -4.859 -2.479 9.211 11 HA SER 2 HA SER 2 -4.547 -5.226 8.647 12 HB2 SER 2 HB2 SER 2 -3.095 -2.852 7.475 13 HB3 SER 2 HB1 SER 2 -3.127 -4.467 6.786 14 HG SER 2 HG SER 2 -5.440 -4.241 6.648 15 H PHE 3 HN PHE 3 -2.200 -6.010 8.048 16 HA PHE 3 HA PHE 3 -0.632 -5.817 10.431 17 HB2 PHE 3 HB2 PHE 3 0.993 -6.875 8.464 18 HB3 PHE 3 HB1 PHE 3 0.014 -7.800 9.611 19 HD1 PHE 3 HD1 PHE 3 0.637 -6.821 6.254 20 HD2 PHE 3 HD2 PHE 3 -2.255 -8.628 8.796 21 HE1 PHE 3 HE1 PHE 3 -0.459 -7.798 4.323 22 HE2 PHE 3 HE2 PHE 3 -3.384 -9.595 6.837 23 HZ PHE 3 HZ PHE 3 -2.482 -9.182 4.582 24 H ASN 4 HN ASN 4 -0.255 -4.781 7.090 25 HA ASN 4 HA ASN 4 2.412 -3.814 7.635 26 HB2 ASN 4 HB2 ASN 4 2.478 -3.439 5.204 27 HB3 ASN 4 HB1 ASN 4 1.995 -5.085 5.613 28 HD21 ASN 4 HD21 ASN 4 0.724 -1.902 4.753 29 HD22 ASN 4 HD22 ASN 4 -0.710 -2.498 3.983 30 H THR 5 HN THR 5 -0.410 -2.393 8.232 31 HA THR 5 HA THR 5 -0.379 -0.010 6.729 32 HB THR 5 HB THR 5 -1.544 0.798 8.982 33 HG1 THR 5 HG1 THR 5 -1.166 -0.981 10.255 34 HG21 THR 5 HG21 THR 5 -2.644 -1.068 6.913 35 HG22 THR 5 HG22 THR 5 -2.704 0.695 6.923 36 HG23 THR 5 HG23 THR 5 -3.643 -0.229 8.098 37 H VAL 6 HN VAL 6 1.842 -1.101 8.973 38 HA VAL 6 HA VAL 6 2.593 1.415 10.077 39 HB VAL 6 HB VAL 6 4.389 0.313 11.088 40 HG11 VAL 6 HG11 VAL 6 2.293 -1.814 10.723 41 HG12 VAL 6 HG12 VAL 6 2.283 -0.535 11.937 42 HG13 VAL 6 HG13 VAL 6 3.523 -1.789 11.987 43 HG21 VAL 6 HG21 VAL 6 5.473 -1.675 10.328 44 HG22 VAL 6 HG22 VAL 6 5.313 -0.582 8.942 45 HG23 VAL 6 HG23 VAL 6 4.214 -1.954 9.118 46 H ARG 7 HN ARG 7 3.909 2.919 9.132 47 HA ARG 7 HA ARG 7 5.670 2.035 7.058 48 HB2 ARG 7 HB2 ARG 7 4.717 3.625 5.370 49 HB3 ARG 7 HB1 ARG 7 3.869 2.132 5.701 50 HG2 ARG 7 HG2 ARG 7 2.721 3.969 7.409 51 HG3 ARG 7 HG1 ARG 7 2.939 4.816 5.874 52 HD2 ARG 7 HD2 ARG 7 1.863 2.946 4.709 53 HD3 ARG 7 HD1 ARG 7 1.601 2.139 6.254 54 HE ARG 7 HE ARG 7 0.297 4.310 6.781 55 HH11 ARG 7 HH11 ARG 7 0.409 2.677 3.686 56 HH12 ARG 7 HH12 ARG 7 -1.056 3.388 3.115 57 HH21 ARG 7 HH21 ARG 7 -1.637 5.255 6.034 58 HH22 ARG 7 HH22 ARG 7 -2.226 4.867 4.453 59 H GLN 8 HN GLN 8 6.958 3.605 6.145 60 HA GLN 8 HA GLN 8 8.523 4.975 7.811 61 HB2 GLN 8 HB2 GLN 8 8.197 4.715 5.012 62 HB3 GLN 8 HB1 GLN 8 8.480 6.423 5.340 63 HG2 GLN 8 HG2 GLN 8 10.506 5.872 6.556 64 HG3 GLN 8 HG1 GLN 8 10.217 4.155 6.283 65 HE21 GLN 8 HE21 GLN 8 12.475 5.784 5.509 66 HE22 GLN 8 HE22 GLN 8 12.579 5.675 3.776 67 H GLY 9 HN GLY 9 8.057 6.452 9.244 68 HA2 GLY 9 HA3 GLY 9 6.147 8.575 8.728 69 HA3 GLY 9 HA2 GLY 9 7.075 8.326 10.200 70 H SER 10 HN SER 10 7.904 10.366 10.454 71 HA SER 10 HA SER 10 8.897 11.977 8.376 72 HB2 SER 10 HB2 SER 10 9.688 12.032 11.297 73 HB3 SER 10 HB1 SER 10 9.851 13.353 10.141 74 HG SER 10 HG SER 10 7.315 12.460 10.151 75 H LYS 11 HN LYS 11 10.324 11.053 7.051 76 HA LYS 11 HA LYS 11 12.070 9.844 6.254 77 HB2 LYS 11 HB2 LYS 11 14.213 10.817 6.719 78 HB3 LYS 11 HB1 LYS 11 13.031 12.090 6.572 79 HG2 LYS 11 HG2 LYS 11 12.983 12.393 8.923 80 HG3 LYS 11 HG1 LYS 11 13.991 10.985 9.199 81 HD2 LYS 11 HD2 LYS 11 15.844 12.110 8.050 82 HD3 LYS 11 HD1 LYS 11 14.821 13.528 7.802 83 HE2 LYS 11 HE2 LYS 11 14.611 13.822 10.204 84 HE3 LYS 11 HE1 LYS 11 15.563 12.368 10.486 85 HZ1 LYS 11 HZ1 LYS 11 17.458 13.441 9.466 86 HZ2 LYS 11 HZ2 LYS 11 16.877 14.381 10.745 87 HZ3 LYS 11 HZ3 LYS 11 16.547 14.831 9.150 88 H GLU 12 HN GLU 12 10.810 8.345 8.170 89 HA GLU 12 HA GLU 12 12.408 7.233 10.171 90 HB2 GLU 12 HB2 GLU 12 10.001 6.858 9.980 91 HB3 GLU 12 HB1 GLU 12 10.228 5.980 8.480 92 HG2 GLU 12 HG2 GLU 12 11.429 4.223 9.694 93 HG3 GLU 12 HG1 GLU 12 11.197 5.117 11.196 94 HA PRO 13 HA PRO 13 15.627 5.054 7.963 95 HB2 PRO 13 HB2 PRO 13 15.233 2.927 9.967 96 HB3 PRO 13 HB1 PRO 13 16.700 3.810 9.555 97 HG2 PRO 13 HG2 PRO 13 15.349 4.252 11.842 98 HG3 PRO 13 HG1 PRO 13 16.226 5.526 10.989 99 HD2 PRO 13 HD2 PRO 13 13.310 5.042 11.179 100 HD3 PRO 13 HD1 PRO 13 14.191 6.564 10.971 101 H TYR 14 HN TYR 14 15.365 3.819 6.212 102 HA TYR 14 HA TYR 14 12.749 2.857 5.788 103 HB2 TYR 14 HB2 TYR 14 13.961 4.019 4.028 104 HB3 TYR 14 HB1 TYR 14 15.137 2.709 3.958 105 HD1 TYR 14 HD1 TYR 14 14.182 0.376 3.543 106 HD2 TYR 14 HD2 TYR 14 12.111 3.942 2.602 107 HE1 TYR 14 HE1 TYR 14 12.804 -0.883 1.985 108 HE2 TYR 14 HE2 TYR 14 10.696 2.706 1.019 109 HH TYR 14 HH TYR 14 10.376 0.722 0.006 110 HA PRO 15 HA PRO 15 14.859 -1.539 5.264 111 HB2 PRO 15 HB2 PRO 15 16.999 -1.306 7.275 112 HB3 PRO 15 HB1 PRO 15 17.020 -2.102 5.706 113 HG2 PRO 15 HG2 PRO 15 18.302 0.211 6.161 114 HG3 PRO 15 HG1 PRO 15 17.610 -0.199 4.597 115 HD2 PRO 15 HD2 PRO 15 16.644 1.718 6.645 116 HD3 PRO 15 HD1 PRO 15 16.460 1.748 4.885 117 H ASP 16 HN ASP 16 14.581 0.465 7.944 118 HA ASP 16 HA ASP 16 13.849 -1.634 9.802 119 HB2 ASP 16 HB2 ASP 16 14.515 1.257 10.042 120 HB3 ASP 16 HB1 ASP 16 13.470 0.559 11.273 121 H PHE 17 HN PHE 17 12.446 1.138 8.140 122 HA PHE 17 HA PHE 17 9.859 1.021 9.178 123 HB2 PHE 17 HB2 PHE 17 9.715 2.796 7.772 124 HB3 PHE 17 HB1 PHE 17 11.184 2.298 6.944 125 HD1 PHE 17 HD1 PHE 17 11.106 1.276 4.818 126 HD2 PHE 17 HD2 PHE 17 7.523 1.922 7.001 127 HE1 PHE 17 HE1 PHE 17 9.796 0.699 2.825 128 HE2 PHE 17 HE2 PHE 17 6.197 1.360 5.008 129 HZ PHE 17 HZ PHE 17 7.333 0.749 2.916 130 H VAL 18 HN VAL 18 11.384 -0.714 6.519 131 HA VAL 18 HA VAL 18 9.008 -2.171 5.911 132 HB VAL 18 HB VAL 18 10.376 -1.824 4.033 133 HG11 VAL 18 HG11 VAL 18 12.479 -1.441 5.373 134 HG12 VAL 18 HG12 VAL 18 12.689 -2.382 3.884 135 HG13 VAL 18 HG13 VAL 18 12.641 -3.201 5.456 136 HG21 VAL 18 HG21 VAL 18 11.050 -4.131 3.395 137 HG22 VAL 18 HG22 VAL 18 9.405 -4.003 4.022 138 HG23 VAL 18 HG23 VAL 18 10.698 -4.631 5.054 139 H ALA 19 HN ALA 19 11.941 -2.802 7.740 140 HA ALA 19 HA ALA 19 11.608 -5.510 8.253 141 HB1 ALA 19 HB1 ALA 19 13.591 -4.231 8.933 142 HB2 ALA 19 HB2 ALA 19 12.927 -5.180 10.262 143 HB3 ALA 19 HB3 ALA 19 12.640 -3.441 10.190 144 H ARG 20 HN ARG 20 9.893 -2.780 9.725 145 HA ARG 20 HA ARG 20 8.604 -4.618 11.565 146 HB2 ARG 20 HB2 ARG 20 7.335 -2.687 12.387 147 HB3 ARG 20 HB1 ARG 20 9.064 -2.411 12.461 148 HG2 ARG 20 HG2 ARG 20 9.009 -0.806 10.800 149 HG3 ARG 20 HG1 ARG 20 7.482 -1.399 10.136 150 HD2 ARG 20 HD2 ARG 20 6.254 -0.552 11.991 151 HD3 ARG 20 HD1 ARG 20 7.724 -0.194 12.877 152 HE ARG 20 HE ARG 20 8.047 1.406 10.797 153 HH11 ARG 20 HH11 ARG 20 5.196 0.795 12.744 154 HH12 ARG 20 HH12 ARG 20 4.523 2.372 12.481 155 HH21 ARG 20 HH21 ARG 20 7.179 3.509 10.494 156 HH22 ARG 20 HH22 ARG 20 5.637 3.901 11.199 157 H LEU 21 HN LEU 21 8.150 -3.050 8.546 158 HA LEU 21 HA LEU 21 5.481 -3.517 8.026 159 HB2 LEU 21 HB2 LEU 21 7.459 -2.493 6.618 160 HB3 LEU 21 HB1 LEU 21 7.571 -4.112 5.925 161 HG LEU 21 HG LEU 21 5.543 -3.886 4.823 162 HD11 LEU 21 HD11 LEU 21 4.887 -1.672 6.755 163 HD12 LEU 21 HD12 LEU 21 4.091 -3.243 6.612 164 HD13 LEU 21 HD13 LEU 21 3.916 -2.044 5.327 165 HD21 LEU 21 HD21 LEU 21 5.586 -1.656 3.766 166 HD22 LEU 21 HD22 LEU 21 7.169 -2.433 3.843 167 HD23 LEU 21 HD23 LEU 21 6.760 -1.146 4.978 168 H GLN 22 HN GLN 22 8.279 -5.570 7.592 169 HA GLN 22 HA GLN 22 6.923 -7.899 6.846 170 HB2 GLN 22 HB2 GLN 22 9.598 -7.719 8.226 171 HB3 GLN 22 HB1 GLN 22 9.002 -9.004 7.177 172 HG2 GLN 22 HG2 GLN 22 8.830 -7.197 5.429 173 HG3 GLN 22 HG1 GLN 22 9.861 -6.245 6.470 174 HE21 GLN 22 HE21 GLN 22 11.388 -6.243 4.752 175 HE22 GLN 22 HE22 GLN 22 12.411 -7.605 4.489 176 H ASP 23 HN ASP 23 8.310 -6.840 9.908 177 HA ASP 23 HA ASP 23 7.876 -9.040 11.471 178 HB2 ASP 23 HB2 ASP 23 8.908 -6.797 12.069 179 HB3 ASP 23 HB1 ASP 23 7.265 -6.283 12.438 180 H VAL 24 HN VAL 24 5.451 -6.472 10.942 181 HA VAL 24 HA VAL 24 3.669 -7.774 12.826 182 HB VAL 24 HB VAL 24 3.745 -5.354 12.925 183 HG11 VAL 24 HG11 VAL 24 4.477 -4.916 10.665 184 HG12 VAL 24 HG12 VAL 24 3.035 -3.968 11.033 185 HG13 VAL 24 HG13 VAL 24 2.907 -5.422 10.042 186 HG21 VAL 24 HG21 VAL 24 1.569 -6.269 13.441 187 HG22 VAL 24 HG22 VAL 24 1.157 -6.354 11.729 188 HG23 VAL 24 HG23 VAL 24 1.332 -4.782 12.515 189 H ALA 25 HN ALA 25 4.189 -7.444 9.464 190 HA ALA 25 HA ALA 25 1.605 -8.497 8.689 191 HB1 ALA 25 HB1 ALA 25 4.099 -8.251 7.062 192 HB2 ALA 25 HB2 ALA 25 2.986 -6.902 7.360 193 HB3 ALA 25 HB3 ALA 25 2.427 -8.342 6.503 194 H GLN 26 HN GLN 26 4.610 -9.589 9.806 195 HA GLN 26 HA GLN 26 4.292 -12.308 8.903 196 HB2 GLN 26 HB2 GLN 26 6.469 -12.228 9.408 197 HB3 GLN 26 HB1 GLN 26 6.237 -10.676 10.192 198 HG2 GLN 26 HG2 GLN 26 7.055 -11.835 11.960 199 HG3 GLN 26 HG1 GLN 26 5.351 -12.230 12.151 200 HE21 GLN 26 HE21 GLN 26 5.377 -13.968 9.796 201 HE22 GLN 26 HE22 GLN 26 6.160 -15.415 10.296 202 H LYS 27 HN LYS 27 3.688 -10.389 11.747 203 HA LYS 27 HA LYS 27 2.764 -12.396 13.477 204 HB2 LYS 27 HB2 LYS 27 1.856 -9.519 13.312 205 HB3 LYS 27 HB1 LYS 27 1.759 -10.573 14.730 206 HG2 LYS 27 HG2 LYS 27 4.279 -9.608 13.392 207 HG3 LYS 27 HG1 LYS 27 3.619 -9.030 14.923 208 HD2 LYS 27 HD2 LYS 27 4.187 -10.975 16.044 209 HD3 LYS 27 HD1 LYS 27 4.238 -11.932 14.563 210 HE2 LYS 27 HE2 LYS 27 6.273 -10.945 13.886 211 HE3 LYS 27 HE1 LYS 27 6.166 -9.710 15.135 212 HZ1 LYS 27 HZ1 LYS 27 7.751 -11.378 15.777 213 HZ2 LYS 27 HZ2 LYS 27 6.624 -12.615 15.548 214 HZ3 LYS 27 HZ3 LYS 27 6.408 -11.498 16.798 215 H SER 28 HN SER 28 1.199 -10.707 10.844 216 HA SER 28 HA SER 28 -1.369 -11.824 11.690 217 HB2 SER 28 HB2 SER 28 -0.781 -9.566 9.786 218 HB3 SER 28 HB1 SER 28 -2.389 -10.091 10.290 219 HG SER 28 HG SER 28 -0.356 -9.114 12.023 220 H ILE 29 HN ILE 29 1.139 -12.212 9.503 221 HA ILE 29 HA ILE 29 -0.611 -13.712 7.660 222 HB ILE 29 HB ILE 29 2.060 -12.435 7.089 223 HG12 ILE 29 HG12 ILE 29 -0.629 -11.832 5.867 224 HG13 ILE 29 HG11 ILE 29 0.140 -10.895 7.150 225 HG21 ILE 29 HG21 ILE 29 1.808 -13.152 4.796 226 HG22 ILE 29 HG22 ILE 29 0.328 -14.024 5.221 227 HG23 ILE 29 HG23 ILE 29 1.877 -14.531 5.895 228 HD11 ILE 29 HD11 ILE 29 1.855 -10.178 5.803 229 HD12 ILE 29 HD12 ILE 29 0.424 -10.080 4.761 230 HD13 ILE 29 HD13 ILE 29 1.554 -11.437 4.592 231 H ALA 30 HN ALA 30 -0.418 -15.847 7.917 232 HA ALA 30 HA ALA 30 1.996 -16.989 9.064 233 HB1 ALA 30 HB1 ALA 30 -0.199 -17.803 9.783 234 HB2 ALA 30 HB2 ALA 30 0.760 -19.086 9.047 235 HB3 ALA 30 HB3 ALA 30 -0.541 -18.324 8.134 236 H ASP 31 HN ASP 31 1.122 -15.959 6.116 237 HA ASP 31 HA ASP 31 2.193 -18.206 4.580 238 HB2 ASP 31 HB2 ASP 31 0.043 -16.925 3.991 239 HB3 ASP 31 HB1 ASP 31 1.129 -15.635 3.486 240 H GLU 32 HN GLU 32 4.258 -18.209 4.017 241 HA GLU 32 HA GLU 32 5.979 -16.014 4.537 242 HB2 GLU 32 HB2 GLU 32 7.709 -17.396 3.478 243 HB3 GLU 32 HB1 GLU 32 6.757 -18.333 4.621 244 HG2 GLU 32 HG2 GLU 32 5.428 -19.212 2.719 245 HG3 GLU 32 HG1 GLU 32 6.522 -18.365 1.624 246 H LYS 33 HN LYS 33 4.009 -16.829 1.831 247 HA LYS 33 HA LYS 33 5.679 -15.391 -0.072 248 HB2 LYS 33 HB2 LYS 33 2.917 -16.578 -0.402 249 HB3 LYS 33 HB1 LYS 33 3.845 -15.827 -1.688 250 HG2 LYS 33 HG2 LYS 33 4.407 -17.955 -2.137 251 HG3 LYS 33 HG1 LYS 33 5.604 -17.677 -0.870 252 HD2 LYS 33 HD2 LYS 33 4.429 -19.792 -0.524 253 HD3 LYS 33 HD1 LYS 33 4.103 -18.653 0.781 254 HE2 LYS 33 HE2 LYS 33 2.100 -19.904 0.009 255 HE3 LYS 33 HE1 LYS 33 1.933 -18.156 -0.097 256 HZ1 LYS 33 HZ1 LYS 33 2.427 -20.055 -2.318 257 HZ2 LYS 33 HZ2 LYS 33 2.539 -18.381 -2.494 258 HZ3 LYS 33 HZ3 LYS 33 1.057 -19.084 -2.074 259 H ALA 34 HN ALA 34 2.418 -15.155 1.273 260 HA ALA 34 HA ALA 34 1.825 -12.594 0.352 261 HB1 ALA 34 HB1 ALA 34 0.191 -14.171 1.354 262 HB2 ALA 34 HB2 ALA 34 0.079 -12.532 1.994 263 HB3 ALA 34 HB3 ALA 34 0.861 -13.795 2.940 264 H ARG 35 HN ARG 35 3.912 -13.608 2.960 265 HA ARG 35 HA ARG 35 3.944 -11.085 4.270 266 HB2 ARG 35 HB2 ARG 35 5.071 -13.603 4.807 267 HB3 ARG 35 HB1 ARG 35 6.439 -12.522 4.579 268 HG2 ARG 35 HG2 ARG 35 4.224 -11.687 6.432 269 HG3 ARG 35 HG1 ARG 35 5.384 -12.875 6.960 270 HD2 ARG 35 HD2 ARG 35 6.022 -10.713 7.722 271 HD3 ARG 35 HD1 ARG 35 7.188 -11.301 6.579 272 HE ARG 35 HE ARG 35 6.973 -9.188 5.898 273 HH11 ARG 35 HH11 ARG 35 3.770 -10.590 5.613 274 HH12 ARG 35 HH12 ARG 35 3.095 -9.154 4.954 275 HH21 ARG 35 HH21 ARG 35 6.009 -7.263 5.219 276 HH22 ARG 35 HH22 ARG 35 4.343 -7.255 4.787 277 H LYS 36 HN LYS 36 6.347 -12.670 2.163 278 HA LYS 36 HA LYS 36 8.038 -10.500 1.798 279 HB2 LYS 36 HB2 LYS 36 7.256 -12.445 -0.357 280 HB3 LYS 36 HB1 LYS 36 8.737 -11.499 -0.268 281 HG2 LYS 36 HG2 LYS 36 9.708 -12.897 1.176 282 HG3 LYS 36 HG1 LYS 36 8.177 -13.293 1.988 283 HD2 LYS 36 HD2 LYS 36 8.959 -15.218 0.744 284 HD3 LYS 36 HD1 LYS 36 7.482 -14.546 0.009 285 HE2 LYS 36 HE2 LYS 36 9.163 -13.181 -1.468 286 HE3 LYS 36 HE1 LYS 36 10.339 -14.385 -0.938 287 HZ1 LYS 36 HZ1 LYS 36 8.953 -16.131 -1.844 288 HZ2 LYS 36 HZ2 LYS 36 9.335 -15.005 -3.043 289 HZ3 LYS 36 HZ3 LYS 36 7.799 -15.000 -2.340 290 H VAL 37 HN VAL 37 5.300 -11.516 -0.209 291 HA VAL 37 HA VAL 37 5.666 -9.616 -2.182 292 HB VAL 37 HB VAL 37 3.421 -10.023 -2.944 293 HG11 VAL 37 HG11 VAL 37 4.893 -11.801 -3.453 294 HG12 VAL 37 HG12 VAL 37 3.384 -12.540 -2.911 295 HG13 VAL 37 HG13 VAL 37 4.773 -12.463 -1.821 296 HG21 VAL 37 HG21 VAL 37 1.854 -11.431 -1.596 297 HG22 VAL 37 HG22 VAL 37 2.132 -9.810 -0.960 298 HG23 VAL 37 HG23 VAL 37 2.933 -11.195 -0.220 299 H ILE 38 HN ILE 38 3.927 -9.380 0.882 300 HA ILE 38 HA ILE 38 3.128 -6.710 0.228 301 HB ILE 38 HB ILE 38 2.120 -8.671 1.959 302 HG12 ILE 38 HG12 ILE 38 1.400 -5.854 1.229 303 HG13 ILE 38 HG11 ILE 38 0.846 -7.326 0.471 304 HG21 ILE 38 HG21 ILE 38 1.721 -7.289 4.018 305 HG22 ILE 38 HG22 ILE 38 2.987 -6.194 3.442 306 HG23 ILE 38 HG23 ILE 38 3.373 -7.873 3.809 307 HD11 ILE 38 HD11 ILE 38 -0.419 -7.887 2.469 308 HD12 ILE 38 HD12 ILE 38 -0.900 -6.328 1.796 309 HD13 ILE 38 HD13 ILE 38 0.133 -6.389 3.224 310 H VAL 39 HN VAL 39 5.717 -8.189 2.206 311 HA VAL 39 HA VAL 39 6.564 -5.766 3.332 312 HB VAL 39 HB VAL 39 8.649 -6.620 3.801 313 HG11 VAL 39 HG11 VAL 39 8.545 -9.034 4.217 314 HG12 VAL 39 HG12 VAL 39 7.072 -9.115 3.253 315 HG13 VAL 39 HG13 VAL 39 7.107 -8.172 4.734 316 HG21 VAL 39 HG21 VAL 39 8.629 -8.517 1.461 317 HG22 VAL 39 HG22 VAL 39 9.965 -8.188 2.568 318 HG23 VAL 39 HG23 VAL 39 9.409 -6.934 1.461 319 H GLU 40 HN GLU 40 7.541 -7.278 0.321 320 HA GLU 40 HA GLU 40 9.082 -5.255 -0.715 321 HB2 GLU 40 HB2 GLU 40 7.489 -7.438 -2.032 322 HB3 GLU 40 HB1 GLU 40 8.707 -6.495 -2.852 323 HG2 GLU 40 HG2 GLU 40 10.428 -7.442 -1.688 324 HG3 GLU 40 HG1 GLU 40 9.427 -7.843 -0.311 325 H LEU 41 HN LEU 41 5.627 -5.811 -0.897 326 HA LEU 41 HA LEU 41 5.164 -3.812 -2.869 327 HB2 LEU 41 HB2 LEU 41 3.644 -5.803 -1.604 328 HB3 LEU 41 HB1 LEU 41 2.847 -4.276 -1.263 329 HG LEU 41 HG LEU 41 1.841 -5.006 -3.230 330 HD11 LEU 41 HD11 LEU 41 2.332 -3.368 -4.791 331 HD12 LEU 41 HD12 LEU 41 4.035 -3.328 -4.353 332 HD13 LEU 41 HD13 LEU 41 2.829 -2.672 -3.253 333 HD21 LEU 41 HD21 LEU 41 3.310 -6.839 -3.767 334 HD22 LEU 41 HD22 LEU 41 4.586 -5.717 -4.241 335 HD23 LEU 41 HD23 LEU 41 3.099 -5.815 -5.188 336 H MET 42 HN MET 42 4.451 -3.914 0.632 337 HA MET 42 HA MET 42 3.460 -1.250 0.672 338 HB2 MET 42 HB2 MET 42 4.400 -2.993 2.941 339 HB3 MET 42 HB1 MET 42 3.496 -1.483 3.131 340 HG2 MET 42 HG2 MET 42 2.575 -4.034 1.826 341 HG3 MET 42 HG1 MET 42 1.995 -3.316 3.322 342 HE1 MET 42 HE1 MET 42 -0.508 -3.561 2.469 343 HE2 MET 42 HE2 MET 42 0.093 -4.277 0.968 344 HE3 MET 42 HE3 MET 42 -1.060 -2.946 0.908 345 H ALA 43 HN ALA 43 6.552 -2.666 0.885 346 HA ALA 43 HA ALA 43 8.140 -0.745 2.013 347 HB1 ALA 43 HB1 ALA 43 9.850 -1.472 0.358 348 HB2 ALA 43 HB2 ALA 43 8.590 -2.415 -0.447 349 HB3 ALA 43 HB3 ALA 43 9.052 -2.793 1.213 350 H TYR 44 HN TYR 44 6.340 -0.652 -0.981 351 HA TYR 44 HA TYR 44 7.470 2.009 -1.600 352 HB2 TYR 44 HB2 TYR 44 7.573 0.527 -3.524 353 HB3 TYR 44 HB1 TYR 44 5.897 0.068 -3.284 354 HD1 TYR 44 HD1 TYR 44 8.136 2.458 -4.800 355 HD2 TYR 44 HD2 TYR 44 4.079 1.722 -3.841 356 HE1 TYR 44 HE1 TYR 44 7.463 4.144 -6.452 357 HE2 TYR 44 HE2 TYR 44 3.379 3.414 -5.474 358 HH TYR 44 HH TYR 44 5.528 4.746 -7.776 359 H GLU 45 HN GLU 45 4.397 0.289 -1.962 360 HA GLU 45 HA GLU 45 2.724 2.365 -2.221 361 HB2 GLU 45 HB2 GLU 45 1.906 0.061 -0.542 362 HB3 GLU 45 HB1 GLU 45 0.976 0.917 -1.763 363 HG2 GLU 45 HG2 GLU 45 3.269 -0.926 -2.209 364 HG3 GLU 45 HG1 GLU 45 1.587 -1.300 -2.515 365 H ASN 46 HN ASN 46 4.131 1.223 0.794 366 HA ASN 46 HA ASN 46 2.343 2.982 2.283 367 HB2 ASN 46 HB2 ASN 46 3.734 0.421 2.888 368 HB3 ASN 46 HB1 ASN 46 3.506 1.562 4.206 369 HD21 ASN 46 HD21 ASN 46 1.981 0.294 5.313 370 HD22 ASN 46 HD22 ASN 46 0.401 0.044 4.700 371 H ALA 47 HN ALA 47 5.595 2.630 1.235 372 HA ALA 47 HA ALA 47 7.015 3.707 3.389 373 HB1 ALA 47 HB1 ALA 47 8.784 4.197 1.789 374 HB2 ALA 47 HB2 ALA 47 7.663 3.907 0.460 375 HB3 ALA 47 HB3 ALA 47 8.112 2.584 1.538 376 H ASN 48 HN ASN 48 8.404 5.747 2.971 377 HA ASN 48 HA ASN 48 6.761 8.007 3.202 378 HB2 ASN 48 HB2 ASN 48 9.665 7.489 3.013 379 HB3 ASN 48 HB1 ASN 48 9.153 9.085 2.470 380 HD21 ASN 48 HD21 ASN 48 10.651 8.034 4.904 381 HD22 ASN 48 HD22 ASN 48 9.805 8.754 6.232 382 HA PRO 49 HA PRO 49 5.422 8.992 -0.870 383 HB2 PRO 49 HB2 PRO 49 6.505 11.699 -0.236 384 HB3 PRO 49 HB1 PRO 49 4.923 11.250 -0.874 385 HG2 PRO 49 HG2 PRO 49 5.290 11.933 1.709 386 HG3 PRO 49 HG1 PRO 49 4.078 10.745 1.203 387 HD2 PRO 49 HD2 PRO 49 6.617 10.330 2.652 388 HD3 PRO 49 HD1 PRO 49 5.186 9.285 2.550 389 H GLU 50 HN GLU 50 8.483 10.404 0.127 390 HA GLU 50 HA GLU 50 9.592 10.598 -2.471 391 HB2 GLU 50 HB2 GLU 50 10.449 12.195 -1.081 392 HB3 GLU 50 HB1 GLU 50 10.438 11.142 0.325 393 HG2 GLU 50 HG2 GLU 50 12.598 10.902 0.037 394 HG3 GLU 50 HG1 GLU 50 12.231 9.989 -1.406 395 H CYS 51 HN CYS 51 9.607 8.229 0.100 396 HA CYS 51 HA CYS 51 12.027 6.987 -0.756 397 HB2 CYS 51 HB2 CYS 51 9.938 6.192 1.281 398 HB3 CYS 51 HB1 CYS 51 11.443 5.323 0.988 399 HG CYS 51 HG CYS 51 13.104 7.061 2.106 400 H GLN 52 HN GLN 52 8.581 6.436 -1.064 401 HA GLN 52 HA GLN 52 8.919 4.002 -2.538 402 HB2 GLN 52 HB2 GLN 52 6.586 4.143 -3.037 403 HB3 GLN 52 HB1 GLN 52 6.798 4.593 -1.352 404 HG2 GLN 52 HG2 GLN 52 6.640 6.962 -2.009 405 HG3 GLN 52 HG1 GLN 52 6.326 6.459 -3.666 406 HE21 GLN 52 HE21 GLN 52 4.907 4.099 -2.677 407 HE22 GLN 52 HE22 GLN 52 3.364 4.627 -2.159 408 H SER 53 HN SER 53 8.747 7.362 -3.096 409 HA SER 53 HA SER 53 8.786 7.303 -5.917 410 HB2 SER 53 HB2 SER 53 9.319 9.307 -3.794 411 HB3 SER 53 HB1 SER 53 9.796 9.680 -5.455 412 HG SER 53 HG SER 53 7.780 10.037 -5.889 413 H ALA 54 HN ALA 54 11.199 6.846 -3.476 414 HA ALA 54 HA ALA 54 13.369 6.877 -5.365 415 HB1 ALA 54 HB1 ALA 54 14.614 5.744 -3.558 416 HB2 ALA 54 HB2 ALA 54 13.111 5.653 -2.632 417 HB3 ALA 54 HB3 ALA 54 13.810 7.220 -3.028 418 H ILE 55 HN ILE 55 10.936 4.709 -4.408 419 HA ILE 55 HA ILE 55 12.364 2.359 -5.254 420 HB ILE 55 HB ILE 55 9.721 2.812 -3.949 421 HG12 ILE 55 HG12 ILE 55 11.966 1.156 -2.917 422 HG13 ILE 55 HG11 ILE 55 12.113 2.918 -2.885 423 HG21 ILE 55 HG21 ILE 55 10.908 0.189 -4.820 424 HG22 ILE 55 HG22 ILE 55 9.421 0.918 -5.423 425 HG23 ILE 55 HG23 ILE 55 9.520 0.372 -3.749 426 HD11 ILE 55 HD11 ILE 55 11.260 1.911 -0.806 427 HD12 ILE 55 HD12 ILE 55 9.813 1.393 -1.694 428 HD13 ILE 55 HD13 ILE 55 10.185 3.116 -1.524 429 H LYS 56 HN LYS 56 9.671 4.303 -6.538 430 HA LYS 56 HA LYS 56 8.315 2.537 -8.037 431 HB2 LYS 56 HB2 LYS 56 8.728 4.655 -9.870 432 HB3 LYS 56 HB1 LYS 56 7.300 4.256 -8.936 433 HG2 LYS 56 HG2 LYS 56 7.647 6.396 -8.263 434 HG3 LYS 56 HG1 LYS 56 8.619 5.546 -7.057 435 HD2 LYS 56 HD2 LYS 56 10.554 6.218 -7.928 436 HD3 LYS 56 HD1 LYS 56 9.963 6.218 -9.591 437 HE2 LYS 56 HE2 LYS 56 8.532 8.273 -8.651 438 HE3 LYS 56 HE1 LYS 56 9.905 8.375 -7.530 439 HZ1 LYS 56 HZ1 LYS 56 10.255 9.738 -9.496 440 HZ2 LYS 56 HZ2 LYS 56 10.088 8.391 -10.502 441 HZ3 LYS 56 HZ3 LYS 56 11.389 8.487 -9.429 442 HA PRO 57 HA PRO 57 11.612 2.395 -11.674 443 HB2 PRO 57 HB2 PRO 57 14.181 2.414 -10.780 444 HB3 PRO 57 HB1 PRO 57 13.348 3.870 -11.346 445 HG2 PRO 57 HG2 PRO 57 13.621 2.834 -8.537 446 HG3 PRO 57 HG1 PRO 57 14.011 4.460 -9.151 447 HD2 PRO 57 HD2 PRO 57 11.709 4.033 -7.938 448 HD3 PRO 57 HD1 PRO 57 11.712 4.990 -9.429 449 H LEU 58 HN LEU 58 12.058 1.157 -8.425 450 HA LEU 58 HA LEU 58 13.016 -1.438 -9.415 451 HB2 LEU 58 HB2 LEU 58 12.604 -0.969 -6.527 452 HB3 LEU 58 HB1 LEU 58 13.901 -1.844 -7.332 453 HG LEU 58 HG LEU 58 13.656 1.164 -7.119 454 HD11 LEU 58 HD11 LEU 58 14.057 0.183 -4.962 455 HD12 LEU 58 HD12 LEU 58 15.552 0.920 -5.545 456 HD13 LEU 58 HD13 LEU 58 15.342 -0.829 -5.619 457 HD21 LEU 58 HD21 LEU 58 15.961 1.183 -7.942 458 HD22 LEU 58 HD22 LEU 58 14.856 0.479 -9.123 459 HD23 LEU 58 HD23 LEU 58 15.901 -0.567 -8.157 460 H LYS 59 HN LYS 59 10.355 0.288 -8.390 461 HA LYS 59 HA LYS 59 8.784 -1.438 -6.962 462 HB2 LYS 59 HB2 LYS 59 8.060 0.792 -7.352 463 HB3 LYS 59 HB1 LYS 59 8.036 0.549 -9.089 464 HG2 LYS 59 HG2 LYS 59 5.813 0.415 -8.649 465 HG3 LYS 59 HG1 LYS 59 6.260 -1.274 -8.456 466 HD2 LYS 59 HD2 LYS 59 5.935 0.735 -6.254 467 HD3 LYS 59 HD1 LYS 59 4.805 -0.568 -6.637 468 HE2 LYS 59 HE2 LYS 59 7.056 -1.995 -6.330 469 HE3 LYS 59 HE1 LYS 59 7.430 -0.641 -5.257 470 HZ1 LYS 59 HZ1 LYS 59 6.332 -2.099 -3.866 471 HZ2 LYS 59 HZ2 LYS 59 5.279 -2.631 -5.076 472 HZ3 LYS 59 HZ3 LYS 59 5.043 -1.108 -4.373 473 H GLY 60 HN GLY 60 8.435 -3.492 -7.327 474 HA2 GLY 60 HA3 GLY 60 7.359 -5.288 -8.362 475 HA3 GLY 60 HA2 GLY 60 7.193 -4.324 -9.821 476 H LYS 61 HN LYS 61 10.214 -3.695 -9.384 477 HA LYS 61 HA LYS 61 11.106 -6.049 -10.902 478 HB2 LYS 61 HB2 LYS 61 12.803 -3.619 -10.710 479 HB3 LYS 61 HB1 LYS 61 12.467 -4.642 -12.098 480 HG2 LYS 61 HG2 LYS 61 10.553 -2.633 -10.955 481 HG3 LYS 61 HG1 LYS 61 11.611 -2.338 -12.323 482 HD2 LYS 61 HD2 LYS 61 9.542 -4.525 -12.228 483 HD3 LYS 61 HD1 LYS 61 9.263 -2.932 -12.933 484 HE2 LYS 61 HE2 LYS 61 11.131 -3.315 -14.476 485 HE3 LYS 61 HE1 LYS 61 11.345 -4.927 -13.796 486 HZ1 LYS 61 HZ1 LYS 61 10.062 -5.002 -15.835 487 HZ2 LYS 61 HZ2 LYS 61 8.915 -3.943 -15.190 488 HZ3 LYS 61 HZ3 LYS 61 9.107 -5.488 -14.526 489 H VAL 62 HN VAL 62 12.142 -7.487 -9.646 490 HA VAL 62 HA VAL 62 14.145 -6.422 -7.780 491 HB VAL 62 HB VAL 62 12.360 -7.463 -6.509 492 HG11 VAL 62 HG11 VAL 62 11.853 -9.861 -6.696 493 HG12 VAL 62 HG12 VAL 62 12.879 -9.947 -8.131 494 HG13 VAL 62 HG13 VAL 62 11.419 -8.959 -8.148 495 HG21 VAL 62 HG21 VAL 62 14.878 -9.113 -6.583 496 HG22 VAL 62 HG22 VAL 62 13.662 -9.211 -5.309 497 HG23 VAL 62 HG23 VAL 62 14.543 -7.706 -5.572 498 HA PRO 63 HA PRO 63 17.260 -8.765 -10.089 499 HB2 PRO 63 HB2 PRO 63 18.240 -9.190 -7.311 500 HB3 PRO 63 HB1 PRO 63 19.135 -8.700 -8.734 501 HG2 PRO 63 HG2 PRO 63 18.507 -6.915 -6.886 502 HG3 PRO 63 HG1 PRO 63 18.398 -6.498 -8.605 503 HD2 PRO 63 HD2 PRO 63 16.221 -7.120 -6.667 504 HD3 PRO 63 HD1 PRO 63 16.231 -5.982 -8.030 505 H ALA 64 HN ALA 64 17.383 -10.896 -10.581 506 HA ALA 64 HA ALA 64 15.467 -12.655 -9.464 507 HB1 ALA 64 HB1 ALA 64 17.768 -13.291 -11.304 508 HB2 ALA 64 HB2 ALA 64 16.160 -12.772 -11.809 509 HB3 ALA 64 HB3 ALA 64 16.372 -14.321 -10.990 510 H GLY 65 HN GLY 65 15.662 -13.478 -7.488 511 HA2 GLY 65 HA3 GLY 65 16.649 -15.206 -6.138 512 HA3 GLY 65 HA2 GLY 65 18.221 -14.753 -6.781 513 H SER 66 HN SER 66 17.225 -11.844 -6.398 514 HA SER 66 HA SER 66 18.214 -11.647 -3.664 515 HB2 SER 66 HB2 SER 66 17.638 -9.435 -5.642 516 HB3 SER 66 HB1 SER 66 18.578 -9.316 -4.152 517 HG SER 66 HG SER 66 19.921 -11.049 -5.222 518 H ASP 67 HN ASP 67 17.228 -9.743 -2.417 519 HA ASP 67 HA ASP 67 14.333 -10.117 -2.242 520 HB2 ASP 67 HB2 ASP 67 16.151 -9.991 -0.293 521 HB3 ASP 67 HB1 ASP 67 15.869 -8.270 -0.474 522 H VAL 68 HN VAL 68 12.838 -8.293 -2.443 523 HA VAL 68 HA VAL 68 13.992 -6.218 -4.108 524 HB VAL 68 HB VAL 68 11.972 -5.760 -4.895 525 HG11 VAL 68 HG11 VAL 68 10.262 -7.463 -4.683 526 HG12 VAL 68 HG12 VAL 68 11.095 -8.140 -3.286 527 HG13 VAL 68 HG13 VAL 68 11.860 -8.181 -4.868 528 HG21 VAL 68 HG21 VAL 68 10.982 -5.747 -2.054 529 HG22 VAL 68 HG22 VAL 68 9.964 -5.393 -3.452 530 HG23 VAL 68 HG23 VAL 68 11.348 -4.363 -3.084 531 H ILE 69 HN ILE 69 13.017 -6.711 -0.834 532 HA ILE 69 HA ILE 69 12.692 -4.047 -0.069 533 HB ILE 69 HB ILE 69 13.553 -6.459 1.505 534 HG12 ILE 69 HG12 ILE 69 11.298 -6.727 1.007 535 HG13 ILE 69 HG11 ILE 69 11.239 -5.915 2.556 536 HG21 ILE 69 HG21 ILE 69 13.060 -3.651 2.504 537 HG22 ILE 69 HG22 ILE 69 14.544 -4.595 2.634 538 HG23 ILE 69 HG23 ILE 69 13.111 -5.071 3.550 539 HD11 ILE 69 HD11 ILE 69 10.865 -4.635 -0.130 540 HD12 ILE 69 HD12 ILE 69 10.884 -3.776 1.410 541 HD13 ILE 69 HD13 ILE 69 9.616 -4.961 1.075 542 H SER 70 HN SER 70 15.466 -6.142 0.002 543 HA SER 70 HA SER 70 17.404 -4.527 1.026 544 HB2 SER 70 HB2 SER 70 17.767 -6.868 0.399 545 HB3 SER 70 HB1 SER 70 17.663 -6.452 -1.307 546 HG SER 70 HG SER 70 19.673 -5.836 -1.249 547 H GLU 71 HN GLU 71 16.006 -4.383 -2.201 548 HA GLU 71 HA GLU 71 17.863 -2.391 -3.153 549 HB2 GLU 71 HB2 GLU 71 15.315 -3.271 -4.472 550 HB3 GLU 71 HB1 GLU 71 16.795 -2.692 -5.229 551 HG2 GLU 71 HG2 GLU 71 16.981 -5.145 -3.606 552 HG3 GLU 71 HG1 GLU 71 16.124 -5.257 -5.136 553 H TYR 72 HN TYR 72 14.670 -2.602 -1.879 554 HA TYR 72 HA TYR 72 13.814 -0.017 -2.720 555 HB2 TYR 72 HB2 TYR 72 12.753 -2.097 -0.824 556 HB3 TYR 72 HB1 TYR 72 12.001 -0.514 -0.948 557 HD1 TYR 72 HD1 TYR 72 13.442 -1.877 -3.969 558 HD2 TYR 72 HD2 TYR 72 