NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
633644 | 6f24 | 34202 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 SER 12 HT1 SER 12 -20.549 -7.260 -2.040 2 H2 SER 12 HT2 SER 12 -21.238 -8.808 -2.065 3 H3 SER 12 HT3 SER 12 -20.316 -8.323 -0.735 4 HA SER 12 HA SER 12 -22.594 -8.214 -0.128 5 HB2 SER 12 HB2 SER 12 -21.193 -6.426 0.742 6 HB3 SER 12 HB1 SER 12 -21.428 -5.485 -0.726 7 HG SER 12 HG SER 12 -23.462 -6.218 1.122 8 H ALA 13 HN ALA 13 -22.317 -5.557 -2.465 9 HA ALA 13 HA ALA 13 -24.643 -6.656 -3.861 10 HB1 ALA 13 HB1 ALA 13 -25.540 -4.354 -4.119 11 HB2 ALA 13 HB2 ALA 13 -24.305 -3.791 -2.992 12 HB3 ALA 13 HB3 ALA 13 -25.536 -4.931 -2.453 13 H LYS 14 HN LYS 14 -23.190 -3.541 -4.513 14 HA LYS 14 HA LYS 14 -21.469 -4.671 -6.585 15 HB2 LYS 14 HB2 LYS 14 -23.536 -2.524 -7.126 16 HB3 LYS 14 HB1 LYS 14 -22.240 -2.955 -8.228 17 HG2 LYS 14 HG2 LYS 14 -23.881 -4.189 -9.152 18 HG3 LYS 14 HG1 LYS 14 -23.359 -5.359 -7.941 19 HD2 LYS 14 HD2 LYS 14 -25.122 -4.664 -6.449 20 HD3 LYS 14 HD1 LYS 14 -25.594 -3.372 -7.552 21 HE2 LYS 14 HE2 LYS 14 -25.717 -6.329 -8.134 22 HE3 LYS 14 HE1 LYS 14 -27.091 -5.303 -7.725 23 HZ1 LYS 14 HZ1 LYS 14 -26.643 -4.006 -9.736 24 HZ2 LYS 14 HZ2 LYS 14 -26.962 -5.626 -10.094 25 HZ3 LYS 14 HZ3 LYS 14 -25.374 -5.052 -10.138 26 H ASP 15 HN ASP 15 -20.988 -3.426 -3.978 27 HA ASP 15 HA ASP 15 -19.358 -1.177 -4.725 28 HB2 ASP 15 HB2 ASP 15 -21.551 -0.137 -4.836 29 HB3 ASP 15 HB1 ASP 15 -21.924 -0.727 -3.217 30 H ILE 16 HN ILE 16 -20.811 -3.096 -2.088 31 HA ILE 16 HA ILE 16 -19.572 -1.296 -0.179 32 HB ILE 16 HB ILE 16 -21.437 -3.612 0.339 33 HG12 ILE 16 HG12 ILE 16 -22.948 -1.526 0.925 34 HG13 ILE 16 HG11 ILE 16 -21.875 -0.698 -0.195 35 HG21 ILE 16 HG21 ILE 16 -20.517 -1.389 2.166 36 HG22 ILE 16 HG22 ILE 16 -20.060 -3.087 2.284 37 HG23 ILE 16 HG23 ILE 16 -21.735 -2.604 2.556 38 HD11 ILE 16 HD11 ILE 16 -23.557 -3.116 -0.810 39 HD12 ILE 16 HD12 ILE 16 -22.466 -2.311 -1.938 40 HD13 ILE 16 HD13 ILE 16 -23.880 -1.458 -1.315 41 H LYS 17 HN LYS 17 -19.888 -4.836 0.242 42 HA LYS 17 HA LYS 17 -17.631 -4.689 1.997 43 HB2 LYS 17 HB2 LYS 17 -19.241 -7.082 1.117 44 HB3 LYS 17 HB1 LYS 17 -18.043 -7.086 2.402 45 HG2 LYS 17 HG2 LYS 17 -20.581 -5.466 2.372 46 HG3 LYS 17 HG1 LYS 17 -20.312 -6.952 3.280 47 HD2 LYS 17 HD2 LYS 17 -18.725 -4.410 3.630 48 HD3 LYS 17 HD1 LYS 17 -20.082 -4.892 4.644 49 HE2 LYS 17 HE2 LYS 17 -18.857 -6.945 5.253 50 HE3 LYS 17 HE1 LYS 17 -17.487 -6.387 4.296 51 HZ1 LYS 17 HZ1 LYS 17 -17.256 -4.493 5.739 52 HZ2 LYS 17 HZ2 LYS 17 -17.242 -5.905 6.669 53 HZ3 LYS 17 HZ3 LYS 17 -18.627 -4.940 6.622 54 H ASP 18 HN ASP 18 -18.207 -6.846 -0.759 55 HA ASP 18 HA ASP 18 -15.413 -7.594 -0.788 56 HB2 ASP 18 HB2 ASP 18 -17.600 -8.443 -2.693 57 HB3 ASP 18 HB1 ASP 18 -16.071 -9.264 -2.388 58 H GLU 19 HN GLU 19 -17.680 -5.786 -2.636 59 HA GLU 19 HA GLU 19 -16.366 -5.681 -5.077 60 HB2 GLU 19 HB2 GLU 19 -18.182 -3.561 -3.943 61 HB3 GLU 19 HB1 GLU 19 -17.894 -3.919 -5.640 62 HG2 GLU 19 HG2 GLU 19 -19.901 -4.958 -5.333 63 HG3 GLU 19 HG1 GLU 19 -18.804 -6.287 -4.979 64 H LYS 20 HN LYS 20 -16.100 -3.516 -2.276 65 HA LYS 20 HA LYS 20 -14.497 -1.546 -3.475 66 HB2 LYS 20 HB2 LYS 20 -13.716 -1.017 -1.190 67 HB3 LYS 20 HB1 LYS 20 -15.466 -1.153 -1.293 68 HG2 LYS 20 HG2 LYS 20 -15.385 -3.356 -0.297 69 HG3 LYS 20 HG1 LYS 20 -13.621 -3.296 -0.263 70 HD2 LYS 20 HD2 LYS 20 -13.619 -1.544 1.328 71 HD3 LYS 20 HD1 LYS 20 -15.343 -1.252 1.101 72 HE2 LYS 20 HE2 LYS 20 -14.898 -2.435 3.190 73 HE3 LYS 20 HE1 LYS 20 -15.865 -3.399 2.078 74 HZ1 LYS 20 HZ1 LYS 20 -14.131 -4.701 3.155 75 HZ2 LYS 20 HZ2 LYS 20 -12.941 -3.702 2.493 76 HZ3 LYS 20 HZ3 LYS 20 -13.912 -4.650 1.481 77 H ILE 21 HN ILE 21 -13.703 -4.624 -2.013 78 HA ILE 21 HA ILE 21 -10.898 -4.278 -1.913 79 HB ILE 21 HB ILE 21 -12.565 -6.801 -1.989 80 HG12 ILE 21 HG12 ILE 21 -11.259 -5.565 0.422 81 HG13 ILE 21 HG11 ILE 21 -12.845 -5.032 -0.121 82 HG21 ILE 21 HG21 ILE 21 -9.676 -6.421 -1.207 83 HG22 ILE 21 HG22 ILE 21 -10.271 -7.286 -2.626 84 HG23 ILE 21 HG23 ILE 21 -10.602 -7.911 -1.007 85 HD11 ILE 21 HD11 ILE 21 -12.094 -7.816 0.730 86 HD12 ILE 21 HD12 ILE 21 -13.677 -7.316 0.126 87 HD13 ILE 21 HD13 ILE 21 -13.062 -6.649 1.634 88 H GLN 22 HN GLN 22 -13.066 -5.851 -4.223 89 HA GLN 22 HA GLN 22 -11.033 -6.715 -5.998 90 HB2 GLN 22 HB2 GLN 22 -13.935 -6.139 -6.607 91 HB3 GLN 22 HB1 GLN 22 -12.850 -7.143 -7.558 92 HG2 GLN 22 HG2 GLN 22 -12.703 -8.746 -5.745 93 HG3 GLN 22 HG1 GLN 22 -13.729 -7.724 -4.738 94 HE21 GLN 22 HE21 GLN 22 -15.293 -9.301 -4.511 95 HE22 GLN 22 HE22 GLN 22 -16.347 -9.752 -5.803 96 H GLN 23 HN GLN 23 -13.135 -3.886 -5.911 97 HA GLN 23 HA GLN 23 -12.392 -2.803 -8.404 98 HB2 GLN 23 HB2 GLN 23 -14.356 -2.269 -6.697 99 HB3 GLN 23 HB1 GLN 23 -13.233 -1.041 -6.143 100 HG2 GLN 23 HG2 GLN 23 -14.342 -1.323 -8.923 101 HG3 GLN 23 HG1 GLN 23 -14.816 -0.126 -7.724 102 HE21 GLN 23 HE21 GLN 23 -13.337 1.532 -7.190 103 HE22 GLN 23 HE22 GLN 23 -12.067 1.977 -8.277 104 H TYR 24 HN TYR 24 -11.414 -1.889 -5.103 105 HA TYR 24 HA TYR 24 -9.573 0.060 -5.986 106 HB2 TYR 24 HB2 TYR 24 -10.105 -1.265 -3.350 107 HB3 TYR 24 HB1 TYR 24 -8.676 -0.253 -3.549 108 HD1 TYR 24 HD1 TYR 24 -12.029 -0.265 -2.566 109 HD2 TYR 24 HD2 TYR 24 -9.199 2.108 -4.671 110 HE1 TYR 24 HE1 TYR 24 -13.388 1.737 -2.124 111 HE2 TYR 24 HE2 TYR 24 -10.546 4.122 -4.235 112 HH TYR 24 HH TYR 24 -12.952 4.646 -3.735 113 H ARG 25 HN ARG 25 -9.211 -3.374 -5.252 114 HA ARG 25 HA ARG 25 -6.463 -3.510 -4.940 115 HB2 ARG 25 HB2 ARG 25 -8.108 -5.393 -4.661 116 HB3 ARG 25 HB1 ARG 25 -8.092 -5.570 -6.410 117 HG2 ARG 25 HG2 ARG 25 -5.683 -6.007 -6.335 118 HG3 ARG 25 HG1 ARG 25 -5.726 -5.867 -4.577 119 HD2 ARG 25 HD2 ARG 25 -5.767 -8.188 -5.166 120 HD3 ARG 25 HD1 ARG 25 -7.345 -7.746 -4.522 121 HE ARG 25 HE ARG 25 -7.736 -7.461 -7.151 122 HH11 ARG 25 HH11 ARG 25 -6.264 -10.047 -5.312 123 HH12 ARG 25 HH12 ARG 25 -6.719 -11.286 -6.440 124 HH21 ARG 25 HH21 ARG 25 -8.342 -9.082 -8.642 125 HH22 ARG 25 HH22 ARG 25 -7.909 -10.733 -8.336 126 H LYS 26 HN LYS 26 -8.338 -3.322 -7.918 127 HA LYS 26 HA LYS 26 -6.313 -4.008 -9.741 128 HB2 LYS 26 HB2 LYS 26 -8.576 -2.049 -10.138 129 HB3 LYS 26 HB1 LYS 26 -7.661 -2.840 -11.412 130 HG2 LYS 26 HG2 LYS 26 -8.528 -5.000 -10.719 131 HG3 LYS 26 HG1 LYS 26 -9.414 -4.231 -9.401 132 HD2 LYS 26 HD2 LYS 26 -9.811 -3.692 -12.339 133 HD3 LYS 26 HD1 LYS 26 -10.864 -4.678 -11.323 134 HE2 LYS 26 HE2 LYS 26 -11.238 -2.668 -9.897 135 HE3 LYS 26 HE1 LYS 26 -10.323 -1.723 -11.067 136 HZ1 LYS 26 HZ1 LYS 26 -12.811 -3.233 -11.661 137 HZ2 LYS 26 HZ2 LYS 26 -11.947 -2.270 -12.752 138 HZ3 LYS 26 HZ3 LYS 26 -12.716 -1.561 -11.425 139 H THR 27 HN THR 27 -7.384 -0.805 -8.663 140 HA THR 27 HA THR 27 -5.261 0.527 -10.069 141 HB THR 27 HB THR 27 -7.417 1.612 -9.840 142 HG1 THR 27 HG1 THR 27 -6.661 3.641 -9.027 143 HG21 THR 27 HG21 THR 27 -8.184 0.743 -7.743 144 HG22 THR 27 HG22 THR 27 -8.145 2.506 -7.636 145 HG23 THR 27 HG23 THR 27 -6.871 1.549 -6.879 146 H LEU 28 HN LEU 28 -5.634 -0.889 -6.996 147 HA LEU 28 HA LEU 28 -3.790 0.747 -5.552 148 HB2 LEU 28 HB2 LEU 28 -5.481 -1.561 -5.053 149 HB3 LEU 28 HB1 LEU 28 -3.926 -1.708 -4.255 150 HG LEU 28 HG LEU 28 -5.691 -0.727 -2.814 151 HD11 LEU 28 HD11 LEU 28 -3.381 -0.262 -2.331 152 HD12 LEU 28 HD12 LEU 28 -4.352 1.175 -2.024 153 HD13 LEU 28 HD13 LEU 28 -3.374 1.071 -3.485 154 HD21 LEU 28 HD21 LEU 28 -6.444 1.553 -3.211 155 HD22 LEU 28 HD22 LEU 28 -6.920 0.499 -4.542 156 HD23 LEU 28 HD23 LEU 28 -5.555 1.598 -4.733 157 H THR 29 HN THR 29 -3.439 -1.900 -7.738 158 HA THR 29 HA THR 29 -0.945 -2.835 -6.673 159 HB THR 29 HB THR 29 -1.993 -3.350 -9.456 160 HG1 THR 29 HG1 THR 29 -3.511 -3.866 -7.669 161 HG21 THR 29 HG21 THR 29 -0.716 -5.459 -9.189 162 HG22 THR 29 HG22 THR 29 -0.135 -4.892 -7.623 163 HG23 THR 29 HG23 THR 29 0.318 -4.035 -9.095 164 H LYS 30 HN LYS 30 0.885 -1.761 -6.795 165 HA LYS 30 HA LYS 30 1.593 -0.319 -9.241 166 HB2 LYS 30 HB2 LYS 30 1.478 0.909 -6.486 167 HB3 LYS 30 HB1 LYS 30 2.380 1.617 -7.816 168 HG2 LYS 30 HG2 LYS 30 -0.564 1.058 -7.941 169 HG3 LYS 30 HG1 LYS 30 0.127 2.599 -7.422 170 HD2 LYS 30 HD2 LYS 30 1.275 2.806 -9.565 171 HD3 LYS 30 HD1 LYS 30 0.591 1.267 -10.087 172 HE2 LYS 30 HE2 LYS 30 -1.013 3.681 -9.302 173 HE3 LYS 30 HE1 LYS 30 -0.604 3.250 -10.961 174 HZ1 LYS 30 HZ1 LYS 30 -2.252 1.657 -9.072 175 HZ2 LYS 30 HZ2 LYS 30 -1.765 1.122 -10.600 176 HZ3 LYS 30 HZ3 LYS 30 -2.789 2.459 -10.461 177 H ILE 31 HN ILE 31 3.805 -0.169 -9.625 178 HA ILE 31 HA ILE 31 5.549 -1.744 -7.898 179 HB ILE 31 HB ILE 31 6.133 -0.304 -10.500 180 HG12 ILE 31 HG12 ILE 31 4.620 -2.302 -10.652 181 HG13 ILE 31 HG11 ILE 31 6.126 -2.468 -11.546 182 HG21 ILE 31 HG21 ILE 31 8.126 -0.446 -9.101 183 HG22 ILE 31 HG22 ILE 31 8.262 -1.509 -10.499 184 HG23 ILE 31 HG23 ILE 31 7.886 -2.183 -8.915 185 HD11 ILE 31 HD11 ILE 31 7.045 -3.837 -9.754 186 HD12 ILE 31 HD12 ILE 31 5.549 -4.521 -10.393 187 HD13 ILE 31 HD13 ILE 31 5.539 -3.665 -8.852 188 H VAL 32 HN VAL 32 6.360 -0.748 -6.167 189 HA VAL 32 HA VAL 32 7.207 2.059 -6.429 190 HB VAL 32 HB VAL 32 6.258 2.629 -4.293 191 HG11 VAL 32 HG11 VAL 32 4.831 2.823 -6.274 192 HG12 VAL 32 HG12 VAL 32 3.896 2.494 -4.816 193 HG13 VAL 32 HG13 VAL 32 4.206 1.200 -5.974 194 HG21 VAL 32 HG21 VAL 32 6.516 0.521 -3.124 195 HG22 VAL 32 HG22 VAL 32 5.303 -0.234 -4.159 196 HG23 VAL 32 HG23 VAL 32 4.834 1.047 -3.040 197 H LYS 33 HN LYS 33 8.472 2.699 -4.382 198 HA LYS 33 HA LYS 33 10.341 0.512 -3.800 199 HB2 LYS 33 HB2 LYS 33 10.778 3.484 -3.410 200 HB3 LYS 33 HB1 LYS 33 11.989 2.209 -3.327 201 HG2 LYS 33 HG2 LYS 33 11.777 1.772 -5.686 202 HG3 LYS 33 HG1 LYS 33 10.453 2.931 -5.814 203 HD2 LYS 33 HD2 LYS 33 12.020 4.701 -5.055 204 HD3 LYS 33 HD1 LYS 33 13.326 3.522 -5.120 205 HE2 LYS 33 HE2 LYS 33 12.820 3.177 -7.529 206 HE3 LYS 33 HE1 LYS 33 11.621 4.468 -7.426 207 HZ1 LYS 33 HZ1 LYS 33 14.520 4.783 -6.866 208 HZ2 LYS 33 HZ2 LYS 33 13.359 6.012 -6.836 209 HZ3 LYS 33 HZ3 LYS 33 13.744 5.251 -8.295 210 H ILE 34 HN ILE 34 10.044 -0.448 -1.921 211 HA ILE 34 HA ILE 34 8.709 0.983 0.225 212 HB ILE 34 HB ILE 34 9.030 -1.828 -0.487 213 HG12 ILE 34 HG12 ILE 34 7.146 -0.277 1.278 214 HG13 ILE 34 HG11 ILE 34 6.900 -0.677 -0.419 215 HG21 ILE 34 HG21 ILE 34 9.251 -1.110 2.437 216 HG22 ILE 34 HG22 ILE 34 10.529 -1.844 1.462 217 HG23 ILE 34 HG23 ILE 34 9.036 -2.732 1.775 218 HD11 ILE 34 HD11 ILE 34 7.003 -2.592 1.895 219 HD12 ILE 34 HD12 ILE 34 6.866 -3.063 0.204 220 HD13 ILE 34 HD13 ILE 34 5.581 -2.126 0.964 221 H LYS 35 HN LYS 35 9.582 1.433 2.163 222 HA LYS 35 HA LYS 35 12.461 0.969 2.507 223 HB2 LYS 35 HB2 LYS 35 10.981 3.595 2.632 224 HB3 LYS 35 HB1 LYS 35 12.574 3.387 3.310 225 HG2 LYS 35 HG2 LYS 35 13.501 3.731 1.336 226 HG3 LYS 35 HG1 LYS 35 12.576 2.394 0.643 227 HD2 LYS 35 HD2 LYS 35 11.470 3.924 -0.556 228 HD3 LYS 35 HD1 LYS 35 10.730 4.418 0.965 229 HE2 LYS 35 HE2 LYS 35 11.677 6.315 -0.247 230 HE3 LYS 35 HE1 LYS 35 12.452 6.068 1.319 231 HZ1 LYS 35 HZ1 LYS 35 14.275 4.935 0.155 232 HZ2 LYS 35 HZ2 LYS 35 14.094 6.534 -0.364 233 HZ3 LYS 35 HZ3 LYS 35 13.535 5.266 -1.329 234 H THR 36 HN THR 36 12.452 -0.285 4.281 235 HA THR 36 HA THR 36 11.013 0.710 6.653 236 HB THR 36 HB THR 36 10.575 -1.548 7.383 237 HG1 THR 36 HG1 THR 36 11.814 -2.456 4.975 238 HG21 THR 36 HG21 THR 36 9.098 -2.377 5.600 239 HG22 THR 36 HG22 THR 36 9.850 -1.253 4.467 240 HG23 THR 36 HG23 THR 36 8.924 -0.638 5.839 241 H ALA 37 HN ALA 37 12.032 -0.566 8.682 242 HA ALA 37 HA ALA 37 14.818 0.040 8.752 243 HB1 ALA 37 HB1 ALA 37 13.434 0.212 10.757 244 HB2 ALA 37 HB2 ALA 37 14.764 -0.919 11.007 245 HB3 ALA 37 HB3 ALA 37 13.135 -1.525 10.709 246 H ILE 38 