9.924 -1.675 -1.608 559 HE1 TYR 72 HE1 TYR 72 12.120 -2.662 -5.872 560 HE2 TYR 72 HE2 TYR 72 8.588 -2.473 -3.508 561 HH TYR 72 HH TYR 72 10.101 -3.652 -6.414 562 H VAL 73 HN VAL 73 15.141 -1.454 0.183 563 HA VAL 73 HA VAL 73 15.181 0.936 1.709 564 HB VAL 73 HB VAL 73 16.387 -0.124 3.339 565 HG11 VAL 73 HG11 VAL 73 14.369 -1.362 3.094 566 HG12 VAL 73 HG12 VAL 73 15.670 -2.458 3.544 567 HG13 VAL 73 HG13 VAL 73 15.105 -2.396 1.877 568 HG21 VAL 73 HG21 VAL 73 18.336 -0.591 1.825 569 HG22 VAL 73 HG22 VAL 73 17.579 -2.149 1.479 570 HG23 VAL 73 HG23 VAL 73 18.067 -1.745 3.133 571 H LYS 74 HN LYS 74 17.241 -0.594 -0.627 572 HA LYS 74 HA LYS 74 19.496 1.114 -0.399 573 HB2 LYS 74 HB2 LYS 74 18.754 -1.135 -1.879 574 HB3 LYS 74 HB1 LYS 74 18.986 0.137 -3.073 575 HG2 LYS 74 HG2 LYS 74 21.089 -0.738 -2.998 576 HG3 LYS 74 HG1 LYS 74 21.229 0.521 -1.774 577 HD2 LYS 74 HD2 LYS 74 20.540 -2.347 -1.171 578 HD3 LYS 74 HD1 LYS 74 22.179 -1.698 -1.109 579 HE2 LYS 74 HE2 LYS 74 19.865 -0.637 0.497 580 HE3 LYS 74 HE1 LYS 74 21.027 -1.817 1.102 581 HZ1 LYS 74 HZ1 LYS 74 21.765 0.886 0.117 582 HZ2 LYS 74 HZ2 LYS 74 22.779 -0.230 0.880 583 HZ3 LYS 74 HZ3 LYS 74 21.527 0.503 1.747 584 H ALA 75 HN ALA 75 16.433 1.253 -2.004 585 HA ALA 75 HA ALA 75 16.921 3.445 -3.726 586 HB1 ALA 75 HB1 ALA 75 14.470 3.678 -3.750 587 HB2 ALA 75 HB2 ALA 75 14.363 2.535 -2.409 588 HB3 ALA 75 HB3 ALA 75 14.980 2.006 -3.972 589 H CYS 76 HN CYS 76 15.639 3.220 -0.441 590 HA CYS 76 HA CYS 76 15.789 6.124 -0.147 591 HB2 CYS 76 HB2 CYS 76 13.805 5.123 0.693 592 HB3 CYS 76 HB1 CYS 76 14.698 3.930 1.620 593 HG CYS 76 HG CYS 76 15.861 6.232 3.139 594 H ASP 77 HN ASP 77 18.004 3.841 -0.083 595 HA ASP 77 HA ASP 77 19.394 4.109 2.311 596 HB2 ASP 77 HB2 ASP 77 20.102 2.420 0.857 597 HB3 ASP 77 HB1 ASP 77 20.255 3.504 -0.515 598 H GLY 78 HN GLY 78 19.102 6.278 -0.394 599 HA2 GLY 78 HA3 GLY 78 21.051 8.117 0.764 600 HA3 GLY 78 HA2 GLY 78 20.195 8.330 -0.756 601 H ILE 79 HN ILE 79 17.653 7.547 0.843 602 HA ILE 79 HA ILE 79 16.949 10.288 1.373 603 HB ILE 79 HB ILE 79 15.300 7.781 1.514 604 HG12 ILE 79 HG12 ILE 79 15.323 9.937 -0.599 605 HG13 ILE 79 HG11 ILE 79 16.188 8.406 -0.744 606 HG21 ILE 79 HG21 ILE 79 14.364 9.520 2.931 607 HG22 ILE 79 HG22 ILE 79 13.354 9.263 1.506 608 HG23 ILE 79 HG23 ILE 79 14.424 10.662 1.588 609 HD11 ILE 79 HD11 ILE 79 13.931 8.597 -1.861 610 HD12 ILE 79 HD12 ILE 79 13.244 8.527 -0.241 611 HD13 ILE 79 HD13 ILE 79 14.209 7.181 -0.850 612 H GLY 80 HN GLY 80 16.846 11.206 3.297 613 HA2 GLY 80 HA3 GLY 80 15.716 10.275 5.578 614 HA3 GLY 80 HA2 GLY 80 17.375 9.716 5.688 615 H GLY 81 HN GLY 81 16.440 12.691 4.122 616 HA2 GLY 81 HA3 GLY 81 16.231 14.641 5.812 617 HA3 GLY 81 HA2 GLY 81 17.888 14.190 6.178 618 H ALA 82 HN ALA 82 19.512 14.860 4.857 619 HA ALA 82 HA ALA 82 19.105 17.243 3.480 620 HB1 ALA 82 HB1 ALA 82 21.427 17.100 2.828 621 HB2 ALA 82 HB2 ALA 82 21.454 15.387 3.243 622 HB3 ALA 82 HB3 ALA 82 21.222 16.595 4.506 623 H MET 83 HN MET 83 19.910 14.064 2.061 624 HA MET 83 HA MET 83 19.661 14.994 -0.610 625 HB2 MET 83 HB2 MET 83 19.461 12.158 0.421 626 HB3 MET 83 HB1 MET 83 19.702 12.629 -1.254 627 HG2 MET 83 HG2 MET 83 21.837 13.679 -0.616 628 HG3 MET 83 HG1 MET 83 21.602 13.095 1.026 629 HE1 MET 83 HE1 MET 83 23.986 11.919 0.941 630 HE2 MET 83 HE2 MET 83 24.217 12.485 -0.713 631 HE3 MET 83 HE3 MET 83 24.472 10.786 -0.319 632 H HIS 84 HN HIS 84 17.450 13.614 1.696 633 HA HIS 84 HA HIS 84 15.262 13.047 0.039 634 HB2 HIS 84 HB2 HIS 84 15.190 12.286 2.302 635 HB3 HIS 84 HB1 HIS 84 15.470 13.903 2.932 636 HD1 HIS 84 HD1 HIS 84 13.416 14.368 4.243 637 HD2 HIS 84 HD2 HIS 84 12.550 12.838 0.485 638 HE1 HIS 84 HE1 HIS 84 10.927 14.530 4.009 639 HE2 HIS 84 HE2 HIS 84 10.407 13.478 1.778 640 H LYS 85 HN LYS 85 16.381 16.109 1.425 641 HA LYS 85 HA LYS 85 13.985 17.489 0.608 642 HB2 LYS 85 HB2 LYS 85 16.601 18.680 1.538 643 HB3 LYS 85 HB1 LYS 85 15.033 19.479 1.487 644 HG2 LYS 85 HG2 LYS 85 15.787 17.152 3.243 645 HG3 LYS 85 HG1 LYS 85 15.586 18.828 3.756 646 HD2 LYS 85 HD2 LYS 85 13.224 18.727 3.168 647 HD3 LYS 85 HD1 LYS 85 13.429 17.074 2.581 648 HE2 LYS 85 HE2 LYS 85 12.523 16.895 4.765 649 HE3 LYS 85 HE1 LYS 85 14.230 16.468 4.889 650 HZ1 LYS 85 HZ1 LYS 85 13.082 19.126 5.558 651 HZ2 LYS 85 HZ2 LYS 85 14.701 18.675 5.719 652 HZ3 LYS 85 HZ3 LYS 85 13.520 17.942 6.682 653 H ALA 86 HN ALA 86 16.951 16.626 -0.822 654 HA ALA 86 HA ALA 86 16.834 18.633 -2.912 655 HB1 ALA 86 HB1 ALA 86 18.998 17.777 -2.079 656 HB2 ALA 86 HB2 ALA 86 18.794 17.543 -3.814 657 HB3 ALA 86 HB3 ALA 86 18.583 16.183 -2.710 658 H MET 87 HN MET 87 16.204 15.205 -2.485 659 HA MET 87 HA MET 87 15.523 14.826 -5.275 660 HB2 MET 87 HB2 MET 87 15.422 12.920 -2.925 661 HB3 MET 87 HB1 MET 87 15.195 12.473 -4.614 662 HG2 MET 87 HG2 MET 87 17.644 13.900 -4.377 663 HG3 MET 87 HG1 MET 87 17.600 12.646 -3.141 664 HE1 MET 87 HE1 MET 87 17.143 11.833 -7.663 665 HE2 MET 87 HE2 MET 87 17.414 13.433 -6.974 666 HE3 MET 87 HE3 MET 87 15.884 12.600 -6.697 667 H LEU 88 HN LEU 88 13.908 15.742 -2.463 668 HA LEU 88 HA LEU 88 11.449 14.599 -2.544 669 HB2 LEU 88 HB2 LEU 88 12.503 16.473 -1.066 670 HB3 LEU 88 HB1 LEU 88 11.689 17.555 -2.176 671 HG LEU 88 HG LEU 88 9.713 17.252 -1.161 672 HD11 LEU 88 HD11 LEU 88 9.402 15.075 -2.246 673 HD12 LEU 88 HD12 LEU 88 8.770 15.068 -0.601 674 HD13 LEU 88 HD13 LEU 88 10.316 14.301 -0.951 675 HD21 LEU 88 HD21 LEU 88 11.458 15.759 0.771 676 HD22 LEU 88 HD22 LEU 88 9.848 16.387 1.139 677 HD23 LEU 88 HD23 LEU 88 11.165 17.496 0.749 678 H MET 89 HN MET 89 12.515 17.396 -4.490 679 HA MET 89 HA MET 89 9.956 17.594 -5.808 680 HB2 MET 89 HB2 MET 89 11.385 19.579 -5.352 681 HB3 MET 89 HB1 MET 89 12.566 18.959 -6.493 682 HG2 MET 89 HG2 MET 89 10.956 19.151 -8.298 683 HG3 MET 89 HG1 MET 89 9.731 19.714 -7.164 684 HE1 MET 89 HE1 MET 89 9.289 21.804 -8.742 685 HE2 MET 89 HE2 MET 89 10.541 21.255 -9.857 686 HE3 MET 89 HE3 MET 89 10.549 22.918 -9.270 687 H ALA 90 HN ALA 90 12.712 15.689 -6.187 688 HA ALA 90 HA ALA 90 12.497 15.456 -9.082 689 HB1 ALA 90 HB1 ALA 90 14.703 15.530 -7.968 690 HB2 ALA 90 HB2 ALA 90 14.465 14.071 -8.929 691 HB3 ALA 90 HB3 ALA 90 14.320 14.003 -7.169 692 H GLN 91 HN GLN 91 12.059 13.442 -6.202 693 HA GLN 91 HA GLN 91 11.272 11.210 -7.917 694 HB2 GLN 91 HB2 GLN 91 11.911 11.282 -4.980 695 HB3 GLN 91 HB1 GLN 91 11.599 9.838 -5.933 696 HG2 GLN 91 HG2 GLN 91 13.555 10.259 -7.269 697 HG3 GLN 91 HG1 GLN 91 13.844 11.761 -6.393 698 HE21 GLN 91 HE21 GLN 91 13.154 10.857 -3.850 699 HE22 GLN 91 HE22 GLN 91 14.326 9.702 -3.343 700 H LEU 92 HN LEU 92 10.134 12.818 -4.929 701 HA LEU 92 HA LEU 92 7.795 11.510 -4.443 702 HB2 LEU 92 HB2 LEU 92 8.888 13.669 -3.391 703 HB3 LEU 92 HB1 LEU 92 7.753 14.500 -4.426 704 HG LEU 92 HG LEU 92 7.282 12.954 -1.940 705 HD11 LEU 92 HD11 LEU 92 5.984 15.362 -3.187 706 HD12 LEU 92 HD12 LEU 92 7.252 15.375 -1.964 707 HD13 LEU 92 HD13 LEU 92 5.657 14.731 -1.572 708 HD21 LEU 92 HD21 LEU 92 5.958 11.621 -3.455 709 HD22 LEU 92 HD22 LEU 92 5.250 13.070 -4.166 710 HD23 LEU 92 HD23 LEU 92 4.893 12.644 -2.492 711 H GLU 93 HN GLU 93 8.565 13.756 -6.950 712 HA GLU 93 HA GLU 93 7.374 14.877 -8.518 713 HB2 GLU 93 HB2 GLU 93 6.816 11.995 -8.724 714 HB3 GLU 93 HB1 GLU 93 6.217 13.089 -9.963 715 HG2 GLU 93 HG2 GLU 93 9.094 13.040 -9.134 716 HG3 GLU 93 HG1 GLU 93 8.465 11.895 -10.307 717 H2 PRO 1 HT1 PRO 1 5.482 -3.962 -13.361 718 H3 PRO 1 HT2 PRO 1 5.946 -2.476 -13.862 719 HA PRO 1 HA PRO 1 6.693 -2.426 -11.832 720 HB2 PRO 1 HB2 PRO 1 4.672 -1.330 -10.461 721 HB3 PRO 1 HB1 PRO 1 5.419 -0.486 -11.822 722 HG2 PRO 1 HG2 PRO 1 2.789 -1.778 -11.649 723 HG3 PRO 1 HG1 PRO 1 3.371 -0.561 -12.799 724 HD2 PRO 1 HD2 PRO 1 3.185 -3.446 -13.115 725 HD3 PRO 1 HD1 PRO 1 3.584 -2.218 -14.334 726 H SER 2 HN SER 2 4.988 -2.504 -9.401 727 HA SER 2 HA SER 2 4.671 -5.252 -8.829 728 HB2 SER 2 HB2 SER 2 3.246 -2.865 -7.653 729 HB3 SER 2 HB1 SER 2 3.244 -4.484 -6.971 730 HG SER 2 HG SER 2 5.587 -4.282 -6.877 731 H PHE 3 HN PHE 3 2.317 -6.028 -8.235 732 HA PHE 3 HA PHE 3 0.751 -5.822 -10.616 733 HB2 PHE 3 HB2 PHE 3 -0.880 -6.867 -8.647 734 HB3 PHE 3 HB1 PHE 3 0.093 -7.800 -9.792 735 HD1 PHE 3 HD1 PHE 3 -0.525 -6.816 -6.437 736 HD2 PHE 3 HD2 PHE 3 2.354 -8.642 -8.977 737 HE1 PHE 3 HE1 PHE 3 0.564 -7.799 -4.505 738 HE2 PHE 3 HE2 PHE 3 3.478 -9.618 -7.019 739 HZ PHE 3 HZ PHE 3 2.578 -9.197 -4.762 740 H ASN 4 HN ASN 4 0.377 -4.785 -7.274 741 HA ASN 4 HA ASN 4 -2.283 -3.798 -7.819 742 HB2 ASN 4 HB2 ASN 4 -2.345 -3.426 -5.386 743 HB3 ASN 4 HB1 ASN 4 -1.871 -5.074 -5.795 744 HD21 ASN 4 HD21 ASN 4 -0.586 -1.898 -4.935 745 HD22 ASN 4 HD22 ASN 4 0.844 -2.500 -4.163 746 H THR 5 HN THR 5 0.548 -2.395 -8.419 747 HA THR 5 HA THR 5 0.534 -0.015 -6.907 748 HB THR 5 HB THR 5 1.706 0.785 -9.163 749 HG1 THR 5 HG1 THR 5 1.318 -1.007 -10.424 750 HG21 THR 5 HG21 THR 5 2.792 -1.080 -7.085 751 HG22 THR 5 HG22 THR 5 2.862 0.683 -7.100 752 HG23 THR 5 HG23 THR 5 3.798 -0.250 -8.271 753 H VAL 6 HN VAL 6 -1.691 -1.087 -9.154 754 HA VAL 6 HA VAL 6 -2.427 1.433 -10.256 755 HB VAL 6 HB VAL 6 -4.231 0.344 -11.268 756 HG11 VAL 6 HG11 VAL 6 -2.156 -1.800 -10.903 757 HG12 VAL 6 HG12 VAL 6 -2.132 -0.517 -12.114 758 HG13 VAL 6 HG13 VAL 6 -3.383 -1.759 -12.170 759 HG21 VAL 6 HG21 VAL 6 -5.330 -1.635 -10.509 760 HG22 VAL 6 HG22 VAL 6 -5.161 -0.545 -9.122 761 HG23 VAL 6 HG23 VAL 6 -4.073 -1.926 -9.300 762 H ARG 7 HN ARG 7 -3.738 2.942 -9.316 763 HA ARG 7 HA ARG 7 -5.503 2.072 -7.240 764 HB2 ARG 7 HB2 ARG 7 -4.541 3.654 -5.551 765 HB3 ARG 7 HB1 ARG 7 -3.702 2.157 -5.882 766 HG2 ARG 7 HG2 ARG 7 -2.540 3.988 -7.588 767 HG3 ARG 7 HG1 ARG 7 -2.755 4.835 -6.052 768 HD2 ARG 7 HD2 ARG 7 -1.689 2.959 -4.887 769 HD3 ARG 7 HD1 ARG 7 -1.431 2.151 -6.433 770 HE ARG 7 HE ARG 7 -0.120 4.318 -6.957 771 HH11 ARG 7 HH11 ARG 7 -0.237 2.680 -3.867 772 HH12 ARG 7 HH12 ARG 7 1.233 3.379 -3.295 773 HH21 ARG 7 HH21 ARG 7 1.822 5.255 -6.205 774 HH22 ARG 7 HH22 ARG 7 2.410 4.857 -4.627 775 H GLN 8 HN GLN 8 -6.782 3.650 -6.327 776 HA GLN 8 HA GLN 8 -8.337 5.034 -7.991 777 HB2 GLN 8 HB2 GLN 8 -8.008 4.773 -5.192 778 HB3 GLN 8 HB1 GLN 8 -8.283 6.481 -5.521 779 HG2 GLN 8 HG2 GLN 8 -10.313 5.940 -6.736 780 HG3 GLN 8 HG1 GLN 8 -10.032 4.221 -6.462 781 HE21 GLN 8 HE21 GLN 8 -12.282 5.863 -5.689 782 HE22 GLN 8 HE22 GLN 8 -12.385 5.758 -3.954 783 H GLY 9 HN GLY 9 -7.872 6.512 -9.423 784 HA2 GLY 9 HA3 GLY 9 -5.938 8.615 -8.908 785 HA3 GLY 9 HA2 GLY 9 -6.870 8.377 -10.380 786 H SER 10 HN SER 10 -7.677 10.427 -10.632 787 HA SER 10 HA SER 10 -8.666 12.039 -8.553 788 HB2 SER 10 HB2 SER 10 -9.442 12.104 -11.480 789 HB3 SER 10 HB1 SER 10 -9.614 13.422 -10.319 790 HG SER 10 HG SER 10 -7.074 12.504 -10.336 791 H LYS 11 HN LYS 11 -10.099 11.124 -7.231 792 HA LYS 11 HA LYS 11 -11.852 9.921 -6.435 793 HB2 LYS 11 HB2 LYS 11 -13.989 10.908 -6.900 794 HB3 LYS 11 HB1 LYS 11 -12.799 12.174 -6.752 795 HG2 LYS 11 HG2 LYS 11 -12.747 12.478 -9.103 796 HG3 LYS 11 HG1 LYS 11 -13.762 11.074 -9.380 797 HD2 LYS 11 HD2 LYS 11 -15.610 12.209 -8.234 798 HD3 LYS 11 HD1 LYS 11 -14.580 13.619 -7.983 799 HE2 LYS 11 HE2 LYS 11 -14.362 13.917 -10.384 800 HE3 LYS 11 HE1 LYS 11 -15.325 12.470 -10.669 801 HZ1 LYS 11 HZ1 LYS 11 -17.211 13.552 -9.646 802 HZ2 LYS 11 HZ2 LYS 11 -16.626 14.494 -10.922 803 HZ3 LYS 11 HZ3 LYS 11 -16.291 14.934 -9.327 804 H GLU 12 HN GLU 12 -10.604 8.413 -8.350 805 HA GLU 12 HA GLU 12 -12.208 7.313 -10.353 806 HB2 GLU 12 HB2 GLU 12 -9.800 6.927 -10.160 807 HB3 GLU 12 HB1 GLU 12 -10.034 6.048 -8.662 808 HG2 GLU 12 HG2 GLU 12 -11.241 4.299 -9.883 809 HG3 GLU 12 HG1 GLU 12 -10.997 5.195 -11.384 810 HA PRO 13 HA PRO 13 -15.439 5.159 -8.143 811 HB2 PRO 13 HB2 PRO 13 -15.062 3.029 -10.148 812 HB3 PRO 13 HB1 PRO 13 -16.523 3.925 -9.735 813 HG2 PRO 13 HG2 PRO 13 -15.169 4.356 -12.021 814 HG3 PRO 13 HG1 PRO 13 -16.034 5.639 -11.166 815 HD2 PRO 13 HD2 PRO 13 -13.123 5.122 -11.357 816 HD3 PRO 13 HD1 PRO 13 -13.987 6.654 -11.152 817 H TYR 14 HN TYR 14 -15.188 3.924 -6.387 818 HA TYR 14 HA TYR 14 -12.578 2.943 -5.968 819 HB2 TYR 14 HB2 TYR 14 -13.782 4.109 -4.206 820 HB3 TYR 14 HB1 TYR 14 -14.966 2.808 -4.136 821 HD1 TYR 14 HD1 TYR 14 -14.024 0.468 -3.723 822 HD2 TYR 14 HD2 TYR 14 -11.932 4.021 -2.781 823 HE1 TYR 14 HE1 TYR 14 -12.652 -0.801 -2.167 824 HE2 TYR 14 HE2 TYR 14 -10.522 2.775 -1.200 825 HH TYR 14 HH TYR 14 -10.216 0.789 -0.187 826 HA PRO 15 HA PRO 15 -14.712 -1.441 -5.446 827 HB2 PRO 15 HB2 PRO 15 -16.852 -1.192 -7.456 828 HB3 PRO 15 HB1 PRO 15 -16.876 -1.989 -5.887 829 HG2 PRO 15 HG2 PRO 15 -18.144 0.332 -6.339 830 HG3 PRO 15 HG1 PRO 15 -17.453 -0.085 -4.776 831 HD2 PRO 15 HD2 PRO 15 -16.477 1.826 -6.821 832 HD3 PRO 15 HD1 PRO 15 -16.292 1.856 -5.063 833 H ASP 16 HN ASP 16 -14.423 0.559 -8.126 834 HA ASP 16 HA ASP 16 -13.704 -1.542 -9.986 835 HB2 ASP 16 HB2 ASP 16 -14.351 1.352 -10.223 836 HB3 ASP 16 HB1 ASP 16 -13.313 0.646 -11.455 837 H PHE 17 HN PHE 17 -12.283 1.212 -8.315 838 HA PHE 17 HA PHE 17 -9.698 1.086 -9.361 839 HB2 PHE 17 HB2 PHE 17 -9.543 2.859 -7.953 840 HB3 PHE 17 HB1 PHE 17 -11.016 2.371 -7.127 841 HD1 PHE 17 HD1 PHE 17 -10.943 1.349 -4.997 842 HD2 PHE 17 HD2 PHE 17 -7.356 1.970 -7.182 843 HE1 PHE 17 HE1 PHE 17 -9.635 0.762 -3.005 844 HE2 PHE 17 HE2 PHE 17 -6.034 1.400 -5.191 845 HZ PHE 17 HZ PHE 17 -7.172 0.796 -3.097 846 H VAL 18 HN VAL 18 -11.232 -0.639 -6.700 847 HA VAL 18 HA VAL 18 -8.867 -2.112 -6.093 848 HB VAL 18 HB VAL 18 -10.234 -1.755 -4.213 849 HG11 VAL 18 HG11 VAL 18 -12.333 -1.358 -5.553 850 HG12 VAL 18 HG12 VAL 18 -12.550 -2.301 -4.065 851 HG13 VAL 18 HG13 VAL 18 -12.506 -3.117 -5.638 852 HG21 VAL 18 HG21 VAL 18 -10.923 -4.058 -3.577 853 HG22 VAL 18 HG22 VAL 18 -9.277 -3.942 -4.203 854 HG23 VAL 18 HG23 VAL 18 -10.573 -4.562 -5.236 855 H ALA 19 HN ALA 19 -11.809 -2.724 -7.917 856 HA ALA 19 HA ALA 19 -11.493 -5.431 -8.432 857 HB1 ALA 19 HB1 ALA 19 -13.468 -4.138 -9.112 858 HB2 ALA 19 HB2 ALA 19 -12.812 -5.097 -10.439 859 HB3 ALA 19 HB3 ALA 19 -12.511 -3.361 -10.373 860 H ARG 20 HN ARG 20 -9.759 -2.714 -9.905 861 HA ARG 20 HA ARG 20 -8.480 -4.560 -11.746 862 HB2 ARG 20 HB2 ARG 20 -7.199 -2.636 -12.567 863 HB3 ARG 20 HB1 ARG 20 -8.924 -2.349 -12.638 864 HG2 ARG 20 HG2 ARG 20 -8.860 -0.747 -10.980 865 HG3 ARG 20 HG1 ARG 20 -7.337 -1.348 -10.315 866 HD2 ARG 20 HD2 ARG 20 -6.106 -0.513 -12.173 867 HD3 ARG 20 HD1 ARG 20 -7.575 -0.142 -13.056 868 HE ARG 20 HE ARG 20 -7.880 1.460 -10.974 869 HH11 ARG 20 HH11 ARG 20 -5.038 0.821 -12.921 870 HH12 ARG 20 HH12 ARG 20 -4.354 2.393 -12.667 871 HH21 ARG 20 HH21 ARG 20 -6.996 3.552 -10.673 872 HH22 ARG 20 HH22 ARG 20 -5.459 3.937 -11.388 873 H LEU 21 HN LEU 21 -8.012 -2.991 -8.728 874 HA LEU 21 HA LEU 21 -5.347 -3.480 -8.207 875 HB2 LEU 21 HB2 LEU 21 -7.320 -2.443 -6.799 876 HB3 LEU 21 HB1 LEU 21 -7.443 -4.060 -6.106 877 HG LEU 21 HG LEU 21 -5.414 -3.849 -5.004 878 HD11 LEU 21 HD11 LEU 21 -4.743 -1.640 -6.935 879 HD12 LEU 21 HD12 LEU 21 -3.958 -3.216 -6.794 880 HD13 LEU 21 HD13 LEU 21 -3.774 -2.019 -5.508 881 HD21 LEU 21 HD21 LEU 21 -5.441 -1.619 -3.947 882 HD22 LEU 21 HD22 LEU 21 -7.030 -2.385 -4.024 883 HD23 LEU 21 HD23 LEU 21 -6.611 -1.102 -5.160 884 H GLN 22 HN GLN 22 -8.162 -5.514 -7.773 885 HA GLN 22 HA GLN 22 -6.822 -7.853 -7.027 886 HB2 GLN 22 HB2 GLN 22 -9.495 -7.653 -8.407 887 HB3 GLN 22 HB1 GLN 22 -8.907 -8.945 -7.361 888 HG2 GLN 22 HG2 GLN 22 -8.720 -7.138 -5.611 889 HG3 GLN 22 HG1 GLN 22 -9.752 -6.184 -6.650 890 HE21 GLN 22 HE21 GLN 22 -11.273 -6.177 -4.929 891 HE22 GLN 22 HE22 GLN 22 -12.305 -7.533 -4.672 892 H ASP 23 HN ASP 23 -8.201 -6.784 -10.091 893 HA ASP 23 HA ASP 23 -7.779 -8.988 -11.653 894 HB2 ASP 23 HB2 ASP 23 -8.797 -6.743 -12.259 895 HB3 ASP 23 HB1 ASP 23 -7.150 -6.235 -12.622 896 H VAL 24 HN VAL 24 -5.338 -6.433 -11.125 897 HA VAL 24 HA VAL 24 -3.563 -7.748 -13.007 898 HB VAL 24 HB VAL 24 -3.625 -5.327 -13.105 899 HG11 VAL 24 HG11 VAL 24 -4.353 -4.884 -10.844 900 HG12 VAL 24 HG12 VAL 24 -2.905 -3.946 -11.214 901 HG13 VAL 24 HG13 VAL 24 -2.785 -5.399 -10.222 902 HG21 VAL 24 HG21 VAL 24 -1.455 -6.253 -13.622 903 HG22 VAL 24 HG22 VAL 24 -1.042 -6.344 -11.911 904 HG23 VAL 24 HG23 VAL 24 -1.207 -4.771 -12.693 905 H ALA 25 HN ALA 25 -4.083 -7.418 -9.647 906 HA ALA 25 HA ALA 25 -1.505 -8.487 -8.871 907 HB1 ALA 25 HB1 ALA 25 -3.997 -8.223 -7.243 908 HB2 ALA 25 HB2 ALA 25 -2.874 -6.883 -7.541 909 HB3 ALA 25 HB3 ALA 25 -2.325 -8.327 -6.685 910 H GLN 26 HN GLN 26 -4.516 -9.558 -9.991 911 HA GLN 26 HA GLN 26 -4.218 -12.278 -9.085 912 HB2 GLN 26 HB2 GLN 26 -6.395 -12.186 -9.591 913 HB3 GLN 26 HB1 GLN 26 -6.152 -10.634 -10.375 914 HG2 GLN 26 HG2 GLN 26 -6.981 -11.790 -12.141 915 HG3 GLN 26 HG1 GLN 26 -5.278 -12.187 -12.337 916 HE21 GLN 26 HE21 GLN 26 -5.322 -13.922 -9.976 917 HE22 GLN 26 HE22 GLN 26 -6.098 -15.370 -10.478 918 H LYS 27 HN LYS 27 -3.602 -10.362 -11.927 919 HA LYS 27 HA LYS 27 -2.694 -12.372 -13.658 920 HB2 LYS 27 HB2 LYS 27 -1.765 -9.502 -13.494 921 HB3 LYS 27 HB1 LYS 27 -1.680 -10.557 -14.912 922 HG2 LYS 27 HG2 LYS 27 -4.191 -9.578 -13.574 923 HG3 LYS 27 HG1 LYS 27 -3.528 -8.996 -15.104 924 HD2 LYS 27 HD2 LYS 27 -4.101 -10.936 -16.231 925 HD3 LYS 27 HD1 LYS 27 -4.158 -11.897 -14.752 926 HE2 LYS 27 HE2 LYS 27 -6.188 -10.898 -14.072 927 HE3 LYS 27 HE1 LYS 27 -6.077 -9.666 -15.324 928 HZ1 LYS 27 HZ1 LYS 27 -7.672 -11.326 -15.962 929 HZ2 LYS 27 HZ2 LYS 27 -6.552 -12.570 -15.728 930 HZ3 LYS 27 HZ3 LYS 27 -6.328 -11.460 -16.981 931 H SER 28 HN SER 28 -1.115 -10.693 -11.029 932 HA SER 28 HA SER 28 1.444 -11.829 -11.875 933 HB2 SER 28 HB2 SER 28 0.874 -9.572 -9.963 934 HB3 SER 28 HB1 SER 28 2.477 -10.102 -10.481 935 HG SER 28 HG SER 28 0.438 -9.129 -12.209 936 H ILE 29 HN ILE 29 -1.069 -12.205 -9.689 937 HA ILE 29 HA ILE 29 0.675 -13.715 -7.846 938 HB ILE 29 HB ILE 29 -1.986 -12.421 -7.269 939 HG12 ILE 29 HG12 ILE 29 0.708 -11.834 -6.051 940 HG13 ILE 29 HG11 ILE 29 -0.057 -10.892 -7.334 941 HG21 ILE 29 HG21 ILE 29 -1.732 -13.142 -4.977 942 HG22 ILE 29 HG22 ILE 29 -0.259 -14.023 -5.407 943 HG23 ILE 29 HG23 ILE 29 -1.814 -14.518 -6.077 944 HD11 ILE 29 HD11 ILE 29 -1.766 -10.165 -5.985 945 HD12 ILE 29 HD12 ILE 29 -0.335 -10.075 -4.945 946 HD13 ILE 29 HD13 ILE 29 -1.471 -11.424 -4.774 947 H ALA 30 HN ALA 30 0.466 -15.843 -8.099 948 HA ALA 30 HA ALA 30 -1.952 -16.974 -9.247 949 HB1 ALA 30 HB1 ALA 30 0.239 -17.792 -9.972 950 HB2 ALA 30 HB2 ALA 30 -0.723 -19.074 -9.237 951 HB3 ALA 30 HB3 ALA 30 0.582 -18.317 -8.324 952 H ASP 31 HN ASP 31 -1.071 -15.950 -6.301 953 HA ASP 31 HA ASP 31 -2.156 -18.190 -4.764 954 HB2 ASP 31 HB2 ASP 31 0.004 -16.922 -4.178 955 HB3 ASP 31 HB1 ASP 31 -1.074 -15.628 -3.669 956 H GLU 32 HN GLU 32 -4.219 -18.182 -4.192 957 HA GLU 32 HA GLU 32 -5.924 -15.969 -4.715 958 HB2 GLU 32 HB2 GLU 32 -7.667 -17.339 -3.662 959 HB3 GLU 32 HB1 GLU 32 -6.724 -18.283 -4.805 960 HG2 GLU 32 HG2 GLU 32 -5.404 -19.173 -2.901 961 HG3 GLU 32 HG1 GLU 32 -6.493 -18.319 -1.807 962 H LYS 33 HN LYS 33 -3.959 -16.804 -2.015 963 HA LYS 33 HA LYS 33 -5.618 -15.355 -0.113 964 HB2 LYS 33 HB2 LYS 33 -2.865 -16.560 0.218 965 HB3 LYS 33 HB1 LYS 33 -3.789 -15.802 1.504 966 HG2 LYS 33 HG2 LYS 33 -4.366 -17.925 1.950 967 HG3 LYS 33 HG1 LYS 33 -5.561 -17.638 0.683 968 HD2 LYS 33 HD2 LYS 33 -4.401 -19.762 0.341 969 HD3 LYS 33 HD1 LYS 33 -4.065 -18.626 -0.966 970 HE2 LYS 33 HE2 LYS 33 -2.073 -19.892 -0.190 971 HE3 LYS 33 HE1 LYS 33 -1.894 -18.146 -0.087 972 HZ1 LYS 33 HZ1 LYS 33 -2.402 -20.041 2.137 973 HZ2 LYS 33 HZ2 LYS 33 -2.508 -18.364 2.308 974 HZ3 LYS 33 HZ3 LYS 33 -1.029 -19.074 1.894 975 H ALA 34 HN ALA 34 -2.359 -15.136 -1.459 976 HA ALA 34 HA ALA 34 -1.750 -12.581 -0.536 977 HB1 ALA 34 HB1 ALA 34 -0.128 -14.169 -1.539 978 HB2 ALA 34 HB2 ALA 34 -0.003 -12.531 -2.178 979 HB3 ALA 34 HB3 ALA 34 -0.797 -13.787 -3.124 980 H ARG 35 HN ARG 35 -3.844 -13.584 -3.142 981 HA ARG 35 HA ARG 35 -3.865 -11.061 -4.453 982 HB2 ARG 35 HB2 ARG 35 -5.010 -13.572 -4.990 983 HB3 ARG 35 HB1 ARG 35 -6.371 -12.481 -4.763 984 HG2 ARG 35 HG2 ARG 35 -4.148 -11.659 -6.614 985 HG3 ARG 35 HG1 ARG 35 -5.316 -12.840 -7.145 986 HD2 ARG 35 HD2 ARG 35 -5.940 -10.674 -7.905 987 HD3 ARG 35 HD1 ARG 35 -7.109 -11.253 -6.762 988 HE ARG 35 HE ARG 35 -6.879 -9.141 -6.081 989 HH11 ARG 35 HH11 ARG 35 -3.686 -10.566 -5.795 990 HH12 ARG 35 HH12 ARG 35 -3.002 -9.134 -5.138 991 HH21 ARG 35 HH21 ARG 35 -5.899 -7.224 -5.401 992 HH22 ARG 35 HH22 ARG 35 -4.234 -7.231 -4.969 993 H LYS 36 HN LYS 36 -6.273 -12.631 -2.341 994 HA LYS 36 HA LYS 36 -7.952 -10.449 -1.977 995 HB2 LYS 36 HB2 LYS 36 -7.183 -12.396 0.178 996 HB3 LYS 36 HB1 LYS 36 -8.657 -11.440 0.089 997 HG2 LYS 36 HG2 LYS 36 -9.638 -12.832 -1.352 998 HG3 LYS 36 HG1 LYS 36 -8.109 -13.237 -2.168 999 HD2 LYS 36 HD2 LYS 36 -8.898 -15.154 -0.925 1000 HD3 LYS 36 HD1 LYS 36 -7.418 -14.493 -0.191 1001 HE2 LYS 36 HE2 LYS 36 -9.092 -13.124 1.290 1002 HE3 LYS 36 HE1 LYS 36 -10.274 -14.323 0.759 1003 HZ1 LYS 36 HZ1 LYS 36 -8.890 -16.081 1.655 1004 HZ2 LYS 36 HZ2 LYS 36 -9.274 -14.960 2.860 1005 HZ3 LYS 36 HZ3 LYS 36 -7.736 -14.952 2.163 1006 H VAL 37 HN VAL 37 -5.218 -11.480 0.028 1007 HA VAL 37 HA VAL 37 -5.571 -9.577 2.001 1008 HB VAL 37 HB VAL 37 -3.327 -9.999 2.762 1009 HG11 VAL 37 HG11 VAL 37 -4.813 -11.766 3.270 1010 HG12 VAL 37 HG12 VAL 37 -3.309 -12.514 2.729 1011 HG13 VAL 37 HG13 VAL 37 -4.695 -12.429 1.638 1012 HG21 VAL 37 HG21 VAL 37 -1.772 -11.418 1.413 1013 HG22 VAL 37 HG22 VAL 37 -2.038 -9.795 0.776 1014 HG23 VAL 37 HG23 VAL 37 -2.849 -11.175 0.037 1015 H ILE 38 HN ILE 38 -3.830 -9.355 -1.064 1016 HA ILE 38 HA ILE 38 -3.019 -6.688 -0.409 1017 HB ILE 38 HB ILE 38 -2.020 -8.655 -2.140 1018 HG12 ILE 38 HG12 ILE 38 -1.283 -5.846 -1.407 1019 HG13 ILE 38 HG11 ILE 38 -0.738 -7.323 -0.652 1020 HG21 ILE 38 HG21 ILE 38 -1.613 -7.276 -4.199 1021 HG22 ILE 38 HG22 ILE 38 -2.874 -6.176 -3.622 1022 HG23 ILE 38 HG23 ILE 38 -3.267 -7.853 -3.991 1023 HD11 ILE 38 HD11 ILE 38 0.523 -7.888 -2.650 1024 HD12 ILE 38 HD12 ILE 38 1.014 -6.333 -1.975 1025 HD13 ILE 38 HD13 ILE 38 -0.019 -6.385 -3.404 1026 H VAL 39 HN VAL 39 -5.615 -8.153 -2.389 1027 HA VAL 39 HA VAL 39 -6.446 -5.724 -3.515 1028 HB VAL 39 HB VAL 39 -8.538 -6.563 -3.984 1029 HG11 VAL 39 HG11 VAL 39 -8.451 -8.978 -4.399 1030 HG12 VAL 39 HG12 VAL 39 -6.976 -9.067 -3.437 1031 HG13 VAL 39 HG13 VAL 39 -7.009 -8.125 -4.919 1032 HG21 VAL 39 HG21 VAL 39 -8.528 -8.461 -1.647 1033 HG22 VAL 39 HG22 VAL 39 -9.863 -8.120 -2.750 1034 HG23 VAL 39 HG23 VAL 39 -9.294 -6.873 -1.640 1035 H GLU 40 HN GLU 40 -7.433 -7.231 -0.506 1036 HA GLU 40 HA GLU 40 -8.960 -5.200 0.530 1037 HB2 GLU 40 HB2 GLU 40 -7.382 -7.392 1.848 1038 HB3 GLU 40 HB1 GLU 40 -8.592 -6.440 2.669 1039 HG2 GLU 40 HG2 GLU 40 -10.322 -7.371 1.504 1040 HG3 GLU 40 HG1 GLU 40 -9.325 -7.783 0.129 1041 H LEU 41 HN LEU 41 -5.510 -5.781 0.721 1042 HA LEU 41 HA LEU 41 -5.035 -3.781 2.688 1043 HB2 LEU 41 HB2 LEU 41 -3.528 -5.781 1.426 1044 HB3 LEU 41 HB1 LEU 41 -2.721 -4.260 1.081 1045 HG LEU 41 HG LEU 41 -1.718 -4.992 3.048 1046 HD11 LEU 41 HD11 LEU 41 -2.200 -3.356 4.613 1047 HD12 LEU 41 HD12 LEU 41 -3.903 -3.305 4.174 1048 HD13 LEU 41 HD13 LEU 41 -2.691 -2.652 3.077 1049 HD21 LEU 41 HD21 LEU 41 -3.193 -6.818 3.584 1050 HD22 LEU 41 HD22 LEU 41 -4.465 -5.691 4.055 1051 HD23 LEU 41 HD23 LEU 41 -2.981 -5.792 5.005 1052 H MET 42 HN MET 42 -4.320 -3.886 -0.812 1053 HA MET 42 HA MET 42 -3.313 -1.227 -0.853 1054 HB2 MET 42 HB2 MET 42 -4.265 -2.963 -3.122 1055 HB3 MET 42 HB1 MET 42 -3.351 -1.460 -3.312 1056 HG2 MET 42 HG2 MET 42 -2.447 -4.016 -2.006 1057 HG3 MET 42 HG1 MET 42 -1.862 -3.302 -3.503 1058 HE1 MET 42 HE1 MET 42 0.640 -3.564 -2.648 1059 HE2 MET 42 HE2 MET 42 0.031 -4.278 -1.150 1060 HE3 MET 42 HE3 MET 42 1.194 -2.954 -1.086 1061 H ALA 43 HN ALA 43 -6.413 -2.622 -1.062 1062 HA ALA 43 HA ALA 43 -7.987 -0.693 -2.193 1063 HB1 ALA 43 HB1 ALA 43 -9.704 -1.407 -0.537 1064 HB2 ALA 43 HB2 ALA 43 -8.450 -2.361 0.265 1065 HB3 ALA 43 HB3 ALA 43 -8.915 -2.733 -1.394 1066 H TYR 44 HN TYR 44 -6.190 -0.612 0.800 1067 HA TYR 44 HA TYR 44 -7.303 2.055 1.422 1068 HB2 TYR 44 HB2 TYR 44 -7.415 0.572 3.346 1069 HB3 TYR 44 HB1 TYR 44 -5.741 0.103 3.104 1070 HD1 TYR 44 HD1 TYR 44 -7.966 2.507 4.621 1071 HD2 TYR 44 HD2 TYR 44 -3.912 1.749 3.659 1072 HE1 TYR 44 HE1 TYR 44 -7.282 4.195 6.266 1073 HE2 TYR 44 HE2 TYR 44 -3.202 3.442 5.286 1074 HH TYR 44 HH TYR 44 -5.307 4.767 7.601 1075 H GLU 45 HN GLU 45 -4.242 0.314 1.782 1076 HA GLU 45 HA GLU 45 -2.556 2.381 2.041 1077 HB2 GLU 45 HB2 GLU 45 -1.749 0.075 0.362 1078 HB3 GLU 45 HB1 GLU 45 -0.815 0.923 1.585 1079 HG2 GLU 45 HG2 GLU 45 -3.121 -0.905 2.027 1080 HG3 GLU 45 HG1 GLU 45 -1.442 -1.292 2.332 1081 H ASN 46 HN ASN 46 -3.966 1.247 -0.974 1082 HA ASN 46 HA ASN 46 -2.170 2.996 -2.463 1083 HB2 ASN 46 HB2 ASN 46 -3.577 0.445 -3.068 1084 HB3 ASN 46 HB1 ASN 46 -3.342 1.586 -4.385 1085 HD21 ASN 46 HD21 ASN 46 -1.822 0.311 -5.494 1086 HD22 ASN 46 HD22 ASN 46 -0.244 0.046 -4.877 1087 H ALA 47 HN ALA 47 -5.421 2.668 -1.413 1088 HA ALA 47 HA ALA 47 -6.835 3.750 -3.568 1089 HB1 ALA 47 HB1 ALA 47 -8.602 4.253 -1.969 1090 HB2 ALA 47 HB2 ALA 47 -7.483 3.956 -0.640 1091 HB3 ALA 47 HB3 ALA 