HN ILE 38 12.900 -2.769 8.112 247 HA ILE 38 HA ILE 38 15.006 -4.656 8.586 248 HB ILE 38 HB ILE 38 12.418 -5.189 7.140 249 HG12 ILE 38 HG12 ILE 38 12.935 -5.367 10.118 250 HG13 ILE 38 HG11 ILE 38 12.009 -4.086 9.342 251 HG21 ILE 38 HG21 ILE 38 14.136 -6.937 7.001 252 HG22 ILE 38 HG22 ILE 38 12.742 -7.470 7.940 253 HG23 ILE 38 HG23 ILE 38 14.224 -6.984 8.761 254 HD11 ILE 38 HD11 ILE 38 10.391 -5.751 8.561 255 HD12 ILE 38 HD12 ILE 38 10.539 -5.734 10.319 256 HD13 ILE 38 HD13 ILE 38 11.312 -7.013 9.382 257 H PHE 39 HN PHE 39 13.374 -3.297 5.758 258 HA PHE 39 HA PHE 39 15.648 -3.872 4.082 259 HB2 PHE 39 HB2 PHE 39 14.228 -5.173 2.435 260 HB3 PHE 39 HB1 PHE 39 14.634 -6.028 3.918 261 HD1 PHE 39 HD1 PHE 39 12.965 -6.825 5.351 262 HD2 PHE 39 HD2 PHE 39 11.933 -4.161 2.205 263 HE1 PHE 39 HE1 PHE 39 10.585 -7.235 5.791 264 HE2 PHE 39 HE2 PHE 39 9.550 -4.568 2.644 265 HZ PHE 39 HZ PHE 39 8.872 -6.102 4.437 266 H HIS 40 HN HIS 40 15.698 -2.605 2.255 267 HA HIS 40 HA HIS 40 13.257 -1.056 1.655 268 HB2 HIS 40 HB2 HIS 40 16.013 -0.288 0.706 269 HB3 HIS 40 HB1 HIS 40 14.578 0.710 0.791 270 HD1 HIS 40 HD1 HIS 40 17.512 -0.389 2.745 271 HD2 HIS 40 HD2 HIS 40 13.979 1.687 3.397 272 HE1 HIS 40 HE1 HIS 40 17.795 0.744 4.968 273 HE2 HIS 40 HE2 HIS 40 15.580 1.854 5.415 274 H GLU 41 HN GLU 41 12.239 -2.018 -0.022 275 HA GLU 41 HA GLU 41 13.858 -3.122 -2.202 276 HB2 GLU 41 HB2 GLU 41 11.642 -4.620 -0.785 277 HB3 GLU 41 HB1 GLU 41 12.467 -5.169 -2.235 278 HG2 GLU 41 HG2 GLU 41 14.597 -5.165 -0.932 279 HG3 GLU 41 HG1 GLU 41 13.647 -4.812 0.508 280 H THR 42 HN THR 42 13.091 -2.569 -4.158 281 HA THR 42 HA THR 42 10.646 -1.216 -4.557 282 HB THR 42 HB THR 42 12.141 -2.774 -6.665 283 HG1 THR 42 HG1 THR 42 13.028 -0.451 -6.938 284 HG21 THR 42 HG21 THR 42 10.456 -0.279 -6.847 285 HG22 THR 42 HG22 THR 42 9.913 -1.903 -7.272 286 HG23 THR 42 HG23 THR 42 11.210 -1.138 -8.190 287 H VAL 43 HN VAL 43 8.622 -1.986 -4.917 288 HA VAL 43 HA VAL 43 8.259 -4.876 -5.079 289 HB VAL 43 HB VAL 43 8.564 -3.973 -2.667 290 HG11 VAL 43 HG11 VAL 43 7.112 -2.096 -2.731 291 HG12 VAL 43 HG12 VAL 43 6.423 -3.283 -1.620 292 HG13 VAL 43 HG13 VAL 43 5.750 -3.098 -3.238 293 HG21 VAL 43 HG21 VAL 43 7.956 -6.222 -3.075 294 HG22 VAL 43 HG22 VAL 43 6.296 -5.766 -3.470 295 HG23 VAL 43 HG23 VAL 43 6.889 -5.594 -1.817 296 H LYS 44 HN LYS 44 6.107 -5.515 -5.607 297 HA LYS 44 HA LYS 44 4.455 -3.395 -6.776 298 HB2 LYS 44 HB2 LYS 44 5.055 -5.620 -7.977 299 HB3 LYS 44 HB1 LYS 44 3.899 -6.353 -6.875 300 HG2 LYS 44 HG2 LYS 44 2.123 -4.982 -7.741 301 HG3 LYS 44 HG1 LYS 44 3.257 -4.149 -8.807 302 HD2 LYS 44 HD2 LYS 44 2.016 -5.872 -10.019 303 HD3 LYS 44 HD1 LYS 44 3.736 -6.256 -9.954 304 HE2 LYS 44 HE2 LYS 44 3.291 -7.778 -8.058 305 HE3 LYS 44 HE1 LYS 44 1.569 -7.430 -8.209 306 HZ1 LYS 44 HZ1 LYS 44 3.272 -8.688 -10.288 307 HZ2 LYS 44 HZ2 LYS 44 1.622 -8.356 -10.440 308 HZ3 LYS 44 HZ3 LYS 44 2.155 -9.492 -9.307 309 H VAL 45 HN VAL 45 3.059 -2.517 -5.405 310 HA VAL 45 HA VAL 45 2.153 -4.072 -3.105 311 HB VAL 45 HB VAL 45 3.055 -1.884 -2.599 312 HG11 VAL 45 HG11 VAL 45 1.995 0.173 -3.394 313 HG12 VAL 45 HG12 VAL 45 0.918 -0.776 -4.417 314 HG13 VAL 45 HG13 VAL 45 2.654 -0.775 -4.725 315 HG21 VAL 45 HG21 VAL 45 0.059 -1.884 -2.275 316 HG22 VAL 45 HG22 VAL 45 1.207 -0.926 -1.340 317 HG23 VAL 45 HG23 VAL 45 1.215 -2.685 -1.211 318 H THR 46 HN THR 46 0.165 -4.867 -2.937 319 HA THR 46 HA THR 46 -1.997 -3.686 -4.508 320 HB THR 46 HB THR 46 -1.073 -5.684 -5.755 321 HG1 THR 46 HG1 THR 46 -3.064 -5.551 -6.437 322 HG21 THR 46 HG21 THR 46 -1.643 -7.917 -4.919 323 HG22 THR 46 HG22 THR 46 -2.225 -7.208 -3.414 324 HG23 THR 46 HG23 THR 46 -0.517 -7.097 -3.836 325 H CYS 47 HN CYS 47 -4.140 -4.896 -3.735 326 HA CYS 47 HA CYS 47 -3.990 -4.911 -0.810 327 HB2 CYS 47 HB2 CYS 47 -5.645 -3.418 -1.210 328 HB3 CYS 47 HB1 CYS 47 -6.096 -4.137 -2.750 329 HG CYS 47 HG CYS 47 -7.407 -6.337 -1.379 330 H SER 48 HN SER 48 -4.953 -6.509 0.387 331 HA SER 48 HA SER 48 -4.460 -9.116 -0.513 332 HB2 SER 48 HB2 SER 48 -5.659 -9.783 1.612 333 HB3 SER 48 HB1 SER 48 -4.331 -8.647 1.830 334 HG SER 48 HG SER 48 -5.956 -6.968 1.807 335 H LYS 49 HN LYS 49 -5.897 -10.880 -0.729 336 HA LYS 49 HA LYS 49 -8.169 -10.358 -2.369 337 HB2 LYS 49 HB2 LYS 49 -7.397 -12.956 -1.027 338 HB3 LYS 49 HB1 LYS 49 -8.384 -12.758 -2.469 339 HG2 LYS 49 HG2 LYS 49 -6.516 -12.040 -3.750 340 HG3 LYS 49 HG1 LYS 49 -5.501 -11.922 -2.311 341 HD2 LYS 49 HD2 LYS 49 -5.783 -14.380 -2.003 342 HD3 LYS 49 HD1 LYS 49 -6.619 -14.427 -3.557 343 HE2 LYS 49 HE2 LYS 49 -4.634 -13.528 -4.656 344 HE3 LYS 49 HE1 LYS 49 -3.799 -13.458 -3.107 345 HZ1 LYS 49 HZ1 LYS 49 -3.149 -15.416 -4.322 346 HZ2 LYS 49 HZ2 LYS 49 -4.757 -15.914 -4.470 347 HZ3 LYS 49 HZ3 LYS 49 -4.023 -15.875 -2.949 348 H ASP 50 HN ASP 50 -7.591 -10.923 0.981 349 HA ASP 50 HA ASP 50 -10.349 -11.319 1.693 350 HB2 ASP 50 HB2 ASP 50 -8.598 -12.297 3.076 351 HB3 ASP 50 HB1 ASP 50 -7.895 -10.709 3.358 352 H GLY 51 HN GLY 51 -8.079 -8.651 1.534 353 HA2 GLY 51 HA2 GLY 51 -8.738 -6.455 1.001 354 HA3 GLY 51 HA1 GLY 51 -10.356 -6.829 1.571 355 H LYS 52 HN LYS 52 -8.085 -7.924 3.756 356 HA LYS 52 HA LYS 52 -8.747 -5.703 5.541 357 HB2 LYS 52 HB2 LYS 52 -9.249 -8.010 6.251 358 HB3 LYS 52 HB1 LYS 52 -7.542 -8.407 6.137 359 HG2 LYS 52 HG2 LYS 52 -7.106 -6.660 7.872 360 HG3 LYS 52 HG1 LYS 52 -8.854 -6.514 8.068 361 HD2 LYS 52 HD2 LYS 52 -8.995 -8.873 8.667 362 HD3 LYS 52 HD1 LYS 52 -7.253 -9.043 8.439 363 HE2 LYS 52 HE2 LYS 52 -6.928 -7.317 10.210 364 HE3 LYS 52 HE1 LYS 52 -8.666 -7.359 10.497 365 HZ1 LYS 52 HZ1 LYS 52 -7.586 -8.772 12.066 366 HZ2 LYS 52 HZ2 LYS 52 -6.750 -9.594 10.848 367 HZ3 LYS 52 HZ3 LYS 52 -8.429 -9.755 10.977 368 H MET 53 HN MET 53 -6.116 -6.920 3.719 369 HA MET 53 HA MET 53 -4.317 -5.133 5.170 370 HB2 MET 53 HB2 MET 53 -2.569 -6.706 5.387 371 HB3 MET 53 HB1 MET 53 -4.014 -7.520 5.965 372 HG2 MET 53 HG2 MET 53 -4.192 -8.757 3.906 373 HG3 MET 53 HG1 MET 53 -2.847 -7.857 3.214 374 HE1 MET 53 HE1 MET 53 -3.936 -10.426 5.981 375 HE2 MET 53 HE2 MET 53 -3.113 -9.182 6.922 376 HE3 MET 53 HE3 MET 53 -2.395 -10.784 6.759 377 H LEU 54 HN LEU 54 -2.204 -4.917 3.992 378 HA LEU 54 HA LEU 54 -2.778 -4.594 1.125 379 HB2 LEU 54 HB2 LEU 54 -2.311 -2.593 2.629 380 HB3 LEU 54 HB1 LEU 54 -0.678 -3.201 2.775 381 HG LEU 54 HG LEU 54 -0.450 -2.997 0.291 382 HD11 LEU 54 HD11 LEU 54 -3.080 -1.535 0.546 383 HD12 LEU 54 HD12 LEU 54 -2.813 -3.050 -0.318 384 HD13 LEU 54 HD13 LEU 54 -2.055 -1.563 -0.888 385 HD21 LEU 54 HD21 LEU 54 -1.144 -0.445 1.739 386 HD22 LEU 54 HD22 LEU 54 -0.064 -0.621 0.356 387 HD23 LEU 54 HD23 LEU 54 0.376 -1.319 1.912 388 H GLU 55 HN GLU 55 -1.905 -6.275 0.050 389 HA GLU 55 HA GLU 55 0.495 -7.540 1.141 390 HB2 GLU 55 HB2 GLU 55 -1.343 -8.530 -1.040 391 HB3 GLU 55 HB1 GLU 55 -0.026 -9.429 -0.303 392 HG2 GLU 55 HG2 GLU 55 -1.295 -9.115 1.901 393 HG3 GLU 55 HG1 GLU 55 -2.656 -8.650 0.883 394 H TRP 56 HN TRP 56 2.392 -7.569 0.086 395 HA TRP 56 HA TRP 56 2.425 -6.391 -2.597 396 HB2 TRP 56 HB2 TRP 56 4.688 -5.357 -1.805 397 HB3 TRP 56 HB1 TRP 56 3.169 -4.557 -1.427 398 HD1 TRP 56 HD1 TRP 56 5.008 -7.415 0.474 399 HE1 TRP 56 HE1 TRP 56 5.310 -6.651 2.914 400 HE3 TRP 56 HE3 TRP 56 2.947 -2.762 0.125 401 HZ2 TRP 56 HZ2 TRP 56 4.747 -4.383 4.480 402 HZ3 TRP 56 HZ3 TRP 56 2.868 -1.360 2.138 403 HH2 TRP 56 HH2 TRP 56 3.746 -2.152 4.271 404 H TYR 57 HN TYR 57 3.743 -7.256 -4.037 405 HA TYR 57 HA TYR 57 5.470 -9.475 -3.139 406 HB2 TYR 57 HB2 TYR 57 4.097 -9.157 -5.826 407 HB3 TYR 57 HB1 TYR 57 5.093 -10.524 -5.326 408 HD1 TYR 57 HD1 TYR 57 1.836 -8.872 -4.979 409 HD2 TYR 57 HD2 TYR 57 4.215 -12.195 -3.798 410 HE1 TYR 57 HE1 TYR 57 -0.173 -9.989 -4.107 411 HE2 TYR 57 HE2 TYR 57 2.209 -13.324 -2.924 412 HH TYR 57 HH TYR 57 -0.019 -12.742 -2.108 413 H LYS 58 HN LYS 58 7.532 -9.384 -3.710 414 HA LYS 58 HA LYS 58 9.010 -7.264 -4.303 415 HB2 LYS 58 HB2 LYS 58 10.722 -8.740 -5.245 416 HB3 LYS 58 HB1 LYS 58 9.957 -9.459 -3.831 417 HG2 LYS 58 HG2 LYS 58 8.992 -10.121 -6.585 418 HG3 LYS 58 HG1 LYS 58 10.412 -10.919 -5.918 419 HD2 LYS 58 HD2 LYS 58 9.188 -12.027 -4.301 420 HD3 LYS 58 HD1 LYS 58 7.883 -10.837 -4.324 421 HE2 LYS 58 HE2 LYS 58 7.023 -11.654 -6.346 422 HE3 LYS 58 HE1 LYS 58 8.492 -12.573 -6.690 423 HZ1 LYS 58 HZ1 LYS 58 6.651 -13.979 -5.970 424 HZ2 LYS 58 HZ2 LYS 58 6.583 -13.165 -4.492 425 HZ3 LYS 58 HZ3 LYS 58 7.954 -14.068 -4.898 426 H GLY 59 HN GLY 59 9.316 -5.828 -5.893 427 HA2 GLY 59 HA2 GLY 59 8.141 -6.474 -8.531 428 HA3 GLY 59 HA1 GLY 59 8.007 -4.891 -7.779 429 H LYS 60 HN LYS 60 10.965 -6.548 -7.400 430 HA LYS 60 HA LYS 60 12.333 -4.581 -9.010 431 HB2 LYS 60 HB2 LYS 60 13.281 -6.804 -7.211 432 HB3 LYS 60 HB1 LYS 60 14.388 -5.830 -8.171 433 HG2 LYS 60 HG2 LYS 60 13.791 -3.854 -7.017 434 HG3 LYS 60 HG1 LYS 60 12.430 -4.652 -6.227 435 HD2 LYS 60 HD2 LYS 60 15.257 -5.568 -5.820 436 HD3 LYS 60 HD1 LYS 60 14.551 -4.271 -4.854 437 HE2 LYS 60 HE2 LYS 60 12.769 -5.777 -4.117 438 HE3 LYS 60 HE1 LYS 60 13.446 -7.067 -5.114 439 HZ1 LYS 60 HZ1 LYS 60 15.015 -5.739 -2.986 440 HZ2 LYS 60 HZ2 LYS 60 15.350 -7.202 -3.768 441 HZ3 LYS 60 HZ3 LYS 60 14.054 -7.098 -2.677 442 H ASN 61 HN ASN 61 12.859 -8.097 -8.817 443 HA ASN 61 HA ASN 61 12.249 -8.699 -11.474 444 HB2 ASN 61 HB2 ASN 61 14.193 -7.249 -11.995 445 HB3 ASN 61 HB1 ASN 61 15.216 -8.289 -11.013 446 HD21 ASN 61 HD21 ASN 61 16.542 -8.820 -12.727 447 HD22 ASN 61 HD22 ASN 61 16.033 -9.862 -14.008 448 H ASP 62 HN ASP 62 15.260 -9.734 -9.972 449 HA ASP 62 HA ASP 62 13.948 -12.208 -9.064 450 HB2 ASP 62 HB2 ASP 62 15.182 -12.570 -11.212 451 HB3 ASP 62 HB1 ASP 62 16.660 -12.058 -10.406 452 H SER 63 HN SER 63 15.582 -9.518 -8.277 453 HA SER 63 HA SER 63 17.344 -10.655 -6.275 454 HB2 SER 63 HB2 SER 63 17.753 -8.100 -5.899 455 HB3 SER 63 HB1 SER 63 18.377 -8.871 -7.357 456 HG SER 63 HG SER 63 17.208 -7.522 -8.444 457 H ASP 64 HN ASP 64 14.742 -11.284 -5.734 458 HA ASP 64 HA ASP 64 13.773 -9.416 -3.718 459 HB2 ASP 64 HB2 ASP 64 11.954 -11.134 -3.424 460 HB3 ASP 64 HB1 ASP 64 12.047 -10.427 -5.032 461 H GLY 65 HN GLY 65 13.882 -9.720 -1.544 462 HA2 GLY 65 HA2 GLY 65 15.716 -11.861 -0.699 463 HA3 GLY 65 HA1 GLY 65 15.441 -10.354 0.159 464 H LYS 66 HN LYS 66 12.928 -12.466 -1.124 465 HA LYS 66 HA LYS 66 12.377 -13.541 1.508 466 HB2 LYS 66 HB2 LYS 66 11.226 -11.344 1.485 467 HB3 LYS 66 HB1 LYS 66 10.313 -11.860 0.079 468 HG2 LYS 66 HG2 LYS 66 9.032 -12.044 2.161 469 HG3 LYS 66 HG1 LYS 66 9.233 -13.592 1.346 470 HD2 LYS 66 HD2 LYS 66 9.565 -13.986 3.661 471 HD3 LYS 66 HD1 LYS 66 11.152 -14.048 2.906 472 HE2 LYS 66 HE2 LYS 66 10.080 -11.570 4.227 473 HE3 LYS 66 HE1 LYS 66 10.960 -12.807 5.115 474 HZ1 LYS 66 HZ1 LYS 66 11.979 -11.127 2.896 475 HZ2 LYS 66 HZ2 LYS 66 12.820 -12.453 3.522 476 HZ3 LYS 66 HZ3 LYS 66 12.483 -11.122 4.507 477 H LYS 67 HN LYS 67 11.756 -13.364 -1.908 478 HA LYS 67 HA LYS 67 10.969 -14.790 -3.450 479 HB2 LYS 67 HB2 LYS 67 11.905 -16.657 -1.326 480 HB3 LYS 67 HB1 LYS 67 10.944 -17.315 -2.644 481 HG2 LYS 67 HG2 LYS 67 13.356 -17.488 -3.069 482 HG3 LYS 67 HG1 LYS 67 12.534 -16.492 -4.269 483 HD2 LYS 67 HD2 LYS 67 13.257 -14.471 -2.980 484 HD3 LYS 67 HD1 LYS 67 14.217 -15.543 -1.953 485 HE2 LYS 67 HE2 LYS 67 15.651 -14.602 -3.635 486 HE3 LYS 67 HE1 LYS 67 15.426 -16.314 -3.982 487 HZ1 LYS 67 HZ1 LYS 67 13.793 -15.726 -5.660 488 HZ2 LYS 67 HZ2 LYS 67 15.264 -14.964 -5.984 489 HZ3 LYS 67 HZ3 LYS 67 13.982 -14.078 -5.320 490 H LYS 68 HN LYS 68 9.345 -13.655 -1.239 491 HA LYS 68 HA LYS 68 6.789 -14.714 -2.015 492 HB2 LYS 68 HB2 LYS 68 7.979 -15.207 0.692 493 HB3 LYS 68 HB1 LYS 68 6.272 -14.825 0.606 494 HG2 LYS 68 HG2 LYS 68 7.610 -17.099 -0.842 495 HG3 LYS 68 HG1 LYS 68 6.693 -17.237 0.662 496 HD2 LYS 68 HD2 LYS 68 4.713 -16.342 -0.496 497 HD3 LYS 68 HD1 LYS 68 5.634 -16.289 -1.998 498 HE2 LYS 68 HE2 LYS 68 5.955 -18.721 -1.864 499 HE3 LYS 68 HE1 LYS 68 4.984 -18.754 -0.393 500 HZ1 LYS 68 HZ1 LYS 68 4.033 -17.858 -3.060 501 HZ2 LYS 68 HZ2 LYS 68 3.104 -17.919 -1.649 502 HZ3 LYS 68 HZ3 LYS 68 3.683 -19.349 -2.341 503 HA PRO 69 HA PRO 69 5.503 -10.493 -0.795 504 HB2 PRO 69 HB2 PRO 69 4.120 -11.579 1.615 505 HB3 PRO 69 HB1 PRO 69 3.538 -10.431 0.406 506 HG2 PRO 69 HG2 PRO 69 2.723 -12.981 0.417 507 HG3 PRO 69 HG1 PRO 69 2.968 -12.084 -1.092 508 HD2 PRO 69 HD2 PRO 69 4.613 -14.225 0.124 509 HD3 PRO 69 HD1 PRO 69 4.409 -13.785 -1.579 510 H ILE 70 HN ILE 70 6.652 -9.019 0.308 511 HA ILE 70 HA ILE 70 8.779 -9.974 1.928 512 HB ILE 70 HB ILE 70 9.424 -7.532 2.106 513 HG12 ILE 70 HG12 ILE 70 7.211 -7.248 0.067 514 HG13 ILE 70 HG11 ILE 70 7.191 -6.565 1.696 515 HG21 ILE 70 HG21 ILE 70 10.396 -9.095 0.502 516 HG22 ILE 70 HG22 ILE 70 10.246 -7.477 -0.183 517 HG23 ILE 70 HG23 ILE 70 9.099 -8.739 -0.640 518 HD11 ILE 70 HD11 ILE 70 7.796 -4.809 0.272 519 HD12 ILE 70 HD12 ILE 70 8.934 -5.813 -0.623 520 HD13 ILE 70 HD13 ILE 70 9.301 -5.330 1.029 521 H GLY 71 HN GLY 71 5.794 -9.747 2.922 522 HA2 GLY 71 HA2 GLY 71 5.265 -9.950 5.258 523 HA3 GLY 71 HA1 GLY 71 6.561 -8.817 5.607 524 H SER 72 HN SER 72 3.570 -9.041 3.807 525 HA SER 72 HA SER 72 2.852 -6.367 3.666 526 HB2 SER 72 HB2 SER 72 0.937 -8.681 3.950 527 HB3 SER 72 HB1 SER 72 0.709 -7.189 3.038 528 HG SER 72 HG SER 72 1.629 -9.450 2.123 529 H PHE 73 HN PHE 73 1.074 -5.260 4.790 530 HA PHE 73 HA PHE 73 0.769 -6.081 7.605 531 HB2 PHE 73 HB2 PHE 73 1.143 -3.892 8.390 532 HB3 PHE 73 HB1 PHE 73 2.377 -4.102 7.153 533 HD1 PHE 73 HD1 PHE 73 2.026 -3.057 4.899 534 HD2 PHE 73 HD2 PHE 73 -0.480 -2.219 8.225 535 HE1 PHE 73 HE1 PHE 73 1.221 -1.020 3.776 536 HE2 PHE 73 HE2 PHE 73 -1.295 -0.194 7.112 537 HZ PHE 73 HZ PHE 73 -0.445 0.416 4.882 538 HA PRO 74 HA PRO 74 -3.542 -5.441 6.820 539 HB2 PRO 74 HB2 PRO 74 -4.250 -4.870 9.495 540 HB3 PRO 74 HB1 PRO 74 -4.283 -6.430 8.686 541 HG2 PRO 74 HG2 PRO 74 -2.563 -5.672 10.765 542 HG3 PRO 74 HG1 PRO 74 -2.429 -7.120 9.758 543 HD2 PRO 74 HD2 PRO 74 -0.926 -4.579 9.626 544 HD3 PRO 74 HD1 PRO 74 -0.454 -6.209 9.108 545 H LEU 75 HN LEU 75 -4.794 -3.818 6.164 546 HA LEU 75 HA LEU 75 -3.796 -1.170 6.278 547 HB2 LEU 75 HB2 LEU 75 -6.387 -2.303 5.250 548 HB3 LEU 75 HB1 LEU 75 -5.932 -0.621 5.072 549 HG LEU 75 HG LEU 75 -4.307 -2.913 3.971 550 HD11 LEU 75 HD11 LEU 75 -5.242 -2.316 1.797 551 HD12 LEU 75 HD12 LEU 75 -6.298 -1.134 2.569 552 HD13 LEU 75 HD13 LEU 75 -6.503 -2.852 2.906 553 HD21 LEU 75 HD21 LEU 75 -3.384 -1.029 2.567 554 HD22 LEU 75 HD22 LEU 75 -2.947 -0.997 4.274 555 HD23 LEU 75 HD23 LEU 75 -4.206 0.080 3.665 556 H ASN 76 HN ASN 76 -6.097 -2.884 8.218 557 HA ASN 76 HA ASN 76 -7.406 -0.523 9.182 558 HB2 ASN 76 HB2 ASN 76 -8.420 -2.055 10.884 559 HB3 ASN 76 HB1 ASN 76 -8.706 -2.516 9.215 560 HD21 ASN 76 HD21 ASN 76 -5.660 -3.110 10.888 561 HD22 ASN 76 HD22 ASN 76 -5.836 -4.829 10.954 562 H LYS 77 HN LYS 77 -4.350 -1.543 9.650 563 HA LYS 77 HA LYS 77 -4.244 -0.745 12.467 564 HB2 LYS 77 HB2 LYS 77 -2.065 -1.841 10.675 565 HB3 LYS 77 HB1 LYS 77 -1.889 -1.488 12.386 566 HG2 LYS 77 HG2 LYS 77 -3.698 -3.573 11.179 567 HG3 LYS 77 HG1 LYS 77 -2.163 -3.867 11.997 568 HD2 LYS 77 HD2 LYS 77 -4.561 -2.576 13.298 569 HD3 LYS 77 HD1 LYS 77 -4.184 -4.295 13.401 570 HE2 LYS 77 HE2 LYS 77 -2.037 -3.754 14.449 571 HE3 LYS 77 HE1 LYS 77 -2.429 -2.041 14.356 572 HZ1 LYS 77 HZ1 LYS 77 -4.368 -2.484 15.776 573 HZ2 LYS 77 HZ2 LYS 77 -2.909 -2.856 16.542 574 HZ3 LYS 77 HZ3 LYS 77 -3.879 -4.097 15.925 575 H ILE 78 HN ILE 78 -4.030 0.650 9.430 576 HA ILE 78 HA ILE 78 -1.808 2.365 9.700 577 HB ILE 78 HB ILE 78 -4.326 2.904 8.116 578 HG12 ILE 78 HG12 ILE 78 -1.732 1.638 7.213 579 HG13 ILE 78 HG11 ILE 78 -3.215 0.744 7.541 580 HG21 ILE 78 HG21 ILE 78 -2.953 4.890 8.454 581 HG22 ILE 78 HG22 ILE 78 -2.876 4.362 6.773 582 HG23 ILE 78 HG23 ILE 78 -1.533 4.024 7.866 583 HD11 ILE 78 HD11 ILE 78 -2.887 1.119 5.158 584 HD12 ILE 78 HD12 ILE 78 -2.877 2.863 5.430 585 HD13 ILE 78 HD13 ILE 78 -4.340 1.927 5.745 586 H THR 79 HN THR 79 -1.499 4.191 10.789 587 HA THR 79 HA THR 79 -3.745 5.214 12.358 588 HB THR 79 HB THR 79 -2.053 6.270 13.790 589 HG1 THR 79 HG1 THR 79 0.149 5.913 13.377 590 HG21 THR 79 HG21 THR 79 -1.059 4.235 14.716 591 HG22 THR 79 HG22 THR 79 -1.438 3.364 13.231 592 HG23 THR 79 HG23 THR 79 -2.740 3.958 14.262 593 H SER 80 HN SER 80 -1.389 6.120 9.934 594 HA SER 80 HA SER 80 -2.980 8.398 9.184 595 HB2 SER 80 HB2 SER 80 -1.608 9.281 11.086 596 HB3 SER 80 HB1 SER 80 -0.159 8.903 10.157 597 HG SER 80 HG SER 80 -1.348 11.132 10.088 598 H ILE 81 HN ILE 81 -2.875 8.591 7.026 599 HA ILE 81 HA ILE 81 -0.417 7.707 5.663 600 HB ILE 81 HB ILE 81 -2.034 6.113 5.044 601 HG12 ILE 81 HG12 ILE 81 -2.004 8.207 2.853 602 HG13 ILE 81 HG11 ILE 81 -0.803 6.942 3.087 603 HG21 ILE 81 HG21 ILE 81 -4.013 7.169 5.906 604 HG22 ILE 81 HG22 ILE 81 -4.293 6.663 4.237 605 HG23 ILE 81 HG23 ILE 81 -3.983 8.361 4.603 606 HD11 ILE 81 HD11 ILE 81 -2.261 6.328 1.291 607 HD12 ILE 81 HD12 ILE 81 -3.683 6.562 2.312 608 HD13 ILE 81 HD13 ILE 81 -2.552 5.257 2.664 609 H ARG 82 HN ARG 82 0.640 9.483 5.112 610 HA ARG 82 HA ARG 82 -0.800 11.559 3.629 611 HB2 ARG 82 HB2 ARG 82 0.733 13.276 4.795 612 HB3 ARG 82 HB1 ARG 82 -0.643 12.644 5.705 613 HG2 ARG 82 HG2 ARG 82 1.053 12.592 7.258 614 HG3 ARG 82 HG1 ARG 82 1.087 10.942 6.635 615 HD2 ARG 82 HD2 ARG 82 2.941 11.459 5.210 616 HD3 ARG 82 HD1 ARG 82 2.840 13.169 5.620 617 HE ARG 82 HE ARG 82 3.888 11.020 7.305 618 HH11 ARG 82 HH11 ARG 82 3.058 14.412 6.979 619 HH12 ARG 82 HH12 ARG 82 4.111 14.918 8.261 620 HH21 ARG 82 HH21 ARG 82 5.272 11.682 8.978 621 HH22 ARG 82 HH22 ARG 82 5.360 13.370 9.404 622 H THR 83 HN THR 83 0.553 12.838 2.246 623 HA THR 83 HA THR 83 2.592 11.257 0.986 624 HB THR 83 HB THR 83 1.998 14.163 0.429 625 HG1 THR 83 HG1 THR 83 0.268 12.108 0.291 626 HG21 THR 83 HG21 THR 83 2.620 13.540 -1.858 627 HG22 THR 83 HG22 THR 83 2.879 11.875 -1.333 628 HG23 THR 83 HG23 THR 83 3.916 13.165 -0.721 629 H LYS 84 HN LYS 84 4.838 11.664 1.009 630 HA LYS 84 HA LYS 84 5.796 12.745 3.426 631 HB2 LYS 84 HB2 LYS 84 7.022 11.036 2.077 632 HB3 LYS 84 HB1 LYS 84 7.463 12.330 0.965 633 HG2 LYS 84 HG2 LYS 84 8.995 13.187 2.357 634 HG3 LYS 84 HG1 LYS 84 7.983 12.937 3.784 635 HD2 LYS 84 HD2 LYS 84 9.786 11.498 4.122 636 HD3 LYS 84 HD1 LYS 84 8.529 10.449 3.459 637 HE2 LYS 84 HE2 LYS 84 10.390 9.839 2.224 638 HE3 LYS 84 HE1 LYS 84 9.601 11.023 1.179 639 HZ1 LYS 84 HZ1 LYS 84 11.918 11.513 2.963 640 HZ2 LYS 84 HZ2 LYS 84 11.116 12.721 2.092 641 HZ3 LYS 84 HZ3 LYS 84 11.937 11.483 1.273 642 H VAL 85 HN VAL 85 5.892 14.712 3.978 643 HA VAL 85 HA VAL 85 5.046 16.779 2.390 644 HB VAL 85 HB VAL 85 5.363 18.058 4.353 645 HG11 VAL 85 HG11 VAL 85 3.569 16.447 4.438 646 HG12 VAL 85 HG12 VAL 85 4.265 16.706 6.038 647 HG13 VAL 85 HG13 VAL 85 4.675 15.256 5.123 648 HG21 VAL 85 HG21 VAL 85 6.667 17.259 6.280 649 HG22 VAL 85 HG22 VAL 85 7.676 17.482 4.847 650 HG23 VAL 85 HG23 VAL 85 7.163 15.858 5.321 651 H ASP 86 HN ASP 86 8.241 15.501 2.756 652 HA ASP 86 HA ASP 86 9.407 17.994 1.731 653 HB2 ASP 86 HB2 ASP 86 11.405 17.461 2.709 654 HB3 ASP 86 HB1 ASP 86 10.311 16.636 3.806 655 H ASN 87 HN ASN 87 8.211 15.129 0.668 656 HA ASN 87 HA ASN 87 9.568 15.274 -1.878 657 HB2 ASN 87 HB2 ASN 87 11.057 13.810 -0.474 658 HB3 ASN 87 HB1 ASN 87 9.702 12.711 -0.266 659 HD21 ASN 87 HD21 ASN 87 12.306 12.263 -1.487 660 HD22 ASN 87 HD22 ASN 87 11.987 11.727 -3.099 661 H LEU 88 HN LEU 88 7.654 15.562 -2.901 662 HA LEU 88 HA LEU 88 5.263 14.304 -2.050 663 HB2 LEU 88 HB2 LEU 88 5.959 15.894 -4.504 664 HB3 LEU 88 HB1 LEU 88 4.350 15.258 -4.230 665 HG LEU 88 HG LEU 88 5.815 17.303 -2.558 666 HD11 LEU 88 HD11 LEU 88 3.974 18.765 -3.215 667 HD12 LEU 88 HD12 LEU 88 3.285 17.467 -4.191 668 HD13 LEU 88 HD13 LEU 88 4.846 18.162 -4.623 669 HD21 LEU 88 HD21 LEU 88 3.734 17.397 -1.220 670 HD22 LEU 88 HD22 LEU 88 4.601 15.873 -1.054 671 HD23 LEU 88 HD23 LEU 88 3.161 15.962 -2.068 672 H LYS 89 HN LYS 89 7.799 13.116 -3.911 673 HA LYS 89 HA LYS 89 6.147 11.356 -5.525 674 HB2 LYS 89 HB2 LYS 89 9.151 11.423 -5.136 675 HB3 LYS 89 HB1 LYS 89 8.306 10.367 -6.256 676 HG2 LYS 89 HG2 LYS 89 9.127 12.120 -7.566 677 HG3 LYS 89 HG1 LYS 89 7.416 12.482 -7.346 678 HD2 LYS 89 HD2 LYS 89 7.978 14.056 -5.558 679 HD3 LYS 89 HD1 LYS 89 9.691 13.689 -5.773 680 HE2 LYS 89 HE2 LYS 89 9.575 14.525 -8.068 681 HE3 LYS 89 HE1 LYS 89 7.866 14.897 -7.843 682 HZ1 LYS 89 HZ1 LYS 89 10.085 16.092 -6.275 683 HZ2 LYS 89 HZ2 LYS 89 8.447 16.488 -6.149 684 HZ3 LYS 89 HZ3 LYS 89 9.296 16.847 -7.565 685 H SER 90 HN SER 90 7.175 11.501 -2.390 686 HA SER 90 HA SER 90 7.072 8.583 -2.065 687 HB2 SER 90 HB2 SER 90 9.247 9.738 -1.456 688 HB3 SER 90 HB1 SER 90 8.357 10.551 -0.170 689 HG SER 90 HG SER 90 8.916 7.794 -0.470 690 H LEU 91 HN LEU 91 6.164 7.902 0.035 691 HA LEU 91 HA LEU 91 4.064 9.678 1.050 692 HB2 LEU 91 HB2 LEU 91 3.098 8.348 -0.783 693 HB3 LEU 91 HB1 LEU 91 3.654 6.880 -0.010 694 HG LEU 91 HG LEU 91 2.161 7.686 1.977 695 HD11 LEU 91 HD11 LEU 91 1.403 9.762 1.422 696 HD12 LEU 91 HD12 LEU 91 0.077 8.767 0.813 697 HD13 LEU 91 HD13 LEU 91 1.299 9.390 -0.295 698 HD21 LEU 91 HD21 LEU 91 1.681 5.655 0.914 699 HD22 LEU 91 HD22 LEU 91 1.215 6.456 -0.589 700 HD23 LEU 91 HD23 LEU 91 0.186 6.591 0.837 701 H GLU 92 HN GLU 92 4.344 9.693 3.205 702 HA GLU 92 HA GLU 92 5.602 7.386 4.479 703 HB2 GLU 92 HB2 GLU 92 6.447 9.672 4.998 704 HB3 GLU 92 HB1 GLU 92 4.879 10.056 5.701 705 HG2 GLU 92 HG2 GLU 92 5.263 8.045 7.220 706 HG3 GLU 92 HG1 GLU 92 6.936 8.104 6.673 707 H ILE 93 HN ILE 93 4.292 5.832 5.171 708 HA ILE 93 HA ILE 93 1.656 6.637 6.196 709 HB ILE 93 HB ILE 93 2.561 4.064 4.927 710 HG12 ILE 93 HG12 ILE 93 0.423 6.094 4.272 711 HG13 ILE 93 HG11 ILE 93 1.927 5.843 3.390 712 HG21 ILE 93 HG21 ILE 93 1.210 3.462 6.855 713 HG22 ILE 93 HG22 ILE 93 0.292 3.194 5.371 714 HG23 ILE 93 HG23 ILE 93 -0.037 4.613 6.367 715 HD11 ILE 93 HD11 ILE 93 -0.182 3.738 3.674 716 HD12 ILE 93 HD12 ILE 93 1.207 3.760 2.585 717 HD13 ILE 93 HD13 ILE 93 -0.122 4.899 2.350 718 H SER 94 HN SER 94 1.535 6.698 8.259 719 HA SER 94 HA SER 94 3.268 5.070 9.933 720 HB2 SER 94 HB2 SER 94 1.193 7.109 10.775 721 HB3 SER 94 HB1 SER 94 2.524 6.475 11.744 722 HG SER 94 HG SER 94 3.494 7.494 9.467 723 H VAL 95 HN VAL 95 2.603 3.241 10.826 724 HA VAL 95 HA VAL 95 -0.270 2.727 11.041 725 HB VAL 95 HB VAL 95 0.081 1.646 9.013 726 HG11 VAL 95 HG11 VAL 95 2.791 0.835 10.028 727 HG12 VAL 95 HG12 VAL 95 2.406 1.949 8.711 728 HG13 VAL 95 HG13 VAL 95 2.079 0.224 8.534 729 HG21 VAL 95 HG21 VAL 95 -0.889 0.064 10.572 730 HG22 VAL 95 HG22 VAL 95 0.721 -0.469 11.059 731 HG23 VAL 95 HG23 VAL 95 0.153 -0.768 9.417 732 H SER 96 HN SER 96 -0.845 1.206 12.623 733 HA SER 96 HA SER 96 0.883 1.035 14.858 734 HB2 SER 96 HB2 SER 96 -1.504 1.073 15.211 735 HB3 SER 96 HB1 SER 96 -1.727 -0.345 14.193 736 HG SER 96 HG SER 96 -0.536 -0.189 16.759 737 H SER 97 HN SER 97 2.623 -0.182 14.863 738 HA SER 97 HA SER 97 2.696 -2.594 13.209 739 HB2 SER 97 HB2 SER 97 5.027 -1.698 12.519 740 HB3 SER 97 HB1 SER 97 3.594 -1.005 11.763 741 HG SER 97 HG SER 97 3.733 0.746 13.171 742 H VAL 98 HN VAL 98 4.341 -4.039 13.649 743 HA VAL 98 HA VAL 98 5.450 -3.928 16.361 744 HB VAL 98 HB VAL 98 5.986 -6.365 15.925 745 HG11 VAL 98 HG11 VAL 98 3.658 -7.134 16.218 746 HG12 VAL 98 HG12 VAL 98 3.090 -5.525 15.768 747 HG13 VAL 98 HG13 VAL 98 