47 -7.940 2.635 -1.716 1092 H ASN 48 HN ASN 48 -8.211 5.802 -3.154 1093 HA ASN 48 HA ASN 48 -6.555 8.054 -3.379 1094 HB2 ASN 48 HB2 ASN 48 -9.461 7.552 -3.195 1095 HB3 ASN 48 HB1 ASN 48 -8.941 9.144 -2.648 1096 HD21 ASN 48 HD21 ASN 48 -10.438 8.105 -5.086 1097 HD22 ASN 48 HD22 ASN 48 -9.587 8.818 -6.416 1098 HA PRO 49 HA PRO 49 -5.211 9.026 0.690 1099 HB2 PRO 49 HB2 PRO 49 -6.277 11.741 0.060 1100 HB3 PRO 49 HB1 PRO 49 -4.697 11.280 0.695 1101 HG2 PRO 49 HG2 PRO 49 -5.060 11.968 -1.885 1102 HG3 PRO 49 HG1 PRO 49 -3.857 10.769 -1.381 1103 HD2 PRO 49 HD2 PRO 49 -6.403 10.379 -2.828 1104 HD3 PRO 49 HD1 PRO 49 -4.978 9.322 -2.731 1105 H GLU 50 HN GLU 50 -8.262 10.452 -0.308 1106 HA GLU 50 HA GLU 50 -9.368 10.660 2.291 1107 HB2 GLU 50 HB2 GLU 50 -10.215 12.264 0.905 1108 HB3 GLU 50 HB1 GLU 50 -10.211 11.214 -0.504 1109 HG2 GLU 50 HG2 GLU 50 -12.372 10.983 -0.214 1110 HG3 GLU 50 HG1 GLU 50 -12.008 10.069 1.228 1111 H CYS 51 HN CYS 51 -9.396 8.289 -0.276 1112 HA CYS 51 HA CYS 51 -11.828 7.063 0.578 1113 HB2 CYS 51 HB2 CYS 51 -9.741 6.260 -1.461 1114 HB3 CYS 51 HB1 CYS 51 -11.250 5.395 -1.167 1115 HG CYS 51 HG CYS 51 -12.905 7.144 -2.280 1116 H GLN 52 HN GLN 52 -8.384 6.493 0.885 1117 HA GLN 52 HA GLN 52 -8.736 4.059 2.357 1118 HB2 GLN 52 HB2 GLN 52 -6.401 4.186 2.854 1119 HB3 GLN 52 HB1 GLN 52 -6.611 4.638 1.172 1120 HG2 GLN 52 HG2 GLN 52 -6.436 7.004 1.828 1121 HG3 GLN 52 HG1 GLN 52 -6.130 6.500 3.487 1122 HE21 GLN 52 HE21 GLN 52 -4.723 4.128 2.496 1123 HE22 GLN 52 HE22 GLN 52 -3.174 4.649 1.985 1124 H SER 53 HN SER 53 -8.541 7.420 2.917 1125 HA SER 53 HA SER 53 -8.581 7.359 5.737 1126 HB2 SER 53 HB2 SER 53 -9.095 9.367 3.616 1127 HB3 SER 53 HB1 SER 53 -9.582 9.742 5.275 1128 HG SER 53 HG SER 53 -7.573 10.103 5.711 1129 H ALA 54 HN ALA 54 -10.996 6.919 3.298 1130 HA ALA 54 HA ALA 54 -13.166 6.964 5.187 1131 HB1 ALA 54 HB1 ALA 54 -14.421 5.839 3.382 1132 HB2 ALA 54 HB2 ALA 54 -12.919 5.736 2.455 1133 HB3 ALA 54 HB3 ALA 54 -13.609 7.308 2.848 1134 H ILE 55 HN ILE 55 -10.746 4.783 4.234 1135 HA ILE 55 HA ILE 55 -12.192 2.442 5.076 1136 HB ILE 55 HB ILE 55 -9.547 2.875 3.767 1137 HG12 ILE 55 HG12 ILE 55 -11.804 1.232 2.739 1138 HG13 ILE 55 HG11 ILE 55 -11.939 2.996 2.705 1139 HG21 ILE 55 HG21 ILE 55 -10.751 0.259 4.638 1140 HG22 ILE 55 HG22 ILE 55 -9.260 0.979 5.243 1141 HG23 ILE 55 HG23 ILE 55 -9.361 0.434 3.569 1142 HD11 ILE 55 HD11 ILE 55 -11.092 1.983 0.625 1143 HD12 ILE 55 HD12 ILE 55 -9.648 1.454 1.515 1144 HD13 ILE 55 HD13 ILE 55 -10.009 3.180 1.346 1145 H LYS 56 HN LYS 56 -9.486 4.366 6.360 1146 HA LYS 56 HA LYS 56 -8.144 2.590 7.859 1147 HB2 LYS 56 HB2 LYS 56 -8.545 4.712 9.695 1148 HB3 LYS 56 HB1 LYS 56 -7.117 4.303 8.762 1149 HG2 LYS 56 HG2 LYS 56 -7.450 6.446 8.091 1150 HG3 LYS 56 HG1 LYS 56 -8.424 5.603 6.881 1151 HD2 LYS 56 HD2 LYS 56 -10.358 6.282 7.750 1152 HD3 LYS 56 HD1 LYS 56 -9.769 6.280 9.413 1153 HE2 LYS 56 HE2 LYS 56 -8.330 8.326 8.477 1154 HE3 LYS 56 HE1 LYS 56 -9.697 8.436 7.350 1155 HZ1 LYS 56 HZ1 LYS 56 -10.047 9.798 9.316 1156 HZ2 LYS 56 HZ2 LYS 56 -9.897 8.449 10.318 1157 HZ3 LYS 56 HZ3 LYS 56 -11.191 8.555 9.237 1158 HA PRO 57 HA PRO 57 -11.442 2.470 11.496 1159 HB2 PRO 57 HB2 PRO 57 -14.012 2.499 10.599 1160 HB3 PRO 57 HB1 PRO 57 -13.173 3.951 11.166 1161 HG2 PRO 57 HG2 PRO 57 -13.446 2.919 8.356 1162 HG3 PRO 57 HG1 PRO 57 -13.829 4.547 8.970 1163 HD2 PRO 57 HD2 PRO 57 -11.529 4.109 7.761 1164 HD3 PRO 57 HD1 PRO 57 -11.526 5.064 9.252 1165 H LEU 58 HN LEU 58 -11.898 1.233 8.247 1166 HA LEU 58 HA LEU 58 -12.870 -1.357 9.235 1167 HB2 LEU 58 HB2 LEU 58 -12.454 -0.889 6.349 1168 HB3 LEU 58 HB1 LEU 58 -13.757 -1.755 7.152 1169 HG LEU 58 HG LEU 58 -13.488 1.251 6.942 1170 HD11 LEU 58 HD11 LEU 58 -13.893 0.275 4.784 1171 HD12 LEU 58 HD12 LEU 58 -15.382 1.025 5.365 1172 HD13 LEU 58 HD13 LEU 58 -15.188 -0.726 5.436 1173 HD21 LEU 58 HD21 LEU 58 -15.794 1.292 7.761 1174 HD22 LEU 58 HD22 LEU 58 -14.699 0.577 8.944 1175 HD23 LEU 58 HD23 LEU 58 -15.750 -0.458 7.975 1176 H LYS 59 HN LYS 59 -10.196 0.351 8.212 1177 HA LYS 59 HA LYS 59 -8.637 -1.383 6.782 1178 HB2 LYS 59 HB2 LYS 59 -7.900 0.842 7.172 1179 HB3 LYS 59 HB1 LYS 59 -7.878 0.597 8.910 1180 HG2 LYS 59 HG2 LYS 59 -5.654 0.452 8.469 1181 HG3 LYS 59 HG1 LYS 59 -6.112 -1.234 8.277 1182 HD2 LYS 59 HD2 LYS 59 -5.776 0.771 6.075 1183 HD3 LYS 59 HD1 LYS 59 -4.654 -0.539 6.456 1184 HE2 LYS 59 HE2 LYS 59 -6.920 -1.947 6.153 1185 HE3 LYS 59 HE1 LYS 59 -7.278 -0.593 5.077 1186 HZ1 LYS 59 HZ1 LYS 59 -6.196 -2.070 3.695 1187 HZ2 LYS 59 HZ2 LYS 59 -5.152 -2.610 4.906 1188 HZ3 LYS 59 HZ3 LYS 59 -4.896 -1.091 4.195 1189 H GLY 60 HN GLY 60 -8.289 -3.441 7.142 1190 HA2 GLY 60 HA3 GLY 60 -7.237 -5.247 8.185 1191 HA3 GLY 60 HA2 GLY 60 -7.068 -4.283 9.644 1192 H LYS 61 HN LYS 61 -10.078 -3.630 9.208 1193 HA LYS 61 HA LYS 61 -10.987 -5.982 10.723 1194 HB2 LYS 61 HB2 LYS 61 -12.669 -3.542 10.532 1195 HB3 LYS 61 HB1 LYS 61 -12.338 -4.565 11.921 1196 HG2 LYS 61 HG2 LYS 61 -10.414 -2.567 10.776 1197 HG3 LYS 61 HG1 LYS 61 -11.469 -2.264 12.144 1198 HD2 LYS 61 HD2 LYS 61 -9.414 -4.464 12.048 1199 HD3 LYS 61 HD1 LYS 61 -9.122 -2.872 12.751 1200 HE2 LYS 61 HE2 LYS 61 -10.986 -3.242 14.302 1201 HE3 LYS 61 HE1 LYS 61 -11.217 -4.850 13.621 1202 HZ1 LYS 61 HZ1 LYS 61 -9.923 -4.944 15.654 1203 HZ2 LYS 61 HZ2 LYS 61 -8.770 -3.892 15.006 1204 HZ3 LYS 61 HZ3 LYS 61 -8.977 -5.431 14.338 1205 H VAL 62 HN VAL 62 -12.030 -7.406 9.465 1206 HA VAL 62 HA VAL 62 -14.028 -6.329 7.599 1207 HB VAL 62 HB VAL 62 -12.253 -7.383 6.326 1208 HG11 VAL 62 HG11 VAL 62 -11.757 -9.783 6.518 1209 HG12 VAL 62 HG12 VAL 62 -12.784 -9.861 7.951 1210 HG13 VAL 62 HG13 VAL 62 -11.318 -8.881 7.970 1211 HG21 VAL 62 HG21 VAL 62 -14.779 -9.022 6.404 1212 HG22 VAL 62 HG22 VAL 62 -13.566 -9.123 5.128 1213 HG23 VAL 62 HG23 VAL 62 -14.442 -7.616 5.394 1214 HA PRO 63 HA PRO 63 -17.160 -8.659 9.902 1215 HB2 PRO 63 HB2 PRO 63 -18.137 -9.076 7.123 1216 HB3 PRO 63 HB1 PRO 63 -19.029 -8.587 8.548 1217 HG2 PRO 63 HG2 PRO 63 -18.394 -6.797 6.705 1218 HG3 PRO 63 HG1 PRO 63 -18.288 -6.387 8.425 1219 HD2 PRO 63 HD2 PRO 63 -16.111 -7.006 6.489 1220 HD3 PRO 63 HD1 PRO 63 -16.118 -5.874 7.857 1221 H ALA 64 HN ALA 64 -17.298 -10.782 10.395 1222 HA ALA 64 HA ALA 64 -15.403 -12.562 9.285 1223 HB1 ALA 64 HB1 ALA 64 -17.705 -13.173 11.132 1224 HB2 ALA 64 HB2 ALA 64 -16.093 -12.661 11.632 1225 HB3 ALA 64 HB3 ALA 64 -16.315 -14.211 10.821 1226 H GLY 65 HN GLY 65 -15.605 -13.371 7.310 1227 HA2 GLY 65 HA3 GLY 65 -16.602 -15.098 5.963 1228 HA3 GLY 65 HA2 GLY 65 -18.171 -14.629 6.604 1229 H SER 66 HN SER 66 -17.149 -11.728 6.217 1230 HA SER 66 HA SER 66 -18.137 -11.531 3.477 1231 HB2 SER 66 HB2 SER 66 -17.550 -9.320 5.456 1232 HB3 SER 66 HB1 SER 66 -18.464 -9.184 3.954 1233 HG SER 66 HG SER 66 -19.819 -10.939 5.038 1234 H ASP 67 HN ASP 67 -17.133 -9.634 2.226 1235 HA ASP 67 HA ASP 67 -14.239 -10.028 2.056 1236 HB2 ASP 67 HB2 ASP 67 -16.060 -9.881 0.104 1237 HB3 ASP 67 HB1 ASP 67 -15.756 -8.165 0.286 1238 H VAL 68 HN VAL 68 -12.733 -8.210 2.261 1239 HA VAL 68 HA VAL 68 -13.878 -6.127 3.925 1240 HB VAL 68 HB VAL 68 -11.853 -5.683 4.714 1241 HG11 VAL 68 HG11 VAL 68 -10.154 -7.397 4.502 1242 HG12 VAL 68 HG12 VAL 68 -10.991 -8.069 3.104 1243 HG13 VAL 68 HG13 VAL 68 -11.756 -8.106 4.686 1244 HG21 VAL 68 HG21 VAL 68 -10.864 -5.676 1.872 1245 HG22 VAL 68 HG22 VAL 68 -9.844 -5.330 3.270 1246 HG23 VAL 68 HG23 VAL 68 -11.222 -4.290 2.902 1247 H ILE 69 HN ILE 69 -12.903 -6.625 0.653 1248 HA ILE 69 HA ILE 69 -12.562 -3.965 -0.113 1249 HB ILE 69 HB ILE 69 -13.440 -6.370 -1.689 1250 HG12 ILE 69 HG12 ILE 69 -11.185 -6.654 -1.189 1251 HG13 ILE 69 HG11 ILE 69 -11.121 -5.841 -2.738 1252 HG21 ILE 69 HG21 ILE 69 -12.922 -3.565 -2.685 1253 HG22 ILE 69 HG22 ILE 69 -14.415 -4.495 -2.814 1254 HG23 ILE 69 HG23 ILE 69 -12.988 -4.985 -3.732 1255 HD11 ILE 69 HD11 ILE 69 -10.740 -4.565 -0.053 1256 HD12 ILE 69 HD12 ILE 69 -10.754 -3.706 -1.592 1257 HD13 ILE 69 HD13 ILE 69 -9.493 -4.899 -1.258 1258 H SER 70 HN SER 70 -15.352 -6.040 -0.177 1259 HA SER 70 HA SER 70 -17.273 -4.407 -1.212 1260 HB2 SER 70 HB2 SER 70 -17.662 -6.747 -0.590 1261 HB3 SER 70 HB1 SER 70 -17.561 -6.334 1.118 1262 HG SER 70 HG SER 70 -19.569 -5.715 1.045 1263 H GLU 71 HN GLU 71 -15.881 -4.280 2.020 1264 HA GLU 71 HA GLU 71 -17.725 -2.277 2.974 1265 HB2 GLU 71 HB2 GLU 71 -15.183 -3.176 4.292 1266 HB3 GLU 71 HB1 GLU 71 -16.661 -2.586 5.050 1267 HG2 GLU 71 HG2 GLU 71 -16.858 -5.036 3.423 1268 HG3 GLU 71 HG1 GLU 71 -16.010 -5.154 4.956 1269 H TYR 72 HN TYR 72 -14.536 -2.506 1.698 1270 HA TYR 72 HA TYR 72 -13.660 0.074 2.541 1271 HB2 TYR 72 HB2 TYR 72 -12.614 -2.013 0.645 1272 HB3 TYR 72 HB1 TYR 72 -11.852 -0.435 0.768 1273 HD1 TYR 72 HD1 TYR 72 -13.301 -1.792 3.789 1274 HD2 TYR 72 HD2 TYR 72 -9.780 -1.611 1.427 1275 HE1 TYR 72 HE1 TYR 72 -11.985 -2.583 5.693 1276 HE2 TYR 72 HE2 TYR 72 -8.451 -2.417 3.328 1277 HH TYR 72 HH TYR 72 -9.967 -3.587 6.236 1278 H VAL 73 HN VAL 73 -14.992 -1.355 -0.364 1279 HA VAL 73 HA VAL 73 -15.020 1.034 -1.887 1280 HB VAL 73 HB VAL 73 -16.231 -0.016 -3.517 1281 HG11 VAL 73 HG11 VAL 73 -14.221 -1.269 -3.273 1282 HG12 VAL 73 HG12 VAL 73 -15.530 -2.355 -3.725 1283 HG13 VAL 73 HG13 VAL 73 -14.965 -2.299 -2.057 1284 HG21 VAL 73 HG21 VAL 73 -18.183 -0.471 -2.005 1285 HG22 VAL 73 HG22 VAL 73 -17.436 -2.033 -1.658 1286 HG23 VAL 73 HG23 VAL 73 -17.919 -1.627 -3.312 1287 H LYS 74 HN LYS 74 -17.090 -0.486 0.448 1288 HA LYS 74 HA LYS 74 -19.332 1.239 0.219 1289 HB2 LYS 74 HB2 LYS 74 -18.605 -1.014 1.699 1290 HB3 LYS 74 HB1 LYS 74 -18.830 0.259 2.893 1291 HG2 LYS 74 HG2 LYS 74 -20.940 -0.601 2.819 1292 HG3 LYS 74 HG1 LYS 74 -21.074 0.657 1.590 1293 HD2 LYS 74 HD2 LYS 74 -20.399 -2.220 0.997 1294 HD3 LYS 74 HD1 LYS 74 -22.035 -1.561 0.932 1295 HE2 LYS 74 HE2 LYS 74 -19.713 -0.520 -0.678 1296 HE3 LYS 74 HE1 LYS 74 -20.882 -1.694 -1.280 1297 HZ1 LYS 74 HZ1 LYS 74 -21.598 1.020 -0.308 1298 HZ2 LYS 74 HZ2 LYS 74 -22.625 -0.091 -1.054 1299 HZ3 LYS 74 HZ3 LYS 74 -21.372 0.624 -1.936 1300 H ALA 75 HN ALA 75 -16.267 1.358 1.824 1301 HA ALA 75 HA ALA 75 -16.741 3.551 3.545 1302 HB1 ALA 75 HB1 ALA 75 -14.289 3.772 3.568 1303 HB2 ALA 75 HB2 ALA 75 -14.190 2.626 2.228 1304 HB3 ALA 75 HB3 ALA 75 -14.811 2.102 3.792 1305 H CYS 76 HN CYS 76 -15.457 3.324 0.262 1306 HA CYS 76 HA CYS 76 -15.596 6.227 -0.034 1307 HB2 CYS 76 HB2 CYS 76 -13.616 5.213 -0.872 1308 HB3 CYS 76 HB1 CYS 76 -14.515 4.025 -1.800 1309 HG CYS 76 HG CYS 76 -15.661 6.349 -3.313 1310 H ASP 77 HN ASP 77 -17.825 3.960 -0.095 1311 HA ASP 77 HA ASP 77 -19.212 4.233 -2.492 1312 HB2 ASP 77 HB2 ASP 77 -19.930 2.548 -1.039 1313 HB3 ASP 77 HB1 ASP 77 -20.070 3.631 0.335 1314 H GLY 78 HN GLY 78 -18.909 6.402 0.212 1315 HA2 GLY 78 HA3 GLY 78 -20.848 8.249 -0.948 1316 HA3 GLY 78 HA2 GLY 78 -19.992 8.457 0.572 1317 H ILE 79 HN ILE 79 -17.449 7.661 -1.018 1318 HA ILE 79 HA ILE 79 -16.727 10.398 -1.548 1319 HB ILE 79 HB ILE 79 -15.095 7.879 -1.692 1320 HG12 ILE 79 HG12 ILE 79 -15.105 10.035 0.422 1321 HG13 ILE 79 HG11 ILE 79 -15.977 8.509 0.566 1322 HG21 ILE 79 HG21 ILE 79 -14.149 9.615 -3.110 1323 HG22 ILE 79 HG22 ILE 79 -13.139 9.349 -1.688 1324 HG23 ILE 79 HG23 ILE 79 -14.200 10.755 -1.765 1325 HD11 ILE 79 HD11 ILE 79 -13.718 8.687 1.684 1326 HD12 ILE 79 HD12 ILE 79 -13.035 8.616 0.062 1327 HD13 ILE 79 HD13 ILE 79 -14.005 7.274 0.672 1328 H GLY 80 HN GLY 80 -16.622 11.316 -3.473 1329 HA2 GLY 80 HA3 GLY 80 -15.494 10.373 -5.751 1330 HA3 GLY 80 HA2 GLY 80 -17.156 9.830 -5.864 1331 H GLY 81 HN GLY 81 -16.205 12.800 -4.299 1332 HA2 GLY 81 HA3 GLY 81 -15.995 14.747 -5.997 1333 HA3 GLY 81 HA2 GLY 81 -17.656 14.301 -6.351 1334 H ALA 82 HN ALA 82 -19.265 14.991 -5.030 1335 HA ALA 82 HA ALA 82 -18.840 17.370 -3.655 1336 HB1 ALA 82 HB1 ALA 82 -21.163 17.237 -2.997 1337 HB2 ALA 82 HB2 ALA 82 -21.198 15.523 -3.409 1338 HB3 ALA 82 HB3 ALA 82 -20.964 16.729 -4.673 1339 H MET 83 HN MET 83 -19.653 14.195 -2.240 1340 HA MET 83 HA MET 83 -19.408 15.119 0.434 1341 HB2 MET 83 HB2 MET 83 -19.227 12.284 -0.603 1342 HB3 MET 83 HB1 MET 83 -19.473 12.754 1.072 1343 HG2 MET 83 HG2 MET 83 -21.598 13.820 0.426 1344 HG3 MET 83 HG1 MET 83 -21.357 13.242 -1.220 1345 HE1 MET 83 HE1 MET 83 -23.764 12.082 -1.122 1346 HE2 MET 83 HE2 MET 83 -23.973 12.644 0.535 1347 HE3 MET 83 HE3 MET 83 -24.246 10.947 0.138 1348 H HIS 84 HN HIS 84 -17.208 13.721 -1.875 1349 HA HIS 84 HA HIS 84 -15.021 13.144 -0.218 1350 HB2 HIS 84 HB2 HIS 84 -14.954 12.386 -2.480 1351 HB3 HIS 84 HB1 HIS 84 -15.225 14.004 -3.110 1352 HD1 HIS 84 HD1 HIS 84 -13.169 14.460 -4.415 1353 HD2 HIS 84 HD2 HIS 84 -12.311 12.913 -0.664 1354 HE1 HIS 84 HE1 HIS 84 -10.678 14.594 -4.191 1355 HE2 HIS 84 HE2 HIS 84 -10.163 13.566 -1.948 1356 H LYS 85 HN LYS 85 -16.125 16.214 -1.603 1357 HA LYS 85 HA LYS 85 -13.720 17.579 -0.782 1358 HB2 LYS 85 HB2 LYS 85 -16.325 18.787 -1.718 1359 HB3 LYS 85 HB1 LYS 85 -14.752 19.574 -1.664 1360 HG2 LYS 85 HG2 LYS 85 -15.520 17.251 -3.420 1361 HG3 LYS 85 HG1 LYS 85 -15.308 18.928 -3.935 1362 HD2 LYS 85 HD2 LYS 85 -12.949 18.811 -3.339 1363 HD3 LYS 85 HD1 LYS 85 -13.164 17.159 -2.756 1364 HE2 LYS 85 HE2 LYS 85 -12.255 16.973 -4.935 1365 HE3 LYS 85 HE1 LYS 85 -13.968 16.569 -5.070 1366 HZ1 LYS 85 HZ1 LYS 85 -12.779 19.216 -5.716 1367 HZ2 LYS 85 HZ2 LYS 85 -14.404 18.783 -5.894 1368 HZ3 LYS 85 HZ3 LYS 85 -13.224 18.043 -6.850 1369 H ALA 86 HN ALA 86 -16.687 16.732 0.646 1370 HA ALA 86 HA ALA 86 -16.558 18.736 2.735 1371 HB1 ALA 86 HB1 ALA 86 -18.730 17.898 1.902 1372 HB2 ALA 86 HB2 ALA 86 -18.524 17.658 3.638 1373 HB3 ALA 86 HB3 ALA 86 -18.322 16.299 2.530 1374 H MET 87 HN MET 87 -15.952 15.307 2.310 1375 HA MET 87 HA MET 87 -15.273 14.923 5.098 1376 HB2 MET 87 HB2 MET 87 -15.186 13.017 2.749 1377 HB3 MET 87 HB1 MET 87 -14.962 12.568 4.436 1378 HG2 MET 87 HG2 MET 87 -17.402 14.010 4.203 1379 HG3 MET 87 HG1 MET 87 -17.364 12.760 2.963 1380 HE1 MET 87 HE1 MET 87 -16.919 11.933 7.485 1381 HE2 MET 87 HE2 MET 87 -17.175 13.537 6.797 1382 HE3 MET 87 HE3 MET 87 -15.652 12.693 6.522 1383 H LEU 88 HN LEU 88 -13.649 15.833 2.289 1384 HA LEU 88 HA LEU 88 -11.198 14.672 2.369 1385 HB2 LEU 88 HB2 LEU 88 -12.243 16.548 0.889 1386 HB3 LEU 88 HB1 LEU 88 -11.425 17.626 1.997 1387 HG LEU 88 HG LEU 88 -9.449 17.316 0.986 1388 HD11 LEU 88 HD11 LEU 88 -9.151 15.136 2.068 1389 HD12 LEU 88 HD12 LEU 88 -8.518 15.128 0.422 1390 HD13 LEU 88 HD13 LEU 88 -10.069 14.368 0.772 1391 HD21 LEU 88 HD21 LEU 88 -11.204 15.839 -0.949 1392 HD22 LEU 88 HD22 LEU 88 -9.590 16.453 -1.316 1393 HD23 LEU 88 HD23 LEU 88 -10.895 17.575 -0.924 1394 H MET 89 HN MET 89 -12.251 17.469 4.319 1395 HA MET 89 HA MET 89 -9.688 17.650 5.636 1396 HB2 MET 89 HB2 MET 89 -11.101 19.647 5.174 1397 HB3 MET 89 HB1 MET 89 -12.287 19.035 6.319 1398 HG2 MET 89 HG2 MET 89 -10.676 19.221 8.124 1399 HG3 MET 89 HG1 MET 89 -9.444 19.767 6.987 1400 HE1 MET 89 HE1 MET 89 -8.994 21.867 8.567 1401 HE2 MET 89 HE2 MET 89 -10.252 21.317 9.673 1402 HE3 MET 89 HE3 MET 89 -10.256 22.981 9.093 1403 H ALA 90 HN ALA 90 -12.462 15.773 6.014 1404 HA ALA 90 HA ALA 90 -12.243 15.536 8.907 1405 HB1 ALA 90 HB1 ALA 90 -14.454 15.630 7.801 1406 HB2 ALA 90 HB2 ALA 90 -14.225 14.164 8.756 1407 HB3 ALA 90 HB3 ALA 90 -14.085 14.103 6.996 1408 H GLN 91 HN GLN 91 -11.821 13.519 6.024 1409 HA GLN 91 HA GLN 91 -11.046 11.282 7.739 1410 HB2 GLN 91 HB2 GLN 91 -11.682 11.360 4.802 1411 HB3 GLN 91 HB1 GLN 91 -11.382 9.913 5.755 1412 HG2 GLN 91 HG2 GLN 91 -13.333 10.347 7.088 1413 HG3 GLN 91 HG1 GLN 91 -13.611 11.853 6.215 1414 HE21 GLN 91 HE21 GLN 91 -12.921 10.937 3.670 1415 HE22 GLN 91 HE22 GLN 91 -14.105 9.795 3.164 1416 H LEU 92 HN LEU 92 -9.899 12.881 4.751 1417 HA LEU 92 HA LEU 92 -7.570 11.557 4.262 1418 HB2 LEU 92 HB2 LEU 92 -8.646 13.722 3.209 1419 HB3 LEU 92 HB1 LEU 92 -7.509 14.547 4.248 1420 HG LEU 92 HG LEU 92 -7.042 13.004 1.761 1421 HD11 LEU 92 HD11 LEU 92 -5.733 15.402 3.018 1422 HD12 LEU 92 HD12 LEU 92 -6.999 15.425 1.792 1423 HD13 LEU 92 HD13 LEU 92 -5.406 14.775 1.402 1424 HD21 LEU 92 HD21 LEU 92 -5.728 11.659 3.278 1425 HD22 LEU 92 HD22 LEU 92 -5.011 13.105 3.988 1426 HD23 LEU 92 HD23 LEU 92 -4.657 12.677 2.315 1427 H GLU 93 HN GLU 93 -8.322 13.807 6.769 1428 HA GLU 93 HA GLU 93 -7.122 14.926 8.335 1429 HB2 GLU 93 HB2 GLU 93 -6.582 12.039 8.541 1430 HB3 GLU 93 HB1 GLU 93 -5.975 13.128 9.780 1431 HG2 GLU 93 HG2 GLU 93 -8.853 13.101 8.955 1432 HG3 GLU 93 HG1 GLU 93 -8.231 11.953 10.126 Start of MODEL 19 1 H2 PRO 1 HT1 PRO 1 -5.057 -3.901 13.354 2 H3 PRO 1 HT2 PRO 1 -5.434 -2.382 13.829 3 HA PRO 1 HA PRO 1 -6.264 -2.389 11.823 4 HB2 PRO 1 HB2 PRO 1 -4.269 -1.336 10.379 5 HB3 PRO 1 HB1 PRO 1 -4.956 -0.467 11.757 6 HG2 PRO 1 HG2 PRO 1 -2.346 -1.786 11.511 7 HG3 PRO 1 HG1 PRO 1 -2.889 -0.575 12.687 8 HD2 PRO 1 HD2 PRO 1 -2.751 -3.477 12.943 9 HD3 PRO 1 HD1 PRO 1 -3.031 -2.258 14.203 10 H SER 2 HN SER 2 -4.479 -2.548 9.384 11 HA SER 2 HA SER 2 -4.286 -5.344 8.921 12 HB2 SER 2 HB2 SER 2 -3.001 -2.961 7.580 13 HB3 SER 2 HB1 SER 2 -2.785 -4.616 7.021 14 HG SER 2 HG SER 2 -5.032 -4.770 6.747 15 H PHE 3 HN PHE 3 -1.911 -6.071 8.178 16 HA PHE 3 HA PHE 3 -0.216 -5.867 10.477 17 HB2 PHE 3 HB2 PHE 3 1.283 -6.749 8.254 18 HB3 PHE 3 HB1 PHE 3 0.596 -7.753 9.540 19 HD1 PHE 3 HD1 PHE 3 0.745 -6.994 6.143 20 HD2 PHE 3 HD2 PHE 3 -1.873 -8.533 9.114 21 HE1 PHE 3 HE1 PHE 3 -0.585 -8.115 4.410 22 HE2 PHE 3 HE2 PHE 3 -3.225 -9.637 7.381 23 HZ PHE 3 HZ PHE 3 -2.577 -9.427 5.013 24 H ASN 4 HN ASN 4 -0.190 -4.732 7.172 25 HA ASN 4 HA ASN 4 2.512 -3.806 7.457 26 HB2 ASN 4 HB2 ASN 4 2.316 -3.435 5.030 27 HB3 ASN 4 HB1 ASN 4 1.863 -5.070 5.503 28 HD21 ASN 4 HD21 ASN 4 0.607 -1.911 4.644 29 HD22 ASN 4 HD22 ASN 4 -0.934 -2.474 4.083 30 H THR 5 HN THR 5 -0.181 -2.336 8.353 31 HA THR 5 HA THR 5 -0.215 0.030 6.797 32 HB THR 5 HB THR 5 -1.417 0.806 9.035 33 HG1 THR 5 HG1 THR 5 -1.240 -0.903 10.348 34 HG21 THR 5 HG21 THR 5 -3.460 -0.002 8.020 35 HG22 THR 5 HG22 THR 5 -2.521 -1.117 7.024 36 HG23 THR 5 HG23 THR 5 -2.341 0.625 6.804 37 H VAL 6 HN VAL 6 2.136 -0.983 8.841 38 HA VAL 6 HA VAL 6 2.489 1.378 10.400 39 HB VAL 6 HB VAL 6 4.446 0.232 11.279 40 HG11 VAL 6 HG11 VAL 6 3.287 -1.682 12.234 41 HG12 VAL 6 HG12 VAL 6 2.104 -1.629 10.925 42 HG13 VAL 6 HG13 VAL 6 2.186 -0.309 12.095 43 HG21 VAL 6 HG21 VAL 6 5.163 -1.933 10.467 44 HG22 VAL 6 HG22 VAL 6 5.187 -0.772 9.125 45 HG23 VAL 6 HG23 VAL 6 3.864 -1.940 9.259 46 H ARG 7 HN ARG 7 3.140 3.197 9.215 47 HA ARG 7 HA ARG 7 4.803 2.501 6.922 48 HB2 ARG 7 HB2 ARG 7 2.941 4.799 7.092 49 HB3 ARG 7 HB1 ARG 7 3.794 4.244 5.652 50 HG2 ARG 7 HG2 ARG 7 1.453 3.160 7.089 51 HG3 ARG 7 HG1 ARG 7 1.695 3.486 5.366 52 HD2 ARG 7 HD2 ARG 7 2.894 1.386 7.032 53 HD3 ARG 7 HD1 ARG 7 1.876 1.222 5.648 54 HE ARG 7 HE ARG 7 3.872 2.518 4.570 55 HH11 ARG 7 HH11 ARG 7 4.570 0.284 7.060 56 HH12 ARG 7 HH12 ARG 7 5.572 -0.726 6.071 57 HH21 ARG 7 HH21 ARG 7 5.093 1.149 3.177 58 HH22 ARG 7 HH22 ARG 7 5.863 -0.240 3.860 59 H GLN 8 HN GLN 8 6.334 3.719 6.227 60 HA GLN 8 HA GLN 8 8.099 5.023 7.764 61 HB2 GLN 8 HB2 GLN 8 7.691 4.617 5.024 62 HB3 GLN 8 HB1 GLN 8 7.932 6.357 5.193 63 HG2 GLN 8 HG2 GLN 8 10.008 5.957 6.422 64 HG3 GLN 8 HG1 GLN 8 9.790 4.222 6.216 65 HE21 GLN 8 HE21 GLN 8 11.985 5.847 5.382 66 HE22 GLN 8 HE22 GLN 8 12.088 5.714 3.650 67 H GLY 9 HN GLY 9 7.689 6.552 9.204 68 HA2 GLY 9 HA3 GLY 9 5.841 8.714 8.703 69 HA3 GLY 9 HA2 GLY 9 6.843 8.494 10.130 70 H SER 10 HN SER 10 7.448 10.690 10.138 71 HA SER 10 HA SER 10 8.420 12.137 7.960 72 HB2 SER 10 HB2 SER 10 9.244 12.440 10.859 73 HB3 SER 10 HB1 SER 10 9.350 13.675 9.604 74 HG SER 10 HG SER 10 6.843 12.565 9.904 75 H LYS 11 HN LYS 11 9.896 11.240 6.677 76 HA LYS 11 HA LYS 11 11.608 9.942 5.956 77 HB2 LYS 11 HB2 LYS 11 13.768 10.924 6.298 78 HB3 LYS 11 HB1 LYS 11 12.598 12.208 6.117 79 HG2 LYS 11 HG2 LYS 11 12.726 12.770 8.365 80 HG3 LYS 11 HG1 LYS 11 13.516 11.263 8.810 81 HD2 LYS 11 HD2 LYS 11 15.477 11.972 7.457 82 HD3 LYS 11 HD1 LYS 11 14.682 13.522 7.186 83 HE2 LYS 11 HE2 LYS 11 14.701 13.991 9.554 84 HE3 LYS 11 HE1 LYS 11 15.365 12.393 9.895 85 HZ1 LYS 11 HZ1 LYS 11 17.358 13.001 8.680 86 HZ2 LYS 11 HZ2 LYS 11 17.075 14.092 9.938 87 HZ3 LYS 11 HZ3 LYS 11 16.721 14.530 8.346 88 H GLU 12 HN GLU 12 10.367 8.489 7.863 89 HA GLU 12 HA GLU 12 11.951 7.544 9.976 90 HB2 GLU 12 HB2 GLU 12 9.520 7.116 9.684 91 HB3 GLU 12 HB1 GLU 12 9.875 6.039 8.345 92 HG2 GLU 12 HG2 GLU 12 11.029 4.520 9.840 93 HG3 GLU 12 HG1 GLU 12 10.773 5.630 11.190 94 HA PRO 13 HA PRO 13 15.328 5.552 7.913 95 HB2 PRO 13 HB2 PRO 13 15.117 3.429 9.936 96 HB3 PRO 13 HB1 PRO 13 16.489 4.464 9.543 97 HG2 PRO 13 HG2 PRO 13 15.005 4.763 11.791 98 HG3 PRO 13 HG1 PRO 13 15.831 6.099 10.985 99 HD2 PRO 13 HD2 PRO 13 12.953 5.458 11.093 100 HD3 PRO 13 HD1 PRO 13 13.754 7.015 10.825 101 H TYR 14 HN TYR 14 15.194 4.242 6.139 102 HA TYR 14 HA TYR 14 12.615 3.242 5.762 103 HB2 TYR 14 HB2 TYR 14 13.857 4.260 3.930 104 HB3 TYR 14 HB1 TYR 14 15.000 2.926 3.938 105 HD1 TYR 14 HD1 TYR 14 13.875 0.571 3.741 106 HD2 TYR 14 HD2 TYR 14 12.112 4.176 2.369 107 HE1 TYR 14 HE1 TYR 14 12.470 -0.729 2.227 108 HE2 TYR 14 HE2 TYR 14 10.689 2.890 0.829 109 HH TYR 14 HH TYR 14 10.194 0.852 0.044 110 HA PRO 15 HA PRO 15 14.645 -1.205 5.421 111 HB2 PRO 15 HB2 PRO 15 16.815 -0.941 7.399 112 HB3 PRO 15 HB1 PRO 15 16.807 -1.775 5.847 113 HG2 PRO 15 HG2 PRO 15 18.111 0.540 6.230 114 HG3 PRO 15 HG1 PRO 15 17.395 0.098 4.683 115 HD2 PRO 15 HD2 PRO 15 16.466 2.065 6.704 116 HD3 PRO 15 HD1 PRO 15 16.261 2.062 4.949 117 H ASP 16 HN ASP 16 14.400 0.863 8.067 118 HA ASP 16 HA ASP 16 13.769 -1.202 9.999 119 HB2 ASP 16 HB2 ASP 16 14.346 1.721 10.127 120 HB3 ASP 16 HB1 ASP 16 13.328 1.038 11.394 121 H PHE 17 HN PHE 17 12.220 1.415 8.262 122 HA PHE 17 HA PHE 17 9.692 1.286 9.503 123 HB2 PHE 17 HB2 PHE 17 9.269 2.991 8.033 124 HB3 PHE 17 HB1 PHE 17 10.914 2.754 7.465 125 HD1 PHE 17 HD1 PHE 17 7.437 1.632 6.874 126 HD2 PHE 17 HD2 PHE 17 11.337 2.085 5.319 127 HE1 PHE 17 HE1 PHE 17 6.647 1.032 4.645 128 HE2 PHE 17 HE2 PHE 17 10.532 1.494 3.104 129 HZ PHE 17 HZ PHE 17 8.177 0.976 2.760 130 H VAL 18 HN VAL 18 11.134 -0.372 6.764 131 HA VAL 18 HA VAL 18 8.788 -1.914 6.214 132 HB VAL 18 HB VAL 18 10.032 -1.493 4.282 133 HG11 VAL 18 HG11 VAL 18 12.459 -2.497 5.770 134 HG12 VAL 18 HG12 VAL 18 12.121 -0.814 5.354 135 HG13 VAL 18 HG13 VAL 18 12.425 -2.002 4.070 136 HG21 VAL 18 HG21 VAL 18 9.312 -3.722 4.193 137 HG22 VAL 18 HG22 VAL 18 10.560 -4.249 5.331 138 HG23 VAL 18 HG23 VAL 18 11.006 -3.756 3.694 139 H ALA 19 HN ALA 19 11.821 -2.409 7.945 140 HA ALA 19 HA ALA 19 11.668 -5.156 8.351 141 HB1 ALA 19 HB1 ALA 19 12.968 -4.817 10.383 142 HB2 ALA 19 HB2 ALA 19 12.586 -3.098 10.366 143 HB3 ALA 19 HB3 ALA 19 13.580 -3.792 9.086 144 H ARG 20 HN ARG 20 9.846 -2.569 9.960 145 HA ARG 20 HA ARG 20 8.667 -4.510 11.751 146 HB2 ARG 20 HB2 ARG 20 7.248 -2.658 12.562 147 HB3 ARG 20 HB1 ARG 20 8.961 -2.300 12.685 148 HG2 ARG 20 HG2 ARG 20 8.874 -0.667 11.076 149 HG3 ARG 20 HG1 ARG 20 7.440 -1.356 10.303 150 HD2 ARG 20 HD2 ARG 20 6.021 -0.572 11.998 151 HD3 ARG 20 HD1 ARG 20 7.355 -0.239 13.081 152 HE ARG 20 HE ARG 20 7.829 1.435 11.011 153 HH11 ARG 20 HH11 ARG 20 5.025 0.838 13.020 154 HH12 ARG 20 HH12 ARG 20 4.423 2.458 12.880 155 HH21 ARG 20 HH21 ARG 20 7.060 3.575 10.855 156 HH22 ARG 20 HH22 ARG 20 5.562 4.002 11.634 157 H LEU 21 HN LEU 21 8.091 -2.910 8.762 158 HA LEU 21 HA LEU 21 5.446 -3.526 8.229 159 HB2 LEU 21 HB2 LEU 21 7.188 -2.266 6.825 160 HB3 LEU 21 HB1 LEU 21 7.690 -3.834 6.240 161 HG LEU 21 HG LEU 21 5.682 -4.154 5.057 162 HD11 LEU 21 HD11 LEU 21 3.964 -3.516 6.462 163 HD12 LEU 21 HD12 LEU 21 3.889 -2.312 5.171 164 HD13 LEU 21 HD13 LEU 21 4.635 -1.908 6.721 165 HD21 LEU 21 HD21 LEU 21 7.141 -2.774 3.862 166 HD22 LEU 21 HD22 LEU 21 6.723 -1.368 4.838 167 HD23 LEU 21 HD23 LEU 21 5.545 -2.037 3.713 168 H GLN 22 HN GLN 22 8.358 -5.431 7.873 169 HA GLN 22 HA GLN 22 7.115 -7.780 6.912 170 HB2 GLN 22 HB2 GLN 22 9.747 -7.559 8.325 171 HB3 GLN 22 HB1 GLN 22 9.215 -8.789 7.152 172 HG2 GLN 22 HG2 GLN 22 8.998 -6.725 5.598 173 HG3 GLN 22 HG1 GLN 22 10.086 -5.980 6.730 174 HE21 GLN 22 HE21 GLN 22 11.386 -5.827 4.810 175 HE22 GLN 22 HE22 GLN 22 12.454 -7.134 4.444 176 H ASP 23 HN ASP 23 8.582 -6.863 9.953 177 HA ASP 23 HA ASP 23 8.161 -9.105 11.465 178 HB2 ASP 23 HB2 ASP 23 7.942 -6.214 12.083 179 HB3 ASP 23 HB1 ASP 23 7.664 -7.399 13.343 180 H VAL 24 HN VAL 24 5.824 -6.486 10.874 181 HA VAL 24 HA VAL 24 3.983 -7.789 12.627 182 HB VAL 24 HB VAL 24 4.019 -5.336 12.590 183 HG11 VAL 24 HG11 VAL 24 4.607 -5.034 10.254 184 HG12 VAL 24 HG12 VAL 24 3.151 -4.122 10.652 185 HG13 VAL 24 HG13 VAL 24 3.026 -5.642 9.767 186 HG21 VAL 24 HG21 VAL 24 1.950 -6.309 13.299 187 HG22 VAL 24 HG22 VAL 24 1.457 -6.607 11.636 188 HG23 VAL 24 HG23 VAL 24 1.545 -4.948 12.244 189 H ALA 25 HN ALA 25 4.623 -7.587 9.245 190 HA ALA 25 HA ALA 25 2.137 -8.603 8.284 191 HB1 ALA 25 HB1 ALA 25 3.739 -7.512 6.765 192 HB2 ALA 25 HB2 ALA 25 3.402 -9.159 6.238 193 HB3 ALA 25 HB3 ALA 25 4.910 -8.793 7.072 194 H GLN 26 HN GLN 26 5.012 -9.780 9.676 195 HA GLN 26 HA GLN 26 4.668 -12.527 9.025 