4.044 -5.746 17.235 748 HG21 VAL 98 HG21 VAL 98 5.952 -6.251 13.468 749 HG22 VAL 98 HG22 VAL 98 4.214 -5.947 13.513 750 HG23 VAL 98 HG23 VAL 98 4.855 -7.490 14.080 751 H HIS 99 HN HIS 99 7.735 -5.529 15.981 752 HA HIS 99 HA HIS 99 9.667 -3.710 15.505 753 HB2 HIS 99 HB2 HIS 99 9.748 -6.666 14.950 754 HB3 HIS 99 HB1 HIS 99 11.175 -5.650 14.792 755 HD1 HIS 99 HD1 HIS 99 11.902 -4.371 17.058 756 HD2 HIS 99 HD2 HIS 99 9.261 -7.549 17.483 757 HE1 HIS 99 HE1 HIS 99 12.006 -5.014 19.485 758 HE2 HIS 99 HE2 HIS 99 10.314 -6.859 19.741 759 H ILE 100 HN ILE 100 9.478 -2.291 13.883 760 HA ILE 100 HA ILE 100 10.609 -2.632 11.413 761 HB ILE 100 HB ILE 100 8.559 -4.120 11.003 762 HG12 ILE 100 HG12 ILE 100 8.948 -1.730 9.188 763 HG13 ILE 100 HG11 ILE 100 9.949 -3.176 9.196 764 HG21 ILE 100 HG21 ILE 100 6.478 -2.941 10.384 765 HG22 ILE 100 HG22 ILE 100 7.171 -1.443 11.006 766 HG23 ILE 100 HG23 ILE 100 6.862 -2.795 12.098 767 HD11 ILE 100 HD11 ILE 100 8.366 -3.222 7.367 768 HD12 ILE 100 HD12 ILE 100 7.027 -3.056 8.501 769 HD13 ILE 100 HD13 ILE 100 8.021 -4.512 8.519 770 H SER 101 HN SER 101 10.535 -0.661 10.212 771 HA SER 101 HA SER 101 9.754 1.604 11.816 772 HB2 SER 101 HB2 SER 101 11.343 1.362 9.285 773 HB3 SER 101 HB1 SER 101 10.914 2.917 9.990 774 HG SER 101 HG SER 101 11.983 1.191 11.814 775 H THR 102 HN THR 102 8.939 3.551 10.472 776 HA THR 102 HA THR 102 6.300 3.025 9.686 777 HB THR 102 HB THR 102 8.072 5.428 9.155 778 HG1 THR 102 HG1 THR 102 6.465 4.584 11.316 779 HG21 THR 102 HG21 THR 102 5.063 5.196 9.067 780 HG22 THR 102 HG22 THR 102 6.128 5.482 7.690 781 HG23 THR 102 HG23 THR 102 5.976 6.701 8.957 782 H TYR 103 HN TYR 103 5.336 2.990 7.634 783 HA TYR 103 HA TYR 103 7.104 1.791 5.667 784 HB2 TYR 103 HB2 TYR 103 5.285 0.408 5.944 785 HB3 TYR 103 HB1 TYR 103 4.180 1.738 6.249 786 HD1 TYR 103 HD1 TYR 103 2.518 1.966 4.722 787 HD2 TYR 103 HD2 TYR 103 6.301 0.561 3.360 788 HE1 TYR 103 HE1 TYR 103 1.623 1.786 2.444 789 HE2 TYR 103 HE2 TYR 103 5.403 0.386 1.073 790 HH TYR 103 HH TYR 103 2.404 1.730 0.158 791 H LEU 104 HN LEU 104 7.895 2.874 4.063 792 HA LEU 104 HA LEU 104 6.554 5.323 3.192 793 HB2 LEU 104 HB2 LEU 104 9.370 4.469 3.385 794 HB3 LEU 104 HB1 LEU 104 8.966 5.464 1.992 795 HG LEU 104 HG LEU 104 8.191 6.281 4.786 796 HD11 LEU 104 HD11 LEU 104 10.609 5.927 4.795 797 HD12 LEU 104 HD12 LEU 104 10.222 7.646 4.859 798 HD13 LEU 104 HD13 LEU 104 10.768 6.921 3.348 799 HD21 LEU 104 HD21 LEU 104 8.131 8.491 3.814 800 HD22 LEU 104 HD22 LEU 104 7.119 7.396 2.872 801 HD23 LEU 104 HD23 LEU 104 8.712 7.863 2.273 802 H PHE 105 HN PHE 105 5.373 5.164 1.530 803 HA PHE 105 HA PHE 105 5.878 3.190 -0.568 804 HB2 PHE 105 HB2 PHE 105 3.608 3.264 0.171 805 HB3 PHE 105 HB1 PHE 105 3.577 5.015 0.150 806 HD1 PHE 105 HD1 PHE 105 3.500 6.206 -2.044 807 HD2 PHE 105 HD2 PHE 105 2.995 1.997 -1.710 808 HE1 PHE 105 HE1 PHE 105 2.434 6.164 -4.252 809 HE2 PHE 105 HE2 PHE 105 1.934 1.955 -3.929 810 HZ PHE 105 HZ PHE 105 1.650 4.042 -5.201 811 H THR 106 HN THR 106 7.270 3.866 -2.125 812 HA THR 106 HA THR 106 7.282 6.745 -2.737 813 HB THR 106 HB THR 106 9.680 4.912 -2.736 814 HG1 THR 106 HG1 THR 106 8.906 5.348 -0.622 815 HG21 THR 106 HG21 THR 106 10.967 6.990 -2.946 816 HG22 THR 106 HG22 THR 106 9.465 7.913 -3.035 817 HG23 THR 106 HG23 THR 106 9.879 6.770 -4.315 818 H PHE 107 HN PHE 107 7.035 7.322 -4.771 819 HA PHE 107 HA PHE 107 7.326 5.269 -6.865 820 HB2 PHE 107 HB2 PHE 107 5.146 6.989 -6.263 821 HB3 PHE 107 HB1 PHE 107 5.840 7.538 -7.781 822 HD1 PHE 107 HD1 PHE 107 3.402 5.523 -6.458 823 HD2 PHE 107 HD2 PHE 107 6.487 5.428 -9.380 824 HE1 PHE 107 HE1 PHE 107 2.220 3.727 -7.649 825 HE2 PHE 107 HE2 PHE 107 5.316 3.635 -10.576 826 HZ PHE 107 HZ PHE 107 3.180 2.779 -9.712 827 H LYS 108 HN LYS 108 7.598 6.517 -9.073 828 HA LYS 108 HA LYS 108 10.014 8.038 -8.741 829 HB2 LYS 108 HB2 LYS 108 9.938 7.866 -11.362 830 HB3 LYS 108 HB1 LYS 108 10.419 6.501 -10.373 831 HG2 LYS 108 HG2 LYS 108 9.017 5.672 -12.051 832 HG3 LYS 108 HG1 LYS 108 8.055 5.677 -10.582 833 HD2 LYS 108 HD2 LYS 108 6.795 7.526 -11.292 834 HD3 LYS 108 HD1 LYS 108 7.966 7.939 -12.547 835 HE2 LYS 108 HE2 LYS 108 7.443 5.794 -13.658 836 HE3 LYS 108 HE1 LYS 108 6.168 5.533 -12.473 837 HZ1 LYS 108 HZ1 LYS 108 5.135 7.610 -13.248 838 HZ2 LYS 108 HZ2 LYS 108 5.243 6.450 -14.469 839 HZ3 LYS 108 HZ3 LYS 108 6.324 7.747 -14.442 840 H THR 109 HN THR 109 6.727 8.681 -9.250 841 HA THR 109 HA THR 109 7.370 11.508 -9.626 842 HB THR 109 HB THR 109 5.562 11.825 -11.258 843 HG1 THR 109 HG1 THR 109 4.580 9.976 -12.194 844 HG21 THR 109 HG21 THR 109 7.791 11.480 -12.158 845 HG22 THR 109 HG22 THR 109 6.594 10.719 -13.207 846 HG23 THR 109 HG23 THR 109 7.560 9.732 -12.108 847 H ARG 110 HN ARG 110 5.529 12.927 -8.979 848 HA ARG 110 HA ARG 110 4.233 11.934 -6.647 849 HB2 ARG 110 HB2 ARG 110 4.725 14.274 -6.675 850 HB3 ARG 110 HB1 ARG 110 3.855 14.507 -8.192 851 HG2 ARG 110 HG2 ARG 110 1.840 13.573 -6.753 852 HG3 ARG 110 HG1 ARG 110 2.819 14.190 -5.425 853 HD2 ARG 110 HD2 ARG 110 2.815 16.399 -6.385 854 HD3 ARG 110 HD1 ARG 110 1.996 15.807 -7.832 855 HE ARG 110 HE ARG 110 0.744 15.783 -5.155 856 HH11 ARG 110 HH11 ARG 110 0.615 16.465 -8.591 857 HH12 ARG 110 HH12 ARG 110 -1.074 16.852 -8.578 858 HH21 ARG 110 HH21 ARG 110 -1.490 16.286 -5.142 859 HH22 ARG 110 HH22 ARG 110 -2.276 16.733 -6.623 860 H GLU 111 HN GLU 111 3.140 12.664 -9.938 861 HA GLU 111 HA GLU 111 0.406 12.441 -9.540 862 HB2 GLU 111 HB2 GLU 111 1.990 11.689 -12.000 863 HB3 GLU 111 HB1 GLU 111 0.249 11.934 -11.955 864 HG2 GLU 111 HG2 GLU 111 0.682 14.268 -11.178 865 HG3 GLU 111 HG1 GLU 111 2.396 13.980 -11.478 866 H GLU 112 HN GLU 112 2.784 9.902 -10.041 867 HA GLU 112 HA GLU 112 0.909 7.815 -10.451 868 HB2 GLU 112 HB2 GLU 112 3.817 7.802 -9.645 869 HB3 GLU 112 HB1 GLU 112 2.887 6.328 -9.898 870 HG2 GLU 112 HG2 GLU 112 3.540 8.460 -11.905 871 HG3 GLU 112 HG1 GLU 112 4.118 6.796 -11.873 872 H ARG 113 HN ARG 113 2.709 8.885 -7.563 873 HA ARG 113 HA ARG 113 1.506 6.876 -5.922 874 HB2 ARG 113 HB2 ARG 113 2.532 8.148 -4.015 875 HB3 ARG 113 HB1 ARG 113 3.655 7.591 -5.234 876 HG2 ARG 113 HG2 ARG 113 4.373 9.732 -4.662 877 HG3 ARG 113 HG1 ARG 113 3.554 9.935 -6.198 878 HD2 ARG 113 HD2 ARG 113 3.143 11.601 -4.221 879 HD3 ARG 113 HD1 ARG 113 1.821 11.105 -5.273 880 HE ARG 113 HE ARG 113 2.057 9.422 -2.982 881 HH11 ARG 113 HH11 ARG 113 0.976 12.593 -3.962 882 HH12 ARG 113 HH12 ARG 113 -0.371 12.615 -2.873 883 HH21 ARG 113 HH21 ARG 113 0.241 9.435 -1.574 884 HH22 ARG 113 HH22 ARG 113 -0.789 10.827 -1.523 885 H GLU 114 HN GLU 114 0.780 10.143 -6.749 886 HA GLU 114 HA GLU 114 -0.930 10.919 -4.718 887 HB2 GLU 114 HB2 GLU 114 -0.098 12.002 -7.068 888 HB3 GLU 114 HB1 GLU 114 -1.777 11.652 -7.451 889 HG2 GLU 114 HG2 GLU 114 -0.886 13.244 -5.062 890 HG3 GLU 114 HG1 GLU 114 -1.358 13.948 -6.605 891 H SER 115 HN SER 115 -1.738 9.199 -7.714 892 HA SER 115 HA SER 115 -4.471 8.915 -7.306 893 HB2 SER 115 HB2 SER 115 -3.320 8.382 -9.430 894 HB3 SER 115 HB1 SER 115 -2.582 6.974 -8.669 895 HG SER 115 HG SER 115 -5.295 7.431 -9.310 896 H TRP 116 HN TRP 116 -1.771 7.014 -6.091 897 HA TRP 116 HA TRP 116 -3.225 4.752 -5.293 898 HB2 TRP 116 HB2 TRP 116 -0.727 4.955 -5.594 899 HB3 TRP 116 HB1 TRP 116 -0.677 5.758 -4.029 900 HD1 TRP 116 HD1 TRP 116 -1.135 2.355 -5.646 901 HE1 TRP 116 HE1 TRP 116 -0.967 0.537 -3.842 902 HE3 TRP 116 HE3 TRP 116 -1.141 5.339 -1.474 903 HZ2 TRP 116 HZ2 TRP 116 -0.860 0.384 -1.036 904 HZ3 TRP 116 HZ3 TRP 116 -1.005 4.262 0.727 905 HH2 TRP 116 HH2 TRP 116 -0.867 1.835 0.945 906 H GLN 117 HN GLN 117 -1.911 7.382 -3.191 907 HA GLN 117 HA GLN 117 -3.211 6.542 -0.881 908 HB2 GLN 117 HB2 GLN 117 -1.478 8.198 -0.707 909 HB3 GLN 117 HB1 GLN 117 -2.392 9.340 -1.676 910 HG2 GLN 117 HG2 GLN 117 -4.158 9.293 0.102 911 HG3 GLN 117 HG1 GLN 117 -3.041 8.350 1.088 912 HE21 GLN 117 HE21 GLN 117 -4.144 10.826 1.809 913 HE22 GLN 117 HE22 GLN 117 -2.846 11.969 1.937 914 H ASN 118 HN ASN 118 -4.384 8.628 -3.486 915 HA ASN 118 HA ASN 118 -6.718 9.563 -2.284 916 HB2 ASN 118 HB2 ASN 118 -6.047 8.927 -5.148 917 HB3 ASN 118 HB1 ASN 118 -7.653 9.481 -4.704 918 HD21 ASN 118 HD21 ASN 118 -4.739 10.617 -3.106 919 HD22 ASN 118 HD22 ASN 118 -4.759 12.213 -3.790 920 H ASN 119 HN ASN 119 -6.089 6.548 -3.986 921 HA ASN 119 HA ASN 119 -8.779 5.577 -3.782 922 HB2 ASN 119 HB2 ASN 119 -6.219 4.084 -4.399 923 HB3 ASN 119 HB1 ASN 119 -7.854 3.499 -4.685 924 HD21 ASN 119 HD21 ASN 119 -5.560 4.013 -6.475 925 HD22 ASN 119 HD22 ASN 119 -6.156 5.071 -7.699 926 H LEU 120 HN LEU 120 -5.697 4.747 -2.218 927 HA LEU 120 HA LEU 120 -6.754 2.634 -0.679 928 HB2 LEU 120 HB2 LEU 120 -4.339 3.014 -1.298 929 HB3 LEU 120 HB1 LEU 120 -4.285 4.252 -0.065 930 HG LEU 120 HG LEU 120 -3.360 1.912 0.498 931 HD11 LEU 120 HD11 LEU 120 -4.085 2.075 2.817 932 HD12 LEU 120 HD12 LEU 120 -5.359 3.200 2.345 933 HD13 LEU 120 HD13 LEU 120 -3.665 3.657 2.163 934 HD21 LEU 120 HD21 LEU 120 -4.965 0.304 1.334 935 HD22 LEU 120 HD22 LEU 120 -5.274 0.644 -0.369 936 HD23 LEU 120 HD23 LEU 120 -6.297 1.363 0.874 937 H GLU 121 HN GLU 121 -6.338 6.078 -0.004 938 HA GLU 121 HA GLU 121 -6.779 5.939 2.771 939 HB2 GLU 121 HB2 GLU 121 -5.909 7.932 1.477 940 HB3 GLU 121 HB1 GLU 121 -7.571 8.243 0.991 941 HG2 GLU 121 HG2 GLU 121 -8.195 8.440 3.369 942 HG3 GLU 121 HG1 GLU 121 -6.498 8.230 3.801 943 H SER 122 HN SER 122 -9.016 6.367 0.056 944 HA SER 122 HA SER 122 -11.354 6.628 1.638 945 HB2 SER 122 HB2 SER 122 -11.158 5.579 -1.198 946 HB3 SER 122 HB1 SER 122 -12.561 6.329 -0.435 947 HG SER 122 HG SER 122 -10.631 7.519 -1.780 948 H PHE 123 HN PHE 123 -9.794 3.853 0.070 949 HA PHE 123 HA PHE 123 -11.642 1.888 0.853 950 HB2 PHE 123 HB2 PHE 123 -9.869 1.529 -0.827 951 HB3 PHE 123 HB1 PHE 123 -8.650 1.648 0.434 952 HD1 PHE 123 HD1 PHE 123 -11.881 -0.191 0.584 953 HD2 PHE 123 HD2 PHE 123 -7.639 -0.435 0.327 954 HE1 PHE 123 HE1 PHE 123 -11.997 -2.628 0.914 955 HE2 PHE 123 HE2 PHE 123 -7.754 -2.866 0.663 956 HZ PHE 123 HZ PHE 123 -9.935 -3.965 0.954 957 H ARG 124 HN ARG 124 -8.837 3.276 2.461 958 HA ARG 124 HA ARG 124 -8.948 1.723 4.813 959 HB2 ARG 124 HB2 ARG 124 -6.967 3.004 4.296 960 HB3 ARG 124 HB1 ARG 124 -7.881 4.506 4.305 961 HG2 ARG 124 HG2 ARG 124 -8.340 4.137 6.717 962 HG3 ARG 124 HG1 ARG 124 -7.258 2.744 6.659 963 HD2 ARG 124 HD2 ARG 124 -5.420 4.175 5.975 964 HD3 ARG 124 HD1 ARG 124 -6.495 5.572 5.947 965 HE ARG 124 HE ARG 124 -6.034 4.080 8.437 966 HH11 ARG 124 HH11 ARG 124 -5.923 7.070 6.618 967 HH12 ARG 124 HH12 ARG 124 -5.542 8.046 8.000 968 HH21 ARG 124 HH21 ARG 124 -5.521 5.358 10.251 969 HH22 ARG 124 HH22 ARG 124 -5.310 7.074 10.058 970 H LYS 125 HN LYS 125 -10.534 4.741 3.859 971 HA LYS 125 HA LYS 125 -11.653 5.343 6.369 972 HB2 LYS 125 HB2 LYS 125 -12.675 6.052 3.616 973 HB3 LYS 125 HB1 LYS 125 -13.298 6.717 5.120 974 HG2 LYS 125 HG2 LYS 125 -11.070 7.656 5.592 975 HG3 LYS 125 HG1 LYS 125 -10.516 7.056 4.028 976 HD2 LYS 125 HD2 LYS 125 -12.232 8.425 2.915 977 HD3 LYS 125 HD1 LYS 125 -12.736 9.048 4.488 978 HE2 LYS 125 HE2 LYS 125 -10.480 9.965 4.825 979 HE3 LYS 125 HE1 LYS 125 -10.014 9.374 3.231 980 HZ1 LYS 125 HZ1 LYS 125 -12.071 11.430 3.823 981 HZ2 LYS 125 HZ2 LYS 125 -11.769 10.798 2.286 982 HZ3 LYS 125 HZ3 LYS 125 -10.571 11.680 3.087 983 H ILE 126 HN ILE 126 -12.679 3.155 3.840 984 HA ILE 126 HA ILE 126 -15.296 2.726 4.856 985 HB ILE 126 HB ILE 126 -13.608 0.864 3.177 986 HG12 ILE 126 HG12 ILE 126 -15.682 2.868 2.268 987 HG13 ILE 126 HG11 ILE 126 -13.950 3.172 2.227 988 HG21 ILE 126 HG21 ILE 126 -15.485 -0.263 4.206 989 HG22 ILE 126 HG22 ILE 126 -15.783 -0.056 2.480 990 HG23 ILE 126 HG23 ILE 126 -16.585 0.996 3.643 991 HD11 ILE 126 HD11 ILE 126 -15.403 1.005 0.728 992 HD12 ILE 126 HD12 ILE 126 -13.663 1.294 0.696 993 HD13 ILE 126 HD13 ILE 126 -14.771 2.506 0.050 994 H MET 127 HN MET 127 -12.164 1.528 5.746 995 HA MET 127 HA MET 127 -13.385 -0.656 7.283 996 HB2 MET 127 HB2 MET 127 -10.511 -0.188 6.484 997 HB3 MET 127 HB1 MET 127 -11.067 -1.540 7.459 998 HG2 MET 127 HG2 MET 127 -12.415 -2.350 5.624 999 HG3 MET 127 HG1 MET 127 -11.962 -0.956 4.647 1000 HE1 MET 127 HE1 MET 127 -8.873 -0.586 5.219 1001 HE2 MET 127 HE2 MET 127 -9.603 -0.556 3.614 1002 HE3 MET 127 HE3 MET 127 -8.194 -1.573 3.926 1003 H SER 128 HN SER 128 -11.123 2.056 7.634 1004 HA SER 128 HA SER 128 -10.946 1.578 10.507 1005 HB2 SER 128 HB2 SER 128 -9.518 3.626 8.795 1006 HB3 SER 128 HB1 SER 128 -9.150 3.228 10.472 1007 HG SER 128 HG SER 128 -8.796 1.023 9.649 1008 H MET 129 HN MET 129 -12.173 3.940 8.221 1009 HA MET 129 HA MET 129 -13.270 5.523 10.441 1010 HB2 MET 129 HB2 MET 129 -13.031 6.206 7.485 1011 HB3 MET 129 HB1 MET 129 -13.707 7.261 8.725 1012 HG2 MET 129 HG2 MET 129 -11.566 7.360 9.855 1013 HG3 MET 129 HG1 MET 129 -10.874 6.246 8.679 1014 HE1 MET 129 HE1 MET 129 -9.513 9.002 9.390 1015 HE2 MET 129 HE2 MET 129 -9.089 9.600 7.786 1016 HE3 MET 129 HE3 MET 129 -8.875 7.893 8.175 1017 H LYS 130 HN LYS 130 -14.251 2.979 9.783 1018 HA LYS 130 HA LYS 130 -16.375 2.936 7.950 1019 HB2 LYS 130 HB2 LYS 130 -15.156 0.952 8.845 1020 HB3 LYS 130 HB1 LYS 130 -15.969 1.188 10.383 1021 HG2 LYS 130 HG2 LYS 130 -18.141 0.872 9.223 1022 HG3 LYS 130 HG1 LYS 130 -17.247 0.491 7.749 1023 HD2 LYS 130 HD2 LYS 130 -17.099 -1.009 10.365 1024 HD3 LYS 130 HD1 LYS 130 -17.923 -1.546 8.901 1025 HE2 LYS 130 HE2 LYS 130 -15.793 -1.608 7.713 1026 HE3 LYS 130 HE1 LYS 130 -14.962 -1.028 9.155 1027 HZ1 LYS 130 HZ1 LYS 130 -15.632 -3.036 10.310 1028 HZ2 LYS 130 HZ2 LYS 130 -14.757 -3.419 8.916 1029 HZ3 LYS 130 HZ3 LYS 130 -16.437 -3.591 8.932 Start of MODEL 2 1 H1 SER 12 HT1 SER 12 -21.530 -8.198 -5.766 2 H2 SER 12 HT2 SER 12 -20.222 -8.647 -4.784 3 H3 SER 12 HT3 SER 12 -20.360 -7.054 -5.336 4 HA SER 12 HA SER 12 -22.325 -8.359 -3.560 5 HB2 SER 12 HB2 SER 12 -20.107 -8.121 -2.474 6 HB3 SER 12 HB1 SER 12 -20.129 -6.399 -2.844 7 HG SER 12 HG SER 12 -21.917 -7.824 -1.152 8 H ALA 13 HN ALA 13 -23.786 -7.414 -5.159 9 HA ALA 13 HA ALA 13 -25.384 -5.939 -5.721 10 HB1 ALA 13 HB1 ALA 13 -24.512 -4.496 -3.228 11 HB2 ALA 13 HB2 ALA 13 -25.737 -5.760 -3.329 12 HB3 ALA 13 HB3 ALA 13 -26.007 -4.205 -4.117 13 H LYS 14 HN LYS 14 -23.483 -3.411 -4.266 14 HA LYS 14 HA LYS 14 -22.701 -2.413 -6.901 15 HB2 LYS 14 HB2 LYS 14 -24.171 -0.806 -4.802 16 HB3 LYS 14 HB1 LYS 14 -23.318 -0.084 -6.154 17 HG2 LYS 14 HG2 LYS 14 -25.467 -0.109 -6.934 18 HG3 LYS 14 HG1 LYS 14 -24.851 -1.627 -7.586 19 HD2 LYS 14 HD2 LYS 14 -25.891 -2.867 -5.797 20 HD3 LYS 14 HD1 LYS 14 -26.403 -1.372 -5.013 21 HE2 LYS 14 HE2 LYS 14 -27.766 -0.853 -7.024 22 HE3 LYS 14 HE1 LYS 14 -27.325 -2.428 -7.680 23 HZ1 LYS 14 HZ1 LYS 14 -28.770 -1.997 -5.122 24 HZ2 LYS 14 HZ2 LYS 14 -28.409 -3.491 -5.826 25 HZ3 LYS 14 HZ3 LYS 14 -29.495 -2.441 -6.584 26 H ASP 15 HN ASP 15 -20.868 -3.613 -5.575 27 HA ASP 15 HA ASP 15 -18.703 -3.342 -4.965 28 HB2 ASP 15 HB2 ASP 15 -19.298 -0.391 -4.933 29 HB3 ASP 15 HB1 ASP 15 -17.700 -1.115 -4.824 30 H ILE 16 HN ILE 16 -20.563 -4.000 -2.976 31 HA ILE 16 HA ILE 16 -19.844 -2.284 -0.734 32 HB ILE 16 HB ILE 16 -21.923 -4.446 -0.984 33 HG12 ILE 16 HG12 ILE 16 -23.346 -2.540 -0.067 34 HG13 ILE 16 HG11 ILE 16 -21.952 -1.497 -0.312 35 HG21 ILE 16 HG21 ILE 16 -22.453 -4.140 1.393 36 HG22 ILE 16 HG22 ILE 16 -21.041 -3.098 1.572 37 HG23 ILE 16 HG23 ILE 16 -20.834 -4.802 1.172 38 HD11 ILE 16 HD11 ILE 16 -22.009 -2.035 -2.708 39 HD12 ILE 16 HD12 ILE 16 -23.493 -1.271 -2.137 40 HD13 ILE 16 HD13 ILE 16 -23.452 -3.008 -2.427 41 H LYS 17 HN LYS 17 -20.150 -5.881 -0.707 42 HA LYS 17 HA LYS 17 -18.109 -5.967 1.296 43 HB2 LYS 17 HB2 LYS 17 -19.487 -8.189 -0.200 44 HB3 LYS 17 HB1 LYS 17 -18.377 -8.440 1.137 45 HG2 LYS 17 HG2 LYS 17 -20.996 -6.960 1.275 46 HG3 LYS 17 HG1 LYS 17 -20.693 -8.599 1.851 47 HD2 LYS 17 HD2 LYS 17 -18.953 -7.652 3.378 48 HD3 LYS 17 HD1 LYS 17 -19.488 -6.042 2.894 49 HE2 LYS 17 HE2 LYS 17 -20.547 -6.659 4.975 50 HE3 LYS 17 HE1 LYS 17 -21.754 -6.583 3.691 51 HZ1 LYS 17 HZ1 LYS 17 -20.495 -9.066 4.724 52 HZ2 LYS 17 HZ2 LYS 17 -21.671 -8.986 3.511 53 HZ3 LYS 17 HZ3 LYS 17 -22.054 -8.526 5.093 54 H ASP 18 HN ASP 18 -18.233 -7.657 -1.816 55 HA ASP 18 HA ASP 18 -15.418 -8.252 -1.625 56 HB2 ASP 18 HB2 ASP 18 -15.948 -9.445 -3.866 57 HB3 ASP 18 HB1 ASP 18 -16.635 -10.084 -2.375 58 H GLU 19 HN GLU 19 -17.480 -6.518 -3.912 59 HA GLU 19 HA GLU 19 -15.489 -6.042 -5.800 60 HB2 GLU 19 HB2 GLU 19 -18.198 -4.950 -5.283 61 HB3 GLU 19 HB1 GLU 19 -17.172 -4.110 -6.441 62 HG2 GLU 19 HG2 GLU 19 -18.020 -6.996 -6.534 63 HG3 GLU 19 HG1 GLU 19 -18.608 -5.693 -7.560 64 H LYS 20 HN LYS 20 -16.347 -4.145 -2.938 65 HA LYS 20 HA LYS 20 -14.941 -1.806 -3.596 66 HB2 LYS 20 HB2 LYS 20 -14.817 -1.323 -1.233 67 HB3 LYS 20 HB1 LYS 20 -16.393 -2.010 -1.586 68 HG2 LYS 20 HG2 LYS 20 -15.856 -4.050 -0.562 69 HG3 LYS 20 HG1 LYS 20 -14.131 -3.674 -0.537 70 HD2 LYS 20 HD2 LYS 20 -14.348 -2.173 1.209 71 HD3 LYS 20 HD1 LYS 20 -16.064 -1.905 0.896 72 HE2 LYS 20 HE2 LYS 20 -15.636 -3.206 2.950 73 HE3 LYS 20 HE1 LYS 20 -16.615 -4.067 1.766 74 HZ1 LYS 20 HZ1 LYS 20 -14.846 -5.411 2.843 75 HZ2 LYS 20 HZ2 LYS 20 -13.693 -4.458 2.056 76 HZ3 LYS 20 HZ3 LYS 20 -14.778 -5.395 1.155 77 H ILE 21 HN ILE 21 -13.888 -4.884 -2.318 78 HA ILE 21 HA ILE 21 -11.205 -4.090 -1.779 79 HB ILE 21 HB ILE 21 -12.426 -6.833 -2.143 80 HG12 ILE 21 HG12 ILE 21 -11.601 -5.472 0.423 81 HG13 ILE 21 HG11 ILE 21 -13.228 -5.346 -0.235 82 HG21 ILE 21 HG21 ILE 21 -10.410 -7.682 -1.022 83 HG22 ILE 21 HG22 ILE 21 -9.720 -6.059 -1.062 84 HG23 ILE 21 HG23 ILE 21 -10.040 -6.918 -2.568 85 HD11 ILE 21 HD11 ILE 21 -11.831 -7.856 0.637 86 HD12 ILE 21 HD12 ILE 21 -13.433 -7.787 -0.104 87 HD13 ILE 21 HD13 ILE 21 -13.153 -7.029 1.463 88 H GLN 22 HN GLN 22 -12.748 -6.009 -4.340 89 HA GLN 22 HA GLN 22 -10.356 -6.549 -5.722 90 HB2 GLN 22 HB2 GLN 22 -13.184 -6.587 -6.786 91 HB3 GLN 22 HB1 GLN 22 -11.789 -7.357 -7.529 92 HG2 GLN 22 HG2 GLN 22 -11.552 -8.688 -5.392 93 HG3 GLN 22 HG1 GLN 22 -13.143 -8.074 -4.949 94 HE21 GLN 22 HE21 GLN 22 -14.945 -8.749 -6.122 95 HE22 GLN 22 HE22 GLN 22 -14.907 -10.151 -7.128 96 H GLN 23 HN GLN 23 -12.765 -3.977 -6.118 97 HA GLN 23 HA GLN 23 -11.745 -2.956 -8.544 98 HB2 GLN 23 HB2 GLN 23 -13.960 -2.341 -7.666 99 HB3 GLN 23 HB1 GLN 23 -13.196 -1.478 -6.345 100 HG2 GLN 23 HG2 GLN 23 -12.215 0.099 -7.862 101 HG3 GLN 23 HG1 GLN 23 -12.808 -0.810 -9.249 102 HE21 GLN 23 HE21 GLN 23 -13.899 0.977 -10.027 103 HE22 GLN 23 HE22 GLN 23 -15.366 1.545 -9.312 104 H TYR 24 HN TYR 24 -11.333 -1.745 -5.230 105 HA TYR 24 HA TYR 24 -9.373 0.145 -5.873 106 HB2 TYR 24 HB2 TYR 24 -10.131 -1.213 -3.307 107 HB3 TYR 24 HB1 TYR 24 -8.731 -0.142 -3.371 108 HD1 TYR 24 HD1 TYR 24 -12.309 -0.324 -3.107 109 HD2 TYR 24 HD2 TYR 24 -9.089 2.239 -4.170 110 HE1 TYR 24 HE1 TYR 24 -13.782 1.626 -2.842 111 HE2 TYR 24 HE2 TYR 24 -10.550 4.198 -3.907 112 HH TYR 24 HH TYR 24 -13.595 4.028 -2.408 113 H ARG 25 HN ARG 25 -9.053 -3.239 -4.875 114 HA ARG 25 HA ARG 25 -6.306 -3.388 -4.560 115 HB2 ARG 25 HB2 ARG 25 -7.916 -5.195 -4.052 116 HB3 ARG 25 HB1 ARG 25 -8.103 -5.479 -5.773 117 HG2 ARG 25 HG2 ARG 25 -5.763 -6.118 -5.939 118 HG3 ARG 25 HG1 ARG 25 -5.553 -5.803 -4.214 119 HD2 ARG 25 HD2 ARG 25 -5.860 -8.185 -4.632 120 HD3 ARG 25 HD1 ARG 25 -7.202 -7.531 -3.695 121 HE ARG 25 HE ARG 25 -7.559 -7.695 -6.581 122 HH11 ARG 25 HH11 ARG 25 -8.237 -9.043 -3.423 123 HH12 ARG 25 HH12 ARG 25 -9.549 -10.031 -3.987 124 HH21 ARG 25 HH21 ARG 25 -9.291 -8.974 -7.322 125 HH22 ARG 25 HH22 ARG 25 -10.136 -10.007 -6.210 126 H LYS 26 HN LYS 26 -8.206 -3.349 -7.498 127 HA LYS 26 HA LYS 26 -6.238 -4.153 -9.334 128 HB2 LYS 26 HB2 LYS 26 -8.650 -3.996 -9.832 129 HB3 LYS 26 HB1 LYS 26 -8.554 -2.248 -9.714 130 HG2 LYS 26 HG2 LYS 26 -6.960 -2.271 -11.622 131 HG3 LYS 26 HG1 LYS 26 -7.252 -4.004 -11.781 132 HD2 LYS 26 HD2 LYS 26 -8.672 -2.879 -13.343 133 HD3 LYS 26 HD1 LYS 26 -9.686 -3.487 -12.034 134 HE2 LYS 26 HE2 LYS 26 -10.395 -1.260 -12.559 135 HE3 LYS 26 HE1 LYS 26 -9.591 -1.223 -10.991 136 HZ1 LYS 26 HZ1 LYS 26 -7.580 -0.433 -12.120 137 HZ2 LYS 26 HZ2 LYS 26 -8.879 0.623 -12.339 138 HZ3 LYS 26 HZ3 LYS 26 -8.410 -0.405 -13.591 139 H THR 27 HN THR 27 -7.266 -0.889 -8.351 140 HA THR 27 HA THR 27 -5.178 0.356 -9.895 141 HB THR 27 HB THR 27 -7.336 1.467 -9.661 142 HG1 THR 27 HG1 THR 27 -6.357 3.343 -9.717 143 HG21 THR 27 HG21 THR 27 -6.646 1.651 -6.734 144 HG22 THR 27 HG22 THR 27 -7.989 0.760 -7.455 145 HG23 THR 27 HG23 THR 27 -7.967 2.522 -7.514 146 H LEU 28 HN LEU 28 -5.524 -0.876 -6.743 147 HA LEU 28 HA LEU 28 -3.566 0.747 -5.453 148 HB2 LEU 28 HB2 LEU 28 -5.267 -1.538 -4.800 149 HB3 LEU 28 HB1 LEU 28 -3.705 -1.601 -4.009 150 HG LEU 28 HG LEU 28 -5.472 -0.564 -2.611 151 HD11 LEU 28 HD11 LEU 28 -4.183 1.425 -1.974 152 HD12 LEU 28 HD12 LEU 28 -3.216 1.247 -3.436 153 HD13 LEU 28 HD13 LEU 28 -3.174 -0.001 -2.192 154 HD21 LEU 28 HD21 LEU 28 -6.755 0.509 -4.402 155 HD22 LEU 28 HD22 LEU 28 -5.425 1.632 -4.680 156 HD23 LEU 28 HD23 LEU 28 -6.297 1.659 -3.147 157 H THR 29 HN THR 29 -3.359 -1.846 -7.661 158 HA THR 29 HA THR 29 -0.836 -2.849 -6.684 159 HB THR 29 HB THR 29 -2.085 -3.417 -9.373 160 HG1 THR 29 HG1 THR 29 -3.478 -3.939 -7.534 161 HG21 THR 29 HG21 THR 29 -0.756 -5.485 -9.224 162 HG22 THR 29 HG22 THR 29 -0.076 -4.940 -7.689 163 HG23 THR 29 HG23 THR 29 0.270 -4.053 -9.174 164 H LYS 30 HN LYS 30 0.971 -1.746 -6.919 165 HA LYS 30 HA LYS 30 1.604 -0.479 -9.476 166 HB2 LYS 30 HB2 LYS 30 1.598 0.976 -6.828 167 HB3 LYS 30 HB1 LYS 30 2.384 1.583 -8.276 168 HG2 LYS 30 HG2 LYS 30 -0.554 0.977 -8.102 169 HG3 LYS 30 HG1 LYS 30 0.151 2.567 -7.806 170 HD2 LYS 30 HD2 LYS 30 1.159 2.453 -10.093 171 HD3 LYS 30 HD1 LYS 30 0.250 0.970 -10.363 172 HE2 LYS 30 HE2 LYS 30 -0.998 3.609 -9.637 173 HE3 LYS 30 HE1 LYS 30 -0.807 3.033 -11.291 174 HZ1 LYS 30 HZ1 LYS 30 -2.383 1.703 -9.148 175 HZ2 LYS 30 HZ2 LYS 30 -2.170 1.103 -10.715 176 HZ3 LYS 30 HZ3 LYS 30 -3.011 2.549 -10.472 177 H ILE 31 HN ILE 31 3.870 -0.134 -9.807 178 HA ILE 31 HA ILE 31 5.614 -1.710 -8.068 179 HB ILE 31 HB ILE 31 6.197 -0.303 -10.685 180 HG12 ILE 31 HG12 ILE 31 4.734 -2.325 -10.825 181 HG13 ILE 31 HG11 ILE 31 6.265 -2.500 -11.676 182 HG21 ILE 31 HG21 ILE 31 8.351 -1.515 -10.641 183 HG22 ILE 31 HG22 ILE 31 7.987 -2.064 -9.005 184 HG23 ILE 31 HG23 ILE 31 8.202 -0.344 -9.331 185 HD11 ILE 31 HD11 ILE 31 5.592 -3.640 -8.974 186 HD12 ILE 31 HD12 ILE 31 7.149 -3.790 -9.790 187 HD13 ILE 31 HD13 ILE 31 5.710 -4.530 -10.493 188 H VAL 32 HN VAL 32 6.446 -0.722 -6.357 189 HA VAL 32 HA VAL 32 7.315 2.078 -6.605 190 HB VAL 32 HB VAL 32 6.323 2.689 -4.505 191 HG11 VAL 32 HG11 VAL 32 3.980 2.599 -5.069 192 HG12 VAL 32 HG12 VAL 32 4.261 1.236 -6.152 193 HG13 VAL 32 HG13 VAL 32 4.930 2.823 -6.538 194 HG21 VAL 32 HG21 VAL 32 4.882 1.140 -3.235 195 HG22 VAL 32 HG22 VAL 32 6.556 0.590 -3.302 196 HG23 VAL 32 HG23 VAL 32 5.339 -0.162 -4.334 197 H LYS 33 HN LYS 33 8.542 2.704 -4.515 198 HA LYS 33 HA LYS 33 10.358 0.485 -3.870 199 HB2 LYS 33 HB2 LYS 33 10.831 3.448 -3.478 200 HB3 LYS 33 HB1 LYS 33 12.010 2.153 -3.313 201 HG2 LYS 33 HG2 LYS 33 11.994 1.711 -5.644 202 HG3 LYS 33 HG1 LYS 33 10.610 2.778 -5.897 203 HD2 LYS 33 HD2 LYS 33 11.975 4.685 -5.181 204 HD3 LYS 33 HD1 LYS 33 13.362 3.611 -4.987 205 HE2 LYS 33 HE2 LYS 33 13.272 3.063 -7.360 206 HE3 LYS 33 HE1 