196 HB2 GLN 26 HB2 GLN 26 6.832 -12.355 9.500 197 HB3 GLN 26 HB1 GLN 26 6.571 -10.794 10.260 198 HG2 GLN 26 HG2 GLN 26 7.410 -11.912 12.018 199 HG3 GLN 26 HG1 GLN 26 5.711 -12.309 12.239 200 HE21 GLN 26 HE21 GLN 26 5.693 -14.101 9.942 201 HE22 GLN 26 HE22 GLN 26 6.487 -15.538 10.448 202 H LYS 27 HN LYS 27 3.937 -10.431 11.708 203 HA LYS 27 HA LYS 27 3.121 -12.368 13.586 204 HB2 LYS 27 HB2 LYS 27 2.191 -9.499 13.334 205 HB3 LYS 27 HB1 LYS 27 2.126 -10.498 14.787 206 HG2 LYS 27 HG2 LYS 27 4.601 -9.524 13.386 207 HG3 LYS 27 HG1 LYS 27 3.955 -8.929 14.913 208 HD2 LYS 27 HD2 LYS 27 4.627 -10.804 16.073 209 HD3 LYS 27 HD1 LYS 27 4.628 -11.823 14.633 210 HE2 LYS 27 HE2 LYS 27 6.624 -10.885 13.838 211 HE3 LYS 27 HE1 LYS 27 6.527 -9.535 14.959 212 HZ1 LYS 27 HZ1 LYS 27 6.998 -11.020 16.775 213 HZ2 LYS 27 HZ2 LYS 27 8.195 -11.204 15.594 214 HZ3 LYS 27 HZ3 LYS 27 6.973 -12.361 15.749 215 H SER 28 HN SER 28 1.448 -10.739 10.969 216 HA SER 28 HA SER 28 -1.103 -11.761 11.989 217 HB2 SER 28 HB2 SER 28 -0.566 -9.590 9.970 218 HB3 SER 28 HB1 SER 28 -2.143 -10.019 10.637 219 HG SER 28 HG SER 28 0.080 -8.880 11.982 220 H ILE 29 HN ILE 29 1.251 -12.311 9.707 221 HA ILE 29 HA ILE 29 -0.646 -13.689 7.928 222 HB ILE 29 HB ILE 29 2.111 -12.621 7.367 223 HG12 ILE 29 HG12 ILE 29 -0.562 -11.871 6.183 224 HG13 ILE 29 HG11 ILE 29 0.355 -10.922 7.361 225 HG21 ILE 29 HG21 ILE 29 0.321 -14.219 5.565 226 HG22 ILE 29 HG22 ILE 29 1.909 -14.678 6.190 227 HG23 ILE 29 HG23 ILE 29 1.766 -13.339 5.050 228 HD11 ILE 29 HD11 ILE 29 2.102 -10.554 5.835 229 HD12 ILE 29 HD12 ILE 29 0.592 -10.180 5.001 230 HD13 ILE 29 HD13 ILE 29 1.430 -11.707 4.680 231 H ALA 30 HN ALA 30 -0.589 -15.851 7.988 232 HA ALA 30 HA ALA 30 1.515 -17.187 9.471 233 HB1 ALA 30 HB1 ALA 30 -0.826 -17.832 9.809 234 HB2 ALA 30 HB2 ALA 30 0.147 -19.186 9.232 235 HB3 ALA 30 HB3 ALA 30 -0.927 -18.334 8.120 236 H ASP 31 HN ASP 31 1.256 -16.125 6.383 237 HA ASP 31 HA ASP 31 2.712 -18.432 5.271 238 HB2 ASP 31 HB2 ASP 31 0.432 -17.550 4.271 239 HB3 ASP 31 HB1 ASP 31 1.500 -16.373 3.514 240 H GLU 32 HN GLU 32 4.631 -18.153 4.337 241 HA GLU 32 HA GLU 32 6.131 -15.763 4.797 242 HB2 GLU 32 HB2 GLU 32 7.905 -16.952 3.592 243 HB3 GLU 32 HB1 GLU 32 7.140 -18.022 4.761 244 HG2 GLU 32 HG2 GLU 32 5.696 -18.847 2.816 245 HG3 GLU 32 HG1 GLU 32 6.848 -18.004 1.777 246 H LYS 33 HN LYS 33 4.272 -17.058 2.122 247 HA LYS 33 HA LYS 33 5.497 -15.505 0.063 248 HB2 LYS 33 HB2 LYS 33 2.686 -16.618 0.107 249 HB3 LYS 33 HB1 LYS 33 3.624 -16.190 -1.304 250 HG2 LYS 33 HG2 LYS 33 4.682 -18.106 -1.350 251 HG3 LYS 33 HG1 LYS 33 4.898 -18.146 0.399 252 HD2 LYS 33 HD2 LYS 33 2.451 -18.692 0.551 253 HD3 LYS 33 HD1 LYS 33 2.488 -18.946 -1.199 254 HE2 LYS 33 HE2 LYS 33 2.759 -21.028 -0.021 255 HE3 LYS 33 HE1 LYS 33 4.234 -20.612 -0.893 256 HZ1 LYS 33 HZ1 LYS 33 4.447 -21.438 1.494 257 HZ2 LYS 33 HZ2 LYS 33 3.882 -19.907 1.951 258 HZ3 LYS 33 HZ3 LYS 33 5.318 -20.055 1.065 259 H ALA 34 HN ALA 34 2.400 -15.235 1.753 260 HA ALA 34 HA ALA 34 1.714 -12.713 0.750 261 HB1 ALA 34 HB1 ALA 34 0.057 -14.169 1.738 262 HB2 ALA 34 HB2 ALA 34 0.098 -12.641 2.622 263 HB3 ALA 34 HB3 ALA 34 0.864 -14.078 3.304 264 H ARG 35 HN ARG 35 3.901 -13.696 3.247 265 HA ARG 35 HA ARG 35 3.942 -11.243 4.723 266 HB2 ARG 35 HB2 ARG 35 4.878 -13.700 5.267 267 HB3 ARG 35 HB1 ARG 35 6.351 -12.988 4.630 268 HG2 ARG 35 HG2 ARG 35 4.813 -11.552 6.757 269 HG3 ARG 35 HG1 ARG 35 5.853 -12.909 7.185 270 HD2 ARG 35 HD2 ARG 35 6.662 -10.355 5.804 271 HD3 ARG 35 HD1 ARG 35 7.054 -10.849 7.456 272 HE ARG 35 HE ARG 35 8.002 -12.457 5.180 273 HH11 ARG 35 HH11 ARG 35 8.662 -10.516 8.018 274 HH12 ARG 35 HH12 ARG 35 10.368 -10.813 7.978 275 HH21 ARG 35 HH21 ARG 35 10.250 -12.845 5.133 276 HH22 ARG 35 HH22 ARG 35 11.275 -12.130 6.336 277 H LYS 36 HN LYS 36 6.208 -12.736 2.414 278 HA LYS 36 HA LYS 36 7.889 -10.543 2.031 279 HB2 LYS 36 HB2 LYS 36 7.031 -12.478 -0.106 280 HB3 LYS 36 HB1 LYS 36 8.512 -11.529 -0.064 281 HG2 LYS 36 HG2 LYS 36 9.543 -12.937 1.341 282 HG3 LYS 36 HG1 LYS 36 8.038 -13.367 2.187 283 HD2 LYS 36 HD2 LYS 36 8.839 -15.251 0.869 284 HD3 LYS 36 HD1 LYS 36 7.307 -14.613 0.230 285 HE2 LYS 36 HE2 LYS 36 8.888 -13.152 -1.278 286 HE3 LYS 36 HE1 LYS 36 10.090 -14.379 -0.878 287 HZ1 LYS 36 HZ1 LYS 36 7.458 -14.947 -2.117 288 HZ2 LYS 36 HZ2 LYS 36 8.674 -16.076 -1.797 289 HZ3 LYS 36 HZ3 LYS 36 8.925 -14.869 -2.951 290 H VAL 37 HN VAL 37 5.123 -11.596 0.070 291 HA VAL 37 HA VAL 37 5.419 -9.732 -1.929 292 HB VAL 37 HB VAL 37 3.101 -10.079 -2.582 293 HG11 VAL 37 HG11 VAL 37 3.099 -12.609 -2.622 294 HG12 VAL 37 HG12 VAL 37 4.558 -12.543 -1.622 295 HG13 VAL 37 HG13 VAL 37 4.558 -11.831 -3.241 296 HG21 VAL 37 HG21 VAL 37 2.804 -11.341 0.131 297 HG22 VAL 37 HG22 VAL 37 1.649 -11.573 -1.183 298 HG23 VAL 37 HG23 VAL 37 1.928 -9.959 -0.525 299 H ILE 38 HN ILE 38 3.770 -9.375 1.173 300 HA ILE 38 HA ILE 38 2.835 -6.777 0.331 301 HB ILE 38 HB ILE 38 1.691 -8.589 1.992 302 HG12 ILE 38 HG12 ILE 38 1.249 -5.617 2.142 303 HG13 ILE 38 HG11 ILE 38 0.767 -6.582 0.757 304 HG21 ILE 38 HG21 ILE 38 3.348 -8.087 3.773 305 HG22 ILE 38 HG22 ILE 38 1.687 -7.717 4.244 306 HG23 ILE 38 HG23 ILE 38 2.780 -6.415 3.775 307 HD11 ILE 38 HD11 ILE 38 -0.286 -6.592 3.546 308 HD12 ILE 38 HD12 ILE 38 -0.590 -7.932 2.436 309 HD13 ILE 38 HD13 ILE 38 -1.148 -6.306 2.039 310 H VAL 39 HN VAL 39 5.394 -8.047 2.434 311 HA VAL 39 HA VAL 39 6.022 -5.482 3.482 312 HB VAL 39 HB VAL 39 8.026 -6.306 4.287 313 HG11 VAL 39 HG11 VAL 39 7.474 -8.498 5.282 314 HG12 VAL 39 HG12 VAL 39 6.106 -8.619 4.179 315 HG13 VAL 39 HG13 VAL 39 6.154 -7.329 5.382 316 HG21 VAL 39 HG21 VAL 39 7.932 -8.559 2.292 317 HG22 VAL 39 HG22 VAL 39 9.123 -8.393 3.583 318 HG23 VAL 39 HG23 VAL 39 9.051 -7.197 2.291 319 H GLU 40 HN GLU 40 7.332 -7.310 0.769 320 HA GLU 40 HA GLU 40 9.017 -5.334 -0.224 321 HB2 GLU 40 HB2 GLU 40 7.771 -7.787 -1.403 322 HB3 GLU 40 HB1 GLU 40 8.903 -6.790 -2.296 323 HG2 GLU 40 HG2 GLU 40 10.630 -7.205 -0.768 324 HG3 GLU 40 HG1 GLU 40 9.540 -7.892 0.407 325 H LEU 41 HN LEU 41 5.609 -5.821 -0.598 326 HA LEU 41 HA LEU 41 5.457 -3.978 -2.833 327 HB2 LEU 41 HB2 LEU 41 3.789 -5.954 -1.821 328 HB3 LEU 41 HB1 LEU 41 2.956 -4.457 -1.443 329 HG LEU 41 HG LEU 41 2.095 -5.012 -3.515 330 HD11 LEU 41 HD11 LEU 41 4.408 -3.411 -4.489 331 HD12 LEU 41 HD12 LEU 41 3.269 -2.727 -3.334 332 HD13 LEU 41 HD13 LEU 41 2.696 -3.290 -4.898 333 HD21 LEU 41 HD21 LEU 41 3.532 -6.887 -4.006 334 HD22 LEU 41 HD22 LEU 41 4.874 -5.797 -4.364 335 HD23 LEU 41 HD23 LEU 41 3.447 -5.812 -5.404 336 H MET 42 HN MET 42 4.292 -3.971 0.545 337 HA MET 42 HA MET 42 3.207 -1.378 0.489 338 HB2 MET 42 HB2 MET 42 4.243 -3.036 2.776 339 HB3 MET 42 HB1 MET 42 3.370 -1.518 2.995 340 HG2 MET 42 HG2 MET 42 2.359 -4.031 1.679 341 HG3 MET 42 HG1 MET 42 1.891 -3.406 3.249 342 HE1 MET 42 HE1 MET 42 -0.693 -3.766 2.371 343 HE2 MET 42 HE2 MET 42 0.013 -4.329 0.852 344 HE3 MET 42 HE3 MET 42 -1.241 -3.088 0.831 345 H ALA 43 HN ALA 43 6.358 -2.590 0.913 346 HA ALA 43 HA ALA 43 7.850 -0.660 2.066 347 HB1 ALA 43 HB1 ALA 43 8.840 -2.649 1.278 348 HB2 ALA 43 HB2 ALA 43 9.611 -1.324 0.399 349 HB3 ALA 43 HB3 ALA 43 8.375 -2.310 -0.386 350 H TYR 44 HN TYR 44 6.231 -0.566 -1.048 351 HA TYR 44 HA TYR 44 7.299 2.129 -1.623 352 HB2 TYR 44 HB2 TYR 44 7.455 0.598 -3.526 353 HB3 TYR 44 HB1 TYR 44 5.771 0.150 -3.300 354 HD1 TYR 44 HD1 TYR 44 8.010 2.378 -4.992 355 HD2 TYR 44 HD2 TYR 44 3.973 1.919 -3.795 356 HE1 TYR 44 HE1 TYR 44 7.341 4.025 -6.676 357 HE2 TYR 44 HE2 TYR 44 3.284 3.577 -5.464 358 HH TYR 44 HH TYR 44 4.226 5.426 -6.722 359 H GLU 45 HN GLU 45 4.310 0.335 -2.079 360 HA GLU 45 HA GLU 45 2.542 2.274 -2.462 361 HB2 GLU 45 HB2 GLU 45 1.816 0.013 -0.682 362 HB3 GLU 45 HB1 GLU 45 0.882 0.727 -1.990 363 HG2 GLU 45 HG2 GLU 45 3.309 -0.979 -2.218 364 HG3 GLU 45 HG1 GLU 45 1.673 -1.464 -2.603 365 H ASN 46 HN ASN 46 3.810 1.311 0.687 366 HA ASN 46 HA ASN 46 1.901 3.088 2.034 367 HB2 ASN 46 HB2 ASN 46 2.887 0.405 2.379 368 HB3 ASN 46 HB1 ASN 46 3.226 1.401 3.787 369 HD21 ASN 46 HD21 ASN 46 1.892 -0.176 4.817 370 HD22 ASN 46 HD22 ASN 46 0.190 0.087 4.856 371 H ALA 47 HN ALA 47 5.108 2.903 1.011 372 HA ALA 47 HA ALA 47 6.482 3.700 3.365 373 HB1 ALA 47 HB1 ALA 47 7.367 4.256 0.557 374 HB2 ALA 47 HB2 ALA 47 7.444 2.649 1.287 375 HB3 ALA 47 HB3 ALA 47 8.360 3.987 1.992 376 H ASN 48 HN ASN 48 8.018 5.765 2.854 377 HA ASN 48 HA ASN 48 6.387 8.074 3.066 378 HB2 ASN 48 HB2 ASN 48 9.287 7.499 2.911 379 HB3 ASN 48 HB1 ASN 48 8.797 9.094 2.346 380 HD21 ASN 48 HD21 ASN 48 10.255 8.048 4.797 381 HD22 ASN 48 HD22 ASN 48 9.419 8.793 6.116 382 HA PRO 49 HA PRO 49 5.096 8.803 -1.041 383 HB2 PRO 49 HB2 PRO 49 5.753 11.563 -1.106 384 HB3 PRO 49 HB1 PRO 49 4.187 10.851 -0.721 385 HG2 PRO 49 HG2 PRO 49 6.309 11.857 1.087 386 HG3 PRO 49 HG1 PRO 49 4.556 11.793 1.334 387 HD2 PRO 49 HD2 PRO 49 6.234 10.107 2.591 388 HD3 PRO 49 HD1 PRO 49 4.616 9.594 2.058 389 H GLU 50 HN GLU 50 8.055 10.509 -0.190 390 HA GLU 50 HA GLU 50 9.213 10.532 -2.740 391 HB2 GLU 50 HB2 GLU 50 10.047 12.193 -1.423 392 HB3 GLU 50 HB1 GLU 50 10.009 11.217 0.035 393 HG2 GLU 50 HG2 GLU 50 12.184 11.030 -0.208 394 HG3 GLU 50 HG1 GLU 50 11.837 9.956 -1.536 395 H CYS 51 HN CYS 51 9.226 8.269 -0.071 396 HA CYS 51 HA CYS 51 11.679 7.027 -0.826 397 HB2 CYS 51 HB2 CYS 51 9.537 6.320 1.184 398 HB3 CYS 51 HB1 CYS 51 10.980 5.346 0.912 399 HG CYS 51 HG CYS 51 11.363 8.647 1.591 400 H GLN 52 HN GLN 52 8.260 6.442 -1.244 401 HA GLN 52 HA GLN 52 8.662 3.975 -2.648 402 HB2 GLN 52 HB2 GLN 52 6.339 4.098 -3.224 403 HB3 GLN 52 HB1 GLN 52 6.511 4.560 -1.540 404 HG2 GLN 52 HG2 GLN 52 6.401 6.943 -2.275 405 HG3 GLN 52 HG1 GLN 52 6.011 6.361 -3.890 406 HE21 GLN 52 HE21 GLN 52 4.595 4.075 -2.841 407 HE22 GLN 52 HE22 GLN 52 3.079 4.626 -2.259 408 H SER 53 HN SER 53 8.452 7.315 -3.285 409 HA SER 53 HA SER 53 8.543 7.238 -6.096 410 HB2 SER 53 HB2 SER 53 9.226 9.244 -3.991 411 HB3 SER 53 HB1 SER 53 9.464 9.610 -5.706 412 HG SER 53 HG SER 53 7.124 9.305 -4.226 413 H ALA 54 HN ALA 54 10.923 6.828 -3.593 414 HA ALA 54 HA ALA 54 13.136 6.859 -5.426 415 HB1 ALA 54 HB1 ALA 54 13.587 7.244 -3.127 416 HB2 ALA 54 HB2 ALA 54 14.317 5.697 -3.551 417 HB3 ALA 54 HB3 ALA 54 12.790 5.745 -2.663 418 H ILE 55 HN ILE 55 10.725 4.669 -4.496 419 HA ILE 55 HA ILE 55 12.202 2.316 -5.253 420 HB ILE 55 HB ILE 55 9.509 2.760 -4.043 421 HG12 ILE 55 HG12 ILE 55 11.743 1.175 -2.885 422 HG13 ILE 55 HG11 ILE 55 11.857 2.940 -2.893 423 HG21 ILE 55 HG21 ILE 55 9.284 0.824 -5.461 424 HG22 ILE 55 HG22 ILE 55 9.375 0.310 -3.776 425 HG23 ILE 55 HG23 ILE 55 10.783 0.150 -4.825 426 HD11 ILE 55 HD11 ILE 55 9.529 1.410 -1.756 427 HD12 ILE 55 HD12 ILE 55 9.883 3.138 -1.597 428 HD13 ILE 55 HD13 ILE 55 10.937 1.946 -0.826 429 H LYS 56 HN LYS 56 9.562 4.227 -6.687 430 HA LYS 56 HA LYS 56 8.222 2.369 -8.120 431 HB2 LYS 56 HB2 LYS 56 8.658 4.431 -10.030 432 HB3 LYS 56 HB1 LYS 56 7.209 4.044 -9.121 433 HG2 LYS 56 HG2 LYS 56 7.493 6.199 -8.495 434 HG3 LYS 56 HG1 LYS 56 8.485 5.424 -7.257 435 HD2 LYS 56 HD2 LYS 56 10.424 6.052 -8.201 436 HD3 LYS 56 HD1 LYS 56 9.770 6.113 -9.837 437 HE2 LYS 56 HE2 LYS 56 9.668 8.193 -7.655 438 HE3 LYS 56 HE1 LYS 56 10.158 8.349 -9.345 439 HZ1 LYS 56 HZ1 LYS 56 7.873 8.140 -10.043 440 HZ2 LYS 56 HZ2 LYS 56 8.010 9.395 -8.918 441 HZ3 LYS 56 HZ3 LYS 56 7.363 7.907 -8.449 442 HA PRO 57 HA PRO 57 11.585 2.163 -11.707 443 HB2 PRO 57 HB2 PRO 57 14.138 2.272 -10.789 444 HB3 PRO 57 HB1 PRO 57 13.274 3.701 -11.377 445 HG2 PRO 57 HG2 PRO 57 13.522 2.694 -8.554 446 HG3 PRO 57 HG1 PRO 57 13.912 4.320 -9.176 447 HD2 PRO 57 HD2 PRO 57 11.594 3.895 -8.007 448 HD3 PRO 57 HD1 PRO 57 11.610 4.817 -9.519 449 H LEU 58 HN LEU 58 11.955 1.020 -8.423 450 HA LEU 58 HA LEU 58 13.011 -1.570 -9.314 451 HB2 LEU 58 HB2 LEU 58 12.459 -1.041 -6.462 452 HB3 LEU 58 HB1 LEU 58 13.794 -1.929 -7.181 453 HG LEU 58 HG LEU 58 13.517 1.081 -7.043 454 HD11 LEU 58 HD11 LEU 58 15.394 0.864 -5.429 455 HD12 LEU 58 HD12 LEU 58 15.158 -0.884 -5.461 456 HD13 LEU 58 HD13 LEU 58 13.874 0.167 -4.863 457 HD21 LEU 58 HD21 LEU 58 15.853 1.109 -7.793 458 HD22 LEU 58 HD22 LEU 58 14.783 0.397 -9.001 459 HD23 LEU 58 HD23 LEU 58 15.799 -0.640 -8.001 460 H LYS 59 HN LYS 59 10.253 0.105 -8.382 461 HA LYS 59 HA LYS 59 8.727 -1.760 -7.028 462 HB2 LYS 59 HB2 LYS 59 7.942 0.500 -7.365 463 HB3 LYS 59 HB1 LYS 59 7.829 0.230 -9.096 464 HG2 LYS 59 HG2 LYS 59 5.671 -0.174 -8.661 465 HG3 LYS 59 HG1 LYS 59 6.275 -1.753 -8.181 466 HD2 LYS 59 HD2 LYS 59 5.820 0.568 -6.346 467 HD3 LYS 59 HD1 LYS 59 4.747 -0.825 -6.506 468 HE2 LYS 59 HE2 LYS 59 7.617 -0.879 -5.556 469 HE3 LYS 59 HE1 LYS 59 6.194 -1.010 -4.542 470 HZ1 LYS 59 HZ1 LYS 59 7.061 -3.162 -4.894 471 HZ2 LYS 59 HZ2 LYS 59 7.116 -2.941 -6.568 472 HZ3 LYS 59 HZ3 LYS 59 5.623 -3.045 -5.784 473 H GLY 60 HN GLY 60 8.493 -3.808 -7.536 474 HA2 GLY 60 HA3 GLY 60 7.371 -5.510 -8.737 475 HA3 GLY 60 HA2 GLY 60 7.400 -4.483 -10.165 476 H LYS 61 HN LYS 61 10.321 -3.880 -9.486 477 HA LYS 61 HA LYS 61 11.382 -6.273 -10.824 478 HB2 LYS 61 HB2 LYS 61 13.006 -3.798 -10.530 479 HB3 LYS 61 HB1 LYS 61 12.871 -4.889 -11.898 480 HG2 LYS 61 HG2 LYS 61 10.802 -2.872 -11.093 481 HG3 LYS 61 HG1 LYS 61 11.991 -2.646 -12.363 482 HD2 LYS 61 HD2 LYS 61 9.911 -4.824 -12.310 483 HD3 LYS 61 HD1 LYS 61 9.768 -3.316 -13.216 484 HE2 LYS 61 HE2 LYS 61 11.742 -3.889 -14.501 485 HE3 LYS 61 HE1 LYS 61 11.934 -5.375 -13.576 486 HZ1 LYS 61 HZ1 LYS 61 9.802 -6.132 -14.425 487 HZ2 LYS 61 HZ2 LYS 61 10.866 -5.797 -15.693 488 HZ3 LYS 61 HZ3 LYS 61 9.629 -4.709 -15.320 489 H VAL 62 HN VAL 62 12.215 -7.650 -9.370 490 HA VAL 62 HA VAL 62 14.188 -6.536 -7.500 491 HB VAL 62 HB VAL 62 12.341 -7.455 -6.214 492 HG11 VAL 62 HG11 VAL 62 12.810 -10.036 -7.693 493 HG12 VAL 62 HG12 VAL 62 11.394 -8.995 -7.824 494 HG13 VAL 62 HG13 VAL 62 11.737 -9.831 -6.308 495 HG21 VAL 62 HG21 VAL 62 13.547 -9.175 -4.895 496 HG22 VAL 62 HG22 VAL 62 14.501 -7.731 -5.228 497 HG23 VAL 62 HG23 VAL 62 14.787 -9.209 -6.148 498 HA PRO 63 HA PRO 63 17.373 -9.059 -9.560 499 HB2 PRO 63 HB2 PRO 63 17.977 -9.566 -6.678 500 HB3 PRO 63 HB1 PRO 63 19.085 -9.234 -7.996 501 HG2 PRO 63 HG2 PRO 63 18.451 -7.313 -6.295 502 HG3 PRO 63 HG1 PRO 63 18.574 -6.960 -8.027 503 HD2 PRO 63 HD2 PRO 63 16.158 -7.217 -6.317 504 HD3 PRO 63 HD1 PRO 63 16.422 -6.218 -7.759 505 H ALA 64 HN ALA 64 17.564 -11.213 -10.020 506 HA ALA 64 HA ALA 64 15.351 -12.842 -9.440 507 HB1 ALA 64 HB1 ALA 64 18.004 -13.638 -10.624 508 HB2 ALA 64 HB2 ALA 64 16.620 -13.009 -11.519 509 HB3 ALA 64 HB3 ALA 64 16.508 -14.569 -10.704 510 H GLY 65 HN GLY 65 15.025 -13.386 -7.357 511 HA2 GLY 65 HA3 GLY 65 15.258 -15.183 -5.821 512 HA3 GLY 65 HA2 GLY 65 16.964 -15.265 -6.219 513 H SER 66 HN SER 66 16.459 -12.062 -5.904 514 HA SER 66 HA SER 66 17.431 -12.155 -3.146 515 HB2 SER 66 HB2 SER 66 17.354 -9.805 -5.040 516 HB3 SER 66 HB1 SER 66 18.257 -9.925 -3.531 517 HG SER 66 HG SER 66 18.927 -12.008 -5.023 518 H ASP 67 HN ASP 67 16.863 -10.018 -1.953 519 HA ASP 67 HA ASP 67 14.000 -10.031 -1.462 520 HB2 ASP 67 HB2 ASP 67 15.883 -10.013 0.293 521 HB3 ASP 67 HB1 ASP 67 16.140 -8.347 -0.168 522 H VAL 68 HN VAL 68 12.583 -8.306 -2.031 523 HA VAL 68 HA VAL 68 13.795 -6.289 -3.729 524 HB VAL 68 HB VAL 68 11.814 -5.830 -4.609 525 HG11 VAL 68 HG11 VAL 68 11.703 -8.256 -4.526 526 HG12 VAL 68 HG12 VAL 68 10.106 -7.513 -4.491 527 HG13 VAL 68 HG13 VAL 68 10.811 -8.159 -3.009 528 HG21 VAL 68 HG21 VAL 68 9.758 -5.368 -3.347 529 HG22 VAL 68 HG22 VAL 68 11.140 -4.414 -2.797 530 HG23 VAL 68 HG23 VAL 68 10.596 -5.805 -1.856 531 H ILE 69 HN ILE 69 12.617 -6.568 -0.486 532 HA ILE 69 HA ILE 69 12.389 -3.870 0.172 533 HB ILE 69 HB ILE 69 13.201 -6.235 1.838 534 HG12 ILE 69 HG12 ILE 69 10.943 -6.429 1.171 535 HG13 ILE 69 HG11 ILE 69 10.895 -5.818 2.810 536 HG21 ILE 69 HG21 ILE 69 14.192 -4.333 2.892 537 HG22 ILE 69 HG22 ILE 69 12.756 -4.775 3.821 538 HG23 ILE 69 HG23 ILE 69 12.711 -3.392 2.724 539 HD11 ILE 69 HD11 ILE 69 9.262 -4.709 1.454 540 HD12 ILE 69 HD12 ILE 69 10.517 -4.210 0.312 541 HD13 ILE 69 HD13 ILE 69 10.507 -3.555 1.951 542 H SER 70 HN SER 70 15.110 -6.044 0.384 543 HA SER 70 HA SER 70 17.155 -4.491 1.236 544 HB2 SER 70 HB2 SER 70 17.512 -6.799 0.633 545 HB3 SER 70 HB1 SER 70 17.132 -6.479 -1.054 546 HG SER 70 HG SER 70 19.409 -5.670 0.429 547 H GLU 71 HN GLU 71 15.664 -4.331 -1.938 548 HA GLU 71 HA GLU 71 17.533 -2.431 -3.007 549 HB2 GLU 71 HB2 GLU 71 14.918 -3.355 -4.167 550 HB3 GLU 71 HB1 GLU 71 16.314 -2.716 -5.027 551 HG2 GLU 71 HG2 GLU 71 16.775 -5.132 -3.427 552 HG3 GLU 71 HG1 GLU 71 15.738 -5.317 -4.836 553 H TYR 72 HN TYR 72 14.358 -2.552 -1.672 554 HA TYR 72 HA TYR 72 13.556 0.018 -2.612 555 HB2 TYR 72 HB2 TYR 72 12.416 -1.989 -0.680 556 HB3 TYR 72 HB1 TYR 72 11.675 -0.412 -0.910 557 HD1 TYR 72 HD1 TYR 72 13.238 -1.880 -3.813 558 HD2 TYR 72 HD2 TYR 72 9.627 -1.641 -1.598 559 HE1 TYR 72 HE1 TYR 72 11.999 -2.742 -5.739 560 HE2 TYR 72 HE2 TYR 72 8.377 -2.523 -3.521 561 HH TYR 72 HH TYR 72 10.025 -3.782 -6.328 562 H VAL 73 HN VAL 73 14.854 -1.344 0.337 563 HA VAL 73 HA VAL 73 14.866 1.069 1.823 564 HB VAL 73 HB VAL 73 16.108 0.063 3.465 565 HG11 VAL 73 HG11 VAL 73 15.404 -2.275 3.712 566 HG12 VAL 73 HG12 VAL 73 14.807 -2.226 2.053 567 HG13 VAL 73 HG13 VAL 73 14.099 -1.176 3.279 568 HG21 VAL 73 HG21 VAL 73 17.813 -1.516 3.289 569 HG22 VAL 73 HG22 VAL 73 18.034 -0.458 1.889 570 HG23 VAL 73 HG23 VAL 73 17.281 -2.040 1.686 571 H LYS 74 HN LYS 74 16.935 -0.496 -0.474 572 HA LYS 74 HA LYS 74 19.179 1.226 -0.252 573 HB2 LYS 74 HB2 LYS 74 19.417 -0.933 -1.157 574 HB3 LYS 74 HB1 LYS 74 18.140 -0.673 -2.328 575 HG2 LYS 74 HG2 LYS 74 19.713 1.228 -3.156 576 HG3 LYS 74 HG1 LYS 74 20.938 0.286 -2.309 577 HD2 LYS 74 HD2 LYS 74 20.875 -0.425 -4.606 578 HD3 LYS 74 HD1 LYS 74 20.194 -1.703 -3.594 579 HE2 LYS 74 HE2 LYS 74 17.925 -0.820 -4.086 580 HE3 LYS 74 HE1 LYS 74 18.668 0.326 -5.209 581 HZ1 LYS 74 HZ1 LYS 74 18.804 -2.636 -5.445 582 HZ2 LYS 74 HZ2 LYS 74 19.550 -1.538 -6.488 583 HZ3 LYS 74 HZ3 LYS 74 17.867 -1.604 -6.403 584 H ALA 75 HN ALA 75 16.146 1.266 -1.939 585 HA ALA 75 HA ALA 75 16.658 3.370 -3.756 586 HB1 ALA 75 HB1 ALA 75 14.705 1.937 -3.934 587 HB2 ALA 75 HB2 ALA 75 14.210 3.623 -3.801 588 HB3 ALA 75 HB3 ALA 75 14.089 2.551 -2.403 589 H CYS 76 HN CYS 76 15.391 3.299 -0.470 590 HA CYS 76 HA CYS 76 15.557 6.206 -0.282 591 HB2 CYS 76 HB2 CYS 76 13.583 5.248 0.610 592 HB3 CYS 76 HB1 CYS 76 14.470 4.076 1.561 593 HG CYS 76 HG CYS 76 13.359 7.012 2.430 594 H ASP 77 HN ASP 77 17.773 3.884 -0.153 595 HA ASP 77 HA ASP 77 19.180 4.492 2.225 596 HB2 ASP 77 HB2 ASP 77 19.726 2.501 1.015 597 HB3 ASP 77 HB1 ASP 77 20.145 3.403 -0.433 598 H GLY 78 HN GLY 78 18.568 6.306 -0.546 599 HA2 GLY 78 HA3 GLY 78 20.636 8.252 0.229 600 HA3 GLY 78 HA2 GLY 78 19.793 8.236 -1.313 601 H ILE 79 HN ILE 79 17.489 7.569 0.965 602 HA ILE 79 HA ILE 79 16.667 10.368 1.037 603 HB ILE 79 HB ILE 79 15.075 7.841 1.333 604 HG12 ILE 79 HG12 ILE 79 14.928 9.998 -0.772 605 HG13 ILE 79 HG11 ILE 79 15.810 8.481 -0.963 606 HG21 ILE 79 HG21 ILE 79 14.168 10.701 1.573 607 HG22 ILE 79 HG22 ILE 79 14.061 9.431 2.794 608 HG23 ILE 79 HG23 ILE 79 13.078 9.336 1.332 609 HD11 ILE 79 HD11 ILE 79 13.491 8.623 -1.953 610 HD12 ILE 79 HD12 ILE 79 12.898 8.562 -0.294 611 HD13 ILE 79 HD13 ILE 79 13.846 7.222 -0.943 612 H GLY 80 HN GLY 80 16.304 11.417 2.893 613 HA2 GLY 80 HA3 GLY 80 15.431 10.969 5.268 614 HA3 GLY 80 HA2 GLY 80 16.890 9.998 5.395 615 H GLY 81 HN GLY 81 16.875 12.897 3.513 616 HA2 GLY 81 HA3 GLY 81 17.920 14.600 5.572 617 HA3 GLY 81 HA2 GLY 81 19.143 13.970 4.489 618 H ALA 82 HN ALA 82 19.644 15.984 3.906 619 HA ALA 82 HA ALA 82 17.940 17.800 2.620 620 HB1 ALA 82 HB1 ALA 82 20.894 17.338 2.522 621 HB2 ALA 82 HB2 ALA 82 20.017 18.494 3.522 622 HB3 ALA 82 HB3 ALA 82 20.097 18.724 1.773 623 H MET 83 HN MET 83 19.674 14.970 1.504 624 HA MET 83 HA MET 83 19.338 15.458 -1.271 625 HB2 MET 83 HB2 MET 83 19.502 12.767 0.094 626 HB3 MET 83 HB1 MET 83 19.787 13.096 -1.605 627 HG2 MET 83 HG2 MET 83 21.698 14.542 -0.916 628 HG3 MET 83 HG1 MET 83 21.461 13.964 0.727 629 HE1 MET 83 HE1 MET 83 24.255 13.684 -0.729 630 HE2 MET 83 HE2 MET 83 24.689 12.030 -0.302 631 HE3 MET 83 HE3 MET 83 23.937 13.081 0.897 632 H HIS 84 HN HIS 84 17.325 14.053 1.227 633 HA HIS 84 HA HIS 84 15.226 13.154 -0.407 634 HB2 HIS 84 HB2 HIS 84 15.151 12.428 1.833 635 HB3 HIS 84 HB1 HIS 84 15.355 14.055 2.463 636 HD1 HIS 84 HD1 HIS 84 13.295 14.250 3.868 637 HD2 HIS 84 HD2 HIS 84 12.442 12.974 0.010 638 HE1 HIS 84 HE1 HIS 84 10.792 14.266 3.690 639 HE2 HIS 84 HE2 HIS 84 10.305 13.633 1.306 640 H LYS 85 HN LYS 85 16.073 16.336 0.832 641 HA LYS 85 HA LYS 85 13.609 17.537 -0.036 642 HB2 LYS 85 HB2 LYS 85 16.198 18.690 0.990 643 HB3 LYS 85 HB1 LYS 85 14.891 19.710 0.407 644 HG2 LYS 85 HG2 LYS 85 14.593 19.644 2.718 645 HG3 LYS 85 HG1 LYS 85 13.415 18.492 2.097 646 HD2 LYS 85 HD2 LYS 85 15.239 16.722 2.514 647 HD3 LYS 85 HD1 LYS 85 16.013 17.957 3.505 648 HE2 LYS 85 HE2 LYS 85 13.226 16.871 3.866 649 HE3 LYS 85 HE1 LYS 85 14.622 16.472 4.860 650 HZ1 LYS 85 HZ1 LYS 85 14.744 18.812 5.523 651 HZ2 LYS 85 HZ2 LYS 85 13.260 18.126 5.941 652 HZ3 LYS 85 HZ3 LYS 85 13.366 19.156 4.607 653 H ALA 86 HN ALA 86 16.589 16.719 -1.470 654 HA ALA 86 HA ALA 86 16.311 18.500 -3.736 655 HB1 ALA 86 HB1 ALA 86 18.306 17.418 -4.583 656 HB2 ALA 86 HB2 ALA 86 18.190 16.178 -3.334 657 HB3 ALA 86 HB3 ALA 86 18.537 17.850 -2.888 658 H MET 87 HN MET 87 16.099 15.036 -3.086 659 HA MET 87 HA MET 87 15.301 14.352 -5.730 660 HB2 MET 87 HB2 MET 87 15.194 12.786 -3.150 661 HB3 MET 87 HB1 MET 87 14.889 12.110 -4.749 662 HG2 MET 87 HG2 MET 87 17.144 12.697 -5.435 663 HG3 MET 87 HG1 MET 87 17.446 13.399 -3.855 664 HE1 MET 87 HE1 MET 87 19.388 11.261 -5.124 665 HE2 MET 87 HE2 MET 87 19.679 10.201 -3.744 666 HE3 MET 87 HE3 MET 87 19.618 11.948 -3.516 667 H LEU 88 HN LEU 88 13.697 15.594 -3.038 668 HA LEU 88 HA LEU 88 11.175 14.554 -3.057 669 HB2 LEU 88 HB2 LEU 88 12.401 16.562 -1.787 670 HB3 LEU 88 HB1 LEU 88 11.423 17.501 -2.892 671 HG LEU 88 HG LEU 88 9.541 17.143 -1.709 672 HD11 LEU 88 HD11 LEU 88 9.349 14.815 -2.432 673 HD12 LEU 88 HD12 LEU 88 8.890 14.992 -0.741 674 HD13 LEU 88 HD13 LEU 88 10.466 14.322 -1.160 675 HD21 LEU 88 HD21 LEU 88 11.116 17.791 0.006 676 HD22 LEU 88 HD22 LEU 88 11.576 16.104 0.237 677 HD23 LEU 88 HD23 LEU 88 9.951 16.641 0.664 678 H MET 89 HN MET 89 12.560 16.957 -5.235 679 HA MET 89 HA MET 89 10.072 17.349 -6.660 680 HB2 MET 89 HB2 MET 89 11.657 19.208 -6.316 681 HB3 MET 89 HB1 MET 89 12.859 18.350 -7.270 682 HG2 MET 89 HG2 MET 89 11.423 18.496 -9.231 683 HG3 MET 89 HG1 MET 89 10.197 19.328 -8.278 684 HE1 MET 89 HE1 MET 89 14.348 21.091 -9.265 685 HE2 MET 89 HE2 MET 89 13.780 19.527 -9.851 686 HE3 MET 89 HE3 MET 89 14.118 19.756 -8.135 687 H ALA 90 HN ALA 90 12.678 15.170 -6.805 688 HA ALA 90 HA ALA 90 12.480 14.794 -9.701 689 HB1 ALA 90 HB1 ALA 90 14.389 13.506 -7.747 690 HB2 ALA 90 HB2 ALA 90 14.711 15.000 -8.629 691 HB3 ALA 90 HB3 ALA 90 14.501 13.488 -9.509 692 H GLN 91 HN GLN 91 11.951 13.089 -6.692 693 HA GLN 91 HA GLN 91 11.071 10.724 -8.182 694 HB2 GLN 91 HB2 GLN 91 11.751 11.075 -5.269 695 HB3 GLN 91 HB1 GLN 91 11.340 9.557 -6.055 696 HG2 GLN 91 HG2 GLN 91 13.311 9.683 -7.416 697 HG3 GLN 91 HG1 GLN 91 13.711 11.261 -6.749 698 HE21 GLN 91 HE21 GLN 91 12.962 10.738 -4.107 699 HE22 GLN 91 HE22 GLN 91 14.082 9.603 -3.464 700 H LEU 92 HN LEU 92 10.172 12.552 -5.257 701 HA LEU 92 HA LEU 92 7.588 11.557 -4.982 702 HB2 LEU 92 HB2 LEU 92 8.969 12.860 -3.332 703 HB3 LEU 92 HB1 LEU 92 8.477 14.305 -4.189 704 HG LEU 92 HG LEU 92 7.199 13.277 -2.037 705 HD11 LEU 92 HD11 LEU 92 5.352 14.766 -2.614 706 HD12 LEU 92 HD12 LEU 92 5.954 14.868 -4.268 707 HD13 LEU 92 HD13 LEU 92 6.915 15.516 -2.937 708 HD21 LEU 92 HD21 LEU 92 5.048 12.368 -2.807 709 HD22 LEU 92 HD22 LEU 92 6.406 11.304 -3.172 710 HD23 LEU 92 HD23 LEU 92 5.692 12.292 -4.446 711 H GLU 93 HN GLU 93 8.844 13.378 -7.444 712 HA GLU 93 HA GLU 93 7.260 15.409 -8.181 713 HB2 GLU 93 HB2 GLU 93 7.666 14.707 -10.564 714 HB3 GLU 93 HB1 GLU 93 9.107 14.818 -9.557 715 HG2 GLU 93 HG2 GLU 93 9.379 12.514 -9.475 716 HG3 GLU 93 HG1 GLU 93 7.713 12.195 -9.947 717 H2 PRO 1 HT1 PRO 1 5.162 -3.928 -13.581 718 H3 PRO 1 HT2 PRO 1 5.548 -2.412 -14.049 719 HA PRO 1 HA PRO 1 6.375 -2.431 -12.043 720 HB2 PRO 1 HB2 PRO 1 4.389 -1.362 -10.603 721 HB3 PRO 1 HB1 PRO 1 5.081 -0.500 -11.981 722 HG2 PRO 1 HG2 PRO 1 2.463 -1.803 -11.731 723 HG3 PRO 1 HG1 PRO 1 3.011 -0.593 -12.907 724 HD2 PRO 1 HD2 PRO 1 2.857 -3.494 -13.166 725 HD3 PRO 1 HD1 PRO 1 3.142 -2.276 -14.426 726 H SER 2 HN SER 2 4.594 -2.577 -9.607 727 HA SER 2 HA SER 2 4.388 -5.372 -9.139 728 HB2 SER 2 HB2 SER 2 3.127 -2.978 -7.791 729 HB3 SER 2 HB1 SER 2 2.901 -4.631 -7.233 730 HG SER 2 HG SER 2 5.139 -4.804 -6.955 731 H PHE 3 HN PHE 3 2.005 -6.078 -8.384 732 HA PHE 3 HA PHE 3 0.310 -5.871 -10.682 733 HB2 PHE 3 HB2 PHE 3 -1.189 -6.741 -8.453 734 HB3 PHE 3 HB1 PHE 3 -0.514 -7.751 -9.740 735 HD1 PHE 3 HD1 PHE 3 -0.647 -6.986 -6.345 736 HD2 PHE 3 HD2 PHE 3 1.955 -8.544 -9.321 