LYS 33 11.864 4.102 -7.558 207 HZ1 LYS 33 HZ1 LYS 33 13.851 5.238 -8.254 208 HZ2 LYS 33 HZ2 LYS 33 14.582 4.975 -6.754 209 HZ3 LYS 33 HZ3 LYS 33 13.232 5.986 -6.871 210 H ILE 34 HN ILE 34 10.065 -0.441 -1.991 211 HA ILE 34 HA ILE 34 8.657 0.977 0.121 212 HB ILE 34 HB ILE 34 9.008 -1.823 -0.614 213 HG12 ILE 34 HG12 ILE 34 7.051 -0.287 1.079 214 HG13 ILE 34 HG11 ILE 34 6.876 -0.693 -0.623 215 HG21 ILE 34 HG21 ILE 34 10.432 -1.851 1.395 216 HG22 ILE 34 HG22 ILE 34 8.940 -2.764 1.625 217 HG23 ILE 34 HG23 ILE 34 9.104 -1.153 2.324 218 HD11 ILE 34 HD11 ILE 34 5.508 -2.172 0.624 219 HD12 ILE 34 HD12 ILE 34 6.824 -2.550 1.733 220 HD13 ILE 34 HD13 ILE 34 6.897 -3.101 0.061 221 H LYS 35 HN LYS 35 9.480 1.384 2.108 222 HA LYS 35 HA LYS 35 12.319 0.793 2.568 223 HB2 LYS 35 HB2 LYS 35 10.930 3.461 2.777 224 HB3 LYS 35 HB1 LYS 35 12.436 3.150 3.584 225 HG2 LYS 35 HG2 LYS 35 13.462 3.808 1.741 226 HG3 LYS 35 HG1 LYS 35 12.880 2.321 0.982 227 HD2 LYS 35 HD2 LYS 35 11.848 3.721 -0.445 228 HD3 LYS 35 HD1 LYS 35 10.690 3.856 0.878 229 HE2 LYS 35 HE2 LYS 35 11.365 6.043 -0.034 230 HE3 LYS 35 HE1 LYS 35 11.727 5.848 1.683 231 HZ1 LYS 35 HZ1 LYS 35 13.712 5.456 -0.490 232 HZ2 LYS 35 HZ2 LYS 35 14.017 5.486 1.174 233 HZ3 LYS 35 HZ3 LYS 35 13.532 6.895 0.378 234 H THR 36 HN THR 36 12.293 -0.526 4.281 235 HA THR 36 HA THR 36 10.575 0.169 6.573 236 HB THR 36 HB THR 36 10.192 -2.194 7.027 237 HG1 THR 36 HG1 THR 36 11.415 -2.847 4.545 238 HG21 THR 36 HG21 THR 36 9.579 -1.553 4.145 239 HG22 THR 36 HG22 THR 36 8.603 -1.070 5.533 240 HG23 THR 36 HG23 THR 36 8.777 -2.778 5.128 241 H ALA 37 HN ALA 37 11.347 -1.355 8.527 242 HA ALA 37 HA ALA 37 14.095 -0.749 9.052 243 HB1 ALA 37 HB1 ALA 37 12.425 -0.771 10.842 244 HB2 ALA 37 HB2 ALA 37 13.731 -1.910 11.172 245 HB3 ALA 37 HB3 ALA 37 12.174 -2.498 10.589 246 H ILE 38 HN ILE 38 12.362 -3.393 7.708 247 HA ILE 38 HA ILE 38 14.354 -5.392 8.259 248 HB ILE 38 HB ILE 38 12.089 -5.554 6.268 249 HG12 ILE 38 HG12 ILE 38 12.093 -6.380 9.182 250 HG13 ILE 38 HG11 ILE 38 11.276 -4.958 8.543 251 HG21 ILE 38 HG21 ILE 38 13.793 -7.270 6.007 252 HG22 ILE 38 HG22 ILE 38 12.304 -7.974 6.638 253 HG23 ILE 38 HG23 ILE 38 13.667 -7.678 7.717 254 HD11 ILE 38 HD11 ILE 38 9.841 -6.392 7.189 255 HD12 ILE 38 HD12 ILE 38 9.726 -6.793 8.903 256 HD13 ILE 38 HD13 ILE 38 10.669 -7.816 7.821 257 H PHE 39 HN PHE 39 13.118 -3.844 5.303 258 HA PHE 39 HA PHE 39 15.717 -3.557 4.187 259 HB2 PHE 39 HB2 PHE 39 15.139 -5.010 2.129 260 HB3 PHE 39 HB1 PHE 39 15.747 -5.799 3.575 261 HD1 PHE 39 HD1 PHE 39 14.866 -7.904 3.646 262 HD2 PHE 39 HD2 PHE 39 12.308 -4.655 2.646 263 HE1 PHE 39 HE1 PHE 39 12.939 -9.428 3.639 264 HE2 PHE 39 HE2 PHE 39 10.378 -6.173 2.637 265 HZ PHE 39 HZ PHE 39 10.692 -8.567 3.138 266 H HIS 40 HN HIS 40 15.764 -2.241 2.390 267 HA HIS 40 HA HIS 40 13.204 -0.981 1.684 268 HB2 HIS 40 HB2 HIS 40 15.914 -0.067 0.730 269 HB3 HIS 40 HB1 HIS 40 14.442 0.872 0.892 270 HD1 HIS 40 HD1 HIS 40 17.511 -0.079 2.664 271 HD2 HIS 40 HD2 HIS 40 13.833 1.595 3.629 272 HE1 HIS 40 HE1 HIS 40 17.812 0.954 4.936 273 HE2 HIS 40 HE2 HIS 40 15.630 2.123 5.409 274 H GLU 41 HN GLU 41 12.220 -1.904 -0.045 275 HA GLU 41 HA GLU 41 13.896 -2.999 -2.190 276 HB2 GLU 41 HB2 GLU 41 11.631 -4.472 -0.836 277 HB3 GLU 41 HB1 GLU 41 12.514 -5.040 -2.245 278 HG2 GLU 41 HG2 GLU 41 13.661 -4.589 0.501 279 HG3 GLU 41 HG1 GLU 41 13.257 -6.146 -0.215 280 H THR 42 HN THR 42 13.136 -2.622 -4.209 281 HA THR 42 HA THR 42 10.718 -1.231 -4.708 282 HB THR 42 HB THR 42 12.151 -2.969 -6.719 283 HG1 THR 42 HG1 THR 42 12.887 -0.337 -6.723 284 HG21 THR 42 HG21 THR 42 11.352 -1.302 -8.313 285 HG22 THR 42 HG22 THR 42 10.605 -0.391 -6.999 286 HG23 THR 42 HG23 THR 42 10.006 -2.000 -7.409 287 H VAL 43 HN VAL 43 8.672 -2.016 -5.026 288 HA VAL 43 HA VAL 43 8.326 -4.911 -5.148 289 HB VAL 43 HB VAL 43 8.529 -4.030 -2.735 290 HG11 VAL 43 HG11 VAL 43 6.385 -3.231 -1.779 291 HG12 VAL 43 HG12 VAL 43 5.771 -3.044 -3.420 292 HG13 VAL 43 HG13 VAL 43 7.153 -2.087 -2.880 293 HG21 VAL 43 HG21 VAL 43 7.789 -6.264 -3.244 294 HG22 VAL 43 HG22 VAL 43 6.152 -5.679 -3.560 295 HG23 VAL 43 HG23 VAL 43 6.820 -5.591 -1.930 296 H LYS 44 HN LYS 44 6.177 -5.578 -5.701 297 HA LYS 44 HA LYS 44 4.545 -3.472 -6.919 298 HB2 LYS 44 HB2 LYS 44 5.094 -5.750 -8.063 299 HB3 LYS 44 HB1 LYS 44 3.914 -6.415 -6.942 300 HG2 LYS 44 HG2 LYS 44 2.203 -4.930 -7.837 301 HG3 LYS 44 HG1 LYS 44 3.378 -4.279 -8.983 302 HD2 LYS 44 HD2 LYS 44 1.985 -5.969 -10.050 303 HD3 LYS 44 HD1 LYS 44 3.660 -6.516 -9.955 304 HE2 LYS 44 HE2 LYS 44 3.093 -7.839 -7.958 305 HE3 LYS 44 HE1 LYS 44 1.417 -7.313 -8.099 306 HZ1 LYS 44 HZ1 LYS 44 1.304 -8.398 -10.256 307 HZ2 LYS 44 HZ2 LYS 44 1.733 -9.502 -9.048 308 HZ3 LYS 44 HZ3 LYS 44 2.910 -8.911 -10.105 309 H VAL 45 HN VAL 45 3.169 -2.542 -5.571 310 HA VAL 45 HA VAL 45 2.325 -4.003 -3.189 311 HB VAL 45 HB VAL 45 3.217 -1.762 -2.848 312 HG11 VAL 45 HG11 VAL 45 2.019 0.222 -3.664 313 HG12 VAL 45 HG12 VAL 45 0.948 -0.819 -4.601 314 HG13 VAL 45 HG13 VAL 45 2.669 -0.751 -4.983 315 HG21 VAL 45 HG21 VAL 45 1.466 -2.597 -1.342 316 HG22 VAL 45 HG22 VAL 45 0.246 -1.815 -2.348 317 HG23 VAL 45 HG23 VAL 45 1.441 -0.840 -1.490 318 H THR 46 HN THR 46 0.353 -4.827 -2.960 319 HA THR 46 HA THR 46 -1.850 -3.726 -4.530 320 HB THR 46 HB THR 46 -0.941 -5.728 -5.756 321 HG1 THR 46 HG1 THR 46 -2.996 -5.471 -6.288 322 HG21 THR 46 HG21 THR 46 -1.376 -7.958 -4.861 323 HG22 THR 46 HG22 THR 46 -1.955 -7.248 -3.353 324 HG23 THR 46 HG23 THR 46 -0.264 -7.070 -3.821 325 H CYS 47 HN CYS 47 -3.966 -4.905 -3.672 326 HA CYS 47 HA CYS 47 -3.717 -4.974 -0.756 327 HB2 CYS 47 HB2 CYS 47 -5.351 -3.405 -1.289 328 HB3 CYS 47 HB1 CYS 47 -6.028 -4.378 -2.582 329 HG CYS 47 HG CYS 47 -6.762 -4.300 0.677 330 H SER 48 HN SER 48 -5.045 -6.561 0.373 331 HA SER 48 HA SER 48 -4.265 -9.137 -0.543 332 HB2 SER 48 HB2 SER 48 -4.339 -8.391 1.851 333 HB3 SER 48 HB1 SER 48 -6.095 -8.478 1.768 334 HG SER 48 HG SER 48 -4.325 -10.646 1.238 335 H LYS 49 HN LYS 49 -5.742 -11.002 -0.592 336 HA LYS 49 HA LYS 49 -7.960 -10.619 -2.316 337 HB2 LYS 49 HB2 LYS 49 -7.301 -13.039 -0.622 338 HB3 LYS 49 HB1 LYS 49 -8.316 -13.008 -2.060 339 HG2 LYS 49 HG2 LYS 49 -6.414 -12.479 -3.444 340 HG3 LYS 49 HG1 LYS 49 -5.376 -12.353 -2.023 341 HD2 LYS 49 HD2 LYS 49 -5.844 -14.739 -1.536 342 HD3 LYS 49 HD1 LYS 49 -6.757 -14.835 -3.041 343 HE2 LYS 49 HE2 LYS 49 -4.500 -15.691 -3.349 344 HE3 LYS 49 HE1 LYS 49 -4.742 -14.225 -4.296 345 HZ1 LYS 49 HZ1 LYS 49 -3.379 -14.348 -1.661 346 HZ2 LYS 49 HZ2 LYS 49 -3.564 -12.971 -2.624 347 HZ3 LYS 49 HZ3 LYS 49 -2.598 -14.249 -3.157 348 H ASP 50 HN ASP 50 -7.545 -11.020 1.137 349 HA ASP 50 HA ASP 50 -10.356 -11.087 1.733 350 HB2 ASP 50 HB2 ASP 50 -7.932 -10.652 3.489 351 HB3 ASP 50 HB1 ASP 50 -9.579 -10.765 4.098 352 H GLY 51 HN GLY 51 -8.000 -8.666 1.151 353 HA2 GLY 51 HA2 GLY 51 -8.413 -6.418 0.731 354 HA3 GLY 51 HA1 GLY 51 -10.023 -6.616 1.393 355 H LYS 52 HN LYS 52 -8.399 -7.938 3.747 356 HA LYS 52 HA LYS 52 -8.714 -5.597 5.373 357 HB2 LYS 52 HB2 LYS 52 -9.391 -7.896 6.069 358 HB3 LYS 52 HB1 LYS 52 -7.688 -8.322 6.170 359 HG2 LYS 52 HG2 LYS 52 -7.406 -6.505 7.853 360 HG3 LYS 52 HG1 LYS 52 -9.155 -6.286 7.827 361 HD2 LYS 52 HD2 LYS 52 -9.428 -8.639 8.513 362 HD3 LYS 52 HD1 LYS 52 -7.672 -8.793 8.610 363 HE2 LYS 52 HE2 LYS 52 -7.646 -6.974 10.283 364 HE3 LYS 52 HE1 LYS 52 -9.405 -6.928 10.228 365 HZ1 LYS 52 HZ1 LYS 52 -9.449 -9.216 11.003 366 HZ2 LYS 52 HZ2 LYS 52 -8.625 -8.226 12.096 367 HZ3 LYS 52 HZ3 LYS 52 -7.759 -9.250 11.067 368 H MET 53 HN MET 53 -6.109 -6.862 3.627 369 HA MET 53 HA MET 53 -4.302 -5.148 5.125 370 HB2 MET 53 HB2 MET 53 -2.626 -6.750 5.484 371 HB3 MET 53 HB1 MET 53 -4.111 -7.561 5.950 372 HG2 MET 53 HG2 MET 53 -4.138 -8.654 3.722 373 HG3 MET 53 HG1 MET 53 -2.567 -7.928 3.398 374 HE1 MET 53 HE1 MET 53 -0.491 -8.288 5.094 375 HE2 MET 53 HE2 MET 53 -0.411 -9.596 6.274 376 HE3 MET 53 HE3 MET 53 -1.438 -8.196 6.578 377 H LEU 54 HN LEU 54 -2.238 -4.826 3.999 378 HA LEU 54 HA LEU 54 -2.733 -4.601 1.111 379 HB2 LEU 54 HB2 LEU 54 -2.284 -2.574 2.586 380 HB3 LEU 54 HB1 LEU 54 -0.654 -3.184 2.770 381 HG LEU 54 HG LEU 54 -0.409 -3.047 0.273 382 HD11 LEU 54 HD11 LEU 54 -1.974 -1.617 -0.946 383 HD12 LEU 54 HD12 LEU 54 -2.997 -1.511 0.485 384 HD13 LEU 54 HD13 LEU 54 -2.774 -3.063 -0.325 385 HD21 LEU 54 HD21 LEU 54 -0.047 -0.636 0.279 386 HD22 LEU 54 HD22 LEU 54 0.509 -1.366 1.783 387 HD23 LEU 54 HD23 LEU 54 -1.018 -0.485 1.742 388 H GLU 55 HN GLU 55 -1.842 -6.295 0.076 389 HA GLU 55 HA GLU 55 0.565 -7.510 1.208 390 HB2 GLU 55 HB2 GLU 55 -1.258 -8.558 -0.961 391 HB3 GLU 55 HB1 GLU 55 0.090 -9.422 -0.236 392 HG2 GLU 55 HG2 GLU 55 -1.147 -9.152 1.981 393 HG3 GLU 55 HG1 GLU 55 -2.533 -8.684 0.999 394 H TRP 56 HN TRP 56 2.480 -7.497 0.184 395 HA TRP 56 HA TRP 56 2.499 -6.392 -2.528 396 HB2 TRP 56 HB2 TRP 56 4.760 -5.330 -1.773 397 HB3 TRP 56 HB1 TRP 56 3.240 -4.532 -1.405 398 HD1 TRP 56 HD1 TRP 56 5.258 -7.254 0.515 399 HE1 TRP 56 HE1 TRP 56 5.525 -6.447 2.945 400 HE3 TRP 56 HE3 TRP 56 2.808 -2.792 0.160 401 HZ2 TRP 56 HZ2 TRP 56 4.788 -4.223 4.500 402 HZ3 TRP 56 HZ3 TRP 56 2.634 -1.386 2.164 403 HH2 TRP 56 HH2 TRP 56 3.602 -2.085 4.291 404 H TYR 57 HN TYR 57 3.793 -7.296 -3.961 405 HA TYR 57 HA TYR 57 5.419 -9.578 -3.042 406 HB2 TYR 57 HB2 TYR 57 3.996 -9.264 -5.700 407 HB3 TYR 57 HB1 TYR 57 4.938 -10.659 -5.188 408 HD1 TYR 57 HD1 TYR 57 1.782 -8.827 -4.741 409 HD2 TYR 57 HD2 TYR 57 4.015 -12.289 -3.667 410 HE1 TYR 57 HE1 TYR 57 -0.254 -9.845 -3.814 411 HE2 TYR 57 HE2 TYR 57 1.980 -13.315 -2.739 412 HH TYR 57 HH TYR 57 -0.178 -12.706 -1.902 413 H LYS 58 HN LYS 58 7.441 -9.708 -3.736 414 HA LYS 58 HA LYS 58 9.149 -7.833 -4.389 415 HB2 LYS 58 HB2 LYS 58 10.444 -9.540 -5.746 416 HB3 LYS 58 HB1 LYS 58 9.967 -10.034 -4.126 417 HG2 LYS 58 HG2 LYS 58 8.154 -10.726 -6.375 418 HG3 LYS 58 HG1 LYS 58 9.669 -11.617 -6.228 419 HD2 LYS 58 HD2 LYS 58 9.101 -12.408 -4.066 420 HD3 LYS 58 HD1 LYS 58 7.755 -11.280 -3.927 421 HE2 LYS 58 HE2 LYS 58 7.079 -13.630 -4.392 422 HE3 LYS 58 HE1 LYS 58 6.498 -12.459 -5.577 423 HZ1 LYS 58 HZ1 LYS 58 8.983 -14.025 -5.994 424 HZ2 LYS 58 HZ2 LYS 58 8.065 -13.183 -7.138 425 HZ3 LYS 58 HZ3 LYS 58 7.461 -14.606 -6.463 426 H GLY 59 HN GLY 59 9.188 -6.216 -5.769 427 HA2 GLY 59 HA2 GLY 59 8.042 -6.640 -8.456 428 HA3 GLY 59 HA1 GLY 59 7.927 -5.125 -7.575 429 H LYS 60 HN LYS 60 10.891 -6.662 -7.174 430 HA LYS 60 HA LYS 60 12.271 -4.656 -8.706 431 HB2 LYS 60 HB2 LYS 60 13.240 -7.043 -7.132 432 HB3 LYS 60 HB1 LYS 60 14.311 -5.908 -7.939 433 HG2 LYS 60 HG2 LYS 60 13.734 -4.163 -6.497 434 HG3 LYS 60 HG1 LYS 60 12.302 -5.011 -5.907 435 HD2 LYS 60 HD2 LYS 60 15.102 -6.028 -5.486 436 HD3 LYS 60 HD1 LYS 60 14.287 -4.955 -4.346 437 HE2 LYS 60 HE2 LYS 60 12.522 -6.580 -4.016 438 HE3 LYS 60 HE1 LYS 60 13.227 -7.633 -5.244 439 HZ1 LYS 60 HZ1 LYS 60 13.757 -8.294 -2.936 440 HZ2 LYS 60 HZ2 LYS 60 14.619 -6.844 -2.741 441 HZ3 LYS 60 HZ3 LYS 60 15.131 -7.990 -3.875 442 H ASN 61 HN ASN 61 12.714 -8.152 -8.642 443 HA ASN 61 HA ASN 61 12.254 -8.619 -11.381 444 HB2 ASN 61 HB2 ASN 61 14.573 -9.074 -12.094 445 HB3 ASN 61 HB1 ASN 61 14.364 -7.381 -11.671 446 HD21 ASN 61 HD21 ASN 61 15.361 -6.575 -9.829 447 HD22 ASN 61 HD22 ASN 61 16.622 -7.431 -9.013 448 H ASP 62 HN ASP 62 14.309 -10.786 -11.463 449 HA ASP 62 HA ASP 62 12.824 -12.808 -10.203 450 HB2 ASP 62 HB2 ASP 62 15.600 -12.762 -11.361 451 HB3 ASP 62 HB1 ASP 62 14.940 -14.208 -10.605 452 H SER 63 HN SER 63 15.471 -10.846 -9.056 453 HA SER 63 HA SER 63 15.994 -12.361 -6.702 454 HB2 SER 63 HB2 SER 63 16.447 -9.408 -7.211 455 HB3 SER 63 HB1 SER 63 17.194 -10.371 -5.936 456 HG SER 63 HG SER 63 18.697 -10.468 -7.455 457 H ASP 64 HN ASP 64 14.221 -12.827 -5.511 458 HA ASP 64 HA ASP 64 12.072 -10.988 -5.125 459 HB2 ASP 64 HB2 ASP 64 12.608 -13.481 -3.524 460 HB3 ASP 64 HB1 ASP 64 11.066 -12.666 -3.744 461 H GLY 65 HN GLY 65 14.396 -12.419 -2.910 462 HA2 GLY 65 HA2 GLY 65 15.494 -11.195 -1.162 463 HA3 GLY 65 HA1 GLY 65 14.157 -10.050 -1.182 464 H LYS 66 HN LYS 66 12.054 -11.881 -1.207 465 HA LYS 66 HA LYS 66 12.340 -13.251 1.386 466 HB2 LYS 66 HB2 LYS 66 10.892 -11.200 1.422 467 HB3 LYS 66 HB1 LYS 66 9.821 -11.999 0.279 468 HG2 LYS 66 HG2 LYS 66 8.925 -12.224 2.488 469 HG3 LYS 66 HG1 LYS 66 9.477 -13.806 1.929 470 HD2 LYS 66 HD2 LYS 66 11.668 -13.244 3.147 471 HD3 LYS 66 HD1 LYS 66 10.736 -11.977 3.947 472 HE2 LYS 66 HE2 LYS 66 9.150 -13.647 4.744 473 HE3 LYS 66 HE1 LYS 66 10.070 -14.907 3.922 474 HZ1 LYS 66 HZ1 LYS 66 11.935 -14.474 5.346 475 HZ2 LYS 66 HZ2 LYS 66 10.572 -14.766 6.301 476 HZ3 LYS 66 HZ3 LYS 66 11.132 -13.187 6.091 477 H LYS 67 HN LYS 67 11.645 -13.506 -1.899 478 HA LYS 67 HA LYS 67 11.041 -15.182 -3.291 479 HB2 LYS 67 HB2 LYS 67 12.432 -16.588 -1.736 480 HB3 LYS 67 HB1 LYS 67 10.957 -16.993 -0.873 481 HG2 LYS 67 HG2 LYS 67 11.535 -18.771 -2.390 482 HG3 LYS 67 HG1 LYS 67 10.050 -17.987 -2.933 483 HD2 LYS 67 HD2 LYS 67 11.343 -16.687 -4.563 484 HD3 LYS 67 HD1 LYS 67 12.819 -17.489 -4.024 485 HE2 LYS 67 HE2 LYS 67 11.898 -19.644 -4.718 486 HE3 LYS 67 HE1 LYS 67 10.422 -18.840 -5.252 487 HZ1 LYS 67 HZ1 LYS 67 11.756 -17.580 -6.844 488 HZ2 LYS 67 HZ2 LYS 67 11.871 -19.243 -7.112 489 HZ3 LYS 67 HZ3 LYS 67 13.141 -18.418 -6.360 490 H LYS 68 HN LYS 68 9.186 -14.003 -0.893 491 HA LYS 68 HA LYS 68 6.687 -14.934 -2.044 492 HB2 LYS 68 HB2 LYS 68 7.495 -15.276 0.863 493 HB3 LYS 68 HB1 LYS 68 5.834 -15.356 0.324 494 HG2 LYS 68 HG2 LYS 68 8.027 -17.183 -0.605 495 HG3 LYS 68 HG1 LYS 68 6.825 -17.569 0.631 496 HD2 LYS 68 HD2 LYS 68 5.040 -17.261 -1.012 497 HD3 LYS 68 HD1 LYS 68 6.238 -16.877 -2.247 498 HE2 LYS 68 HE2 LYS 68 7.222 -19.121 -1.945 499 HE3 LYS 68 HE1 LYS 68 5.948 -19.497 -0.784 500 HZ1 LYS 68 HZ1 LYS 68 5.439 -20.357 -2.984 501 HZ2 LYS 68 HZ2 LYS 68 5.525 -18.801 -3.639 502 HZ3 LYS 68 HZ3 LYS 68 4.313 -19.185 -2.527 503 HA PRO 69 HA PRO 69 5.275 -10.736 -0.767 504 HB2 PRO 69 HB2 PRO 69 4.014 -11.849 1.705 505 HB3 PRO 69 HB1 PRO 69 3.384 -10.658 0.563 506 HG2 PRO 69 HG2 PRO 69 2.520 -13.164 0.496 507 HG3 PRO 69 HG1 PRO 69 2.806 -12.261 -1.002 508 HD2 PRO 69 HD2 PRO 69 4.398 -14.433 0.231 509 HD3 PRO 69 HD1 PRO 69 4.185 -14.027 -1.478 510 H ILE 70 HN ILE 70 6.502 -9.247 0.198 511 HA ILE 70 HA ILE 70 8.693 -10.210 1.748 512 HB ILE 70 HB ILE 70 9.599 -7.915 1.612 513 HG12 ILE 70 HG12 ILE 70 7.203 -7.339 -0.129 514 HG13 ILE 70 HG11 ILE 70 7.370 -6.759 1.527 515 HG21 ILE 70 HG21 ILE 70 9.982 -7.986 -0.826 516 HG22 ILE 70 HG22 ILE 70 8.685 -9.169 -0.981 517 HG23 ILE 70 HG23 ILE 70 10.143 -9.574 -0.076 518 HD11 ILE 70 HD11 ILE 70 7.982 -5.030 -0.042 519 HD12 ILE 70 HD12 ILE 70 9.180 -6.090 -0.785 520 HD13 ILE 70 HD13 ILE 70 9.396 -5.542 0.876 521 H GLY 71 HN GLY 71 5.807 -9.746 2.879 522 HA2 GLY 71 HA2 GLY 71 5.454 -9.776 5.270 523 HA3 GLY 71 HA1 GLY 71 6.780 -8.637 5.433 524 H SER 72 HN SER 72 3.619 -8.989 3.993 525 HA SER 72 HA SER 72 3.029 -6.249 3.666 526 HB2 SER 72 HB2 SER 72 1.079 -8.536 3.949 527 HB3 SER 72 HB1 SER 72 0.862 -7.039 3.042 528 HG SER 72 HG SER 72 1.894 -9.348 2.208 529 H PHE 73 HN PHE 73 1.039 -5.233 4.727 530 HA PHE 73 HA PHE 73 0.804 -5.958 7.571 531 HB2 PHE 73 HB2 PHE 73 1.194 -3.781 8.327 532 HB3 PHE 73 HB1 PHE 73 2.354 -3.914 7.007 533 HD1 PHE 73 HD1 PHE 73 1.856 -2.820 4.827 534 HD2 PHE 73 HD2 PHE 73 -0.580 -2.255 8.260 535 HE1 PHE 73 HE1 PHE 73 0.841 -0.838 3.779 536 HE2 PHE 73 HE2 PHE 73 -1.615 -0.299 7.222 537 HZ PHE 73 HZ PHE 73 -0.897 0.429 4.976 538 HA PRO 74 HA PRO 74 -3.533 -5.388 6.769 539 HB2 PRO 74 HB2 PRO 74 -4.268 -4.815 9.430 540 HB3 PRO 74 HB1 PRO 74 -4.244 -6.386 8.639 541 HG2 PRO 74 HG2 PRO 74 -2.560 -5.545 10.721 542 HG3 PRO 74 HG1 PRO 74 -2.380 -7.002 9.736 543 HD2 PRO 74 HD2 PRO 74 -0.957 -4.413 9.562 544 HD3 PRO 74 HD1 PRO 74 -0.423 -6.037 9.089 545 H LEU 75 HN LEU 75 -4.839 -3.799 6.101 546 HA LEU 75 HA LEU 75 -3.896 -1.132 6.123 547 HB2 LEU 75 HB2 LEU 75 -6.500 -2.325 5.203 548 HB3 LEU 75 HB1 LEU 75 -6.064 -0.649 4.954 549 HG LEU 75 HG LEU 75 -4.513 -2.999 3.869 550 HD11 LEU 75 HD11 LEU 75 -5.433 -2.332 1.698 551 HD12 LEU 75 HD12 LEU 75 -6.445 -1.132 2.503 552 HD13 LEU 75 HD13 LEU 75 -6.693 -2.851 2.817 553 HD21 LEU 75 HD21 LEU 75 -3.523 -1.155 2.445 554 HD22 LEU 75 HD22 LEU 75 -3.041 -1.174 4.139 555 HD23 LEU 75 HD23 LEU 75 -4.249 -0.018 3.580 556 H ASN 76 HN ASN 76 -6.167 -2.788 8.142 557 HA ASN 76 HA ASN 76 -7.620 -0.516 9.028 558 HB2 ASN 76 HB2 ASN 76 -8.401 -1.987 10.854 559 HB3 ASN 76 HB1 ASN 76 -8.542 -2.757 9.279 560 HD21 ASN 76 HD21 ASN 76 -7.013 -4.371 8.704 561 HD22 ASN 76 HD22 ASN 76 -6.163 -5.252 9.932 562 H LYS 77 HN LYS 77 -4.489 -1.635 9.682 563 HA LYS 77 HA LYS 77 -4.336 -0.579 12.372 564 HB2 LYS 77 HB2 LYS 77 -2.158 -1.676 10.584 565 HB3 LYS 77 HB1 LYS 77 -2.012 -1.347 12.304 566 HG2 LYS 77 HG2 LYS 77 -3.924 -3.351 11.128 567 HG3 LYS 77 HG1 LYS 77 -2.310 -3.746 11.716 568 HD2 LYS 77 HD2 LYS 77 -4.448 -2.453 13.405 569 HD3 LYS 77 HD1 LYS 77 -4.158 -4.192 13.343 570 HE2 LYS 77 HE2 LYS 77 -1.816 -3.765 14.057 571 HE3 LYS 77 HE1 LYS 77 -2.228 -2.064 14.251 572 HZ1 LYS 77 HZ1 LYS 77 -2.351 -3.207 16.352 573 HZ2 LYS 77 HZ2 LYS 77 -3.441 -4.336 15.722 574 HZ3 LYS 77 HZ3 LYS 77 -3.904 -2.718 15.887 575 H ILE 78 HN ILE 78 -4.047 0.677 9.242 576 HA ILE 78 HA ILE 78 -1.873 2.434 9.472 577 HB ILE 78 HB ILE 78 -4.408 2.924 7.898 578 HG12 ILE 78 HG12 ILE 78 -1.813 1.641 7.016 579 HG13 ILE 78 HG11 ILE 78 -3.301 0.763 7.364 580 HG21 ILE 78 HG21 ILE 78 -3.014 4.388 6.530 581 HG22 ILE 78 HG22 ILE 78 -1.625 4.043 7.562 582 HG23 ILE 78 HG23 ILE 78 -3.012 4.916 8.214 583 HD11 ILE 78 HD11 ILE 78 -4.418 1.913 5.537 584 HD12 ILE 78 HD12 ILE 78 -2.975 1.070 4.977 585 HD13 ILE 78 HD13 ILE 78 -2.944 2.821 5.197 586 H THR 79 HN THR 79 -1.557 4.201 10.640 587 HA THR 79 HA THR 79 -3.799 5.255 12.153 588 HB THR 79 HB THR 79 -2.077 6.504 13.433 589 HG1 THR 79 HG1 THR 79 -0.062 6.534 12.772 590 HG21 THR 79 HG21 THR 79 -2.806 4.297 14.177 591 HG22 THR 79 HG22 THR 79 -1.099 4.544 14.535 592 HG23 THR 79 HG23 THR 79 -1.578 3.540 13.164 593 H SER 80 HN SER 80 -1.321 6.315 9.859 594 HA SER 80 HA SER 80 -3.119 8.365 8.883 595 HB2 SER 80 HB2 SER 80 -0.431 9.115 10.055 596 HB3 SER 80 HB1 SER 80 -1.497 10.205 9.170 597 HG SER 80 HG SER 80 -2.850 8.986 11.155 598 H ILE 81 HN ILE 81 -3.031 8.168 6.738 599 HA ILE 81 HA ILE 81 -0.480 7.471 5.470 600 HB ILE 81 HB ILE 81 -2.134 6.030 4.629 601 HG12 ILE 81 HG12 ILE 81 -1.942 8.313 2.648 602 HG13 ILE 81 HG11 ILE 81 -0.788 6.996 2.817 603 HG21 ILE 81 HG21 ILE 81 -4.096 7.116 5.519 604 HG22 ILE 81 HG22 ILE 81 -4.332 6.741 3.809 605 HG23 ILE 81 HG23 ILE 81 -3.968 8.395 4.306 606 HD11 ILE 81 HD11 ILE 81 -3.594 6.879 1.769 607 HD12 ILE 81 HD12 ILE 81 -2.698 5.440 2.249 608 HD13 ILE 81 HD13 ILE 81 -2.087 6.460 0.946 609 H ARG 82 HN ARG 82 0.729 9.181 5.010 610 HA ARG 82 HA ARG 82 -0.540 11.522 3.811 611 HB2 ARG 82 HB2 ARG 82 0.863 13.007 5.273 612 HB3 ARG 82 HB1 ARG 82 -0.443 12.169 6.094 613 HG2 ARG 82 HG2 ARG 82 1.274 11.915 7.589 614 HG3 ARG 82 HG1 ARG 82 1.410 10.422 6.659 615 HD2 ARG 82 HD2 ARG 82 3.604 11.363 6.941 616 HD3 ARG 82 HD1 ARG 82 3.123 11.514 5.249 617 HE ARG 82 HE ARG 82 2.410 13.883 6.058 618 HH11 ARG 82 HH11 ARG 82 5.255 12.130 7.145 619 HH12 ARG 82 HH12 ARG 82 6.196 13.576 7.351 620 HH21 ARG 82 HH21 ARG 82 3.653 15.762 6.353 621 HH22 ARG 82 HH22 ARG 82 5.289 15.630 6.918 622 H THR 83 HN THR 83 1.073 13.033 2.867 623 HA THR 83 HA THR 83 3.007 11.404 1.412 624 HB THR 83 HB THR 83 2.223 14.263 0.874 625 HG1 THR 83 HG1 THR 83 0.657 12.144 0.742 626 HG21 THR 83 HG21 THR 83 4.268 13.508 -0.235 627 HG22 THR 83 HG22 THR 83 2.969 13.738 -1.407 628 HG23 THR 83 HG23 THR 83 3.408 12.112 -0.885 629 H LYS 84 HN LYS 84 5.189 11.789 1.391 630 HA LYS 84 HA LYS 84 6.309 13.384 3.487 631 HB2 LYS 84 HB2 LYS 84 7.366 11.298 2.615 632 HB3 LYS 84 HB1 LYS 84 7.715 12.167 1.124 633 HG2 LYS 84 HG2 LYS 84 9.442 13.242 2.002 634 HG3 LYS 84 HG1 LYS 84 8.587 13.585 3.510 635 HD2 LYS 84 HD2 LYS 84 10.305 12.162 4.184 636 HD3 LYS 84 HD1 LYS 84 8.937 11.064 3.984 637 HE2 LYS 84 HE2 LYS 84 10.575 9.915 2.853 638 HE3 LYS 84 HE1 LYS 84 9.862 10.858 1.543 639 HZ1 LYS 84 HZ1 LYS 84 11.638 12.539 1.950 640 HZ2 LYS 84 HZ2 LYS 84 12.214 11.051 1.390 641 HZ3 LYS 84 HZ3 LYS 84 12.366 11.453 3.022 642 H VAL 85 HN VAL 85 6.808 15.504 3.380 643 HA VAL 85 HA VAL 85 6.154 16.940 1.046 644 HB VAL 85 HB VAL 85 6.808 18.872 2.379 645 HG11 VAL 85 HG11 VAL 85 4.533 18.041 2.506 646 HG12 VAL 85 HG12 VAL 85 5.044 18.667 4.072 647 HG13 VAL 85 HG13 VAL 85 5.005 16.928 3.788 648 HG21 VAL 85 HG21 VAL 85 8.633 17.927 3.645 649 HG22 VAL 85 HG22 VAL 85 7.524 16.806 4.440 650 HG23 VAL 85 HG23 VAL 85 7.406 18.541 4.761 651 H ASP 86 HN ASP 86 9.157 15.921 2.535 652 HA ASP 86 HA ASP 86 10.736 17.728 0.931 653 HB2 ASP 86 HB2 ASP 86 12.616 16.921 2.072 654 HB3 ASP 86 HB1 ASP 86 11.340 16.846 3.269 655 H ASN 87 HN ASN 87 9.022 15.114 0.289 656 HA ASN 87 HA ASN 87 10.267 14.644 -2.233 657 HB2 ASN 87 HB2 ASN 87 11.587 13.132 -0.671 658 HB3 ASN 87 HB1 ASN 87 10.087 12.262 -0.371 659 HD21 ASN 87 HD21 ASN 87 12.570 11.328 -1.563 660 HD22 ASN 87 HD22 ASN 87 12.152 10.723 -3.126 661 H LEU 88 HN LEU 88 8.204 15.494 -2.699 662 HA LEU 88 HA LEU 88 5.799 14.420 -1.709 663 HB2 LEU 88 HB2 LEU 88 6.623 16.408 -3.709 664 HB3 LEU 88 HB1 LEU 88 5.050 15.683 -4.007 665 HG LEU 88 HG LEU 88 5.881 17.103 -1.464 666 HD11 LEU 88 HD11 LEU 88 4.184 18.034 -3.775 667 HD12 LEU 88 HD12 LEU 88 5.767 18.660 -3.314 668 HD13 LEU 88 HD13 LEU 88 4.382 18.890 -2.248 669 HD21 LEU 88 HD21 LEU 88 3.205 16.074 -2.398 670 HD22 LEU 88 HD22 LEU 88 3.474 17.062 -0.962 671 HD23 LEU 88 HD23 LEU 88 4.164 15.443 -1.059 672 H LYS 89 HN LYS 89 7.939 13.222 -4.019 673 HA LYS 89 HA LYS 89 5.991 11.761 -5.557 674 HB2 LYS 89 HB2 LYS 89 8.884 11.039 -5.396 675 HB3 LYS 89 HB1 LYS 89 7.783 10.812 -6.733 676 HG2 LYS 89 HG2 LYS 89 8.996 13.375 -5.776 677 HG3 LYS 89 HG1 LYS 89 9.346 12.520 -7.277 678 HD2 LYS 89 HD2 LYS 89 7.019 12.879 -7.961 679 HD3 LYS 89 HD1 LYS 89 6.764 13.826 -6.500 680 HE2 LYS 89 HE2 LYS 89 8.510 15.387 -7.210 681 HE3 LYS 89 HE1 LYS 89 8.759 14.440 -8.673 682 HZ1 LYS 89 HZ1 LYS 89 6.544 14.978 -9.393 683 HZ2 LYS 89 HZ2 LYS 89 7.379 16.402 -9.045 684 HZ3 LYS 89 HZ3 LYS 89 6.229 15.816 -7.956 685 H SER 90 HN SER 90 7.433 11.511 -2.534 686 HA SER 90 HA SER 90 6.986 8.618 -2.339 687 HB2 SER 90 HB2 SER 90 9.243 9.584 -1.691 688 HB3 SER 90 HB1 SER 90 8.423 10.397 -0.356 689 HG SER 90 HG SER 90 8.912 7.656 -0.754 690 H LEU 91 HN LEU 91 6.071 7.883 -0.271 691 HA LEU 91 HA LEU 91 4.087 9.728 0.855 692 HB2 LEU 91 HB2 LEU 91 3.090 8.423 -1.009 693 HB3 LEU 91 HB1 LEU 91 3.517 6.948 -0.169 694 HG LEU 91 HG LEU 91 2.064 8.026 1.755 695 HD11 LEU 91 HD11 LEU 91 0.861 9.229 -0.733 696 HD12 LEU 91 HD12 LEU 91 1.690 10.123 0.540 697 HD13 LEU 91 HD13 LEU 91 0.184 9.280 0.896 698 HD21 LEU 91 HD21 LEU 91 1.598 5.890 0.813 699 HD22 LEU 91 HD22 LEU 91 1.034 6.616 -0.695 700 HD23 LEU 91 HD23 LEU 91 0.103 6.828 0.788 701 H GLU 92 HN GLU 92 4.310 9.677 2.990 702 HA GLU 92 HA GLU 92 5.626 7.379 4.233 703 HB2 GLU 92 HB2 GLU 92 6.552 9.629 4.640 704 HB3 GLU 92 HB1 GLU 92 5.017 10.132 5.330 705 HG2 GLU 92 HG2 GLU 92 5.336 8.302 7.040 706 HG3 GLU 92 HG1 GLU 92 6.982 8.149 6.425 