737 HE1 PHE 3 HE1 PHE 3 0.678 -8.111 -4.613 738 HE2 PHE 3 HE2 PHE 3 3.302 -9.654 -7.588 739 HZ PHE 3 HZ PHE 3 2.663 -9.437 -5.218 740 H ASN 4 HN ASN 4 0.297 -4.730 -7.382 741 HA ASN 4 HA ASN 4 -2.398 -3.787 -7.656 742 HB2 ASN 4 HB2 ASN 4 -2.189 -3.415 -5.231 743 HB3 ASN 4 HB1 ASN 4 -1.748 -5.053 -5.704 744 HD21 ASN 4 HD21 ASN 4 -0.472 -1.902 -4.850 745 HD22 ASN 4 HD22 ASN 4 1.068 -2.472 -4.294 746 H THR 5 HN THR 5 0.296 -2.335 -8.570 747 HA THR 5 HA THR 5 0.358 0.031 -7.011 748 HB THR 5 HB THR 5 1.558 0.794 -9.253 749 HG1 THR 5 HG1 THR 5 1.359 -0.913 -10.563 750 HG21 THR 5 HG21 THR 5 3.599 -0.029 -8.244 751 HG22 THR 5 HG22 THR 5 2.654 -1.133 -7.242 752 HG23 THR 5 HG23 THR 5 2.489 0.610 -7.025 753 H VAL 6 HN VAL 6 -2.004 -0.968 -9.049 754 HA VAL 6 HA VAL 6 -2.355 1.392 -10.608 755 HB VAL 6 HB VAL 6 -4.320 0.254 -11.479 756 HG11 VAL 6 HG11 VAL 6 -3.175 -1.672 -12.429 757 HG12 VAL 6 HG12 VAL 6 -1.986 -1.618 -11.125 758 HG13 VAL 6 HG13 VAL 6 -2.066 -0.304 -12.300 759 HG21 VAL 6 HG21 VAL 6 -5.047 -1.904 -10.660 760 HG22 VAL 6 HG22 VAL 6 -5.060 -0.741 -9.318 761 HG23 VAL 6 HG23 VAL 6 -3.745 -1.917 -9.456 762 H ARG 7 HN ARG 7 -2.990 3.214 -9.425 763 HA ARG 7 HA ARG 7 -4.649 2.531 -7.124 764 HB2 ARG 7 HB2 ARG 7 -2.773 4.819 -7.307 765 HB3 ARG 7 HB1 ARG 7 -3.624 4.272 -5.862 766 HG2 ARG 7 HG2 ARG 7 -1.295 3.172 -7.305 767 HG3 ARG 7 HG1 ARG 7 -1.529 3.503 -5.581 768 HD2 ARG 7 HD2 ARG 7 -2.745 1.405 -7.237 769 HD3 ARG 7 HD1 ARG 7 -1.724 1.240 -5.855 770 HE ARG 7 HE ARG 7 -3.708 2.549 -4.774 771 HH11 ARG 7 HH11 ARG 7 -4.429 0.317 -7.259 772 HH12 ARG 7 HH12 ARG 7 -5.434 -0.686 -6.267 773 HH21 ARG 7 HH21 ARG 7 -4.935 1.190 -3.375 774 HH22 ARG 7 HH22 ARG 7 -5.716 -0.196 -4.055 775 H GLN 8 HN GLN 8 -6.171 3.762 -6.425 776 HA GLN 8 HA GLN 8 -7.930 5.074 -7.960 777 HB2 GLN 8 HB2 GLN 8 -7.518 4.669 -5.221 778 HB3 GLN 8 HB1 GLN 8 -7.750 6.411 -5.392 779 HG2 GLN 8 HG2 GLN 8 -9.831 6.022 -6.618 780 HG3 GLN 8 HG1 GLN 8 -9.624 4.286 -6.409 781 HE21 GLN 8 HE21 GLN 8 -11.811 5.925 -5.574 782 HE22 GLN 8 HE22 GLN 8 -11.909 5.792 -3.842 783 H GLY 9 HN GLY 9 -7.517 6.598 -9.405 784 HA2 GLY 9 HA3 GLY 9 -5.653 8.751 -8.916 785 HA3 GLY 9 HA2 GLY 9 -6.662 8.531 -10.338 786 H SER 10 HN SER 10 -7.255 10.734 -10.348 787 HA SER 10 HA SER 10 -8.207 12.187 -8.169 788 HB2 SER 10 HB2 SER 10 -9.037 12.497 -11.065 789 HB3 SER 10 HB1 SER 10 -9.125 13.734 -9.811 790 HG SER 10 HG SER 10 -6.633 12.622 -10.065 791 H LYS 11 HN LYS 11 -9.690 11.319 -6.878 792 HA LYS 11 HA LYS 11 -11.402 10.016 -6.154 793 HB2 LYS 11 HB2 LYS 11 -13.559 11.012 -6.487 794 HB3 LYS 11 HB1 LYS 11 -12.381 12.289 -6.311 795 HG2 LYS 11 HG2 LYS 11 -12.513 12.848 -8.560 796 HG3 LYS 11 HG1 LYS 11 -13.315 11.345 -8.999 797 HD2 LYS 11 HD2 LYS 11 -15.265 12.067 -7.641 798 HD3 LYS 11 HD1 LYS 11 -14.460 13.612 -7.371 799 HE2 LYS 11 HE2 LYS 11 -14.485 14.084 -9.738 800 HE3 LYS 11 HE1 LYS 11 -15.159 12.490 -10.080 801 HZ1 LYS 11 HZ1 LYS 11 -17.144 13.107 -8.856 802 HZ2 LYS 11 HZ2 LYS 11 -16.861 14.197 -10.117 803 HZ3 LYS 11 HZ3 LYS 11 -16.500 14.636 -8.526 804 H GLU 12 HN GLU 12 -10.177 8.554 -8.056 805 HA GLU 12 HA GLU 12 -11.772 7.612 -10.164 806 HB2 GLU 12 HB2 GLU 12 -9.345 7.171 -9.871 807 HB3 GLU 12 HB1 GLU 12 -9.707 6.099 -8.533 808 HG2 GLU 12 HG2 GLU 12 -10.868 4.584 -10.025 809 HG3 GLU 12 HG1 GLU 12 -10.604 5.690 -11.376 810 HA PRO 13 HA PRO 13 -15.158 5.645 -8.093 811 HB2 PRO 13 HB2 PRO 13 -14.963 3.518 -10.112 812 HB3 PRO 13 HB1 PRO 13 -16.328 4.564 -9.718 813 HG2 PRO 13 HG2 PRO 13 -14.845 4.849 -11.972 814 HG3 PRO 13 HG1 PRO 13 -15.663 6.190 -11.167 815 HD2 PRO 13 HD2 PRO 13 -12.789 5.534 -11.277 816 HD3 PRO 13 HD1 PRO 13 -13.582 7.095 -11.013 817 H TYR 14 HN TYR 14 -15.030 4.335 -6.317 818 HA TYR 14 HA TYR 14 -12.454 3.324 -5.945 819 HB2 TYR 14 HB2 TYR 14 -13.684 4.353 -4.111 820 HB3 TYR 14 HB1 TYR 14 -14.835 3.025 -4.114 821 HD1 TYR 14 HD1 TYR 14 -13.720 0.664 -3.917 822 HD2 TYR 14 HD2 TYR 14 -11.936 4.259 -2.553 823 HE1 TYR 14 HE1 TYR 14 -12.321 -0.642 -2.406 824 HE2 TYR 14 HE2 TYR 14 -10.517 2.968 -1.014 825 HH TYR 14 HH TYR 14 -10.031 0.925 -0.228 826 HA PRO 15 HA PRO 15 -14.508 -1.112 -5.590 827 HB2 PRO 15 HB2 PRO 15 -16.682 -0.840 -7.559 828 HB3 PRO 15 HB1 PRO 15 -16.674 -1.668 -6.006 829 HG2 PRO 15 HG2 PRO 15 -17.964 0.654 -6.396 830 HG3 PRO 15 HG1 PRO 15 -17.250 0.212 -4.849 831 HD2 PRO 15 HD2 PRO 15 -16.313 2.167 -6.875 832 HD3 PRO 15 HD1 PRO 15 -16.107 2.170 -5.119 833 H ASP 16 HN ASP 16 -14.253 0.952 -8.239 834 HA ASP 16 HA ASP 16 -13.644 -1.121 -10.169 835 HB2 ASP 16 HB2 ASP 16 -14.207 1.804 -10.305 836 HB3 ASP 16 HB1 ASP 16 -13.207 1.108 -11.580 837 H PHE 17 HN PHE 17 -12.075 1.492 -8.446 838 HA PHE 17 HA PHE 17 -9.552 1.347 -9.691 839 HB2 PHE 17 HB2 PHE 17 -9.116 3.050 -8.223 840 HB3 PHE 17 HB1 PHE 17 -10.760 2.823 -7.652 841 HD1 PHE 17 HD1 PHE 17 -7.288 1.681 -7.068 842 HD2 PHE 17 HD2 PHE 17 -11.181 2.160 -5.502 843 HE1 PHE 17 HE1 PHE 17 -6.496 1.078 -4.841 844 HE2 PHE 17 HE2 PHE 17 -10.373 1.566 -3.288 845 HZ PHE 17 HZ PHE 17 -8.022 1.036 -2.952 846 H VAL 18 HN VAL 18 -10.994 -0.302 -6.949 847 HA VAL 18 HA VAL 18 -8.657 -1.857 -6.400 848 HB VAL 18 HB VAL 18 -9.894 -1.426 -4.465 849 HG11 VAL 18 HG11 VAL 18 -12.332 -2.415 -5.946 850 HG12 VAL 18 HG12 VAL 18 -11.982 -0.734 -5.532 851 HG13 VAL 18 HG13 VAL 18 -12.290 -1.919 -4.245 852 HG21 VAL 18 HG21 VAL 18 -9.187 -3.659 -4.377 853 HG22 VAL 18 HG22 VAL 18 -10.441 -4.179 -5.510 854 HG23 VAL 18 HG23 VAL 18 -10.879 -3.683 -3.872 855 H ALA 19 HN ALA 19 -11.694 -2.333 -8.129 856 HA ALA 19 HA ALA 19 -11.561 -5.086 -8.523 857 HB1 ALA 19 HB1 ALA 19 -12.868 -4.747 -10.551 858 HB2 ALA 19 HB2 ALA 19 -12.477 -3.028 -10.541 859 HB3 ALA 19 HB3 ALA 19 -13.469 -3.715 -9.255 860 H ARG 20 HN ARG 20 -9.732 -2.510 -10.144 861 HA ARG 20 HA ARG 20 -8.570 -4.461 -11.933 862 HB2 ARG 20 HB2 ARG 20 -7.142 -2.621 -12.752 863 HB3 ARG 20 HB1 ARG 20 -8.853 -2.254 -12.872 864 HG2 ARG 20 HG2 ARG 20 -8.752 -0.616 -11.268 865 HG3 ARG 20 HG1 ARG 20 -7.323 -1.312 -10.496 866 HD2 ARG 20 HD2 ARG 20 -5.899 -0.541 -12.196 867 HD3 ARG 20 HD1 ARG 20 -7.234 -0.201 -13.275 868 HE ARG 20 HE ARG 20 -7.691 1.477 -11.201 869 HH11 ARG 20 HH11 ARG 20 -4.904 0.861 -13.231 870 HH12 ARG 20 HH12 ARG 20 -4.292 2.476 -13.103 871 HH21 ARG 20 HH21 ARG 20 -6.906 3.613 -11.051 872 HH22 ARG 20 HH22 ARG 20 -5.425 4.037 -11.858 873 H LEU 21 HN LEU 21 -7.970 -2.859 -8.951 874 HA LEU 21 HA LEU 21 -5.329 -3.492 -8.423 875 HB2 LEU 21 HB2 LEU 21 -7.062 -2.221 -7.015 876 HB3 LEU 21 HB1 LEU 21 -7.571 -3.785 -6.427 877 HG LEU 21 HG LEU 21 -5.563 -4.114 -5.248 878 HD11 LEU 21 HD11 LEU 21 -3.844 -3.491 -6.660 879 HD12 LEU 21 HD12 LEU 21 -3.758 -2.286 -5.371 880 HD13 LEU 21 HD13 LEU 21 -4.507 -1.878 -6.918 881 HD21 LEU 21 HD21 LEU 21 -7.008 -2.723 -4.050 882 HD22 LEU 21 HD22 LEU 21 -6.586 -1.322 -5.032 883 HD23 LEU 21 HD23 LEU 21 -5.407 -1.995 -3.909 884 H GLN 22 HN GLN 22 -8.254 -5.378 -8.055 885 HA GLN 22 HA GLN 22 -7.022 -7.736 -7.097 886 HB2 GLN 22 HB2 GLN 22 -9.658 -7.500 -8.503 887 HB3 GLN 22 HB1 GLN 22 -9.131 -8.730 -7.327 888 HG2 GLN 22 HG2 GLN 22 -8.892 -6.662 -5.781 889 HG3 GLN 22 HG1 GLN 22 -9.983 -5.915 -6.911 890 HE21 GLN 22 HE21 GLN 22 -11.277 -5.754 -4.987 891 HE22 GLN 22 HE22 GLN 22 -12.344 -7.058 -4.612 892 H ASP 23 HN ASP 23 -8.492 -6.810 -10.135 893 HA ASP 23 HA ASP 23 -8.090 -9.055 -11.646 894 HB2 ASP 23 HB2 ASP 23 -7.847 -6.169 -12.267 895 HB3 ASP 23 HB1 ASP 23 -7.570 -7.356 -13.525 896 H VAL 24 HN VAL 24 -5.732 -6.455 -11.063 897 HA VAL 24 HA VAL 24 -3.906 -7.768 -12.820 898 HB VAL 24 HB VAL 24 -3.928 -5.317 -12.781 899 HG11 VAL 24 HG11 VAL 24 -4.507 -5.007 -10.446 900 HG12 VAL 24 HG12 VAL 24 -3.045 -4.107 -10.847 901 HG13 VAL 24 HG13 VAL 24 -2.930 -5.628 -9.961 902 HG21 VAL 24 HG21 VAL 24 -1.870 -6.302 -13.499 903 HG22 VAL 24 HG22 VAL 24 -1.373 -6.602 -11.836 904 HG23 VAL 24 HG23 VAL 24 -1.453 -4.944 -12.445 905 H ALA 25 HN ALA 25 -4.539 -7.563 -9.436 906 HA ALA 25 HA ALA 25 -2.056 -8.590 -8.482 907 HB1 ALA 25 HB1 ALA 25 -3.644 -7.486 -6.959 908 HB2 ALA 25 HB2 ALA 25 -3.313 -9.133 -6.430 909 HB3 ALA 25 HB3 ALA 25 -4.823 -8.762 -7.257 910 H GLN 26 HN GLN 26 -4.941 -9.753 -9.863 911 HA GLN 26 HA GLN 26 -4.612 -12.500 -9.204 912 HB2 GLN 26 HB2 GLN 26 -6.775 -12.317 -9.676 913 HB3 GLN 26 HB1 GLN 26 -6.506 -10.758 -10.438 914 HG2 GLN 26 HG2 GLN 26 -7.354 -11.872 -12.193 915 HG3 GLN 26 HG1 GLN 26 -5.657 -12.279 -12.416 916 HE21 GLN 26 HE21 GLN 26 -5.649 -14.067 -10.113 917 HE22 GLN 26 HE22 GLN 26 -6.447 -15.501 -10.620 918 H LYS 27 HN LYS 27 -3.878 -10.412 -11.896 919 HA LYS 27 HA LYS 27 -3.077 -12.356 -13.771 920 HB2 LYS 27 HB2 LYS 27 -2.127 -9.493 -13.529 921 HB3 LYS 27 HB1 LYS 27 -2.078 -10.496 -14.981 922 HG2 LYS 27 HG2 LYS 27 -4.537 -9.505 -13.568 923 HG3 LYS 27 HG1 LYS 27 -3.895 -8.913 -15.096 924 HD2 LYS 27 HD2 LYS 27 -4.583 -10.782 -16.254 925 HD3 LYS 27 HD1 LYS 27 -4.588 -11.801 -14.813 926 HE2 LYS 27 HE2 LYS 27 -6.574 -10.843 -14.012 927 HE3 LYS 27 HE1 LYS 27 -6.474 -9.501 -15.145 928 HZ1 LYS 27 HZ1 LYS 27 -6.962 -10.998 -16.947 929 HZ2 LYS 27 HZ2 LYS 27 -8.150 -11.168 -15.754 930 HZ3 LYS 27 HZ3 LYS 27 -6.936 -12.332 -15.907 931 H SER 28 HN SER 28 -1.384 -10.731 -11.164 932 HA SER 28 HA SER 28 1.155 -11.778 -12.188 933 HB2 SER 28 HB2 SER 28 0.636 -9.591 -10.180 934 HB3 SER 28 HB1 SER 28 2.213 -10.044 -10.833 935 HG SER 28 HG SER 28 0.016 -8.871 -12.190 936 H ILE 29 HN ILE 29 -1.198 -12.302 -9.899 937 HA ILE 29 HA ILE 29 0.693 -13.694 -8.125 938 HB ILE 29 HB ILE 29 -2.055 -12.608 -7.555 939 HG12 ILE 29 HG12 ILE 29 0.628 -11.872 -6.384 940 HG13 ILE 29 HG11 ILE 29 -0.289 -10.919 -7.558 941 HG21 ILE 29 HG21 ILE 29 -0.266 -14.213 -5.757 942 HG22 ILE 29 HG22 ILE 29 -1.858 -14.666 -6.377 943 HG23 ILE 29 HG23 ILE 29 -1.706 -13.326 -5.239 944 HD11 ILE 29 HD11 ILE 29 -2.026 -10.539 -6.024 945 HD12 ILE 29 HD12 ILE 29 -0.509 -10.174 -5.196 946 HD13 ILE 29 HD13 ILE 29 -1.356 -11.697 -4.872 947 H ALA 30 HN ALA 30 0.621 -15.861 -8.175 948 HA ALA 30 HA ALA 30 -1.494 -17.178 -9.657 949 HB1 ALA 30 HB1 ALA 30 0.842 -17.834 -10.003 950 HB2 ALA 30 HB2 ALA 30 -0.134 -19.183 -9.422 951 HB3 ALA 30 HB3 ALA 30 0.947 -18.336 -8.316 952 H ASP 31 HN ASP 31 -1.200 -16.120 -6.568 953 HA ASP 31 HA ASP 31 -2.673 -18.412 -5.448 954 HB2 ASP 31 HB2 ASP 31 -0.389 -17.532 -4.459 955 HB3 ASP 31 HB1 ASP 31 -1.452 -16.348 -3.702 956 H GLU 32 HN GLU 32 -4.587 -18.124 -4.495 957 HA GLU 32 HA GLU 32 -6.077 -15.724 -4.970 958 HB2 GLU 32 HB2 GLU 32 -7.857 -16.901 -3.758 959 HB3 GLU 32 HB1 GLU 32 -7.100 -17.971 -4.931 960 HG2 GLU 32 HG2 GLU 32 -5.659 -18.823 -3.000 961 HG3 GLU 32 HG1 GLU 32 -6.788 -17.960 -1.950 962 H LYS 33 HN LYS 33 -4.228 -17.023 -2.291 963 HA LYS 33 HA LYS 33 -5.434 -15.454 -0.235 964 HB2 LYS 33 HB2 LYS 33 -2.631 -16.586 -0.278 965 HB3 LYS 33 HB1 LYS 33 -3.567 -16.153 1.131 966 HG2 LYS 33 HG2 LYS 33 -4.632 -18.066 1.177 967 HG3 LYS 33 HG1 LYS 33 -4.853 -18.104 -0.569 968 HD2 LYS 33 HD2 LYS 33 -2.410 -18.665 -0.730 969 HD3 LYS 33 HD1 LYS 33 -2.440 -18.919 1.020 970 HE2 LYS 33 HE2 LYS 33 -2.727 -21.000 -0.158 971 HE3 LYS 33 HE1 LYS 33 -4.196 -20.576 0.720 972 HZ1 LYS 33 HZ1 LYS 33 -4.433 -21.401 -1.661 973 HZ2 LYS 33 HZ2 LYS 33 -3.854 -19.874 -2.126 974 HZ3 LYS 33 HZ3 LYS 33 -5.285 -20.007 -1.228 975 H ALA 34 HN ALA 34 -2.341 -15.212 -1.933 976 HA ALA 34 HA ALA 34 -1.637 -12.691 -0.939 977 HB1 ALA 34 HB1 ALA 34 0.010 -14.158 -1.932 978 HB2 ALA 34 HB2 ALA 34 -0.027 -12.632 -2.815 979 HB3 ALA 34 HB3 ALA 34 -0.801 -14.064 -3.495 980 H ARG 35 HN ARG 35 -3.838 -13.667 -3.428 981 HA ARG 35 HA ARG 35 -3.866 -11.215 -4.907 982 HB2 ARG 35 HB2 ARG 35 -4.819 -13.664 -5.448 983 HB3 ARG 35 HB1 ARG 35 -6.285 -12.945 -4.805 984 HG2 ARG 35 HG2 ARG 35 -4.747 -11.517 -6.940 985 HG3 ARG 35 HG1 ARG 35 -5.797 -12.869 -7.362 986 HD2 ARG 35 HD2 ARG 35 -6.588 -10.311 -5.980 987 HD3 ARG 35 HD1 ARG 35 -6.987 -10.802 -7.632 988 HE ARG 35 HE ARG 35 -7.939 -12.405 -5.353 989 HH11 ARG 35 HH11 ARG 35 -8.588 -10.463 -8.185 990 HH12 ARG 35 HH12 ARG 35 -10.298 -10.735 -8.144 991 HH21 ARG 35 HH21 ARG 35 -10.193 -12.773 -5.293 992 HH22 ARG 35 HH22 ARG 35 -11.213 -12.051 -6.498 993 H LYS 36 HN LYS 36 -6.135 -12.692 -2.586 994 HA LYS 36 HA LYS 36 -7.801 -10.486 -2.208 995 HB2 LYS 36 HB2 LYS 36 -6.952 -12.420 -0.067 996 HB3 LYS 36 HB1 LYS 36 -8.428 -11.463 -0.110 997 HG2 LYS 36 HG2 LYS 36 -9.468 -12.869 -1.509 998 HG3 LYS 36 HG1 LYS 36 -7.967 -13.309 -2.358 999 HD2 LYS 36 HD2 LYS 36 -8.781 -15.185 -1.033 1000 HD3 LYS 36 HD1 LYS 36 -7.240 -14.558 -0.403 1001 HE2 LYS 36 HE2 LYS 36 -8.801 -13.081 1.109 1002 HE3 LYS 36 HE1 LYS 36 -10.016 -14.299 0.717 1003 HZ1 LYS 36 HZ1 LYS 36 -7.383 -14.894 1.940 1004 HZ2 LYS 36 HZ2 LYS 36 -8.616 -16.006 1.636 1005 HZ3 LYS 36 HZ3 LYS 36 -8.840 -14.789 2.786 1006 H VAL 37 HN VAL 37 -5.041 -11.554 -0.247 1007 HA VAL 37 HA VAL 37 -5.315 -9.683 1.746 1008 HB VAL 37 HB VAL 37 -3.000 -10.046 2.393 1009 HG11 VAL 37 HG11 VAL 37 -3.014 -12.573 2.432 1010 HG12 VAL 37 HG12 VAL 37 -4.477 -12.497 1.440 1011 HG13 VAL 37 HG13 VAL 37 -4.464 -11.785 3.058 1012 HG21 VAL 37 HG21 VAL 37 -2.718 -11.313 -0.320 1013 HG22 VAL 37 HG22 VAL 37 -1.563 -11.548 0.991 1014 HG23 VAL 37 HG23 VAL 37 -1.833 -9.934 0.332 1015 H ILE 38 HN ILE 38 -3.671 -9.344 -1.363 1016 HA ILE 38 HA ILE 38 -2.721 -6.748 -0.528 1017 HB ILE 38 HB ILE 38 -1.592 -8.569 -2.189 1018 HG12 ILE 38 HG12 ILE 38 -1.127 -5.603 -2.343 1019 HG13 ILE 38 HG11 ILE 38 -0.649 -6.568 -0.959 1020 HG21 ILE 38 HG21 ILE 38 -3.251 -8.059 -3.966 1021 HG22 ILE 38 HG22 ILE 38 -1.588 -7.701 -4.443 1022 HG23 ILE 38 HG23 ILE 38 -2.672 -6.392 -3.972 1023 HD11 ILE 38 HD11 ILE 38 0.399 -6.587 -3.749 1024 HD12 ILE 38 HD12 ILE 38 0.696 -7.929 -2.639 1025 HD13 ILE 38 HD13 ILE 38 1.265 -6.306 -2.243 1026 H VAL 39 HN VAL 39 -5.292 -8.004 -2.620 1027 HA VAL 39 HA VAL 39 -5.906 -5.438 -3.672 1028 HB VAL 39 HB VAL 39 -7.917 -6.251 -4.468 1029 HG11 VAL 39 HG11 VAL 39 -7.382 -8.448 -5.462 1030 HG12 VAL 39 HG12 VAL 39 -6.012 -8.576 -4.363 1031 HG13 VAL 39 HG13 VAL 39 -6.055 -7.287 -5.568 1032 HG21 VAL 39 HG21 VAL 39 -7.829 -8.501 -2.471 1033 HG22 VAL 39 HG22 VAL 39 -9.023 -8.331 -3.759 1034 HG23 VAL 39 HG23 VAL 39 -8.940 -7.132 -2.468 1035 H GLU 40 HN GLU 40 -7.219 -7.252 -0.952 1036 HA GLU 40 HA GLU 40 -8.892 -5.265 0.043 1037 HB2 GLU 40 HB2 GLU 40 -7.656 -7.726 1.220 1038 HB3 GLU 40 HB1 GLU 40 -8.778 -6.722 2.119 1039 HG2 GLU 40 HG2 GLU 40 -10.515 -7.127 0.597 1040 HG3 GLU 40 HG1 GLU 40 -9.435 -7.822 -0.582 1041 H LEU 41 HN LEU 41 -5.485 -5.773 0.408 1042 HA LEU 41 HA LEU 41 -5.316 -3.928 2.640 1043 HB2 LEU 41 HB2 LEU 41 -3.662 -5.914 1.627 1044 HB3 LEU 41 HB1 LEU 41 -2.821 -4.424 1.245 1045 HG LEU 41 HG LEU 41 -1.957 -4.981 3.312 1046 HD11 LEU 41 HD11 LEU 41 -4.256 -3.365 4.295 1047 HD12 LEU 41 HD12 LEU 41 -3.121 -2.690 3.131 1048 HD13 LEU 41 HD13 LEU 41 -2.542 -3.251 4.693 1049 HD21 LEU 41 HD21 LEU 41 -3.400 -6.847 3.810 1050 HD22 LEU 41 HD22 LEU 41 -4.735 -5.752 4.170 1051 HD23 LEU 41 HD23 LEU 41 -3.308 -5.771 5.207 1052 H MET 42 HN MET 42 -4.156 -3.935 -0.740 1053 HA MET 42 HA MET 42 -3.058 -1.348 -0.690 1054 HB2 MET 42 HB2 MET 42 -4.109 -2.999 -2.975 1055 HB3 MET 42 HB1 MET 42 -3.226 -1.488 -3.194 1056 HG2 MET 42 HG2 MET 42 -2.230 -4.008 -1.879 1057 HG3 MET 42 HG1 MET 42 -1.764 -3.388 -3.452 1058 HE1 MET 42 HE1 MET 42 0.825 -3.763 -2.581 1059 HE2 MET 42 HE2 MET 42 0.116 -4.320 -1.062 1060 HE3 MET 42 HE3 MET 42 1.378 -3.088 -1.042 1061 H ALA 43 HN ALA 43 -6.218 -2.539 -1.102 1062 HA ALA 43 HA ALA 43 -7.701 -0.603 -2.256 1063 HB1 ALA 43 HB1 ALA 43 -8.700 -2.584 -1.461 1064 HB2 ALA 43 HB2 ALA 43 -9.462 -1.254 -0.583 1065 HB3 ALA 43 HB3 ALA 43 -8.227 -2.245 0.200 1066 H TYR 44 HN TYR 44 -6.075 -0.514 0.853 1067 HA TYR 44 HA TYR 44 -7.123 2.190 1.428 1068 HB2 TYR 44 HB2 TYR 44 -7.281 0.660 3.333 1069 HB3 TYR 44 HB1 TYR 44 -5.602 0.201 3.101 1070 HD1 TYR 44 HD1 TYR 44 -7.821 2.447 4.802 1071 HD2 TYR 44 HD2 TYR 44 -3.792 1.957 3.588 1072 HE1 TYR 44 HE1 TYR 44 -7.133 4.090 6.481 1073 HE2 TYR 44 HE2 TYR 44 -3.081 3.609 5.253 1074 HH TYR 44 HH TYR 44 -4.021 5.477 6.502 1075 H GLU 45 HN GLU 45 -4.146 0.376 1.872 1076 HA GLU 45 HA GLU 45 -2.364 2.304 2.250 1077 HB2 GLU 45 HB2 GLU 45 -1.656 0.034 0.476 1078 HB3 GLU 45 HB1 GLU 45 -0.714 0.746 1.778 1079 HG2 GLU 45 HG2 GLU 45 -3.149 -0.946 2.019 1080 HG3 GLU 45 HG1 GLU 45 -1.515 -1.437 2.403 1081 H ASN 46 HN ASN 46 -3.644 1.347 -0.893 1082 HA ASN 46 HA ASN 46 -1.724 3.110 -2.247 1083 HB2 ASN 46 HB2 ASN 46 -2.734 0.433 -2.585 1084 HB3 ASN 46 HB1 ASN 46 -3.068 1.428 -3.994 1085 HD21 ASN 46 HD21 ASN 46 -1.748 -0.162 -5.027 1086 HD22 ASN 46 HD22 ASN 46 -0.047 0.085 -5.073 1087 H ALA 47 HN ALA 47 -4.933 2.943 -1.213 1088 HA ALA 47 HA ALA 47 -6.308 3.746 -3.564 1089 HB1 ALA 47 HB1 ALA 47 -7.183 4.313 -0.757 1090 HB2 ALA 47 HB2 ALA 47 -7.269 2.704 -1.480 1091 HB3 ALA 47 HB3 ALA 47 -8.180 4.043 -2.188 1092 H ASN 48 HN ASN 48 -7.835 5.819 -3.050 1093 HA ASN 48 HA ASN 48 -6.189 8.119 -3.270 1094 HB2 ASN 48 HB2 ASN 48 -9.091 7.561 -3.111 1095 HB3 ASN 48 HB1 ASN 48 -8.590 9.153 -2.547 1096 HD21 ASN 48 HD21 ASN 48 -10.058 8.116 -4.996 1097 HD22 ASN 48 HD22 ASN 48 -9.217 8.855 -6.318 1098 HA PRO 49 HA PRO 49 -4.880 8.847 0.831 1099 HB2 PRO 49 HB2 PRO 49 -5.519 11.612 0.894 1100 HB3 PRO 49 HB1 PRO 49 -3.959 10.891 0.504 1101 HG2 PRO 49 HG2 PRO 49 -6.081 11.907 -1.297 1102 HG3 PRO 49 HG1 PRO 49 -4.329 11.831 -1.550 1103 HD2 PRO 49 HD2 PRO 49 -6.021 10.153 -2.799 1104 HD3 PRO 49 HD1 PRO 49 -4.405 9.631 -2.270 1105 H GLU 50 HN GLU 50 -7.831 10.570 -0.015 1106 HA GLU 50 HA GLU 50 -8.982 10.604 2.538 1107 HB2 GLU 50 HB2 GLU 50 -9.808 12.270 1.223 1108 HB3 GLU 50 HB1 GLU 50 -9.780 11.291 -0.233 1109 HG2 GLU 50 HG2 GLU 50 -11.955 11.116 0.013 1110 HG3 GLU 50 HG1 GLU 50 -11.613 10.044 1.344 1111 H CYS 51 HN CYS 51 -9.014 8.337 -0.125 1112 HA CYS 51 HA CYS 51 -11.474 7.112 0.636 1113 HB2 CYS 51 HB2 CYS 51 -9.342 6.388 -1.378 1114 HB3 CYS 51 HB1 CYS 51 -10.793 5.427 -1.103 1115 HG CYS 51 HG CYS 51 -11.158 8.730 -1.773 1116 H GLN 52 HN GLN 52 -8.056 6.508 1.047 1117 HA GLN 52 HA GLN 52 -8.471 4.044 2.454 1118 HB2 GLN 52 HB2 GLN 52 -6.146 4.154 3.021 1119 HB3 GLN 52 HB1 GLN 52 -6.321 4.614 1.337 1120 HG2 GLN 52 HG2 GLN 52 -6.197 6.996 2.068 1121 HG3 GLN 52 HG1 GLN 52 -5.806 6.416 3.683 1122 HE21 GLN 52 HE21 GLN 52 -4.405 4.119 2.638 1123 HE22 GLN 52 HE22 GLN 52 -2.889 4.660 2.051 1124 H SER 53 HN SER 53 -8.240 7.382 3.086 1125 HA SER 53 HA SER 53 -8.326 7.309 5.896 1126 HB2 SER 53 HB2 SER 53 -8.996 9.320 3.795 1127 HB3 SER 53 HB1 SER 53 -9.229 9.686 5.510 1128 HG SER 53 HG SER 53 -6.895 9.370 4.026 1129 H ALA 54 HN ALA 54 -10.713 6.911 3.403 1130 HA ALA 54 HA ALA 54 -12.922 6.956 5.243 1131 HB1 ALA 54 HB1 ALA 54 -13.371 7.343 2.944 1132 HB2 ALA 54 HB2 ALA 54 -14.113 5.802 3.370 1133 HB3 ALA 54 HB3 ALA 54 -12.587 5.838 2.480 1134 H ILE 55 HN ILE 55 -10.523 4.753 4.309 1135 HA ILE 55 HA ILE 55 -12.014 2.409 5.070 1136 HB ILE 55 HB ILE 55 -9.320 2.835 3.855 1137 HG12 ILE 55 HG12 ILE 55 -11.568 1.262 2.704 1138 HG13 ILE 55 HG11 ILE 55 -11.671 3.028 2.711 1139 HG21 ILE 55 HG21 ILE 55 -9.102 0.899 5.274 1140 HG22 ILE 55 HG22 ILE 55 -9.204 0.383 3.589 1141 HG23 ILE 55 HG23 ILE 55 -10.608 0.234 4.644 1142 HD11 ILE 55 HD11 ILE 55 -9.358 1.483 1.567 1143 HD12 ILE 55 HD12 ILE 55 -9.701 3.214 1.409 1144 HD13 ILE 55 HD13 ILE 55 -10.765 2.028 0.643 1145 H LYS 56 HN LYS 56 -9.357 4.306 6.492 1146 HA LYS 56 HA LYS 56 -8.024 2.444 7.929 1147 HB2 LYS 56 HB2 LYS 56 -8.445 4.510 9.836 1148 HB3 LYS 56 HB1 LYS 56 -7.001 4.115 8.926 1149 HG2 LYS 56 HG2 LYS 56 -7.274 6.271 8.297 1150 HG3 LYS 56 HG1 LYS 56 -8.272 5.500 7.061 1151 HD2 LYS 56 HD2 LYS 56 -10.207 6.138 8.012 1152 HD3 LYS 56 HD1 LYS 56 -9.544 6.201 9.645 1153 HE2 LYS 56 HE2 LYS 56 -9.440 8.272 7.456 1154 HE3 LYS 56 HE1 LYS 56 -9.918 8.438 9.149 1155 HZ1 LYS 56 HZ1 LYS 56 -7.632 8.211 9.832 1156 HZ2 LYS 56 HZ2 LYS 56 -7.763 9.465 8.704 1157 HZ3 LYS 56 HZ3 LYS 56 -7.132 7.970 8.235 1158 HA PRO 57 HA PRO 57 -11.376 2.265 11.523 1159 HB2 PRO 57 HB2 PRO 57 -13.932 2.388 10.619 1160 HB3 PRO 57 HB1 PRO 57 -13.054 3.814 11.200 1161 HG2 PRO 57 HG2 PRO 57 -13.321 2.801 8.378 1162 HG3 PRO 57 HG1 PRO 57 -13.700 4.431 8.997 1163 HD2 PRO 57 HD2 PRO 57 -11.389 3.992 7.822 1164 HD3 PRO 57 HD1 PRO 57 -11.395 4.916 9.332 1165 H LEU 58 HN LEU 58 -11.764 1.115 8.247 1166 HA LEU 58 HA LEU 58 -12.837 -1.467 9.141 1167 HB2 LEU 58 HB2 LEU 58 -12.288 -0.940 6.286 1168 HB3 LEU 58 HB1 LEU 58 -13.625 -1.823 7.010 1169 HG LEU 58 HG LEU 58 -13.337 1.186 6.870 1170 HD11 LEU 58 HD11 LEU 58 -15.217 0.979 5.260 1171 HD12 LEU 58 HD12 LEU 58 -14.995 -0.770 5.295 1172 HD13 LEU 58 HD13 LEU 58 -13.704 0.269 4.691 1173 HD21 LEU 58 HD21 LEU 58 -15.670 1.222 7.627 1174 HD22 LEU 58 HD22 LEU 58 -14.599 0.507 8.832 1175 HD23 LEU 58 HD23 LEU 58 -15.626 -0.528 7.836 1176 H LYS 59 HN LYS 59 -10.073 0.190 8.194 1177 HA LYS 59 HA LYS 59 -8.560 -1.684 6.841 1178 HB2 LYS 59 HB2 LYS 59 -7.762 0.573 7.174 1179 HB3 LYS 59 HB1 LYS 59 -7.645 0.302 8.906 1180 HG2 LYS 59 HG2 LYS 59 -5.491 -0.113 8.462 1181 HG3 LYS 59 HG1 LYS 59 -6.106 -1.691 7.989 1182 HD2 LYS 59 HD2 LYS 59 -5.646 0.623 6.146 1183 HD3 LYS 59 HD1 LYS 59 -4.580 -0.776 6.307 1184 HE2 LYS 59 HE2 LYS 59 -7.451 -0.814 5.363 1185 HE3 LYS 59 HE1 LYS 59 -6.030 -0.961 4.349 1186 HZ1 LYS 59 HZ1 LYS 59 -6.914 -3.107 4.714 1187 HZ2 LYS 59 HZ2 LYS 59 -6.962 -2.878 6.383 1188 HZ3 LYS 59 HZ3 LYS 59 -5.474 -2.996 5.596 1189 H GLY 60 HN GLY 60 -8.314 -3.732 7.345 1190 HA2 GLY 60 HA3 GLY 60 -7.221 -5.439 8.549 1191 HA3 GLY 60 HA2 GLY 60 -7.237 -4.411 9.977 1192 H LYS 61 HN LYS 61 -10.157 -3.789 9.305 1193 HA LYS 61 HA LYS 61 -11.228 -6.175 10.650 1194 HB2 LYS 61 HB2 LYS 61 -12.835 -3.689 10.357 1195 HB3 LYS 61 HB1 LYS 61 -12.705 -4.780 11.726 1196 HG2 LYS 61 HG2 LYS 61 -10.624 -2.779 10.916 1197 HG3 LYS 61 HG1 LYS 61 -11.810 -2.542 12.186 1198 HD2 LYS 61 HD2 LYS 61 -9.742 -4.732 12.137 1199 HD3 LYS 61 HD1 LYS 61 -9.594 -3.225 13.042 1200 HE2 LYS 61 HE2 LYS 61 -11.579 -3.787 14.323 1201 HE3 LYS 61 HE1 LYS 61 -11.771 -5.272 13.399 1202 HZ1 LYS 61 HZ1 LYS 61 -9.654 -6.046 14.261 1203 HZ2 LYS 61 HZ2 LYS 61 -10.717 -5.691 15.526 1204 HZ3 LYS 61 HZ3 LYS 61 -9.467 -4.619 15.150 1205 H VAL 62 HN VAL 62 -12.073 -7.550 9.197 1206 HA VAL 62 HA VAL 62 -14.047 -6.425 7.333 1207 HB VAL 62 HB VAL 62 -12.208 -7.362 6.043 1208 HG11 VAL 62 HG11 VAL 62 -12.698 -9.939 7.523 1209 HG12 VAL 62 HG12 VAL 62 -11.274 -8.906 7.656 1210 HG13 VAL 62 HG13 VAL 62 -11.620 -9.739 6.139 1211 HG21 VAL 62 HG21 VAL 62 -13.431 -9.070 4.730 1212 HG22 VAL 62 HG22 VAL 62 -14.374 -7.619 5.065 1213 HG23 VAL 62 HG23 VAL 62 -14.669 -9.095 5.987 1214 HA PRO 63 HA PRO 63 -17.240 -8.925 9.411 1215 HB2 PRO 63 HB2 PRO 63 -17.856 -9.435 6.531 1216 HB3 PRO 63 HB1 PRO 63 -18.959 -9.096 7.852 1217 HG2 PRO 63 HG2 PRO 63 -18.324 -7.181 6.144 1218 HG3 PRO 63 HG1 PRO 63 -18.439 -6.825 7.876 1219 HD2 PRO 63 HD2 PRO 63 -16.028 -7.093 6.159 1220 HD3 PRO 63 HD1 PRO 63 -16.282 -6.093 7.602 1221 H ALA 64 HN ALA 64 -17.444 -11.078 9.874 1222 HA ALA 64 HA ALA 64 -15.234 -12.716 9.294 1223 HB1 ALA 64 HB1 ALA 64 -17.891 -13.503 10.482 1224 HB2 ALA 64 HB2 ALA 64 -16.507 -12.876 11.377 1225 HB3 ALA 64 HB3 ALA 64 -16.398 -14.438 10.564 1226 H GLY 65 HN GLY 65 -14.924 -13.252 7.195 1227 HA2 GLY 65 HA3 GLY 65 -15.173 -15.072 5.675 1228 HA3 GLY 65 HA2 GLY 65 -16.880 -15.137 6.082 1229 H SER 66 HN SER 66 -16.346 -11.940 5.753 1230 HA SER 66 HA SER 66 -17.336 -12.033 3.002 1231 HB2 SER 66 HB2 SER 66 -17.243 -9.680 4.892 1232 HB3 SER 66 HB1 SER 66 -18.156 -9.802 3.390 1233 HG SER 66 HG SER 66 -18.829 -11.880 4.878 1234 H ASP 67 HN ASP 67 -16.763 -9.889 1.810 1235 HA ASP 67 HA ASP 67 -13.904 -9.930 1.304 1236 HB2 ASP 67 HB2 ASP 67 -15.795 -9.899 -0.441 1237 HB3 ASP 67 HB1 ASP 67 -16.038 -8.231 0.019 1238 H VAL 68 HN VAL 68 -12.469 -8.213 1.860 1239 HA VAL 68 HA VAL 68 -13.663 -6.187 3.564 1240 HB VAL 68 HB VAL 68 -11.677 -5.737 4.436 1241 HG11 VAL 68 HG11 VAL 68 -11.582 -8.161 4.361 1242 HG12 VAL 68 HG12 VAL 68 -9.980 -7.427 4.320 1243 HG13 VAL 68 HG13 VAL 68 -10.692 -8.075 2.841 1244 HG21 VAL 68 HG21 VAL 68 -9.621 -5.291 3.165 1245 HG22 VAL 68 HG22 VAL 68 -11.001 -4.329 2.623 1246 HG23 VAL 68 HG23 VAL 68 -10.471 -5.723 1.679 1247 H ILE 69 HN ILE 69 -12.497 -6.481 0.318 1248 HA ILE 69 HA ILE 69 -12.252 -3.785 -0.346 1249 HB ILE 69 HB ILE 69 -13.085 -6.147 -2.006 1250 HG12 ILE 69 HG12 ILE 69 -10.824 -6.353 -1.348 1251 HG13 ILE 69 HG11 ILE 69 -10.778 -5.742 -2.987 1252 HG21 ILE 69 HG21 ILE 69 -14.070 -4.240 -3.059 1253 HG22 ILE 69 HG22 ILE 69 -12.642 -4.692 -3.994 1254 HG23 ILE 69 HG23 ILE 69 -12.583 -3.309 -2.900 1255 HD11 ILE 69 HD11 ILE 69 -9.134 -4.641 -1.633 1256 HD12 ILE 69 HD12 ILE 69 -10.386 -4.134 -0.489 1257 HD13 ILE 69 HD13 ILE 69 -10.376 -3.481 -2.129 1258 H SER 70 HN SER 70 -14.986 -5.940 -0.546 1259 HA SER 70 HA SER 70 -17.020 -4.370 -1.398 1260 HB2 SER 70 HB2 SER 70 -17.402 -6.672 -0.798 1261 HB3 SER 70 HB1 SER 70 -17.011 -6.357 0.890 1262 HG SER 70 HG SER 70 -19.289 -5.551 -0.583 1263 H GLU 71 HN GLU 71 -15.524 -4.221 1.777 1264 HA GLU 71 HA GLU 71 -17.378 -2.306 2.847 1265 HB2 GLU 71 HB2 GLU 71 -14.764 -3.243 4.004 1266 HB3 GLU 71 HB1 GLU 71 -16.157 -2.597 4.866 1267 HG2 GLU 71 HG2 GLU 71 -16.630 -5.012 3.266 1268 HG3 GLU 71 HG1 GLU 71 -15.596 -5.200 4.678 1269 H TYR 72 HN TYR 72 -14.210 -2.447 1.503 1270 HA TYR 72 HA TYR 72 -13.389 0.117 2.438 1271 HB2 TYR 72 HB2 TYR 72 -12.270 -1.900 0.504 1272 HB3 TYR 72 HB1 TYR 72 -11.517 -0.329 0.729 1273 HD1 TYR 72 HD1 TYR 72 -13.082 -1.782 3.636 1274 HD2 TYR 72 HD2 TYR 72 -9.475 -1.567 1.414 1275 HE1 TYR 72 HE1 TYR 72 -11.844 -2.646 5.563 1276 HE2 TYR 72 HE2 TYR 72 -8.226 -2.450 3.337 1277 HH TYR 72 HH TYR 72 -9.861 -3.707 6.140 1278 H VAL 73 HN VAL 73 -14.705 -1.240 -0.505 1279 HA VAL 73 HA VAL 73 -14.707 1.171 -1.995 1280 HB VAL 73 HB VAL 73 -15.959 0.170 -3.632 1281 HG11 VAL 73 HG11 VAL 73 -15.268 -2.172 -3.877 1282 HG12 VAL 73 HG12 VAL 73 -14.667 -2.123 -2.220 1283 HG13 VAL 73 HG13 VAL 73 -13.956 -1.079 -3.449 1284 HG21 VAL 73 HG21 VAL 73 -17.675 -1.397 -3.449 1285 HG22 VAL 73 HG22 VAL 73 -17.883 -0.338 -2.046 1286 HG23 VAL 73 HG23 VAL 73 -17.138 -1.926 -1.850 1287 H LYS 74 HN LYS 74 -16.775 -0.377 0.312 1288 HA LYS 74 HA LYS 74 -19.013 1.355 0.092 1289 HB2 LYS 74 HB2 LYS 74 -19.265 -0.802 0.998 1290 HB3 LYS 74 HB1 LYS 74 -17.983 -0.551 2.165 1291 HG2 LYS 74 HG2 LYS 74 -19.540 1.360 2.999 1292 HG3 LYS 74 HG1 LYS 74 -20.776 0.428 2.154 1293 HD2 LYS 74 HD2 LYS 74 -20.709 -0.287 4.452 1294 HD3 LYS 74 HD1 LYS 74 -20.035 -1.570 3.439 1295 HE2 LYS 74 HE2 LYS 74 -17.762 -0.691 3.921 1296 HE3 LYS 74 HE1 LYS 74 -18.496 0.461 5.041 1297 HZ1 LYS 74 HZ1 LYS 74 -18.638 -2.497 5.289 1298 HZ2 LYS 74 HZ2 LYS 74 -19.381 -1.394 6.326 1299 HZ3 LYS 74 HZ3 LYS 74 -17.698 -1.463 6.241 1300 H ALA 75 HN ALA 75 -15.974 1.382 1.769 1301 HA ALA 75 HA ALA 75 -16.468 3.490 3.586 1302 HB1 ALA 75 HB1 ALA 75 -14.525 2.043 3.763 1303 HB2 ALA 75 HB2 ALA 75 -14.018 3.726 3.625 1304 HB3 ALA 75 HB3 ALA 75 -13.910 2.651 2.228 1305 H CYS 76 HN CYS 76 -15.218 3.405 0.293 1306 HA CYS 76 HA CYS 76 -15.361 6.313 0.106 1307 HB2 CYS 76 HB2 CYS 76 -13.394 5.340 -0.790 1308 HB3 CYS 76 HB1 CYS 76 -14.293 4.173 -1.738 1309 HG CYS 76 HG CYS 76 -13.165 7.105 -2.609 1310 H ASP 77 HN ASP 77 -17.590 4.006 -0.017 1311 HA ASP 77 HA ASP 77 -18.997 4.615 -2.393 1312 HB2 ASP 77 HB2 ASP 77 -19.558 2.633 -1.172 1313 HB3 ASP 77 HB1 ASP 77 -19.965 3.542 0.274 1314 H GLY 78 HN GLY 78 -18.378 6.433 0.380 1315 HA2 GLY 78 HA3 GLY 78 -20.429 8.394 -0.401 1316 HA3 GLY 78 HA2 GLY 78 -19.587 8.371 1.143 1317 H ILE 79 HN ILE 79 -17.290 7.688 -1.142 1318 HA ILE 79 HA ILE 79 -16.448 10.482 -1.215 1319 HB ILE 79 HB ILE 79 -14.873 7.943 -1.516 1320 HG12 ILE 79 HG12 ILE 79 -14.706 10.102 0.586 1321 HG13 ILE 79 HG11 ILE 79 -15.595 8.591 0.781 1322 HG21 ILE 79 HG21 ILE 79 -13.950 10.797 -1.764 1323 HG22 ILE 79 HG22 ILE 79 -13.850 9.523 -2.981 1324 HG23 ILE 79 HG23 ILE 79 -12.867 9.427 -1.519 1325 HD11 ILE 79 HD11 ILE 79 -13.273 8.721 1.764 1326 HD12 ILE 79 HD12 ILE 79 -12.686 8.654 0.104 1327 HD13 ILE 79 HD13 ILE 79 -13.639 7.321 0.758 1328 H GLY 80 HN GLY 80 -16.084 11.530 -3.075 1329 HA2 GLY 80 HA3 GLY 80 -15.222 11.070 -5.454 1330 HA3 GLY 80 HA2 GLY 80 -16.689 10.112 -5.575 1331 H GLY 81 HN GLY 81 -16.659 13.002 -3.687 1332 HA2 GLY 81 HA3 GLY 81 -17.690 14.711 -5.751 1333 HA3 GLY 81 HA2 GLY 81 -18.914 14.092 -4.665 1334 H ALA 82 HN ALA 82 -19.398 16.117 -4.094 1335 HA ALA 82 HA ALA 82 -17.685 17.918 -2.809 1336 HB1 ALA 82 HB1 ALA 82 -20.641 17.470 -2.694 1337 HB2 ALA 82 HB2 ALA 82 -19.762 18.623 -3.698 1338 HB3 ALA 82 HB3 ALA 82 -19.833 18.853 -1.949 1339 H MET 83 HN MET 83 -19.425 15.095 -1.682 1340 HA MET 83 HA MET 83 -19.079 15.589 1.091 1341 HB2 MET 83 HB2 MET 83 -19.264 12.897 -0.271 1342 HB3 MET 83 HB1 MET 83 -19.545 13.231 1.428 1343 HG2 MET 83 HG2 MET 83 -21.446 14.688 0.744 1344 HG3 MET 83 HG1 MET 83 -21.213 14.116 -0.905 1345 HE1 MET 83 HE1 MET 83 -24.001 13.844 0.562 1346 HE2 MET 83 HE2 MET 83 -24.447 12.191 0.137 1347 HE3 MET 83 HE3 MET 83 -23.698 13.239 -1.067 1348 H HIS 84 HN HIS 84 -17.077 14.175 -1.411 1349 HA HIS 84 HA HIS 84 -14.983 13.260 0.219 1350 HB2 HIS 84 HB2 HIS 84 -14.918 12.533 -2.020 1351 HB3 HIS 84 HB1 HIS 84 -15.117 14.160 -2.651 1352 HD1 HIS 84 HD1 HIS 84 -13.055 14.355 -4.066 1353 HD2 HIS 84 HD2 HIS 84 -12.200 13.060 -0.212 1354 HE1 HIS 84 HE1 HIS 84 -10.551 14.349 -3.895 1355 HE2 HIS 84 HE2 HIS 84 -10.065 13.717 -1.512 1356 H LYS 85 HN LYS 85 -15.808 16.447 -1.030 1357 HA LYS 85 HA LYS 85 -13.339 17.634 -0.162 1358 HB2 LYS 85 HB2 LYS 85 -15.923 18.803 -1.182 1359 HB3 LYS 85 HB1 LYS 85 -14.607 19.814 -0.606 1360 HG2 LYS 85 HG2 LYS 85 -14.316 19.743 -2.919 1361 HG3 LYS 85 HG1 LYS 85 -13.144 18.583 -2.297 1362 HD2 LYS 85 HD2 LYS 85 -14.983 16.823 -2.703 1363 HD3 LYS 85 HD1 LYS 85 -15.751 18.060 -3.697 1364 HE2 LYS 85 HE2 LYS 85 -12.977 16.950 -4.064 1365 HE3 LYS 85 HE1 LYS 85 -14.378 16.565 -5.052 1366 HZ1 LYS 85 HZ1 LYS 85 -14.482 18.895 -5.726 1367 HZ2 LYS 85 HZ2 LYS 85 -12.994 18.207 -6.131 1368 HZ3 LYS 85 HZ3 LYS 85 -13.110 19.241 -4.799 1369 H ALA 86 HN ALA 86 -16.319 16.833 1.277 1370 HA ALA 86 HA ALA 86 -16.027 18.615 3.540 1371 HB1 ALA 86 HB1 ALA 86 -18.026 17.557 4.389 1372 HB2 ALA 86 HB2 ALA 86 -17.923 16.307 3.149 1373 HB3 ALA 86 HB3 ALA 86 -18.256 17.980 2.692 1374 H MET 87 HN MET 87 -15.842 15.150 2.898 1375 HA MET 87 HA MET 87 -15.039 14.467 5.541 1376 HB2 MET 87 HB2 MET 87 -14.949 12.895 2.965 1377 HB3 MET 87 HB1 MET 87 -14.646 12.222 4.567 1378 HG2 MET 87 HG2 MET 87 -16.896 12.826 5.255 1379 HG3 MET 87 HG1 MET 87 -17.196 13.527 3.673 1380 HE1 MET 87 HE1 MET 87 -19.146 11.397 4.949 1381 HE2 MET 87 HE2 MET 87 -19.444 10.338 3.571 1382 HE3 MET 87 HE3 MET 87 -19.376 12.084 3.342 1383 H LEU 88 HN LEU 88 -13.438 15.691 2.843 1384 HA LEU 88 HA LEU 88 -10.922 14.635 2.856 1385 HB2 LEU 88 HB2 LEU 88 -12.135 16.653 1.587 1386 HB3 LEU 88 HB1 LEU 88 -11.148 17.584 2.690 1387 HG LEU 88 HG LEU 88 -9.272 17.212 1.501 1388 HD11 LEU 88 HD11 LEU 88 -9.090 14.884 2.227 1389 HD12 LEU 88 HD12 LEU 88 -8.640 15.054 0.533 1390 HD13 LEU 88 HD13 LEU 88 -10.218 14.395 0.963 1391 HD21 LEU 88 HD21 LEU 88 -10.848 17.865 -0.208 1392 HD22 LEU 88 HD22 LEU 88 -11.317 16.181 -0.438 1393 HD23 LEU 88 HD23 LEU 88 -9.689 16.711 -0.868 1394 H MET 89 HN MET 89 -12.285 17.051 5.036 1395 HA MET 89 HA MET 89 -9.788 17.435 6.448 1396 HB2 MET 89 HB2 MET 89 -11.369 19.298 6.110 1397 HB3 MET 89 HB1 MET 89 -12.567 18.447 7.071 1398 HG2 MET 89 HG2 MET 89 -11.118 18.588 9.023 1399 HG3 MET 89 HG1 MET 89 -9.896 19.418 8.061 1400 HE1 MET 89 HE1 MET 89 -14.037 21.190 9.063 1401 HE2 MET 89 HE2 MET 89 -13.475 19.621 9.644 1402 HE3 MET 89 HE3 MET 89 -13.814 19.859 7.930 1403 H ALA 90 HN ALA 90 -12.409 15.275 6.608 1404 HA ALA 90 HA ALA 90 -12.204 14.897 9.503 1405 HB1 ALA 90 HB1 ALA 90 -14.128 13.633 7.549 1406 HB2 ALA 90 HB2 ALA 90 -14.434 15.128 8.438 1407 HB3 ALA 90 HB3 ALA 90 -14.238 13.609 9.310 1408 H GLN 91 HN GLN 91 -11.693 13.186 6.492 1409 HA GLN 91 HA GLN 91 -10.824 10.819 7.984 1410 HB2 GLN 91 HB2 GLN 91 -11.512 11.165 5.074 1411 HB3 GLN 91 HB1 GLN 91 -11.110 9.647 5.864 1412 HG2 GLN 91 HG2 GLN 91 -13.077 9.790 7.228 1413 HG3 GLN 91 HG1 GLN 91 -13.465 11.371 6.560 1414 HE21 GLN 91 HE21 GLN 91 -12.723 10.834 3.919 1415 HE22 GLN 91 HE22 GLN 91 -13.855 9.710 3.279 1416 H LEU 92 HN LEU 92 -9.922 12.633 5.052 1417 HA LEU 92 HA LEU 92 -7.346 11.624 4.773 1418 HB2 LEU 92 HB2 LEU 92 -8.722 12.932 3.124 1419 HB3 LEU 92 HB1 LEU 92 -8.218 14.376 3.977 1420 HG LEU 92 HG LEU 92 -6.954 13.332 1.821 1421 HD11 LEU 92 HD11 LEU 92 -5.097 14.816 2.386 1422 HD12 LEU 92 HD12 LEU 92 -5.692 14.924 4.043 1423 HD13 LEU 92 HD13 LEU 92 -6.655 15.573 2.716 1424 HD21 LEU 92 HD21 LEU 92 -4.805 12.415 2.590 1425 HD22 LEU 92 HD22 LEU 92 -6.168 11.360 2.961 1426 HD23 LEU 92 HD23 LEU 92 -5.446 12.348 4.231 1427 H GLU 93 HN GLU 93 -8.586 13.448 7.240 1428 HA GLU 93 HA GLU 93 -6.998 15.479 7.963 1429 HB2 GLU 93 HB2 GLU 93 -7.383 14.777 10.352 1430 HB3 GLU 93 HB1 GLU 93 -8.832 14.896 9.356 1431 HG2 GLU 93 HG2 GLU 93 -9.117 12.593 9.275 1432 HG3 GLU 93 HG1 GLU 93 -7.445 12.264 9.729 Start of MODEL 20 1 H2 PRO 1 HT1 PRO 1 -5.104 -4.378 13.561 2 H3 PRO 1 HT2 PRO 1 -5.592 -2.934 14.158 3 HA PRO 1 HA PRO 1 -6.264 -2.728 12.109 4 HB2 PRO 1 HB2 PRO 1 -4.197 -1.544 10.892 5 HB3 PRO 1 HB1 PRO 1 -4.990 -0.795 12.283 6 HG2 PRO 1 HG2 PRO 1 -2.360 -2.086 12.105 7 HG3 PRO 1 HG1 PRO 1 -2.971 -0.946 13.316 8 HD2 PRO 1 HD2 PRO 1 -2.801 -3.845 13.455 9 HD3 PRO 1 HD1 PRO 1 -3.254 -2.700 14.733 10 H SER 2 HN SER 2 -4.580 -2.623 9.719 11 HA SER 2 HA SER 2 -4.167 -5.333 9.014 12 HB2 SER 2 HB2 SER 2 -2.950 -2.823 7.858 13 HB3 SER 2 HB1 SER 2 -2.847 -4.411 7.134 14 HG SER 2 HG SER 2 -5.226 -4.392 7.218 15 H PHE 3 HN PHE 3 -1.969 -6.197 8.484 16 HA PHE 3 HA PHE 3 -0.166 -5.834 10.643 17 HB2 PHE 3 HB2 PHE 3 1.317 -6.931 8.601 18 HB3 PHE 3 HB1 PHE 3 0.397 -7.844 9.793 19 HD1 PHE 3 HD1 PHE 3 0.763 -6.857 6.355 20 HD2 PHE 3 HD2 PHE 3 -1.862 -8.717 9.148 21 HE1 PHE 3 HE1 PHE 3 -0.498 -7.859 4.523 22 HE2 PHE 3 HE2 PHE 3 -3.145 -9.700 7.297 23 HZ PHE 3 HZ PHE 3 -2.462 -9.273 4.972 24 H ASN 4 HN ASN 4 -0.160 -4.881 7.266 25 HA ASN 4 HA ASN 4 2.517 -3.836 7.491 26 HB2 ASN 4 HB2 ASN 4 2.305 -3.568 5.074 27 HB3 ASN 4 HB1 ASN 4 1.829 -5.189 5.576 28 HD21 ASN 4 HD21 ASN 4 0.662 -2.058 4.537 29 HD22 ASN 4 HD22 ASN 4 -0.934 -2.578 4.115 30 H THR 5 HN THR 5 -0.444 -2.463 8.088 31 HA THR 5 HA THR 5 -0.347 -0.157 6.465 32 HB THR 5 HB THR 5 -2.420 -0.917 7.441 33 HG1 THR 5 HG1 THR 5 -2.062 1.395 7.022 34 HG21 THR 5 HG21 THR 5 -1.729 -1.824 9.440 35 HG22 THR 5 HG22 THR 5 -2.700 -0.421 9.914 36 HG23 THR 5 HG23 THR 5 -0.934 -0.332 9.934 37 H VAL 6 HN VAL 6 1.663 -1.040 8.979 38 HA VAL 6 HA VAL 6 2.222 1.537 10.055 39 HB VAL 6 HB VAL 6 4.043 0.555 11.156 40 HG11 VAL 6 HG11 VAL 6 2.090 -1.692 10.728 41 HG12 VAL 6 HG12 VAL 6 1.934 -0.387 11.906 42 HG13 VAL 6 HG13 VAL 6 3.241 -1.562 12.058 43 HG21 VAL 6 HG21 VAL 6 5.247 -1.407 10.480 44 HG22 VAL 6 HG22 VAL 6 5.127 -0.323 9.086 45 HG23 VAL 6 HG23 VAL 6 4.074 -1.737 9.199 46 H ARG 7 HN ARG 7 3.666 3.102 9.249 47 HA ARG 7 HA ARG 7 5.444 2.292 7.166 48 HB2 ARG 7 HB2 ARG 7 4.505 4.018 5.554 49 HB3 ARG 7 HB1 ARG 7 3.792 2.444 5.722 50 HG2 ARG 7 HG2 ARG 7 2.397 4.099 7.478 51 HG3 ARG 7 HG1 ARG 7 2.572 4.973 5.951 52 HD2 ARG 7 HD2 ARG 7 1.850 2.849 4.808 53 HD3 ARG 7 HD1 ARG 7 1.370 2.236 6.388 54 HE ARG 7 HE ARG 7 -0.134 3.873 4.715 55 HH11 ARG 7 HH11 ARG 7 0.761 3.879 8.109 56 HH12 ARG 7 HH12 ARG 7 -0.659 4.738 8.599 57 HH21 ARG 7 HH21 ARG 7 -1.964 4.993 5.351 58 HH22 ARG 7 HH22 ARG 7 -2.221 5.368 7.025 59 H GLN 8 HN GLN 8 6.740 3.828 6.271 60 HA GLN 8 HA GLN 8 8.336 5.228 7.898 61 HB2 GLN 8 HB2 GLN 8 7.979 4.864 5.112 62 HB3 GLN 8 HB1 GLN 8 8.294 6.575 5.365 63 HG2 GLN 8 HG2 GLN 8 10.338 6.059 6.529 64 HG3 GLN 8 HG1 GLN 8 10.009 4.332 6.402 65 HE21 GLN 8 HE21 GLN 8 12.280 5.822 5.465 66 HE22 GLN 8 HE22 GLN 8 12.345 5.590 3.742 67 H GLY 9 HN GLY 9 7.984 6.836 9.238 68 HA2 GLY 9 HA3 GLY 9 6.222 9.044 8.540 69 HA3 GLY 9 HA2 GLY 9 7.130 8.855 10.036 70 H SER 10 HN SER 10 7.696 11.142 9.709 71 HA SER 10 HA SER 10 8.979 12.265 7.570 72 HB2 SER 10 HB2 SER 10 9.635 12.786 10.478 73 HB3 SER 10 HB1 SER 10 9.897 13.893 9.129 74 HG SER 10 HG SER 10 7.475 13.513 8.827 75 H LYS 11 HN LYS 11 10.517 11.335 6.448 76 HA LYS 11 HA LYS 11 12.212 9.933 5.879 77 HB2 LYS 11 HB2 LYS 11 14.392 10.813 6.374 78 HB3 LYS 11 HB1 LYS 11 13.312 12.142 6.036 79 HG2 LYS 11 HG2 LYS 11 13.347 12.881 8.191 80 HG3 LYS 11 HG1 LYS 11 13.769 11.314 8.864 81 HD2 LYS 11 HD2 LYS 11 16.023 11.548 7.880 82 HD3 LYS 11 HD1 LYS 11 15.583 13.151 7.300 83 HE2 LYS 11 HE2 LYS 11 15.208 13.886 9.601 84 HE3 LYS 11 HE1 LYS 11 15.629 12.278 10.185 85 HZ1 LYS 11 HZ1 LYS 11 17.433 14.153 8.756 86 HZ2 LYS 11 HZ2 LYS 11 17.846 12.582 9.221 87 HZ3 LYS 11 HZ3 LYS 11 17.503 13.745 10.395 88 H GLU 12 HN GLU 12 10.790 8.605 7.821 89 HA GLU 12 HA GLU 12 12.326 7.630 9.968 90 HB2 GLU 12 HB2 GLU 12 9.905 7.320 9.807 91 HB3 GLU 12 HB1 GLU 12 10.098 6.324 8.381 92 HG2 GLU 12 HG2 GLU 12 11.228 4.620 9.709 93 HG3 GLU 12 HG1 GLU 12 11.062 5.634 11.142 94 HA PRO 13 HA PRO 13 15.540 5.276 7.983 95 HB2 PRO 13 HB2 PRO 13 14.957 3.271 10.087 96 HB3 PRO 13 HB1 PRO 13 16.497 4.005 9.647 97 HG2 PRO 13 HG2 PRO 13 15.186 4.715 11.869 98 HG3 PRO 13 HG1 PRO 13 16.111 5.879 10.914 99 HD2 PRO 13 HD2 PRO 13 13.178 5.534 11.146 100 HD3 PRO 13 HD1 PRO 13 14.120 6.997 10.818 101 H TYR 14 HN TYR 14 15.260 4.034 6.231 102 HA TYR 14 HA TYR 14 12.659 3.029 5.817 103 HB2 TYR 14 HB2 TYR 14 13.896 4.122 4.018 104 HB3 TYR 14 HB1 TYR 14 15.048 2.792 3.999 105 HD1 TYR 14 HD1 TYR 14 14.060 0.455 3.668 106 HD2 TYR 14 HD2 TYR 14 12.027 4.016 2.619 107 HE1 TYR 14 HE1 TYR 14 12.641 -0.838 2.166 108 HE2 TYR 14 HE2 TYR 14 10.583 2.743 1.095 109 HH TYR 14 HH TYR 14 10.230 0.746 0.154 110 HA PRO 15 HA PRO 15 14.783 -1.359 5.434 111 HB2 PRO 15 HB2 PRO 15 16.937 -1.048 7.425 112 HB3 PRO 15 HB1 PRO 15 16.945 -1.911 5.890 113 HG2 PRO 15 HG2 PRO 15 18.230 0.413 6.220 114 HG3 PRO 15 HG1 PRO 15 17.499 -0.047 4.687 115 HD2 PRO 15 HD2 PRO 15 16.581 1.929 6.704 116 HD3 PRO 15 HD1 PRO 15 16.371 1.919 4.947 117 H ASP 16 HN ASP 16 14.492 0.722 8.048 118 HA ASP 16 HA ASP 16 13.756 -1.308 9.981 119 HB2 ASP 16 HB2 ASP 16 14.435 1.574 10.111 120 HB3 ASP 16 HB1 ASP 16 13.286 0.995 11.309 121 H PHE 17 HN PHE 17 12.323 1.433 8.261 122 HA PHE 17 HA PHE 17 9.738 1.312 9.286 123 HB2 PHE 17 HB2 PHE 17 9.615 3.055 7.833 124 HB3 PHE 17 HB1 PHE 17 11.050 2.504 6.980 125 HD1 PHE 17 HD1 PHE 17 10.895 1.522 4.864 126 HD2 PHE 17 HD2 PHE 17 7.375 2.072 7.183 127 HE1 PHE 17 HE1 PHE 17 9.525 0.895 2.926 128 HE2 PHE 17 HE2 PHE 17 5.995 1.458 5.243 129 HZ PHE 17 HZ PHE 17 7.070 0.866 3.112 130 H VAL 18 HN VAL 18 11.274 -0.479 6.689 131 HA VAL 18 HA VAL 18 8.909 -1.986 6.133 132 HB VAL 18 HB VAL 18 10.203 -1.637 4.221 133 HG11 VAL 18 HG11 VAL 18 12.578 -2.241 4.054 134 HG12 VAL 18 HG12 VAL 18 12.573 -2.672 5.775 135 HG13 VAL 18 HG13 VAL 18 12.296 -0.999 5.284 136 HG21 VAL 18 HG21 VAL 18 9.382 -3.859 4.237 137 HG22 VAL 18 HG22 VAL 18 10.688 -4.394 5.302 138 HG23 VAL 18 HG23 VAL 18 11.041 -3.920 3.635 139 H ALA 19 HN ALA 19 11.912 -2.567 7.930 140 HA ALA 19 HA ALA 19 11.616 -5.320 8.304 141 HB1 ALA 19 HB1 ALA 19 13.036 -5.104 10.251 142 HB2 ALA 19 HB2 ALA 19 12.726 -3.369 10.326 143 HB3 ALA 19 HB3 ALA 19 13.626 -4.044 8.971 144 H ARG 20 HN ARG 20 9.925 -2.668 9.929 145 HA ARG 20 HA ARG 20 8.691 -4.543 11.766 146 HB2 ARG 20 HB2 ARG 20 7.343 -2.631 12.548 147 HB3 ARG 20 HB1 ARG 20 9.065 -2.297 12.624 148 HG2 ARG 20 HG2 ARG 20 8.975 -0.760 10.898 149 HG3 ARG 20 HG1 ARG 20 7.463 -1.413 10.263 150 HD2 ARG 20 HD2 ARG 20 6.205 -0.480 12.031 151 HD3 ARG 20 HD1 ARG 20 7.647 -0.118 12.963 152 HE ARG 20 HE ARG 20 8.053 1.405 10.831 153 HH11 ARG 20 HH11 ARG 20 5.160 0.943 12.750 154 HH12 ARG 20 HH12 ARG 20 4.561 2.544 12.456 155 HH21 ARG 20 HH21 ARG 20 7.296 3.524 10.484 156 HH22 ARG 20 HH22 ARG 20 5.767 4.008 11.166 157 H LEU 21 HN LEU 21 8.114 -2.889 8.796 158 HA LEU 21 HA LEU 21 5.484 -3.453 8.260 159 HB2 LEU 21 HB2 LEU 21 7.324 -2.236 6.893 160 HB3 LEU 21 HB1 LEU 21 7.675 -3.811 6.232 161 HG LEU 21 HG LEU 21 5.643 -3.910 5.071 162 HD11 LEU 21 HD11 LEU 21 4.126 -3.154 6.782 163 HD12 LEU 21 HD12 LEU 21 3.882 -2.197 5.321 164 HD13 LEU 21 HD13 LEU 21 4.782 -1.521 6.682 165 HD21 LEU 21 HD21 LEU 21 5.653 -1.811 3.781 166 HD22 LEU 21 HD22 LEU 21 7.264 -2.480 4.032 167 HD23 LEU 21 HD23 LEU 21 6.718 -1.107 4.996 168 H GLN 22 HN GLN 22 8.345 -5.438 7.662 169 HA GLN 22 HA GLN 22 7.006 -7.766 6.846 170 HB2 GLN 22 HB2 GLN 22 9.672 -7.806 8.191 171 HB3 GLN 22 HB1 GLN 22 9.062 -8.804 6.865 172 HG2 GLN 22 HG2 GLN 22 9.180 -6.830 5.432 173 HG3 GLN 22 HG1 GLN 22 9.867 -5.921 6.765 174 HE21 GLN 22 HE21 GLN 22 10.986 -6.379 4.273 175 HE22 GLN 22 HE22 GLN 22 12.455 -7.260 4.468 176 H ASP 23 HN ASP 23 8.470 -6.767 9.863 177 HA ASP 23 HA ASP 23 8.225 -9.037 11.370 178 HB2 ASP 23 HB2 ASP 23 9.149 -6.794 12.076 179 HB3 ASP 23 HB1 ASP 23 7.479 -6.329 12.400 180 H VAL 24 HN VAL 24 5.719 -6.550 10.983 181 HA VAL 24 HA VAL 24 3.953 -8.096 12.652 182 HB VAL 24 HB VAL 24 3.919 -5.675 12.893 183 HG11 VAL 24 HG11 VAL 24 3.085 -4.238 11.093 184 HG12 VAL 24 HG12 VAL 24 3.039 -5.636 10.019 185 HG13 VAL 24 HG13 VAL 24 4.580 -5.063 10.656 186 HG21 VAL 24 HG21 VAL 24 1.837 -6.763 13.407 187 HG22 VAL 24 HG22 VAL 24 1.379 -6.790 11.706 188 HG23 VAL 24 HG23 VAL 24 1.470 -5.252 12.569 189 H ALA 25 HN ALA 25 4.623 -7.639 9.310 190 HA ALA 25 HA ALA 25 2.158 -8.728 8.315 191 HB1 ALA 25 HB1 ALA 25 3.606 -7.375 6.857 192 HB2 ALA 25 HB2 ALA 25 3.373 -8.991 6.193 193 HB3 ALA 25 HB3 ALA 25 4.883 -8.582 7.006 194 H GLN 26 HN GLN 26 4.976 -9.805 9.789 195 HA GLN 26 HA GLN 26 4.734 -12.550 8.941 196 HB2 GLN 26 HB2 GLN 26 6.915 -12.339 9.328 197 HB3 GLN 26 HB1 GLN 26 6.653 -10.817 10.161 198 HG2 GLN 26 HG2 GLN 26 7.607 -11.995 11.818 199 HG3 GLN 26 HG1 GLN 26 5.926 -12.416 12.120 200 HE21 GLN 26 HE21 GLN 26 5.793 -14.115 9.757 201 HE22 GLN 26 HE22 GLN 26 6.622 -15.563 10.162 202 H LYS 27 HN LYS 27 4.128 -10.547 11.732 203 HA LYS 27 HA LYS 27 3.348 -12.561 13.547 204 HB2 LYS 27 HB2 LYS 27 2.414 -9.689 13.452 205 HB3 LYS 27 HB1 LYS 27 2.400 -10.753 14.862 206 HG2 LYS 27 HG2 LYS 27 4.836 -9.739 13.414 207 HG3 LYS 27 HG1 LYS 27 4.240 -9.184 14.979 208 HD2 LYS 27 HD2 LYS 27 4.901 -11.122 16.057 209 HD3 LYS 27 HD1 LYS 27 4.889 -12.074 14.571 210 HE2 LYS 27 HE2 LYS 27 6.893 -11.157 13.823 211 HE3 LYS 27 HE1 LYS 27 6.795 -9.802 14.941 212 HZ1 LYS 27 HZ1 LYS 27 7.197 -11.343 16.768 213 HZ2 LYS 27 HZ2 LYS 27 8.454 -11.408 15.640 214 HZ3 LYS 27 HZ3 LYS 27 7.292 -12.633 15.681 215 H SER 28 HN SER 28 1.600 -10.854 11.037 216 HA SER 28 HA SER 28 -0.924 -11.901 12.087 217 HB2 SER 28 HB2 SER 28 -0.399 -9.715 10.079 218 HB3 SER 28 HB1 SER 28 -1.989 -10.182 10.689 219 HG SER 28 HG SER 28 0.129 -8.876 12.010 220 H ILE 29 HN ILE 29 1.402 -12.459 9.763 221 HA ILE 29 HA ILE 29 -0.535 -13.835 8.023 222 HB ILE 29 HB ILE 29 2.129 -12.630 7.311 223 HG12 ILE 29 HG12 ILE 29 -0.632 -11.929 6.313 224 HG13 ILE 29 HG11 ILE 29 0.294 -11.003 7.501 225 HG21 ILE 29 HG21 ILE 29 1.629 -13.273 4.997 226 HG22 ILE 29 HG22 ILE 29 0.264 -14.230 5.593 227 HG23 ILE 29 HG23 ILE 29 1.913 -14.641 6.074 228 HD11 ILE 29 HD11 ILE 29 1.269 -11.599 4.725 229 HD12 ILE 29 HD12 ILE 29 1.974 -10.492 5.914 230 HD13 ILE 29 HD13 ILE 29 0.411 -10.120 5.178 231 H ALA 30 HN ALA 30 -0.316 -15.996 7.874 232 HA ALA 30 HA ALA 30 2.031 -17.269 9.068 233 HB1 ALA 30 HB1 ALA 30 0.731 -19.321 8.980 234 HB2 ALA 30 HB2 ALA 30 -0.543 -18.494 8.085 235 HB3 ALA 30 HB3 ALA 30 -0.197 -18.036 9.752 236 H ASP 31 HN ASP 31 1.215 -16.099 6.178 237 HA ASP 31 HA ASP 31 2.385 -18.268 4.551 238 HB2 ASP 31 HB2 ASP 31 0.067 -17.273 4.079 239 HB3 ASP 31 HB1 ASP 31 0.939 -15.835 3.577 240 H GLU 32 HN GLU 32 4.454 -18.019 4.169 241 HA GLU 32 HA GLU 32 5.938 -15.678 4.509 242 HB2 GLU 32 HB2 GLU 32 7.720 -16.820 3.350 243 HB3 GLU 32 HB1 GLU 32 6.869 -18.000 4.338 244 HG2 GLU 32 HG2 GLU 32 6.795 -19.253 2.508 245 HG3 GLU 32 HG1 GLU 32 5.544 -18.150 1.934 246 H LYS 33 HN LYS 33 4.007 -16.782 1.803 247 HA LYS 33 HA LYS 33 5.381 -15.182 -0.141 248 HB2 LYS 33 HB2 LYS 33 2.657 -16.487 -0.293 249 HB3 LYS 33 HB1 LYS 33 3.486 -15.726 -1.640 250 HG2 LYS 33 HG2 LYS 33 4.226 -17.778 -2.103 251 HG3 LYS 33 HG1 LYS 33 5.352 -17.519 -0.771 252 HD2 LYS 33 HD2 LYS 33 4.231 -19.668 -0.556 253 HD3 LYS 33 HD1 LYS 33 3.791 -18.591 0.768 254 HE2 LYS 33 HE2 LYS 33 1.874 -19.857 -0.136 255 HE3 LYS 33 HE1 LYS 33 1.669 -18.114 -0.255 256 HZ1 LYS 33 HZ1 LYS 33 2.431 -18.312 -2.601 257 HZ2 LYS 33 HZ2 LYS 33 0.951 -19.065 -2.282 258 HZ3 LYS 33 HZ3 LYS 33 2.361 -19.995 -2.442 259 H ALA 34 HN ALA 34 2.189 -15.041 1.385 260 HA ALA 34 HA ALA 34 1.536 -12.458 0.520 261 HB1 ALA 34 HB1 ALA 34 -0.112 -13.997 1.454 262 HB2 ALA 34 HB2 ALA 34 -0.123 -12.463 2.323 263 HB3 ALA 34 HB3 ALA 34 0.653 -13.875 3.037 264 H ARG 35 HN ARG 35 3.585 -13.574 3.124 265 HA ARG 35 HA ARG 35 3.710 -11.149 4.616 266 HB2 ARG 35 HB2 ARG 35 4.573 -13.606 5.153 267 HB3 ARG 35 HB1 ARG 35 6.058 -12.996 4.442 268 HG2 ARG 35 HG2 ARG 35 4.729 -11.434 6.622 269 HG3 ARG 35 HG1 ARG 35 5.663 -12.873 7.023 270 HD2 ARG 35 HD2 ARG 35 6.643 -10.389 5.619 271 HD3 ARG 35 HD1 ARG 35 7.053 -10.940 7.249 272 HE ARG 35 HE ARG 35 7.757 -12.672 4.991 273 HH11 ARG 35 HH11 ARG 35 8.755 -10.532 7.573 274 HH12 ARG 35 HH12 ARG 35 10.439 -10.896 7.391 275 HH21 ARG 35 HH21 ARG 35 9.988 -13.158 4.770 276 HH22 ARG 35 HH22 ARG 35 11.139 -12.373 5.806 277 H LYS 36 HN LYS 36 5.977 -12.620 2.307 278 HA LYS 36 HA LYS 36 7.719 -10.453 2.028 279 HB2 LYS 36 HB2 LYS 36 6.901 -12.375 -0.137 280 HB3 LYS 36 HB1 LYS 36 8.367 -11.403 -0.099 281 HG2 LYS 36 HG2 LYS 36 9.416 -12.808 1.260 282 HG3 LYS 36 HG1 LYS 36 7.951 -13.140 2.208 283 HD2 LYS 36 HD2 LYS 36 8.611 -15.133 1.008 284 HD3 LYS 36 HD1 LYS 36 7.092 -14.485 0.356 285 HE2 LYS 36 HE2 LYS 36 8.639 -13.225 -1.303 286 HE3 LYS 36 HE1 LYS 36 9.846 -14.419 -0.811 287 HZ1 LYS 36 HZ1 LYS 36 7.195 -15.050 -1.985 288 HZ2 LYS 36 HZ2 LYS 36 8.328 -16.190 -1.464 289 HZ3 LYS 36 HZ3 LYS 36 8.686 -15.179 -2.771 290 H VAL 37 HN VAL 37 4.991 -11.394 -0.027 291 HA VAL 37 HA VAL 37 5.414 -9.442 -1.943 292 HB VAL 37 HB VAL 37 3.172 -9.791 -2.767 293 HG11 VAL 37 HG11 VAL 37 3.150 -12.298 -2.873 294 HG12 VAL 37 HG12 VAL 37 4.504 -12.286 -1.739 295 HG13 VAL 37 HG13 VAL 37 4.675 -11.538 -3.331 296 HG21 VAL 37 HG21 VAL 37 2.652 -11.107 -0.114 297 HG22 VAL 37 HG22 VAL 37 1.593 -11.272 -1.514 298 HG23 VAL 37 HG23 VAL 37 1.857 -9.685 -0.788 299 H ILE 38 HN ILE 38 3.675 -9.225 1.112 300 HA ILE 38 HA ILE 38 2.733 -6.600 0.373 301 HB ILE 38 HB ILE 38 1.585 -8.444 1.991 302 HG12 ILE 38 HG12 ILE 38 1.207 -5.477 2.306 303 HG13 ILE 38 HG11 ILE 38 0.714 -6.339 0.853 304 HG21 ILE 38 HG21 ILE 38 1.634 -7.648 4.277 305 HG22 ILE 38 HG22 ILE 38 2.754 -6.361 3.833 306 HG23 ILE 38 HG23 ILE 38 3.278 -8.046 3.765 307 HD11 ILE 38 HD11 ILE 38 -1.222 -6.206 2.062 308 HD12 ILE 38 HD12 ILE 38 -0.398 -6.395 3.597 309 HD13 ILE 38 HD13 ILE 38 -0.623 -7.794 2.541 310 H VAL 39 HN VAL 39 5.291 -7.954 2.413 311 HA VAL 39 HA VAL 39 5.919 -5.411 3.511 312 HB VAL 39 HB VAL 39 7.878 -6.283 4.385 313 HG11 VAL 39 HG11 VAL 39 5.984 -7.360 5.360 314 HG12 VAL 39 HG12 VAL 39 7.307 -8.527 5.241 315 HG13 VAL 39 HG13 VAL 39 5.977 -8.586 4.092 316 HG21 VAL 39 HG21 VAL 39 9.045 -8.294 3.628 317 HG22 VAL 39 HG22 VAL 39 8.961 -7.073 2.358 318 HG23 VAL 39 HG23 VAL 39 7.884 -8.468 2.310 319 H GLU 40 HN GLU 40 7.244 -7.234 0.779 320 HA GLU 40 HA GLU 40 8.922 -5.283 -0.234 321 HB2 GLU 40 HB2 GLU 40 7.501 -7.601 -1.498 322 HB3 GLU 40 HB1 GLU 40 8.688 -6.631 -2.348 323 HG2 GLU 40 HG2 GLU 40 10.410 -7.281 -0.916 324 HG3 GLU 40 HG1 GLU 40 9.313 -7.911 0.280 325 H LEU 41 HN LEU 41 5.460 -5.640 -0.580 326 HA LEU 41 HA LEU 41 5.405 -3.671 -2.707 327 HB2 LEU 41 HB2 LEU 41 3.648 -5.650 -1.866 328 HB3 LEU 41 HB1 LEU 41 2.840 -4.144 -1.474 329 HG LEU 41 HG LEU 41 2.076 -4.616 -3.613 330 HD11 LEU 41 HD11 LEU 41 2.918 -2.920 -5.024 331 HD12 LEU 41 HD12 LEU 41 4.484 -2.929 -4.222 332 HD13 LEU 41 HD13 LEU 41 3.061 -2.332 -3.371 333 HD21 LEU 41 HD21 LEU 41 3.553 -6.486 -4.074 334 HD22 LEU 41 HD22 LEU 41 4.887 -5.374 -4.379 335 HD23 LEU 41 HD23 LEU 41 3.484 -5.386 -5.450 336 H MET 42 HN MET 42 4.293 -3.799 0.681 337 HA MET 42 HA MET 42 3.345 -1.132 0.750 338 HB2 MET 42 HB2 MET 42 4.271 -2.904 3.010 339 HB3 MET 42 HB1 MET 42 3.385 -1.387 3.215 340 HG2 MET 42 HG2 MET 42 2.454 -3.959 1.980 341 HG3 MET 42 HG1 MET 42 1.823 -3.130 3.393 342 HE1 MET 42 HE1 MET 42 -0.609 -3.427 2.527 343 HE2 MET 42 HE2 MET 42 -0.004 -4.261 1.091 344 HE3 MET 42 HE3 MET 42 -1.150 -2.929 0.918 345 H ALA 43 HN ALA 43 6.424 -2.570 1.018 346 HA ALA 43 HA ALA 43 8.020 -0.675 2.148 347 HB1 ALA 43 HB1 ALA 43 9.714 -1.412 0.457 348 HB2 ALA 43 HB2 ALA 43 8.429 -2.352 -0.313 349 HB3 ALA 43 HB3 ALA 43 8.918 -2.716 1.341 350 H TYR 44 HN TYR 44 6.296 -0.569 -0.892 351 HA TYR 44 HA TYR 44 7.392 2.102 -1.492 352 HB2 TYR 44 HB2 TYR 44 7.469 0.578 -3.385 353 HB3 TYR 44 HB1 TYR 44 5.793 0.139 -3.113 354 HD1 TYR 44 HD1 TYR 44 8.033 2.519 -4.720 355 HD2 TYR 44 HD2 TYR 44 3.979 1.734 -3.714 356 HE1 TYR 44 HE1 TYR 44 7.314 4.155 -6.397 357 HE2 TYR 44 HE2 TYR 44 3.244 3.381 -5.376 358 HH TYR 44 HH TYR 44 5.273 4.641 -7.757 359 H GLU 45 HN GLU 45 4.324 0.383 -1.799 360 HA GLU 45 HA GLU 45 2.660 2.514 -2.041 361 HB2 GLU 45 HB2 GLU 45 2.017 -0.086 -0.687 362 HB3 GLU 45 HB1 GLU 45 0.875 0.981 -1.491 363 HG2 GLU 45 HG2 GLU 45 3.143 -0.480 -2.825 364 HG3 GLU 45 HG1 GLU 45 1.462 -0.988 -2.851 365 H ASN 46 HN ASN 46 4.055 1.317 0.948 366 HA ASN 46 HA ASN 46 2.237 3.026 2.456 367 HB2 ASN 46 HB2 ASN 46 3.802 0.550 3.093 368 HB3 ASN 46 HB1 ASN 46 3.364 1.656 4.378 369 HD21 ASN 46 HD21 ASN 46 1.870 0.376 5.431 370 HD22 ASN 46 HD22 ASN 46 0.399 -0.112 4.692 371 H ALA 47 HN ALA 47 5.472 2.697 1.369 372 HA ALA 47 HA ALA 47 6.893 3.842 3.488 373 HB1 ALA 47 HB1 ALA 47 8.652 4.304 1.863 374 HB2 ALA 47 HB2 ALA 47 7.532 3.942 0.552 375 HB3 ALA 47 HB3 ALA 47 8.007 2.672 1.680 376 H ASN 48 HN ASN 48 8.250 5.850 3.046 377 HA ASN 48 HA ASN 48 6.675 8.150 3.163 378 HB2 ASN 48 HB2 ASN 48 9.559 7.533 2.860 379 HB3 ASN 48 HB1 ASN 48 9.048 9.144 2.371 380 HD21 ASN 48 HD21 ASN 48 10.711 8.178 4.623 381 HD22 ASN 48 HD22 ASN 48 9.955 8.841 6.035 382 HA PRO 49 HA PRO 49 5.429 8.881 -0.977 383 HB2 PRO 49 HB2 PRO 49 5.689 11.659 -0.925 384 HB3 PRO 49 HB1 PRO 49 4.262 10.746 -0.436 385 HG2 PRO 49 HG2 PRO 49 6.429 11.927 1.229 386 HG3 PRO 49 HG1 PRO 49 4.699 11.763 1.581 387 HD2 PRO 49 HD2 PRO 49 6.534 10.155 2.707 388 HD3 PRO 49 HD1 PRO 49 4.919 9.561 2.261 389 H GLU 50 HN GLU 50 8.414 10.168 0.235 390 HA GLU 50 HA GLU 50 9.564 10.678 -2.360 391 HB2 GLU 50 HB2 GLU 50 11.438 11.495 -1.151 392 HB3 GLU 50 HB1 GLU 50 10.019 11.995 -0.241 393 HG2 GLU 50 HG2 GLU 50 11.076 9.419 0.562 394 HG3 GLU 50 HG1 GLU 50 12.163 10.773 0.828 395 H CYS 51 HN CYS 51 9.500 8.215 0.088 396 HA CYS 51 HA CYS 51 11.947 6.973 -0.734 397 HB2 CYS 51 HB2 CYS 51 9.859 6.192 1.321 398 HB3 CYS 51 HB1 CYS 51 11.364 5.311 1.033 399 HG CYS 51 HG CYS 51 12.998 6.964 2.240 400 H GLN 52 HN GLN 52 8.504 6.351 -0.981 401 HA GLN 52 HA GLN 52 8.810 3.944 -2.477 402 HB2 GLN 52 HB2 GLN 52 6.476 4.220 -3.049 403 HB3 GLN 52 HB1 GLN 52 6.702 4.545 -1.337 404 HG2 GLN 52 HG2 GLN 52 6.704 6.966 -1.862 405 HG3 GLN 52 HG1 GLN 52 6.308 6.561 -3.531 406 HE21 GLN 52 HE21 GLN 52 4.747 4.261 -2.667 407 HE22 GLN 52 HE22 GLN 52 3.266 4.871 -2.066 408 H SER 53 HN SER 53 8.799 7.297 -3.018 409 HA SER 53 HA SER 53 8.742 7.244 -5.842 410 HB2 SER 53 HB2 SER 53 9.352 9.233 -3.717 411 HB3 SER 53 HB1 SER 53 9.743 9.623 -5.399 412 HG SER 53 HG SER 53 7.320 9.508 -4.138 413 H ALA 54 HN ALA 54 11.177 6.791 -3.430 414 HA ALA 54 HA ALA 54 13.338 6.807 -5.326 415 HB1 ALA 54 HB1 ALA 54 13.101 5.609 -2.578 416 HB2 ALA 54 HB2 ALA 54 13.772 7.189 -2.978 417 HB3 ALA 54 HB3 ALA 54 14.600 5.723 -3.505 418 H ILE 55 HN ILE 55 10.881 4.683 -4.377 419 HA ILE 55 HA ILE 55 12.278 2.293 -5.160 420 HB ILE 55 HB ILE 55 9.631 2.817 -3.893 421 HG12 ILE 55 HG12 ILE 55 11.826 1.112 -2.826 422 HG13 ILE 55 HG11 ILE 55 12.013 2.872 -2.805 423 HG21 ILE 55 HG21 ILE 55 9.261 0.927 -5.327 424 HG22 ILE 55 HG22 ILE 55 9.399 0.367 -3.661 425 HG23 ILE 55 HG23 ILE 55 10.753 0.171 -4.771 426 HD11 ILE 55 HD11 ILE 55 11.110 1.882 -0.726 427 HD12 ILE 55 HD12 ILE 55 9.657 1.417 -1.632 428 HD13 ILE 55 HD13 ILE 55 10.086 3.126 -1.454 429 H LYS 56 HN LYS 56 9.653 4.279 -6.522 430 HA LYS 56 HA LYS 56 8.243 2.456 -7.941 431 HB2 LYS 56 HB2 LYS 56 8.712 4.559 -9.823 432 HB3 LYS 56 HB1 LYS 56 7.248 4.131 -8.963 433 HG2 LYS 56 HG2 LYS 56 7.477 6.252 -8.236 434 HG3 LYS 56 HG1 LYS 56 8.497 5.467 -7.026 435 HD2 LYS 56 HD2 LYS 56 10.409 6.185 -7.957 436 HD3 LYS 56 HD1 LYS 56 9.747 6.273 -9.588 437 HE2 LYS 56 HE2 LYS 56 9.599 8.291 -7.355 438 HE3 LYS 56 HE1 LYS 56 10.053 8.508 -9.044 439 HZ1 LYS 56 HZ1 LYS 56 7.894 9.475 -8.586 440 HZ2 LYS 56 HZ2 LYS 56 7.292 7.979 -8.085 441 HZ3 LYS 56 HZ3 LYS 56 7.751 8.209 -9.697 442 HA PRO 57 HA PRO 57 11.528 2.273 -11.606 443 HB2 PRO 57 HB2 PRO 57 14.097 2.262 -10.700 444 HB3 PRO 57 HB1 PRO 57 13.286 3.727 -11.274 445 HG2 PRO 57 HG2 PRO 57 13.512 2.692 -8.459 446 HG3 PRO 57 HG1 PRO 57 13.948 4.308 -9.071 447 HD2 PRO 57 HD2 PRO 57 11.627 3.957 -7.891 448 HD3 PRO 57 HD1 PRO 57 11.659 4.876 -9.404 449 H LEU 58 HN LEU 58 11.963 1.047 -8.348 450 HA LEU 58 HA LEU 58 12.899 -1.559 -9.324 451 HB2 LEU 58 HB2 LEU 58 12.438 -1.067 -6.446 452 HB3 LEU 58 HB1 LEU 58 13.729 -1.981 -7.218 453 HG LEU 58 HG LEU 58 13.542 1.035 -7.038 454 HD11 LEU 58 HD11 LEU 58 15.186 -0.969 -5.505 455 HD12 LEU 58 HD12 LEU 58 13.904 0.062 -4.869 456 HD13 LEU 58 HD13 LEU 58 15.412 0.779 -5.444 457 HD21 LEU 58 HD21 LEU 58 14.752 0.310 -9.023 458 HD22 LEU 58 HD22 LEU 58 15.770 -0.741 -8.036 459 HD23 LEU 58 HD23 LEU 58 15.853 1.010 -7.839 460 H LYS 59 HN LYS 59 10.209 0.178 -8.294 461 HA LYS 59 HA LYS 59 8.654 -1.665 -6.947 462 HB2 LYS 59 HB2 LYS 59 7.906 0.604 -7.216 463 HB3 LYS 59 HB1 LYS 59 7.797 0.402 -8.954 464 HG2 LYS 59 HG2 LYS 59 5.620 0.055 -8.538 465 HG3 LYS 59 HG1 LYS 59 6.174 -1.563 -8.130 466 HD2 LYS 59 HD2 LYS 59 5.768 0.690 -6.204 467 HD3 LYS 59 HD1 LYS 59 4.692 -0.699 -6.406 468 HE2 LYS 59 HE2 LYS 59 7.570 -0.773 -5.494 469 HE3 LYS 59 HE1 LYS 59 6.161 -0.959 -4.466 470 HZ1 LYS 59 HZ1 LYS 59 7.058 -2.800 -6.589 471 HZ2 LYS 59 HZ2 LYS 59 5.585 -2.951 -5.781 472 HZ3 LYS 59 HZ3 LYS 59 7.044 -3.093 -4.924 473 H GLY 60 HN GLY 60 8.379 -3.702 -7.475 474 HA2 GLY 60 HA3 GLY 60 7.171 -5.355 -8.672 475 HA3 GLY 60 HA2 GLY 60 7.225 -4.322 -10.095 476 H LYS 61 HN LYS 61 10.161 -3.814 -9.436 477 HA LYS 61 HA LYS 61 11.130 -6.214 -10.828 478 HB2 LYS 61 HB2 LYS 61 12.855 -3.817 -10.535 479 HB3 LYS 61 HB1 LYS 61 12.600 -4.848 -11.935 480 HG2 LYS 61 HG2 LYS 61 10.677 -2.760 -10.961 481 HG3 LYS 61 HG1 LYS 61 11.824 -2.540 -12.270 482 HD2 LYS 61 HD2 LYS 61 9.680 -4.651 -12.245 483 HD3 LYS 61 HD1 LYS 61 9.491 -3.067 -12.996 484 HE2 LYS 61 HE2 LYS 61 11.376 -3.530 -14.461 485 HE3 LYS 61 HE1 LYS 61 11.589 -5.105 -13.700 486 HZ1 LYS 61 HZ1 LYS 61 9.416 -5.762 -14.486 487 HZ2 LYS 61 HZ2 LYS 61 10.365 -5.257 -15.792 488 HZ3 LYS 61 HZ3 LYS 61 9.164 -4.239 -15.176 489 H VAL 62 HN VAL 62 11.944 -7.637 -9.416 490 HA VAL 62 HA VAL 62 13.947 -6.624 -7.515 491 HB VAL 62 HB VAL 62 12.045 -7.490 -6.265 492 HG11 VAL 62 HG11 VAL 62 11.352 -9.836 -6.397 493 HG12 VAL 62 HG12 VAL 62 12.452 -10.077 -7.756 494 HG13 VAL 62 HG13 VAL 62 11.079 -8.981 -7.917 495 HG21 VAL 62 HG21 VAL 62 13.174 -9.273 -4.953 496 HG22 VAL 62 HG22 VAL 62 14.177 -7.854 -5.247 497 HG23 VAL 62 HG23 VAL 62 14.433 -9.325 -6.188 498 HA PRO 63 HA PRO 63 16.989 -9.383 -9.527 499 HB2 PRO 63 HB2 PRO 63 17.524 -9.922 -6.639 500 HB3 PRO 63 HB1 PRO 63 18.666 -9.666 -7.944 501 HG2 PRO 63 HG2 PRO 63 18.148 -7.713 -6.234 502 HG3 PRO 63 HG1 PRO 63 18.331 -7.361 -7.960 503 HD2 PRO 63 HD2 PRO 63 15.870 -7.445 -6.299 504 HD3 PRO 63 HD1 PRO 63 16.236 -6.460 -7.729 505 H ALA 64 HN ALA 64 16.969 -11.539 -9.984 506 HA ALA 64 HA ALA 64 14.641 -12.978 -9.420 507 HB1 ALA 64 HB1 ALA 64 17.257 -14.037 -10.473 508 HB2 ALA 64 HB2 ALA 64 15.982 -13.302 -11.443 509 HB3 ALA 64 HB3 ALA 64 15.686 -14.824 -10.604 510 H GLY 65 HN GLY 65 14.144 -13.576 -7.401 511 HA2 GLY 65 HA3 GLY 65 14.188 -15.308 -5.807 512 HA3 GLY 65 HA2 GLY 65 15.883 -15.578 -6.177 513 H SER 66 HN SER 66 15.868 -12.373 -5.902 514 HA SER 66 HA SER 66 16.784 -12.556 -3.143 515 HB2 SER 66 HB2 SER 66 16.907 -10.179 -4.997 516 HB3 SER 66 HB1 SER 66 17.866 -10.460 -3.545 517 HG SER 66 HG SER 66 18.691 -12.364 -4.671 518 H ASP 67 HN ASP 67 16.391 -10.456 -1.841 519 HA ASP 67 HA ASP 67 13.544 -10.152 -1.446 520 HB2 ASP 67 HB2 ASP 67 15.708 -10.070 0.220 521 HB3 ASP 67 HB1 ASP 67 15.436 -8.360 -0.047 522 H VAL 68 HN VAL 68 12.291 -8.381 -2.116 523 HA VAL 68 HA VAL 68 13.648 -6.469 -3.809 524 HB VAL 68 HB VAL 68 11.683 -5.839 -4.652 525 HG11 VAL 68 HG11 VAL 68 9.889 -7.428 -4.552 526 HG12 VAL 68 HG12 VAL 68 10.555 -8.127 -3.077 527 HG13 VAL 68 HG13 VAL 68 11.440 -8.266 -4.593 528 HG21 VAL 68 HG21 VAL 68 10.508 -5.804 -1.881 529 HG22 VAL 68 HG22 VAL 68 9.673 -5.289 -3.346 530 HG23 VAL 68 HG23 VAL 68 11.114 -4.426 -2.799 531 H ILE 69 HN ILE 69 12.587 -6.696 -0.562 532 HA ILE 69 HA ILE 69 12.410 -4.014 0.135 533 HB ILE 69 HB ILE 69 13.239 -6.413 1.738 534 HG12 ILE 69 HG12 ILE 69 10.969 -6.602 1.116 535 HG13 ILE 69 HG11 ILE 69 10.938 -5.953 2.744 536 HG21 ILE 69 HG21 ILE 69 12.829 -4.982 3.758 537 HG22 ILE 69 HG22 ILE 69 12.770 -3.581 2.686 538 HG23 ILE 69 HG23 ILE 69 14.252 -4.527 2.817 539 HD11 ILE 69 HD11 ILE 69 10.530 -4.437 0.205 540 HD12 ILE 69 HD12 ILE 69 10.656 -3.698 1.798 541 HD13 ILE 69 HD13 ILE 69 9.327 -4.810 1.447 542 H SER 70 HN SER 70 15.115 -6.203 0.213 543 HA SER 70 HA SER 70 17.152 -4.657 1.133 544 HB2 SER 70 HB2 SER 70 17.500 -6.971 0.548 545 HB3 SER 70 HB1 SER 70 17.171 -6.650 -1.151 546 HG SER 70 HG SER 70 19.432 -6.006 0.393 547 H GLU 71 HN GLU 71 15.651 -4.482 -2.042 548 HA GLU 71 HA GLU 71 17.554 -2.574 -3.084 549 HB2 GLU 71 HB2 GLU 71 14.932 -3.379 -4.306 550 HB3 GLU 71 HB1 GLU 71 16.399 -2.844 -5.121 551 HG2 GLU 71 HG2 GLU 71 16.607 -5.288 -3.500 552 HG3 GLU 71 HG1 GLU 71 15.643 -5.396 -4.965 553 H TYR 72 HN TYR 72 14.400 -2.666 -1.711 554 HA TYR 72 HA TYR 72 13.613 -0.070 -2.597 555 HB2 TYR 72 HB2 TYR 72 12.474 -2.098 -0.689 556 HB3 TYR 72 HB1 TYR 72 11.760 -0.502 -0.859 557 HD1 TYR 72 HD1 TYR 72 13.233 -1.940 -3.828 558 HD2 TYR 72 HD2 TYR 72 9.670 -1.651 -1.543 559 HE1 TYR 72 HE1 TYR 72 11.940 -2.740 -5.743 560 HE2 TYR 72 HE2 TYR 72 8.365 -2.466 -3.459 561 HH TYR 72 HH TYR 72 9.938 -3.702 -6.326 562 H VAL 73 HN VAL 73 14.931 -1.508 0.306 563 HA VAL 73 HA VAL 73 15.012 0.898 1.811 564 HB VAL 73 HB VAL 73 16.222 -0.146 3.451 565 HG11 VAL 73 HG11 VAL 73 14.858 -2.407 2.050 566 HG12 VAL 73 HG12 VAL 73 14.183 -1.337 3.274 567 HG13 VAL 73 HG13 VAL 73 15.463 -2.467 3.704 568 HG21 VAL 73 HG21 VAL 73 17.936 -1.667 3.281 569 HG22 VAL 73 HG22 VAL 73 18.096 -0.741 1.780 570 HG23 VAL 73 HG23 VAL 73 17.332 -2.332 1.757 571 H LYS 74 HN LYS 74 17.037 -0.720 -0.492 572 HA LYS 74 HA LYS 74 19.341 0.912 -0.322 573 HB2 LYS 74 HB2 LYS 74 18.510 -1.304 -1.779 574 HB3 LYS 74 HB1 LYS 74 18.676 -0.037 -2.986 575 HG2 LYS 74 HG2 LYS 74 20.779 -0.865 -3.064 576 HG3 LYS 74 HG1 LYS 74 20.999 0.316 -1.774 577 HD2 LYS 74 HD2 LYS 74 20.309 -2.578 -1.300 578 HD3 LYS 74 HD1 LYS 74 21.959 -1.955 -1.313 579 HE2 LYS 74 HE2 LYS 74 19.779 -0.951 0.504 580 HE3 LYS 74 HE1 LYS 74 20.952 -2.187 0.959 581 HZ1 LYS 74 HZ1 LYS 74 22.722 -0.617 0.659 582 HZ2 LYS 74 HZ2 LYS 74 21.577 0.052 1.706 583 HZ3 LYS 74 HZ3 LYS 74 21.656 0.566 0.097 584 H ALA 75 HN ALA 75 16.272 1.131 -1.938 585 HA ALA 75 HA ALA 75 16.800 3.303 -3.657 586 HB1 ALA 75 HB1 ALA 75 14.232 2.459 -2.323 587 HB2 ALA 75 HB2 ALA 75 14.828 1.917 -3.891 588 HB3 ALA 75 HB3 ALA 75 14.354 3.600 -3.664 589 H CYS 76 HN CYS 76 15.496 3.160 -0.374 590 HA CYS 76 HA CYS 76 15.711 6.059 -0.116 591 HB2 CYS 76 HB2 CYS 76 13.708 5.125 0.728 592 HB3 CYS 76 HB1 CYS 76 14.560 3.901 1.651 593 HG CYS 76 HG CYS 76 15.768 6.109 3.229 594 H ASP 77 HN ASP 77 17.887 3.734 -0.007 595 HA ASP 77 HA ASP 77 19.249 4.091 2.414 596 HB2 ASP 77 HB2 ASP 77 19.852 2.252 1.048 597 HB3 ASP 77 HB1 ASP 77 20.193 3.268 -0.345 598 H GLY 78 HN GLY 78 18.867 6.141 -0.296 599 HA2 GLY 78 HA3 GLY 78 20.938 7.966 0.697 600 HA3 GLY 78 HA2 GLY 78 20.106 8.099 -0.845 601 H ILE 79 HN ILE 79 17.646 7.397 1.142 602 HA ILE 79 HA ILE 79 16.958 10.203 1.381 603 HB ILE 79 HB ILE 79 15.299 7.725 1.685 604 HG12 ILE 79 HG12 ILE 79 15.224 9.903 -0.409 605 HG13 ILE 79 HG11 ILE 79 16.047 8.361 -0.614 606 HG21 ILE 79 HG21 ILE 79 13.362 9.139 1.909 607 HG22 ILE 79 HG22 ILE 79 14.360 10.586 1.770 608 HG23 ILE 79 HG23 ILE 79 14.522 9.535 3.178 609 HD11 ILE 79 HD11 ILE 79 13.792 8.527 -1.658 610 HD12 ILE 79 HD12 ILE 79 13.117 8.605 -0.031 611 HD13 ILE 79 HD13 ILE 79 14.007 7.171 -0.551 612 H GLY 80 HN GLY 80 17.455 11.193 3.169 613 HA2 GLY 80 HA3 GLY 80 16.193 10.705 5.576 614 HA3 GLY 80 HA2 GLY 80 17.786 9.982 5.706 615 H GLY 81 HN GLY 81 16.334 12.936 4.436 616 HA2 GLY 81 HA3 GLY 81 16.914 15.154 4.965 617 HA3 GLY 81 HA2 GLY 81 18.333 14.551 5.813 618 H ALA 82 HN ALA 82 18.603 16.661 4.120 619 HA ALA 82 HA ALA 82 19.844 17.466 2.407 620 HB1 ALA 82 HB1 ALA 82 21.554 16.337 3.724 621 HB2 ALA 82 HB2 ALA 82 21.946 16.346 2.004 622 HB3 ALA 82 HB3 ALA 82 21.326 14.879 2.760 623 H MET 83 HN MET 83 20.463 14.177 1.311 624 HA MET 83 HA MET 83 19.868 14.790 -1.371 625 HB2 MET 83 HB2 MET 83 20.125 12.126 0.034 626 HB3 MET 83 HB1 MET 83 19.953 12.298 -1.707 627 HG2 MET 83 HG2 MET 83 22.017 13.670 -1.721 628 HG3 MET 83 HG1 MET 83 22.206 13.328 -0.003 629 HE1 MET 83 HE1 MET 83 22.864 10.995 0.993 630 HE2 MET 83 HE2 MET 83 22.893 9.502 0.057 631 HE3 MET 83 HE3 MET 83 21.367 10.344 0.326 632 H HIS 84 HN HIS 84 17.959 13.346 1.201 633 HA HIS 84 HA HIS 84 15.667 12.583 -0.218 634 HB2 HIS 84 HB2 HIS 84 15.741 11.996 2.075 635 HB3 HIS 84 HB1 HIS 84 16.142 13.628 2.578 636 HD1 HIS 84 HD1 HIS 84 14.265 13.918 4.238 637 HD2 HIS 84 HD2 HIS 84 12.898 12.830 0.470 638 HE1 HIS 84 HE1 HIS 84 11.776 14.174 4.326 639 HE2 HIS 84 HE2 HIS 84 10.958 13.326 2.111 640 H LYS 85 HN LYS 85 16.798 15.780 0.731 641 HA LYS 85 HA LYS 85 14.284 17.053 0.113 642 HB2 LYS 85 HB2 LYS 85 16.992 18.295 0.631 643 HB3 LYS 85 HB1 LYS 85 15.443 19.129 0.637 644 HG2 LYS 85 HG2 LYS 85 16.204 16.919 2.534 645 HG3 LYS 85 HG1 LYS 85 16.294 18.642 2.900 646 HD2 LYS 85 HD2 LYS 85 13.935 18.886 2.730 647 HD3 LYS 85 HD1 LYS 85 13.754 17.272 2.039 648 HE2 LYS 85 HE2 LYS 85 14.370 16.236 4.103 649 HE3 LYS 85 HE1 LYS 85 14.820 17.793 4.806 650 HZ1 LYS 85 HZ1 LYS 85 12.521 18.481 4.730 651 HZ2 LYS 85 HZ2 LYS 85 12.645 17.025 5.574 652 HZ3 LYS 85 HZ3 LYS 85 12.064 17.036 3.985 653 H ALA 86 HN ALA 86 17.348 16.481 -1.472 654 HA ALA 86 HA ALA 86 16.896 18.115 -3.756 655 HB1 ALA 86 HB1 ALA 86 18.510 15.572 -3.715 656 HB2 ALA 86 HB2 ALA 86 19.097 17.080 -3.002 657 HB3 ALA 86 HB3 ALA 86 18.743 17.001 -4.728 658 H MET 87 HN MET 87 16.535 14.683 -3.124 659 HA MET 87 HA MET 87 15.420 14.078 -5.684 660 HB2 MET 87 HB2 MET 87 15.402 12.360 -3.197 661 HB3 MET 87 HB1 MET 87 15.302 11.822 -4.873 662 HG2 MET 87 HG2 MET 87 17.620 12.980 -5.088 663 HG3 MET 87 HG1 MET 87 17.646 12.824 -3.338 664 HE1 MET 87 HE1 MET 87 19.799 11.498 -5.351 665 HE2 MET 87 HE2 MET 87 20.023 9.934 -4.567 666 HE3 MET 87 HE3 MET 87 19.904 11.401 -3.595 667 H LEU 88 HN LEU 88 14.177 15.326 -2.834 668 HA LEU 88 HA LEU 88 11.650 14.294 -2.583 669 HB2 LEU 88 HB2 LEU 88 12.950 16.297 -1.412 670 HB3 LEU 88 HB1 LEU 88 11.941 17.248 -2.483 671 HG LEU 88 HG LEU 88 10.194 17.052 -1.108 672 HD11 LEU 88 HD11 LEU 88 10.724 14.088 -0.889 673 HD12 LEU 88 HD12 LEU 88 9.693 14.852 -2.100 674 HD13 LEU 88 HD13 LEU 88 9.256 14.929 -0.395 675 HD21 LEU 88 HD21 LEU 88 11.908 17.300 0.570 676 HD22 LEU 88 HD22 LEU 88 12.166 15.557 0.597 677 HD23 LEU 88 HD23 LEU 88 10.639 16.232 1.171 678 H MET 89 HN MET 89 12.571 17.064 -4.644 679 HA MET 89 HA MET 89 9.966 17.201 -5.824 680 HB2 MET 89 HB2 MET 89 11.384 19.195 -5.528 681 HB3 MET 89 HB1 MET 89 12.553 18.528 -6.658 682 HG2 MET 89 HG2 MET 89 10.848 18.602 -8.428 683 HG3 MET 89 HG1 MET 89 9.722 19.333 -7.286 684 HE1 MET 89 HE1 MET 89 10.471 20.591 -10.125 685 HE2 MET 89 HE2 MET 89 10.640 22.292 -9.695 686 HE3 MET 89 HE3 MET 89 9.330 21.334 -9.004 687 H ALA 90 HN ALA 90 12.705 15.284 -6.391 688 HA ALA 90 HA ALA 90 12.216 15.057 -9.259 689 HB1 ALA 90 HB1 ALA 90 14.521 15.359 -8.371 690 HB2 ALA 90 HB2 ALA 90 14.331 13.902 -9.348 691 HB3 ALA 90 HB3 ALA 90 14.380 13.782 -7.586 692 H GLN 91 HN GLN 91 11.685 13.304 -6.348 693 HA GLN 91 HA GLN 91 10.970 10.933 -7.922 694 HB2 GLN 91 HB2 GLN 91 11.740 11.081 -5.009 695 HB3 GLN 91 HB1 GLN 91 11.417 9.618 -5.932 696 HG2 GLN 91 HG2 GLN 91 13.313 10.086 -7.358 697 HG3 GLN 91 HG1 GLN 91 13.634 11.551 -6.450 698 HE21 GLN 91 HE21 GLN 91 13.022 10.505 -3.910 699 HE22 GLN 91 HE22 GLN 91 14.253 9.394 -3.494 700 H LEU 92 HN LEU 92 10.054 12.689 -4.941 701 HA LEU 92 HA LEU 92 7.620 11.560 -4.363 702 HB2 LEU 92 HB2 LEU 92 8.982 13.594 -3.340 703 HB3 LEU 92 HB1 LEU 92 7.869 14.539 -4.297 704 HG LEU 92 HG LEU 92 7.395 12.974 -1.818 705 HD11 LEU 92 HD11 LEU 92 7.655 15.364 -1.728 706 HD12 LEU 92 HD12 LEU 92 5.999 14.923 -1.311 707 HD13 LEU 92 HD13 LEU 92 6.365 15.577 -2.909 708 HD21 LEU 92 HD21 LEU 92 4.947 13.000 -2.234 709 HD22 LEU 92 HD22 LEU 92 5.822 11.868 -3.266 710 HD23 LEU 92 HD23 LEU 92 5.273 13.413 -3.917 711 H GLU 93 HN GLU 93 8.586 13.708 -6.864 712 HA GLU 93 HA GLU 93 6.551 15.061 -7.847 713 HB2 GLU 93 HB2 GLU 93 7.454 14.769 -10.097 714 HB3 GLU 93 HB1 GLU 93 8.758 14.950 -8.924 715 HG2 GLU 93 HG2 GLU 93 9.387 12.719 -9.093 716 HG3 GLU 93 HG1 GLU 93 7.845 12.238 -9.799 717 H2 PRO 1 HT1 PRO 1 5.236 -4.396 -13.747 718 H3 PRO 1 HT2 PRO 1 5.739 -2.957 -14.342 719 HA PRO 1 HA PRO 1 6.400 -2.752 -12.293 720 HB2 PRO 1 HB2 PRO 1 4.336 -1.559 -11.082 721 HB3 PRO 1 HB1 PRO 1 5.136 -0.812 -12.470 722 HG2 PRO 1 HG2 PRO 1 2.500 -2.094 -12.301 723 HG3 PRO 1 HG1 PRO 1 3.118 -0.952 -13.507 724 HD2 PRO 1 HD2 PRO 1 2.936 -3.844 -13.660 725 HD3 PRO 1 HD1 PRO 1 3.404 -2.698 -14.932 726 H SER 2 HN SER 2 4.716 -2.635 -9.909 727 HA SER 2 HA SER 2 4.286 -5.344 -9.208 728 HB2 SER 2 HB2 SER 2 3.100 -2.828 -8.039 729 HB3 SER 2 HB1 SER 2 2.970 -4.419 -7.325 730 HG SER 2 HG SER 2 5.360 -4.423 -7.445 731 H PHE 3 HN PHE 3 2.086 -6.191 -8.666 732 HA PHE 3 HA PHE 3 0.284 -5.825 -10.824 733 HB2 PHE 3 HB2 PHE 3 -1.203 -6.909 -8.778 734 HB3 PHE 3 HB1 PHE 3 -0.291 -7.831 -9.970 735 HD1 PHE 3 HD1 PHE 3 -0.650 -6.836 -6.536 736 HD2 PHE 3 HD2 PHE 3 1.966 -8.714 -9.325 737 HE1 PHE 3 HE1 PHE 3 0.605 -7.843 -4.701 738 HE2 PHE 3 HE2 PHE 3 3.243 -9.703 -7.474 739 HZ PHE 3 HZ PHE 3 2.563 -9.268 -5.149 740 H ASN 4 HN ASN 4 0.281 -4.869 -7.448 741 HA ASN 4 HA ASN 4 -2.389 -3.807 -7.674 742 HB2 ASN 4 HB2 ASN 4 -2.174 -3.540 -5.258 743 HB3 ASN 4 HB1 ASN 4 -1.704 -5.162 -5.760 744 HD21 ASN 4 HD21 ASN 4 -0.523 -2.037 -4.724 745 HD22 ASN 4 HD22 ASN 4 1.072 -2.564 -4.301 746 H THR 5 HN THR 5 0.583 -2.452 -8.267 747 HA THR 5 HA THR 5 0.499 -0.143 -6.653 748 HB THR 5 HB THR 5 2.566 -0.921 -7.627 749 HG1 THR 5 HG1 THR 5 2.217 1.398 -7.216 750 HG21 THR 5 HG21 THR 5 1.872 -1.825 -9.626 751 HG22 THR 5 HG22 THR 5 2.852 -0.428 -10.101 752 HG23 THR 5 HG23 THR 5 1.086 -0.328 -10.122 753 H VAL 6 HN VAL 6 -1.517 -1.017 -9.165 754 HA VAL 6 HA VAL 6 -2.059 1.561 -10.247 755 HB VAL 6 HB VAL 6 -3.887 0.588 -11.346 756 HG11 VAL 6 HG11 VAL 6 -1.943 -1.667 -10.918 757 HG12 VAL 6 HG12 VAL 6 -1.787 -0.367 -12.101 758 HG13 VAL 6 HG13 VAL 6 -3.099 -1.538 -12.245 759 HG21 VAL 6 HG21 VAL 6 -5.102 -1.367 -10.669 760 HG22 VAL 6 HG22 VAL 6 -4.975 -0.282 -9.275 761 HG23 VAL 6 HG23 VAL 6 -3.930 -1.702 -9.389 762 H ARG 7 HN ARG 7 -3.479 3.143 -9.431 763 HA ARG 7 HA ARG 7 -5.275 2.338 -7.357 764 HB2 ARG 7 HB2 ARG 7 -4.330 4.063 -5.747 765 HB3 ARG 7 HB1 ARG 7 -3.623 2.485 -5.911 766 HG2 ARG 7 HG2 ARG 7 -2.220 4.129 -7.671 767 HG3 ARG 7 HG1 ARG 7 -2.390 5.004 -6.144 768 HD2 ARG 7 HD2 ARG 7 -1.682 2.877 -4.998 769 HD3 ARG 7 HD1 ARG 7 -1.206 2.258 -6.577 770 HE ARG 7 HE ARG 7 0.308 3.889 -4.904 771 HH11 ARG 7 HH11 ARG 7 -0.586 3.895 -8.304 772 HH12 ARG 7 HH12 ARG 7 0.839 4.754 -8.790 773 HH21 ARG 7 HH21 ARG 7 2.148 5.000 -5.553 774 HH22 ARG 7 HH22 ARG 7 2.401 5.363 -7.230 775 H GLN 8 HN GLN 8 -6.563 3.883 -6.462 776 HA GLN 8 HA GLN 8 -8.152 5.289 -8.093 777 HB2 GLN 8 HB2 GLN 8 -7.796 4.927 -5.306 778 HB3 GLN 8 HB1 GLN 8 -8.102 6.639 -5.561 779 HG2 GLN 8 HG2 GLN 8 -10.151 6.133 -6.723 780 HG3 GLN 8 HG1 GLN 8 -9.832 4.406 -6.593 781 HE21 GLN 8 HE21 GLN 8 -12.097 5.904 -5.663 782 HE22 GLN 8 HE22 GLN 8 -12.162 5.684 -3.939 783 H GLY 9 HN GLY 9 -7.799 6.901 -9.430 784 HA2 GLY 9 HA3 GLY 9 -6.014 9.096 -8.743 785 HA3 GLY 9 HA2 GLY 9 -6.925 8.909 -10.236 786 H SER 10 HN SER 10 -7.487 11.199 -9.924 787 HA SER 10 HA SER 10 -8.758 12.329 -7.772 788 HB2 SER 10 HB2 SER 10 -9.399 12.856 -10.683 789 HB3 SER 10 HB1 SER 10 -9.692 13.955 -9.336 790 HG SER 10 HG SER 10 -7.248 13.551 -9.025 791 H LYS 11 HN LYS 11 -10.303 11.402 -6.651 792 HA LYS 11 HA LYS 11 -12.006 10.013 -6.083 793 HB2 LYS 11 HB2 LYS 11 -14.178 10.911 -6.575 794 HB3 LYS 11 HB1 LYS 11 -13.088 12.232 -6.240 795 HG2 LYS 11 HG2 LYS 11 -13.123 12.970 -8.395 796 HG3 LYS 11 HG1 LYS 11 -13.554 11.405 -9.066 797 HD2 LYS 11 HD2 LYS 11 -15.806 11.655 -8.077 798 HD3 LYS 11 HD1 LYS 11 -15.355 13.259 -7.508 799 HE2 LYS 11 HE2 LYS 11 -14.977 13.977 -9.811 800 HE3 LYS 11 HE1 LYS 11 -15.402 12.366 -10.387 801 HZ1 LYS 11 HZ1 LYS 11 -17.203 14.253 -8.970 802 HZ2 LYS 11 HZ2 LYS 11 -17.620 12.684 -9.438 803 HZ3 LYS 11 HZ3 LYS 11 -17.266 13.845 -10.609 804 H GLU 12 HN GLU 12 -10.591 8.678 -8.023 805 HA GLU 12 HA GLU 12 -12.130 7.705 -10.167 806 HB2 GLU 12 HB2 GLU 12 -9.712 7.382 -9.999 807 HB3 GLU 12 HB1 GLU 12 -9.914 6.391 -8.571 808 HG2 GLU 12 HG2 GLU 12 -11.047 4.688 -9.895 809 HG3 GLU 12 HG1 GLU 12 -10.884 5.701 -11.330 810 HA PRO 13 HA PRO 13 -15.357 5.375 -8.170 811 HB2 PRO 13 HB2 PRO 13 -14.790 3.363 -10.272 812 HB3 PRO 13 HB1 PRO 13 -16.325 4.110 -9.832 813 HG2 PRO 13 HG2 PRO 13 -15.007 4.805 -12.058 814 HG3 PRO 13 HG1 PRO 13 -15.927 5.976 -11.106 815 HD2 PRO 13 HD2 PRO 13 -12.994 5.617 -11.337 816 HD3 PRO 13 HD1 PRO 13 -13.929 7.083 -11.010 817 H TYR 14 HN TYR 14 -15.081 4.135 -6.420 818 HA TYR 14 HA TYR 14 -12.488 3.117 -6.005 819 HB2 TYR 14 HB2 TYR 14 -13.719 4.219 -4.209 820 HB3 TYR 14 HB1 TYR 14 -14.879 2.895 -4.188 821 HD1 TYR 14 HD1 TYR 14 -13.903 0.553 -3.855 822 HD2 TYR 14 HD2 TYR 14 -11.850 4.104 -2.810 823 HE1 TYR 14 HE1 TYR 14 -12.491 -0.747 -2.352 824 HE2 TYR 14 HE2 TYR 14 -10.414 2.826 -1.284 825 HH TYR 14 HH TYR 14 -10.070 0.826 -0.342 826 HA PRO 15 HA PRO 15 -14.636 -1.260 -5.618 827 HB2 PRO 15 HB2 PRO 15 -16.790 -0.942 -7.610 828 HB3 PRO 15 HB1 PRO 15 -16.802 -1.801 -6.072 829 HG2 PRO 15 HG2 PRO 15 -18.074 0.529 -6.407 830 HG3 PRO 15 HG1 PRO 15 -17.347 0.068 -4.873 831 HD2 PRO 15 HD2 PRO 15 -16.416 2.037 -6.892 832 HD3 PRO 15 HD1 PRO 15 -16.208 2.028 -5.136 833 H ASP 16 HN ASP 16 -14.337 0.817 -8.234 834 HA ASP 16 HA ASP 16 -13.611 -1.220 -10.163 835 HB2 ASP 16 HB2 ASP 16 -14.285 1.662 -10.302 836 HB3 ASP 16 HB1 ASP 16 -13.128 1.080 -11.492 837 H PHE 17 HN PHE 17 -12.164 1.514 -8.446 838 HA PHE 17 HA PHE 17 -9.583 1.381 -9.477 839 HB2 PHE 17 HB2 PHE 17 -9.446 3.123 -8.023 840 HB3 PHE 17 HB1 PHE 17 -10.883 2.581 -7.169 841 HD1 PHE 17 HD1 PHE 17 -10.732 1.600 -5.054 842 HD2 PHE 17 HD2 PHE 17 -7.209 2.129 -7.374 843 HE1 PHE 17 HE1 PHE 17 -9.367 0.969 -3.116 844 HE2 PHE 17 HE2 PHE 17 -5.832 1.509 -5.433 845 HZ PHE 17 HZ PHE 17 -6.911 0.928 -3.301 846 H VAL 18 HN VAL 18 -11.124 -0.397 -6.873 847 HA VAL 18 HA VAL 18 -8.768 -1.919 -6.319 848 HB VAL 18 HB VAL 18 -10.058 -1.560 -4.408 849 HG11 VAL 18 HG11 VAL 18 -12.438 -2.153 -4.237 850 HG12 VAL 18 HG12 VAL 18 -12.436 -2.583 -5.958 851 HG13 VAL 18 HG13 VAL 18 -12.150 -0.913 -5.468 852 HG21 VAL 18 HG21 VAL 18 -9.248 -3.786 -4.417 853 HG22 VAL 18 HG22 VAL 18 -10.557 -4.317 -5.481 854 HG23 VAL 18 HG23 VAL 18 -10.908 -3.838 -3.815 855 H ALA 19 HN ALA 19 -11.778 -2.488 -8.110 856 HA ALA 19 HA ALA 19 -11.495 -5.242 -8.485 857 HB1 ALA 19 HB1 ALA 19 -12.915 -5.021 -10.431 858 HB2 ALA 19 HB2 ALA 19 -12.595 -3.288 -10.513 859 HB3 ALA 19 HB3 ALA 19 -13.499 -3.954 -9.153 860 H ARG 20 HN ARG 20 -9.785 -2.600 -10.105 861 HA ARG 20 HA ARG 20 -8.569 -4.483 -11.950 862 HB2 ARG 20 HB2 ARG 20 -7.212 -2.581 -12.735 863 HB3 ARG 20 HB1 ARG 20 -8.932 -2.236 -12.809 864 HG2 ARG 20 HG2 ARG 20 -8.828 -0.699 -11.083 865 HG3 ARG 20 HG1 ARG 20 -7.319 -1.362 -10.450 866 HD2 ARG 20 HD2 ARG 20 -6.058 -0.438 -12.217 867 HD3 ARG 20 HD1 ARG 20 -7.497 -0.063 -13.150 868 HE ARG 20 HE ARG 20 -7.888 1.456 -11.009 869 HH11 ARG 20 HH11 ARG 20 -5.004 0.972 -12.932 870 HH12 ARG 20 HH12 ARG 20 -4.404 2.577 -12.660 871 HH21 ARG 20 HH21 ARG 20 -7.122 3.573 -10.673 872 HH22 ARG 20 HH22 ARG 20 -5.597 4.050 -11.366 873 H LEU 21 HN LEU 21 -7.978 -2.831 -8.979 874 HA LEU 21 HA LEU 21 -5.350 -3.412 -8.444 875 HB2 LEU 21 HB2 LEU 21 -7.185 -2.181 -7.080 876 HB3 LEU 21 HB1 LEU 21 -7.541 -3.753 -6.417 877 HG LEU 21 HG LEU 21 -5.511 -3.859 -5.254 878 HD11 LEU 21 HD11 LEU 21 -3.992 -3.114 -6.968 879 HD12 LEU 21 HD12 LEU 21 -3.742 -2.155 -5.509 880 HD13 LEU 21 HD13 LEU 21 -4.640 -1.477 -6.870 881 HD21 LEU 21 HD21 LEU 21 -5.510 -1.758 -3.969 882 HD22 LEU 21 HD22 LEU 21 -7.125 -2.421 -4.219 883 HD23 LEU 21 HD23 LEU 21 -6.573 -1.051 -5.185 884 H GLN 22 HN GLN 22 -8.223 -5.378 -7.837 885 HA GLN 22 HA GLN 22 -6.897 -7.713 -7.019 886 HB2 GLN 22 HB2 GLN 22 -9.563 -7.736 -8.366 887 HB3 GLN 22 HB1 GLN 22 -8.961 -8.738 -7.039 888 HG2 GLN 22 HG2 GLN 22 -9.067 -6.759 -5.608 889 HG3 GLN 22 HG1 GLN 22 -9.747 -5.849 -6.943 890 HE21 GLN 22 HE21 GLN 22 -10.870 -6.300 -4.447 891 HE22 GLN 22 HE22 GLN 22 -12.346 -7.172 -4.645 892 H ASP 23 HN ASP 23 -8.360 -6.717 -10.035 893 HA ASP 23 HA ASP 23 -8.128 -8.984 -11.544 894 HB2 ASP 23 HB2 ASP 23 -9.043 -6.737 -12.249 895 HB3 ASP 23 HB1 ASP 23 -7.370 -6.273 -12.562 896 H VAL 24 HN VAL 24 -5.606 -6.513 -11.155 897 HA VAL 24 HA VAL 24 -3.849 -8.066 -12.828 898 HB VAL 24 HB VAL 24 -3.798 -5.646 -13.069 899 HG11 VAL 24 HG11 VAL 24 -2.959 -4.212 -11.272 900 HG12 VAL 24 HG12 VAL 24 -2.920 -5.611 -10.198 901 HG13 VAL 24 HG13 VAL 24 -4.459 -5.029 -10.834 902 HG21 VAL 24 HG21 VAL 24 -1.725 -6.745 -13.581 903 HG22 VAL 24 HG22 VAL 24 -1.267 -6.773 -11.882 904 HG23 VAL 24 HG23 VAL 24 -1.349 -5.235 -12.745 905 H ALA 25 HN ALA 25 -4.517 -7.607 -9.486 906 HA ALA 25 HA ALA 25 -2.056 -8.704 -8.492 907 HB1 ALA 25 HB1 ALA 25 -3.497 -7.342 -7.034 908 HB2 ALA 25 HB2 ALA 25 -3.270 -8.959 -6.369 909 HB3 ALA 25 HB3 ALA 25 -4.779 -8.544 -7.180 910 H GLN 26 HN GLN 26 -4.881 -9.766 -9.965 911 HA GLN 26 HA GLN 26 -4.654 -12.511 -9.113 912 HB2 GLN 26 HB2 GLN 26 -6.836 -12.288 -9.498 913 HB3 GLN 26 HB1 GLN 26 -6.566 -10.769 -10.334 914 HG2 GLN 26 HG2 GLN 26 -7.527 -11.944 -11.988 915 HG3 GLN 26 HG1 GLN 26 -5.848 -12.369 -12.291 916 HE21 GLN 26 HE21 GLN 26 -5.732 -14.076 -9.921 917 HE22 GLN 26 HE22 GLN 26 -6.562 -15.519 -10.339 918 H LYS 27 HN LYS 27 -4.041 -10.518 -11.910 919 HA LYS 27 HA LYS 27 -3.269 -12.539 -13.720 920 HB2 LYS 27 HB2 LYS 27 -2.317 -9.670 -13.626 921 HB3 LYS 27 HB1 LYS 27 -2.309 -10.735 -15.034 922 HG2 LYS 27 HG2 LYS 27 -4.739 -9.703 -13.590 923 HG3 LYS 27 HG1 LYS 27 -4.139 -9.156 -15.157 924 HD2 LYS 27 HD2 LYS 27 -4.812 -11.093 -16.227 925 HD3 LYS 27 HD1 LYS 27 -4.808 -12.039 -14.738 926 HE2 LYS 27 HE2 LYS 27 -6.808 -11.106 -13.996 927 HE3 LYS 27 HE1 LYS 27 -6.699 -9.756 -15.121 928 HZ1 LYS 27 HZ1 LYS 27 -7.102 -11.302 -16.943 929 HZ2 LYS 27 HZ2 LYS 27 -8.369 -11.350 -15.823 930 HZ3 LYS 27 HZ3 LYS 27 -7.218 -12.588 -15.851 931 H SER 28 HN SER 28 -1.509 -10.830 -11.215 932 HA SER 28 HA SER 28 1.008 -11.902 -12.260 933 HB2 SER 28 HB2 SER 28 0.496 -9.708 -10.257 934 HB3 SER 28 HB1 SER 28 2.082 -10.185 -10.869 935 HG SER 28 HG SER 28 -0.027 -8.853 -12.176 936 H ILE 29 HN ILE 29 -1.323 -12.436 -9.934 937 HA ILE 29 HA ILE 29 0.608 -13.825 -8.196 938 HB ILE 29 HB ILE 29 -2.048 -12.603 -7.481 939 HG12 ILE 29 HG12 ILE 29 0.718 -11.917 -6.487 940 HG13 ILE 29 HG11 ILE 29 -0.203 -10.988 -7.677 941 HG21 ILE 29 HG21 ILE 29 -1.550 -13.250 -5.170 942 HG22 ILE 29 HG22 ILE 29 -0.191 -14.215 -5.765 943 HG23 ILE 29 HG23 ILE 29 -1.843 -14.616 -6.245 944 HD11 ILE 29 HD11 ILE 29 -1.182 -11.575 -4.901 945 HD12 ILE 29 HD12 ILE 29 -1.879 -10.463 -6.092 946 HD13 ILE 29 HD13 ILE 29 -0.314 -10.102 -5.355 947 H ALA 30 HN ALA 30 0.378 -15.988 -8.052 948 HA ALA 30 HA ALA 30 -1.984 -17.242 -9.237 949 HB1 ALA 30 HB1 ALA 30 -0.700 -19.305 -9.151 950 HB2 ALA 30 HB2 ALA 30 0.578 -18.491 -8.250 951 HB3 ALA 30 HB3 ALA 30 0.243 -18.027 -9.917 952 H ASP 31 HN ASP 31 -1.148 -16.078 -6.346 953 HA ASP 31 HA ASP 31 -2.333 -18.235 -4.717 954 HB2 ASP 31 HB2 ASP 31 -0.012 -17.256 -4.246 955 HB3 ASP 31 HB1 ASP 31 -0.873 -15.812 -3.746 956 H GLU 32 HN GLU 32 -4.399 -17.973 -4.336 957 HA GLU 32 HA GLU 32 -5.870 -15.627 -4.678 958 HB2 GLU 32 HB2 GLU 32 -7.657 -16.762 -3.522 959 HB3 GLU 32 HB1 GLU 32 -6.810 -17.944 -4.508 960 HG2 GLU 32 HG2 GLU 32 -6.744 -19.195 -2.674 961 HG3 GLU 32 HG1 GLU 32 -5.488 -18.099 -2.104 962 H LYS 33 HN LYS 33 -3.945 -16.737 -1.969 963 HA LYS 33 HA LYS 33 -5.313 -15.128 -0.028 964 HB2 LYS 33 HB2 LYS 33 -2.597 -16.450 0.127 965 HB3 LYS 33 HB1 LYS 33 -3.418 -15.681 1.473 966 HG2 LYS 33 HG2 LYS 33 -4.172 -17.729 1.942 967 HG3 LYS 33 HG1 LYS 33 -5.298 -17.463 0.609 968 HD2 LYS 33 HD2 LYS 33 -4.189 -19.621 0.399 969 HD3 LYS 33 HD1 LYS 33 -3.749 -18.547 -0.928 970 HE2 LYS 33 HE2 LYS 33 -1.835 -19.816 -0.034 971 HE3 LYS 33 HE1 LYS 33 -1.623 -18.075 0.088 972 HZ1 LYS 33 HZ1 LYS 33 -2.382 -18.279 2.436 973 HZ2 LYS 33 HZ2 LYS 33 -0.903 -19.036 2.110 974 HZ3 LYS 33 HZ3 LYS 33 -2.314 -19.963 2.267 975 H ALA 34 HN ALA 34 -2.121 -15.006 -1.554 976 HA ALA 34 HA ALA 34 -1.454 -12.426 -0.694 977 HB1 ALA 34 HB1 ALA 34 0.187 -13.975 -1.623 978 HB2 ALA 34 HB2 ALA 34 0.207 -12.443 -2.497 979 HB3 ALA 34 HB3 ALA 34 -0.578 -13.853 -3.207 980 H ARG 35 HN ARG 35 -3.511 -13.533 -3.295 981 HA ARG 35 HA ARG 35 -3.620 -11.110 -4.791 982 HB2 ARG 35 HB2 ARG 35 -4.499 -13.563 -5.325 983 HB3 ARG 35 HB1 ARG 35 -5.980 -12.943 -4.614 984 HG2 ARG 35 HG2 ARG 35 -4.642 -11.393 -6.796 985 HG3 ARG 35 HG1 ARG 35 -5.585 -12.825 -7.195 986 HD2 ARG 35 HD2 ARG 35 -6.548 -10.333 -5.794 987 HD3 ARG 35 HD1 ARG 35 -6.964 -10.886 -7.423 988 HE ARG 35 HE ARG 35 -7.678 -12.604 -5.157 989 HH11 ARG 35 HH11 ARG 35 -8.666 -10.465 -7.743 990 HH12 ARG 35 HH12 ARG 35 -10.353 -10.821 -7.567 991 HH21 ARG 35 HH21 ARG 35 -9.906 -13.086 -4.937 992 HH22 ARG 35 HH22 ARG 35 -11.054 -12.307 -5.983 993 H LYS 36 HN LYS 36 -5.892 -12.566 -2.479 994 HA LYS 36 HA LYS 36 -7.623 -10.389 -2.206 995 HB2 LYS 36 HB2 LYS 36 -6.817 -12.313 -0.037 996 HB3 LYS 36 HB1 LYS 36 -8.278 -11.333 -0.078 997 HG2 LYS 36 HG2 LYS 36 -9.337 -12.736 -1.436 998 HG3 LYS 36 HG1 LYS 36 -7.872 -13.078 -2.382 999 HD2 LYS 36 HD2 LYS 36 -8.542 -15.062 -1.175 1000 HD3 LYS 36 HD1 LYS 36 -7.020 -14.420 -0.527 1001 HE2 LYS 36 HE2 LYS 36 -8.558 -13.149 1.131 1002 HE3 LYS 36 HE1 LYS 36 -9.772 -14.335 0.642 1003 HZ1 LYS 36 HZ1 LYS 36 -7.125 -14.982 1.807 1004 HZ2 LYS 36 HZ2 LYS 36 -8.267 -16.114 1.293 1005 HZ3 LYS 36 HZ3 LYS 36 -8.612 -15.100 2.599 1006 H VAL 37 HN VAL 37 -4.901 -11.344 -0.149 1007 HA VAL 37 HA VAL 37 -5.317 -9.391 1.767 1008 HB VAL 37 HB VAL 37 -3.079 -9.751 2.594 1009 HG11 VAL 37 HG11 VAL 37 -3.063 -12.260 2.703 1010 HG12 VAL 37 HG12 VAL 37 -4.416 -12.242 1.566 1011 HG13 VAL 37 HG13 VAL 37 -4.587 -11.493 3.158 1012 HG21 VAL 37 HG21 VAL 37 -2.559 -11.067 -0.058 1013 HG22 VAL 37 HG22 VAL 37 -1.502 -11.235 1.343 1014 HG23 VAL 37 HG23 VAL 37 -1.759 -9.649 0.617 1015 H ILE 38 HN ILE 38 -3.573 -9.184 -1.287 1016 HA ILE 38 HA ILE 38 -2.618 -6.561 -0.552 1017 HB ILE 38 HB ILE 38 -1.481 -8.416 -2.168 1018 HG12 ILE 38 HG12 ILE 38 -1.083 -5.453 -2.487 1019 HG13 ILE 38 HG11 ILE 38 -0.595 -6.313 -1.034 1020 HG21 ILE 38 HG21 ILE 38 -1.524 -7.623 -4.454 1021 HG22 ILE 38 HG22 ILE 38 -2.635 -6.326 -4.013 1022 HG23 ILE 38 HG23 ILE 38 -3.171 -8.007 -3.943 1023 HD11 ILE 38 HD11 ILE 38 1.342 -6.193 -2.243 1024 HD12 ILE 38 HD12 ILE 38 0.517 -6.381 -3.778 1025 HD13 ILE 38 HD13 ILE 38 0.734 -7.780 -2.720 1026 H VAL 39 HN VAL 39 -5.184 -7.906 -2.590 1027 HA VAL 39 HA VAL 39 -5.797 -5.360 -3.692 1028 HB VAL 39 HB VAL 39 -7.762 -6.221 -4.564 1029 HG11 VAL 39 HG11 VAL 39 -5.870 -7.309 -5.535 1030 HG12 VAL 39 HG12 VAL 39 -7.202 -8.468 -5.419 1031 HG13 VAL 39 HG13 VAL 39 -5.873 -8.535 -4.267 1032 HG21 VAL 39 HG21 VAL 39 -8.938 -8.230 -3.803 1033 HG22 VAL 39 HG22 VAL 39 -8.851 -7.004 -2.537 1034 HG23 VAL 39 HG23 VAL 39 -7.779 -8.402 -2.484 1035 H GLU 40 HN GLU 40 -7.131 -7.171 -0.957 1036 HA GLU 40 HA GLU 40 -8.799 -5.209 0.052 1037 HB2 GLU 40 HB2 GLU 40 -7.388 -7.531 1.318 1038 HB3 GLU 40 HB1 GLU 40 -8.568 -6.554 2.169 1039 HG2 GLU 40 HG2 GLU 40 -10.296 -7.198 0.741 1040 HG3 GLU 40 HG1 GLU 40 -9.203 -7.841 -0.453 1041 H LEU 41 HN LEU 41 -5.338 -5.584 0.398 1042 HA LEU 41 HA LEU 41 -5.272 -3.614 2.524 1043 HB2 LEU 41 HB2 LEU 41 -3.526 -5.603 1.684 1044 HB3 LEU 41 HB1 LEU 41 -2.710 -4.104 1.291 1045 HG LEU 41 HG LEU 41 -1.948 -4.575 3.430 1046 HD11 LEU 41 HD11 LEU 41 -2.777 -2.876 4.839 1047 HD12 LEU 41 HD12 LEU 41 -4.345 -2.877 4.039 1048 HD13 LEU 41 HD13 LEU 41 -2.920 -2.287 3.186 1049 HD21 LEU 41 HD21 LEU 41 -3.430 -6.438 3.894 1050 HD22 LEU 41 HD22 LEU 41 -4.760 -5.320 4.199 1051 HD23 LEU 41 HD23 LEU 41 -3.358 -5.335 5.268 1052 H MET 42 HN MET 42 -4.163 -3.751 -0.865 1053 HA MET 42 HA MET 42 -3.199 -1.087 -0.936 1054 HB2 MET 42 HB2 MET 42 -4.133 -2.860 -3.194 1055 HB3 MET 42 HB1 MET 42 -3.240 -1.348 -3.402 1056 HG2 MET 42 HG2 MET 42 -2.319 -3.922 -2.165 1057 HG3 MET 42 HG1 MET 42 -1.689 -3.099 -3.580 1058 HE1 MET 42 HE1 MET 42 0.750 -3.411 -2.713 1059 HE2 MET 42 HE2 MET 42 0.138 -4.237 -1.275 1060 HE3 MET 42 HE3 MET 42 1.292 -2.913 -1.106 1061 H ALA 43 HN ALA 43 -6.284 -2.515 -1.205 1062 HA ALA 43 HA ALA 43 -7.868 -0.609 -2.334 1063 HB1 ALA 43 HB1 ALA 43 -9.566 -1.335 -0.647 1064 HB2 ALA 43 HB2 ALA 43 -8.290 -2.280 0.129 1065 HB3 ALA 43 HB3 ALA 43 -8.776 -2.644 -1.526 1066 H TYR 44 HN TYR 44 -6.144 -0.509 0.708 1067 HA TYR 44 HA TYR 44 -7.224 2.171 1.301 1068 HB2 TYR 44 HB2 TYR 44 -7.312 0.650 3.197 1069 HB3 TYR 44 HB1 TYR 44 -5.638 0.198 2.926 1070 HD1 TYR 44 HD1 TYR 44 -7.863 2.592 4.531 1071 HD2 TYR 44 HD2 TYR 44 -3.815 1.786 3.524 1072 HE1 TYR 44 HE1 TYR 44 -7.136 4.224 6.204 1073 HE2 TYR 44 HE2 TYR 44 -3.070 3.430 5.186 1074 HH TYR 44 HH TYR 44 -5.090 4.694 7.567 1075 H GLU 45 HN GLU 45 -4.166 0.433 1.612 1076 HA GLU 45 HA GLU 45 -2.489 2.555 1.844 1077 HB2 GLU 45 HB2 GLU 45 -1.863 -0.056 0.503 1078 HB3 GLU 45 HB1 GLU 45 -0.714 1.010 1.301 1079 HG2 GLU 45 HG2 GLU 45 -2.989 -0.431 2.647 1080 HG3 GLU 45 HG1 GLU 45 -1.311 -0.947 2.675 1081 H ASN 46 HN ASN 46 -3.897 1.363 -1.138 1082 HA ASN 46 HA ASN 46 -2.072 3.060 -2.649 1083 HB2 ASN 46 HB2 ASN 46 -3.644 0.587 -3.284 1084 HB3 ASN 46 HB1 ASN 46 -3.202 1.692 -4.570 1085 HD21 ASN 46 HD21 ASN 46 -1.716 0.401 -5.621 1086 HD22 ASN 46 HD22 ASN 46 -0.247 -0.093 -4.882 1087 H ALA 47 HN ALA 47 -5.307 2.748 -1.561 1088 HA ALA 47 HA ALA 47 -6.721 3.901 -3.679 1089 HB1 ALA 47 HB1 ALA 47 -8.474 4.377 -2.051 1090 HB2 ALA 47 HB2 ALA 47 -7.353 4.006 -0.742 1091 HB3 ALA 47 HB3 ALA 47 -7.839 2.740 -1.871 1092 H ASN 48 HN ASN 48 -8.064 5.919 -3.239 1093 HA ASN 48 HA ASN 48 -6.474 8.211 -3.360 1094 HB2 ASN 48 HB2 ASN 48 -9.363 7.613 -3.055 1095 HB3 ASN 48 HB1 ASN 48 -8.839 9.223 -2.573 1096 HD21 ASN 48 HD21 ASN 48 -10.510 8.262 -4.821 1097 HD22 ASN 48 HD22 ASN 48 -9.750 8.916 -6.234 1098 HA PRO 49 HA PRO 49 -5.225 8.933 0.780 1099 HB2 PRO 49 HB2 PRO 49 -5.463 11.714 0.725 1100 HB3 PRO 49 HB1 PRO 49 -4.043 10.789 0.238 1101 HG2 PRO 49 HG2 PRO 49 -6.199 11.984 -1.428 1102 HG3 PRO 49 HG1 PRO 49 -4.471 11.808 -1.780 1103 HD2 PRO 49 HD2 PRO 49 -6.318 10.211 -2.905 1104 HD3 PRO 49 HD1 PRO 49 -4.707 9.605 -2.458 1105 H GLU 50 HN GLU 50 -8.202 10.236 -0.434 1106 HA GLU 50 HA GLU 50 -9.347 10.759 2.160 1107 HB2 GLU 50 HB2 GLU 50 -11.217 11.583 0.951 1108 HB3 GLU 50 HB1 GLU 50 -9.796 12.076 0.043 1109 HG2 GLU 50 HG2 GLU 50 -10.863 9.506 -0.763 1110 HG3 GLU 50 HG1 GLU 50 -11.947 10.863 -1.024 1111 H CYS 51 HN CYS 51 -9.296 8.292 -0.283 1112 HA CYS 51 HA CYS 51 -11.751 7.066 0.540 1113 HB2 CYS 51 HB2 CYS 51 -9.670 6.268 -1.515 1114 HB3 CYS 51 HB1 CYS 51 -11.181 5.402 -1.226 1115 HG CYS 51 HG CYS 51 -12.801 7.061 -2.442 1116 H GLN 52 HN GLN 52 -8.313 6.424 0.786 1117 HA GLN 52 HA GLN 52 -8.632 4.021 2.286 1118 HB2 GLN 52 HB2 GLN 52 -6.296 4.285 2.855 1119 HB3 GLN 52 HB1 GLN 52 -6.522 4.608 1.143 1120 HG2 GLN 52 HG2 GLN 52 -6.512 7.029 1.663 1121 HG3 GLN 52 HG1 GLN 52 -6.115 6.626 3.333 1122 HE21 GLN 52 HE21 GLN 52 -4.571 4.318 2.475 1123 HE22 GLN 52 HE22 GLN 52 -3.087 4.917 1.873 1124 H SER 53 HN SER 53 -8.604 7.373 2.823 1125 HA SER 53 HA SER 53 -8.547 7.325 5.648 1126 HB2 SER 53 HB2 SER 53 -9.142 9.315 3.519 1127 HB3 SER 53 HB1 SER 53 -9.529 9.709 5.203 1128 HG SER 53 HG SER 53 -7.109 9.577 3.940 1129 H ALA 54 HN ALA 54 -10.984 6.884 3.236 1130 HA ALA 54 HA ALA 54 -13.146 6.913 5.130 1131 HB1 ALA 54 HB1 ALA 54 -12.914 5.711 2.385 1132 HB2 ALA 54 HB2 ALA 54 -13.576 7.295 2.782 1133 HB3 ALA 54 HB3 ALA 54 -14.412 5.833 3.311 1134 H ILE 55 HN ILE 55 -10.699 4.775 4.185 1135 HA ILE 55 HA ILE 55 -12.109 2.393 4.971 1136 HB ILE 55 HB ILE 55 -9.460 2.902 3.704 1137 HG12 ILE 55 HG12 ILE 55 -11.665 1.208 2.640 1138 HG13 ILE 55 HG11 ILE 55 -11.841 2.969 2.618 1139 HG21 ILE 55 HG21 ILE 55 -9.101 1.009 5.141 1140 HG22 ILE 55 HG22 ILE 55 -9.241 0.448 3.475 1141 HG23 ILE 55 HG23 ILE 55 -10.597 0.262 4.586 1142 HD11 ILE 55 HD11 ILE 55 -10.947 1.972 0.540 1143 HD12 ILE 55 HD12 ILE 55 -9.495 1.500 1.445 1144 HD13 ILE 55 HD13 ILE 55 -9.915 3.209 1.266 1145 H LYS 56 HN LYS 56 -9.468 4.364 6.327 1146 HA LYS 56 HA LYS 56 -8.071 2.537 7.751 1147 HB2 LYS 56 HB2 LYS 56 -8.528 4.647 9.630 1148 HB3 LYS 56 HB1 LYS 56 -7.066 4.209 8.769 1149 HG2 LYS 56 HG2 LYS 56 -7.284 6.329 8.039 1150 HG3 LYS 56 HG1 LYS 56 -8.308 5.547 6.832 1151 HD2 LYS 56 HD2 LYS 56 -10.215 6.276 7.759 1152 HD3 LYS 56 HD1 LYS 56 -9.554 6.363 9.392 1153 HE2 LYS 56 HE2 LYS 56 -9.394 8.378 7.155 1154 HE3 LYS 56 HE1 LYS 56 -9.847 8.599 8.843 1155 HZ1 LYS 56 HZ1 LYS 56 -7.685 9.553 8.396 1156 HZ2 LYS 56 HZ2 LYS 56 -7.092 8.058 7.878 1157 HZ3 LYS 56 HZ3 LYS 56 -7.547 8.273 9.495 1158 HA PRO 57 HA PRO 57 -11.358 2.376 11.416 1159 HB2 PRO 57 HB2 PRO 57 -13.925 2.379 10.511 1160 HB3 PRO 57 HB1 PRO 57 -13.105 3.841 11.083 1161 HG2 PRO 57 HG2 PRO 57 -13.338 2.802 8.269 1162 HG3 PRO 57 HG1 PRO 57 -13.765 4.421 8.879 1163 HD2 PRO 57 HD2 PRO 57 -11.446 4.056 7.700 1164 HD3 PRO 57 HD1 PRO 57 -11.473 4.977 9.213 1165 H LEU 58 HN LEU 58 -11.799 1.148 8.163 1166 HA LEU 58 HA LEU 58 -12.750 -1.452 9.140 1167 HB2 LEU 58 HB2 LEU 58 -12.288 -0.963 6.263 1168 HB3 LEU 58 HB1 LEU 58 -13.584 -1.869 7.036 1169 HG LEU 58 HG LEU 58 -13.380 1.146 6.850 1170 HD11 LEU 58 HD11 LEU 58 -15.033 -0.853 5.322 1171 HD12 LEU 58 HD12 LEU 58 -13.749 0.173 4.683 1172 HD13 LEU 58 HD13 LEU 58 -15.255 0.895 5.259 1173 HD21 LEU 58 HD21 LEU 58 -14.595 0.429 8.838 1174 HD22 LEU 58 HD22 LEU 58 -15.619 -0.615 7.850 1175 HD23 LEU 58 HD23 LEU 58 -15.691 1.137 7.652 1176 H LYS 59 HN LYS 59 -10.050 0.268 8.107 1177 HA LYS 59 HA LYS 59 -8.505 -1.585 6.764 1178 HB2 LYS 59 HB2 LYS 59 -7.746 0.682 7.031 1179 HB3 LYS 59 HB1 LYS 59 -7.637 0.480 8.770 1180 HG2 LYS 59 HG2 LYS 59 -5.462 0.122 8.349 1181 HG3 LYS 59 HG1 LYS 59 -6.024 -1.494 7.946 1182 HD2 LYS 59 HD2 LYS 59 -5.610 0.753 6.013 1183 HD3 LYS 59 HD1 LYS 59 -4.541 -0.639 6.216 1184 HE2 LYS 59 HE2 LYS 59 -7.420 -0.705 5.308 1185 HE3 LYS 59 HE1 LYS 59 -6.012 -0.899 4.279 1186 HZ1 LYS 59 HZ1 LYS 59 -6.917 -2.734 6.406 1187 HZ2 LYS 59 HZ2 LYS 59 -5.447 -2.894 5.599 1188 HZ3 LYS 59 HZ3 LYS 59 -6.904 -3.032 4.745 1189 H GLY 60 HN GLY 60 -8.220 -3.624 7.290 1190 HA2 GLY 60 HA3 GLY 60 -7.043 -5.283 8.501 1191 HA3 GLY 60 HA2 GLY 60 -7.096 -4.247 9.922 1192 H LYS 61 HN LYS 61 -10.027 -3.719 9.251 1193 HA LYS 61 HA LYS 61 -11.008 -6.112 10.649 1194 HB2 LYS 61 HB2 LYS 61 -12.722 -3.706 10.355 1195 HB3 LYS 61 HB1 LYS 61 -12.473 -4.737 11.756 1196 HG2 LYS 61 HG2 LYS 61 -10.539 -2.662 10.778 1197 HG3 LYS 61 HG1 LYS 61 -11.683 -2.434 12.089 1198 HD2 LYS 61 HD2 LYS 61 -9.549 -4.558 12.062 1199 HD3 LYS 61 HD1 LYS 61 -9.352 -2.974 12.811 1200 HE2 LYS 61 HE2 LYS 61 -11.236 -3.429 14.281 1201 HE3 LYS 61 HE1 LYS 61 -11.455 -5.004 13.524 1202 HZ1 LYS 61 HZ1 LYS 61 -9.278 -5.665 14.311 1203 HZ2 LYS 61 HZ2 LYS 61 -10.228 -5.158 15.613 1204 HZ3 LYS 61 HZ3 LYS 61 -9.027 -4.142 14.999 1205 H VAL 62 HN VAL 62 -11.827 -7.534 9.237 1206 HA VAL 62 HA VAL 62 -13.827 -6.514 7.337 1207 HB VAL 62 HB VAL 62 -11.931 -7.391 6.088 1208 HG11 VAL 62 HG11 VAL 62 -11.253 -9.740 6.222 1209 HG12 VAL 62 HG12 VAL 62 -12.353 -9.973 7.582 1210 HG13 VAL 62 HG13 VAL 62 -10.974 -8.885 7.740 1211 HG21 VAL 62 HG21 VAL 62 -13.071 -9.167 4.776 1212 HG22 VAL 62 HG22 VAL 62 -14.067 -7.742 5.072 1213 HG23 VAL 62 HG23 VAL 62 -14.329 -9.211 6.012 1214 HA PRO 63 HA PRO 63 -16.885 -9.252 9.352 1215 HB2 PRO 63 HB2 PRO 63 -17.429 -9.793 6.469 1216 HB3 PRO 63 HB1 PRO 63 -18.566 -9.526 7.775 1217 HG2 PRO 63 HG2 PRO 63 -18.038 -7.582 6.059 1218 HG3 PRO 63 HG1 PRO 63 -18.217 -7.225 7.783 1219 HD2 PRO 63 HD2 PRO 63 -15.758 -7.327 6.121 1220 HD3 PRO 63 HD1 PRO 63 -16.118 -6.339 7.550 1221 H ALA 64 HN ALA 64 -16.876 -11.405 9.814 1222 HA ALA 64 HA ALA 64 -14.555 -12.855 9.257 1223 HB1 ALA 64 HB1 ALA 64 -17.180 -13.893 10.311 1224 HB2 ALA 64 HB2 ALA 64 -15.896 -13.170 11.278 1225 HB3 ALA 64 HB3 ALA 64 -15.616 -14.695 10.441 1226 H GLY 65 HN GLY 65 -14.064 -13.448 7.228 1227 HA2 GLY 65 HA3 GLY 65 -14.122 -15.198 5.644 1228 HA3 GLY 65 HA2 GLY 65 -15.817 -15.452 6.017 1229 H SER 66 HN SER 66 -15.778 -12.252 5.733 1230 HA SER 66 HA SER 66 -16.687 -12.434 2.975 1231 HB2 SER 66 HB2 SER 66 -16.817 -10.060 4.830 1232 HB3 SER 66 HB1 SER 66 -17.764 -10.333 3.369 1233 HG SER 66 HG SER 66 -18.608 -12.240 4.476 1234 H ASP 67 HN ASP 67 -16.284 -10.352 1.661 1235 HA ASP 67 HA ASP 67 -13.439 -10.051 1.267 1236 HB2 ASP 67 HB2 ASP 67 -15.604 -9.962 -0.398 1237 HB3 ASP 67 HB1 ASP 67 -15.333 -8.252 -0.125 1238 H VAL 68 HN VAL 68 -12.180 -8.285 1.937 1239 HA VAL 68 HA VAL 68 -13.529 -6.364 3.631 1240 HB VAL 68 HB VAL 68 -11.560 -5.741 4.474 1241 HG11 VAL 68 HG11 VAL 68 -9.774 -7.341 4.375 1242 HG12 VAL 68 HG12 VAL 68 -10.446 -8.041 2.902 1243 HG13 VAL 68 HG13 VAL 68 -11.329 -8.170 4.421 1244 HG21 VAL 68 HG21 VAL 68 -10.384 -5.718 1.702 1245 HG22 VAL 68 HG22 VAL 68 -9.546 -5.207 3.166 1246 HG23 VAL 68 HG23 VAL 68 -10.982 -4.335 2.619 1247 H ILE 69 HN ILE 69 -12.465 -6.600 0.382 1248 HA ILE 69 HA ILE 69 -12.276 -3.920 -0.317 1249 HB ILE 69 HB ILE 69 -13.120 -6.314 -1.917 1250 HG12 ILE 69 HG12 ILE 69 -10.852 -6.519 -1.294 1251 HG13 ILE 69 HG11 ILE 69 -10.816 -5.873 -2.922 1252 HG21 ILE 69 HG21 ILE 69 -12.702 -4.887 -3.936 1253 HG22 ILE 69 HG22 ILE 69 -12.629 -3.486 -2.864 1254 HG23 ILE 69 HG23 ILE 69 -14.118 -4.419 -2.993 1255 HD11 ILE 69 HD11 ILE 69 -10.399 -4.358 -0.386 1256 HD12 ILE 69 HD12 ILE 69 -10.522 -3.617 -1.979 1257 HD13 ILE 69 HD13 ILE 69 -9.199 -4.737 -1.628 1258 H SER 70 HN SER 70 -14.994 -6.093 -0.399 1259 HA SER 70 HA SER 70 -17.020 -4.534 -1.314 1260 HB2 SER 70 HB2 SER 70 -17.386 -6.845 -0.732 1261 HB3 SER 70 HB1 SER 70 -17.049 -6.529 0.966 1262 HG SER 70 HG SER 70 -19.314 -5.888 -0.567 1263 H GLU 71 HN GLU 71 -15.522 -4.368 1.863 1264 HA GLU 71 HA GLU 71 -17.412 -2.446 2.902 1265 HB2 GLU 71 HB2 GLU 71 -14.796 -3.270 4.123 1266 HB3 GLU 71 HB1 GLU 71 -16.256 -2.718 4.938 1267 HG2 GLU 71 HG2 GLU 71 -16.495 -5.164 3.324 1268 HG3 GLU 71 HG1 GLU 71 -15.527 -5.277 4.787 1269 H TYR 72 HN TYR 72 -14.258 -2.557 1.530 1270 HA TYR 72 HA TYR 72 -13.457 0.035 2.411 1271 HB2 TYR 72 HB2 TYR 72 -12.333 -2.002 0.504 1272 HB3 TYR 72 HB1 TYR 72 -11.608 -0.409 0.673 1273 HD1 TYR 72 HD1 TYR 72 -13.091 -1.839 3.643 1274 HD2 TYR 72 HD2 TYR 72 -9.526 -1.569 1.359 1275 HE1 TYR 72 HE1 TYR 72 -11.801 -2.638 5.561 1276 HE2 TYR 72 HE2 TYR 72 -8.224 -2.385 3.276 1277 HH TYR 72 HH TYR 72 -9.789 -3.630 6.130 1278 H VAL 73 HN VAL 73 -14.786 -1.400 -0.490 1279 HA VAL 73 HA VAL 73 -14.853 1.006 -1.998 1280 HB VAL 73 HB VAL 73 -16.069 -0.034 -3.636 1281 HG11 VAL 73 HG11 VAL 73 -14.719 -2.302 -2.234 1282 HG12 VAL 73 HG12 VAL 73 -14.038 -1.238 -3.461 1283 HG13 VAL 73 HG13 VAL 73 -15.326 -2.362 -3.886 1284 HG21 VAL 73 HG21 VAL 73 -17.794 -1.541 -3.465 1285 HG22 VAL 73 HG22 VAL 73 -17.946 -0.614 -1.964 1286 HG23 VAL 73 HG23 VAL 73 -17.195 -2.210 -1.942 1287 H LYS 74 HN LYS 74 -16.884 -0.596 0.311 1288 HA LYS 74 HA LYS 74 -19.181 1.046 0.137 1289 HB2 LYS 74 HB2 LYS 74 -18.360 -1.172 1.600 1290 HB3 LYS 74 HB1 LYS 74 -18.523 0.098 2.804 1291 HG2 LYS 74 HG2 LYS 74 -20.624 -0.725 2.880 1292 HG3 LYS 74 HG1 LYS 74 -20.840 0.455 1.592 1293 HD2 LYS 74 HD2 LYS 74 -20.166 -2.441 1.113 1294 HD3 LYS 74 HD1 LYS 74 -21.814 -1.812 1.130 1295 HE2 LYS 74 HE2 LYS 74 -19.634 -0.814 -0.689 1296 HE3 LYS 74 HE1 LYS 74 -20.813 -2.043 -1.145 1297 HZ1 LYS 74 HZ1 LYS 74 -22.579 -0.466 -0.841 1298 HZ2 LYS 74 HZ2 LYS 74 -21.431 0.208 -1.879 1299 HZ3 LYS 74 HZ3 LYS 74 -21.510 0.708 -0.267 1300 H ALA 75 HN ALA 75 -16.112 1.250 1.755 1301 HA ALA 75 HA ALA 75 -16.626 3.430 3.468 1302 HB1 ALA 75 HB1 ALA 75 -14.064 2.566 2.133 1303 HB2 ALA 75 HB2 ALA 75 -14.663 2.032 3.703 1304 HB3 ALA 75 HB3 ALA 75 -14.177 3.710 3.472 1305 H CYS 76 HN CYS 76 -15.328 3.273 0.185 1306 HA CYS 76 HA CYS 76 -15.523 6.173 -0.077 1307 HB2 CYS 76 HB2 CYS 76 -13.525 5.220 -0.916 1308 HB3 CYS 76 HB1 CYS 76 -14.386 4.008 -1.847 1309 HG CYS 76 HG CYS 76 -15.566 6.217 -3.433 1310 H ASP 77 HN ASP 77 -17.712 3.865 -0.179 1311 HA ASP 77 HA ASP 77 -19.070 4.229 -2.606 1312 HB2 ASP 77 HB2 ASP 77 -19.679 2.390 -1.240 1313 HB3 ASP 77 HB1 ASP 77 -20.023 3.408 0.151 1314 H GLY 78 HN GLY 78 -18.672 6.276 0.103 1315 HA2 GLY 78 HA3 GLY 78 -20.740 8.105 -0.891 1316 HA3 GLY 78 HA2 GLY 78 -19.906 8.241 0.650 1317 H ILE 79 HN ILE 79 -17.446 7.520 -1.328 1318 HA ILE 79 HA ILE 79 -16.743 10.320 -1.581 1319 HB ILE 79 HB ILE 79 -15.099 7.832 -1.880 1320 HG12 ILE 79 HG12 ILE 79 -15.011 10.012 0.212 1321 HG13 ILE 79 HG11 ILE 79 -15.845 8.476 0.421 1322 HG21 ILE 79 HG21 ILE 79 -13.155 9.237 -2.108 1323 HG22 ILE 79 HG22 ILE 79 -14.147 10.688 -1.968 1324 HG23 ILE 79 HG23 ILE 79 -14.316 9.637 -3.375 1325 HD11 ILE 79 HD11 ILE 79 -13.587 8.632 1.462 1326 HD12 ILE 79 HD12 ILE 79 -12.913 8.701 -0.165 1327 HD13 ILE 79 HD13 ILE 79 -13.811 7.274 0.359 1328 H GLY 80 HN GLY 80 -17.230 11.309 -3.368 1329 HA2 GLY 80 HA3 GLY 80 -15.977 10.818 -5.775 1330 HA3 GLY 80 HA2 GLY 80 -17.573 10.098 -5.901 1331 H GLY 81 HN GLY 81 -16.110 13.053 -4.640 1332 HA2 GLY 81 HA3 GLY 81 -16.684 15.272 -5.174 1333 HA3 GLY 81 HA2 GLY 81 -18.106 14.673 -6.020 1334 H ALA 82 HN ALA 82 -18.361 16.789 -4.331 1335 HA ALA 82 HA ALA 82 -19.596 17.599 -2.614 1336 HB1 ALA 82 HB1 ALA 82 -21.312 16.473 -3.928 1337 HB2 ALA 82 HB2 ALA 82 -21.702 16.487 -2.209 1338 HB3 ALA 82 HB3 ALA 82 -21.088 15.015 -2.964 1339 H MET 83 HN MET 83 -20.238 14.323 -1.511 1340 HA MET 83 HA MET 83 -19.628 14.930 1.166 1341 HB2 MET 83 HB2 MET 83 -19.903 12.267 -0.233 1342 HB3 MET 83 HB1 MET 83 -19.724 12.440 1.507 1343 HG2 MET 83 HG2 MET 83 -21.784 13.823 1.528 1344 HG3 MET 83 HG1 MET 83 -21.983 13.476 -0.188 1345 HE1 MET 83 HE1 MET 83 -22.650 11.149 -1.177 1346 HE2 MET 83 HE2 MET 83 -22.688 9.657 -0.239 1347 HE3 MET 83 HE3 MET 83 -21.157 10.486 -0.515 1348 H HIS 84 HN HIS 84 -17.724 13.474 -1.406 1349 HA HIS 84 HA HIS 84 -15.441 12.697 0.017 1350 HB2 HIS 84 HB2 HIS 84 -15.514 12.106 -2.274 1351 HB3 HIS 84 HB1 HIS 84 -15.909 13.737 -2.781 1352 HD1 HIS 84 HD1 HIS 84 -14.035 14.019 -4.439 1353 HD2 HIS 84 HD2 HIS 84 -12.672 12.926 -0.675 1354 HE1 HIS 84 HE1 HIS 84 -11.545 14.267 -4.530 1355 HE2 HIS 84 HE2 HIS 84 -10.735 13.380 -2.326 1356 H LYS 85 HN LYS 85 -16.552 15.901 -0.933 1357 HA LYS 85 HA LYS 85 -14.032 17.159 -0.317 1358 HB2 LYS 85 HB2 LYS 85 -16.732 18.418 -0.834 1359 HB3 LYS 85 HB1 LYS 85 -15.179 19.244 -0.843 1360 HG2 LYS 85 HG2 LYS 85 -15.958 17.034 -2.736 1361 HG3 LYS 85 HG1 LYS 85 -16.035 18.757 -3.105 1362 HD2 LYS 85 HD2 LYS 85 -13.672 18.980 -2.941 1363 HD3 LYS 85 HD1 LYS 85 -13.503 17.368 -2.248 1364 HE2 LYS 85 HE2 LYS 85 -14.121 16.333 -4.311 1365 HE3 LYS 85 HE1 LYS 85 -14.573 17.890 -5.012 1366 HZ1 LYS 85 HZ1 LYS 85 -12.275 18.579 -4.942 1367 HZ2 LYS 85 HZ2 LYS 85 -12.400 17.124 -5.791 1368 HZ3 LYS 85 HZ3 LYS 85 -11.815 17.131 -4.204 1369 H ALA 86 HN ALA 86 -17.094 16.600 1.270 1370 HA ALA 86 HA ALA 86 -16.636 18.236 3.552 1371 HB1 ALA 86 HB1 ALA 86 -18.266 15.702 3.512 1372 HB2 ALA 86 HB2 ALA 86 -18.845 17.211 2.797 1373 HB3 ALA 86 HB3 ALA 86 -18.492 17.134 4.523 1374 H MET 87 HN MET 87 -16.302 14.802 2.922 1375 HA MET 87 HA MET 87 -15.184 14.192 5.479 1376 HB2 MET 87 HB2 MET 87 -15.177 12.472 2.994 1377 HB3 MET 87 HB1 MET 87 -15.077 11.936 4.671 1378 HG2 MET 87 HG2 MET 87 -17.390 13.101 4.889 1379 HG3 MET 87 HG1 MET 87 -17.418 12.954 3.140 1380 HE1 MET 87 HE1 MET 87 -19.573 11.642 5.156 1381 HE2 MET 87 HE2 MET 87 -19.816 10.083 4.368 1382 HE3 MET 87 HE3 MET 87 -19.688 11.549 3.399 1383 H LEU 88 HN LEU 88 -13.936 15.430 2.628 1384 HA LEU 88 HA LEU 88 -11.416 14.383 2.378 1385 HB2 LEU 88 HB2 LEU 88 -12.701 16.394 1.205 1386 HB3 LEU 88 HB1 LEU 88 -11.687 17.339 2.275 1387 HG LEU 88 HG LEU 88 -9.940 17.131 0.901 1388 HD11 LEU 88 HD11 LEU 88 -10.488 14.171 0.686 1389 HD12 LEU 88 HD12 LEU 88 -9.450 14.932 1.893 1390 HD13 LEU 88 HD13 LEU 88 -9.016 15.002 0.187 1391 HD21 LEU 88 HD21 LEU 88 -11.654 17.389 -0.777 1392 HD22 LEU 88 HD22 LEU 88 -11.923 15.647 -0.802 1393 HD23 LEU 88 HD23 LEU 88 -10.393 16.312 -1.378 1394 H MET 89 HN MET 89 -12.315 17.169 4.436 1395 HA MET 89 HA MET 89 -9.708 17.285 5.612 1396 HB2 MET 89 HB2 MET 89 -11.118 19.288 5.318 1397 HB3 MET 89 HB1 MET 89 -12.283 18.627 6.454 1398 HG2 MET 89 HG2 MET 89 -10.580 18.700 8.220 1399 HG3 MET 89 HG1 MET 89 -9.450 19.420 7.075 1400 HE1 MET 89 HE1 MET 89 -10.200 20.686 9.914 1401 HE2 MET 89 HE2 MET 89 -10.358 22.388 9.485 1402 HE3 MET 89 HE3 MET 89 -9.050 21.425 8.798 1403 H ALA 90 HN ALA 90 -12.463 15.390 6.185 1404 HA ALA 90 HA ALA 90 -11.972 15.161 9.053 1405 HB1 ALA 90 HB1 ALA 90 -14.275 15.478 8.160 1406 HB2 ALA 90 HB2 ALA 90 -14.093 14.024 9.144 1407 HB3 ALA 90 HB3 ALA 90 -14.144 13.897 7.383 1408 H GLN 91 HN GLN 91 -11.452 13.403 6.143 1409 HA GLN 91 HA GLN 91 -10.748 11.030 7.722 1410 HB2 GLN 91 HB2 GLN 91 -11.519 11.176 4.809 1411 HB3 GLN 91 HB1 GLN 91 -11.204 9.715 5.737 1412 HG2 GLN 91 HG2 GLN 91 -13.095 10.193 7.162 1413 HG3 GLN 91 HG1 GLN 91 -13.411 11.659 6.252 1414 HE21 GLN 91 HE21 GLN 91 -12.808 10.610 3.713 1415 HE22 GLN 91 HE22 GLN 91 -14.046 9.506 3.298 1416 H LEU 92 HN LEU 92 -9.827 12.779 4.742 1417 HA LEU 92 HA LEU 92 -7.401 11.632 4.160 1418 HB2 LEU 92 HB2 LEU 92 -8.749 13.674 3.136 1419 HB3 LEU 92 HB1 LEU 92 -7.631 14.613 4.092 1420 HG LEU 92 HG LEU 92 -7.167 13.042 1.613 1421 HD11 LEU 92 HD11 LEU 92 -7.414 15.436 1.524 1422 HD12 LEU 92 HD12 LEU 92 -5.761 14.985 1.106 1423 HD13 LEU 92 HD13 LEU 92 -6.122 15.642 2.704 1424 HD21 LEU 92 HD21 LEU 92 -4.720 13.054 2.028 1425 HD22 LEU 92 HD22 LEU 92 -5.598 11.931 3.064 1426 HD23 LEU 92 HD23 LEU 92 -5.041 13.474 3.711 1427 H GLU 93 HN GLU 93 -8.351 13.788 6.663 1428 HA GLU 93 HA GLU 93 -6.302 15.130 7.644 1429 HB2 GLU 93 HB2 GLU 93 -7.212 14.853 9.891 1430 HB3 GLU 93 HB1 GLU 93 -8.517 15.033 8.720 1431 HG2 GLU 93 HG2 GLU 93 -9.155 12.804 8.903 1432 HG3 GLU 93 HG1 GLU 93 -7.615 12.320 9.612
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