707 H ILE 93 HN ILE 93 4.303 5.863 5.016 708 HA ILE 93 HA ILE 93 1.682 6.736 6.029 709 HB ILE 93 HB ILE 93 2.520 4.121 4.793 710 HG12 ILE 93 HG12 ILE 93 0.443 6.195 4.085 711 HG13 ILE 93 HG11 ILE 93 1.940 5.877 3.214 712 HG21 ILE 93 HG21 ILE 93 -0.055 4.770 6.228 713 HG22 ILE 93 HG22 ILE 93 1.150 3.572 6.710 714 HG23 ILE 93 HG23 ILE 93 0.210 3.340 5.232 715 HD11 ILE 93 HD11 ILE 93 1.157 3.786 2.464 716 HD12 ILE 93 HD12 ILE 93 -0.135 4.961 2.184 717 HD13 ILE 93 HD13 ILE 93 -0.236 3.843 3.545 718 H SER 94 HN SER 94 1.604 6.826 8.122 719 HA SER 94 HA SER 94 3.251 5.059 9.729 720 HB2 SER 94 HB2 SER 94 2.124 6.433 11.627 721 HB3 SER 94 HB1 SER 94 3.325 7.227 10.612 722 HG SER 94 HG SER 94 1.805 8.418 9.697 723 H VAL 95 HN VAL 95 2.515 3.353 10.763 724 HA VAL 95 HA VAL 95 -0.371 2.906 10.900 725 HB VAL 95 HB VAL 95 -0.041 1.669 8.982 726 HG11 VAL 95 HG11 VAL 95 2.710 0.971 9.982 727 HG12 VAL 95 HG12 VAL 95 2.277 2.034 8.634 728 HG13 VAL 95 HG13 VAL 95 1.979 0.296 8.522 729 HG21 VAL 95 HG21 VAL 95 -0.938 0.146 10.636 730 HG22 VAL 95 HG22 VAL 95 0.691 -0.303 11.140 731 HG23 VAL 95 HG23 VAL 95 0.122 -0.722 9.524 732 H SER 96 HN SER 96 -1.034 1.536 12.560 733 HA SER 96 HA SER 96 0.640 1.463 14.856 734 HB2 SER 96 HB2 SER 96 -1.891 1.609 14.855 735 HB3 SER 96 HB1 SER 96 -1.920 -0.085 14.363 736 HG SER 96 HG SER 96 -0.781 0.953 16.753 737 H SER 97 HN SER 97 2.311 0.140 15.004 738 HA SER 97 HA SER 97 2.315 -2.226 13.276 739 HB2 SER 97 HB2 SER 97 4.736 -1.499 12.780 740 HB3 SER 97 HB1 SER 97 3.430 -0.598 12.013 741 HG SER 97 HG SER 97 3.707 1.050 13.447 742 H VAL 98 HN VAL 98 3.769 -3.829 13.729 743 HA VAL 98 HA VAL 98 4.796 -3.943 16.474 744 HB VAL 98 HB VAL 98 3.249 -5.764 15.610 745 HG11 VAL 98 HG11 VAL 98 5.601 -6.417 13.849 746 HG12 VAL 98 HG12 VAL 98 4.000 -5.887 13.330 747 HG13 VAL 98 HG13 VAL 98 4.201 -7.460 14.105 748 HG21 VAL 98 HG21 VAL 98 4.422 -7.583 16.613 749 HG22 VAL 98 HG22 VAL 98 4.833 -6.115 17.499 750 HG23 VAL 98 HG23 VAL 98 5.977 -6.804 16.348 751 H HIS 99 HN HIS 99 6.992 -5.631 16.107 752 HA HIS 99 HA HIS 99 9.054 -3.994 15.613 753 HB2 HIS 99 HB2 HIS 99 8.967 -6.928 14.916 754 HB3 HIS 99 HB1 HIS 99 10.444 -5.984 15.055 755 HD1 HIS 99 HD1 HIS 99 8.576 -8.295 16.923 756 HD2 HIS 99 HD2 HIS 99 10.436 -4.694 17.850 757 HE1 HIS 99 HE1 HIS 99 8.910 -8.331 19.411 758 HE2 HIS 99 HE2 HIS 99 10.167 -6.210 19.930 759 H ILE 100 HN ILE 100 8.876 -2.566 13.955 760 HA ILE 100 HA ILE 100 10.073 -2.967 11.532 761 HB ILE 100 HB ILE 100 8.001 -4.403 11.058 762 HG12 ILE 100 HG12 ILE 100 8.541 -2.029 9.259 763 HG13 ILE 100 HG11 ILE 100 9.468 -3.525 9.289 764 HG21 ILE 100 HG21 ILE 100 6.690 -1.685 11.037 765 HG22 ILE 100 HG22 ILE 100 6.294 -3.046 12.089 766 HG23 ILE 100 HG23 ILE 100 5.974 -3.146 10.358 767 HD11 ILE 100 HD11 ILE 100 7.503 -4.757 8.535 768 HD12 ILE 100 HD12 ILE 100 7.936 -3.471 7.408 769 HD13 ILE 100 HD13 ILE 100 6.575 -3.259 8.508 770 H SER 101 HN SER 101 10.216 -0.999 10.410 771 HA SER 101 HA SER 101 9.375 1.297 11.921 772 HB2 SER 101 HB2 SER 101 11.063 1.098 9.446 773 HB3 SER 101 HB1 SER 101 10.780 2.580 10.353 774 HG SER 101 HG SER 101 11.591 0.683 12.046 775 H THR 102 HN THR 102 8.795 3.282 10.451 776 HA THR 102 HA THR 102 6.151 2.889 9.609 777 HB THR 102 HB THR 102 8.084 5.163 9.086 778 HG1 THR 102 HG1 THR 102 7.393 4.535 11.320 779 HG21 THR 102 HG21 THR 102 6.256 5.284 7.479 780 HG22 THR 102 HG22 THR 102 6.101 6.562 8.686 781 HG23 THR 102 HG23 THR 102 5.080 5.127 8.784 782 H TYR 103 HN TYR 103 5.219 2.844 7.559 783 HA TYR 103 HA TYR 103 6.936 1.600 5.576 784 HB2 TYR 103 HB2 TYR 103 5.043 0.301 5.848 785 HB3 TYR 103 HB1 TYR 103 4.000 1.687 6.124 786 HD1 TYR 103 HD1 TYR 103 2.372 1.953 4.560 787 HD2 TYR 103 HD2 TYR 103 6.143 0.439 3.281 788 HE1 TYR 103 HE1 TYR 103 1.529 1.813 2.259 789 HE2 TYR 103 HE2 TYR 103 5.296 0.309 0.973 790 HH TYR 103 HH TYR 103 2.356 1.744 -0.005 791 H LEU 104 HN LEU 104 7.763 2.680 3.984 792 HA LEU 104 HA LEU 104 6.528 5.206 3.171 793 HB2 LEU 104 HB2 LEU 104 9.290 4.298 3.485 794 HB3 LEU 104 HB1 LEU 104 9.005 5.171 1.989 795 HG LEU 104 HG LEU 104 8.143 6.283 4.655 796 HD11 LEU 104 HD11 LEU 104 10.225 7.556 4.703 797 HD12 LEU 104 HD12 LEU 104 10.797 6.695 3.276 798 HD13 LEU 104 HD13 LEU 104 10.543 5.823 4.788 799 HD21 LEU 104 HD21 LEU 104 7.179 7.277 2.638 800 HD22 LEU 104 HD22 LEU 104 8.798 7.567 2.004 801 HD23 LEU 104 HD23 LEU 104 8.259 8.404 3.458 802 H PHE 105 HN PHE 105 5.353 5.112 1.476 803 HA PHE 105 HA PHE 105 5.838 3.151 -0.639 804 HB2 PHE 105 HB2 PHE 105 3.560 3.249 0.057 805 HB3 PHE 105 HB1 PHE 105 3.557 5.003 0.070 806 HD1 PHE 105 HD1 PHE 105 3.393 6.257 -2.011 807 HD2 PHE 105 HD2 PHE 105 3.142 2.015 -1.947 808 HE1 PHE 105 HE1 PHE 105 2.389 6.290 -4.239 809 HE2 PHE 105 HE2 PHE 105 2.139 2.047 -4.194 810 HZ PHE 105 HZ PHE 105 1.753 4.193 -5.343 811 H THR 106 HN THR 106 7.252 3.825 -2.192 812 HA THR 106 HA THR 106 7.324 6.720 -2.730 813 HB THR 106 HB THR 106 9.638 4.798 -2.924 814 HG1 THR 106 HG1 THR 106 9.011 5.153 -0.759 815 HG21 THR 106 HG21 THR 106 11.001 6.809 -3.147 816 HG22 THR 106 HG22 THR 106 9.554 7.815 -3.060 817 HG23 THR 106 HG23 THR 106 9.796 6.735 -4.434 818 H PHE 107 HN PHE 107 6.731 7.298 -4.685 819 HA PHE 107 HA PHE 107 7.006 5.375 -6.894 820 HB2 PHE 107 HB2 PHE 107 4.863 7.039 -6.128 821 HB3 PHE 107 HB1 PHE 107 5.537 7.769 -7.578 822 HD1 PHE 107 HD1 PHE 107 3.380 5.258 -6.314 823 HD2 PHE 107 HD2 PHE 107 5.906 6.213 -9.596 824 HE1 PHE 107 HE1 PHE 107 2.180 3.626 -7.698 825 HE2 PHE 107 HE2 PHE 107 4.713 4.576 -10.989 826 HZ PHE 107 HZ PHE 107 2.859 3.269 -10.034 827 H LYS 108 HN LYS 108 7.258 6.715 -9.053 828 HA LYS 108 HA LYS 108 9.658 8.281 -8.748 829 HB2 LYS 108 HB2 LYS 108 9.510 8.245 -11.351 830 HB3 LYS 108 HB1 LYS 108 9.995 6.807 -10.469 831 HG2 LYS 108 HG2 LYS 108 8.540 6.083 -12.143 832 HG3 LYS 108 HG1 LYS 108 7.579 6.065 -10.672 833 HD2 LYS 108 HD2 LYS 108 6.399 7.999 -11.297 834 HD3 LYS 108 HD1 LYS 108 7.578 8.403 -12.548 835 HE2 LYS 108 HE2 LYS 108 6.938 6.343 -13.745 836 HE3 LYS 108 HE1 LYS 108 5.678 6.072 -12.545 837 HZ1 LYS 108 HZ1 LYS 108 5.874 8.382 -14.403 838 HZ2 LYS 108 HZ2 LYS 108 4.696 8.212 -13.204 839 HZ3 LYS 108 HZ3 LYS 108 4.755 7.117 -14.489 840 H THR 109 HN THR 109 6.307 8.849 -9.260 841 HA THR 109 HA THR 109 6.936 11.707 -9.467 842 HB THR 109 HB THR 109 4.980 12.036 -10.948 843 HG1 THR 109 HG1 THR 109 4.030 10.195 -11.904 844 HG21 THR 109 HG21 THR 109 7.132 11.898 -12.013 845 HG22 THR 109 HG22 THR 109 5.968 11.016 -13.001 846 HG23 THR 109 HG23 THR 109 7.089 10.136 -11.962 847 H ARG 110 HN ARG 110 5.177 13.099 -8.696 848 HA ARG 110 HA ARG 110 4.085 12.116 -6.253 849 HB2 ARG 110 HB2 ARG 110 4.745 14.428 -6.334 850 HB3 ARG 110 HB1 ARG 110 3.709 14.727 -7.725 851 HG2 ARG 110 HG2 ARG 110 1.849 13.907 -6.012 852 HG3 ARG 110 HG1 ARG 110 3.030 14.526 -4.856 853 HD2 ARG 110 HD2 ARG 110 3.018 16.685 -5.942 854 HD3 ARG 110 HD1 ARG 110 1.949 16.073 -7.203 855 HE ARG 110 HE ARG 110 1.206 16.600 -4.405 856 HH11 ARG 110 HH11 ARG 110 0.290 15.933 -7.725 857 HH12 ARG 110 HH12 ARG 110 -1.404 16.141 -7.431 858 HH21 ARG 110 HH21 ARG 110 -1.025 16.877 -4.021 859 HH22 ARG 110 HH22 ARG 110 -2.156 16.679 -5.322 860 H GLU 111 HN GLU 111 2.771 12.830 -9.450 861 HA GLU 111 HA GLU 111 0.058 12.740 -8.718 862 HB2 GLU 111 HB2 GLU 111 1.352 12.212 -11.396 863 HB3 GLU 111 HB1 GLU 111 -0.377 12.420 -11.145 864 HG2 GLU 111 HG2 GLU 111 0.062 14.683 -10.260 865 HG3 GLU 111 HG1 GLU 111 1.770 14.467 -10.634 866 H GLU 112 HN GLU 112 2.316 10.215 -9.653 867 HA GLU 112 HA GLU 112 0.376 8.172 -9.971 868 HB2 GLU 112 HB2 GLU 112 3.350 8.099 -9.471 869 HB3 GLU 112 HB1 GLU 112 2.386 6.634 -9.630 870 HG2 GLU 112 HG2 GLU 112 2.855 8.770 -11.682 871 HG3 GLU 112 HG1 GLU 112 3.371 7.086 -11.730 872 H ARG 113 HN ARG 113 2.403 9.167 -7.230 873 HA ARG 113 HA ARG 113 1.359 7.148 -5.508 874 HB2 ARG 113 HB2 ARG 113 2.603 8.201 -3.741 875 HB3 ARG 113 HB1 ARG 113 3.597 8.226 -5.185 876 HG2 ARG 113 HG2 ARG 113 3.952 10.332 -4.389 877 HG3 ARG 113 HG1 ARG 113 2.583 10.630 -5.459 878 HD2 ARG 113 HD2 ARG 113 1.091 10.310 -3.467 879 HD3 ARG 113 HD1 ARG 113 2.541 10.295 -2.467 880 HE ARG 113 HE ARG 113 2.934 12.594 -3.521 881 HH11 ARG 113 HH11 ARG 113 -0.213 11.231 -2.806 882 HH12 ARG 113 HH12 ARG 113 -0.978 12.766 -2.568 883 HH21 ARG 113 HH21 ARG 113 1.920 14.635 -3.164 884 HH22 ARG 113 HH22 ARG 113 0.237 14.699 -2.751 885 H GLU 114 HN GLU 114 0.457 10.364 -6.386 886 HA GLU 114 HA GLU 114 -1.299 11.056 -4.334 887 HB2 GLU 114 HB2 GLU 114 -0.556 12.079 -6.833 888 HB3 GLU 114 HB1 GLU 114 -2.292 11.845 -6.941 889 HG2 GLU 114 HG2 GLU 114 -0.898 13.395 -4.780 890 HG3 GLU 114 HG1 GLU 114 -1.645 14.101 -6.211 891 H SER 115 HN SER 115 -1.997 9.447 -7.426 892 HA SER 115 HA SER 115 -4.695 8.960 -7.051 893 HB2 SER 115 HB2 SER 115 -3.504 8.580 -9.185 894 HB3 SER 115 HB1 SER 115 -2.678 7.196 -8.472 895 HG SER 115 HG SER 115 -5.481 7.472 -8.865 896 H TRP 116 HN TRP 116 -1.917 6.941 -6.183 897 HA TRP 116 HA TRP 116 -3.284 4.728 -5.204 898 HB2 TRP 116 HB2 TRP 116 -0.793 5.063 -5.691 899 HB3 TRP 116 HB1 TRP 116 -0.688 5.760 -4.081 900 HD1 TRP 116 HD1 TRP 116 -1.330 2.446 -5.873 901 HE1 TRP 116 HE1 TRP 116 -0.888 0.523 -4.226 902 HE3 TRP 116 HE3 TRP 116 -0.680 5.183 -1.583 903 HZ2 TRP 116 HZ2 TRP 116 -0.336 0.213 -1.486 904 HZ3 TRP 116 HZ3 TRP 116 -0.188 3.980 0.496 905 HH2 TRP 116 HH2 TRP 116 -0.023 1.550 0.548 906 H GLN 117 HN GLN 117 -1.932 7.475 -3.357 907 HA GLN 117 HA GLN 117 -2.844 6.802 -0.842 908 HB2 GLN 117 HB2 GLN 117 -1.364 8.583 -0.863 909 HB3 GLN 117 HB1 GLN 117 -2.190 9.399 -2.179 910 HG2 GLN 117 HG2 GLN 117 -4.001 10.017 -0.667 911 HG3 GLN 117 HG1 GLN 117 -3.183 9.187 0.658 912 HE21 GLN 117 HE21 GLN 117 -3.175 11.962 -1.439 913 HE22 GLN 117 HE22 GLN 117 -2.033 12.890 -0.529 914 H ASN 118 HN ASN 118 -4.533 8.764 -3.290 915 HA ASN 118 HA ASN 118 -6.781 9.353 -1.702 916 HB2 ASN 118 HB2 ASN 118 -6.295 9.331 -4.664 917 HB3 ASN 118 HB1 ASN 118 -7.901 9.660 -4.021 918 HD21 ASN 118 HD21 ASN 118 -4.579 10.724 -4.084 919 HD22 ASN 118 HD22 ASN 118 -4.882 12.380 -3.671 920 H ASN 119 HN ASN 119 -6.100 6.697 -3.910 921 HA ASN 119 HA ASN 119 -8.662 5.494 -3.756 922 HB2 ASN 119 HB2 ASN 119 -5.978 4.240 -4.373 923 HB3 ASN 119 HB1 ASN 119 -7.537 3.469 -4.633 924 HD21 ASN 119 HD21 ASN 119 -5.423 4.102 -6.511 925 HD22 ASN 119 HD22 ASN 119 -6.129 5.110 -7.719 926 H LEU 120 HN LEU 120 -5.589 4.822 -2.083 927 HA LEU 120 HA LEU 120 -6.565 2.621 -0.634 928 HB2 LEU 120 HB2 LEU 120 -4.151 3.095 -0.960 929 HB3 LEU 120 HB1 LEU 120 -4.296 4.437 0.158 930 HG LEU 120 HG LEU 120 -5.003 2.860 1.932 931 HD11 LEU 120 HD11 LEU 120 -5.932 1.092 0.581 932 HD12 LEU 120 HD12 LEU 120 -4.635 0.450 1.583 933 HD13 LEU 120 HD13 LEU 120 -4.354 0.757 -0.129 934 HD21 LEU 120 HD21 LEU 120 -2.801 1.861 2.316 935 HD22 LEU 120 HD22 LEU 120 -2.686 3.543 1.807 936 HD23 LEU 120 HD23 LEU 120 -2.345 2.250 0.657 937 H GLU 121 HN GLU 121 -6.294 6.058 0.251 938 HA GLU 121 HA GLU 121 -6.971 5.792 2.939 939 HB2 GLU 121 HB2 GLU 121 -6.162 7.906 2.017 940 HB3 GLU 121 HB1 GLU 121 -7.643 8.085 1.085 941 HG2 GLU 121 HG2 GLU 121 -8.930 8.189 3.175 942 HG3 GLU 121 HG1 GLU 121 -7.431 8.056 4.090 943 H SER 122 HN SER 122 -9.079 6.262 0.134 944 HA SER 122 HA SER 122 -11.492 6.428 1.594 945 HB2 SER 122 HB2 SER 122 -10.993 7.075 -0.868 946 HB3 SER 122 HB1 SER 122 -11.290 5.374 -1.226 947 HG SER 122 HG SER 122 -13.127 6.925 -1.360 948 H PHE 123 HN PHE 123 -9.813 3.708 0.059 949 HA PHE 123 HA PHE 123 -11.755 1.742 0.677 950 HB2 PHE 123 HB2 PHE 123 -10.017 1.409 -1.030 951 HB3 PHE 123 HB1 PHE 123 -8.775 1.475 0.212 952 HD1 PHE 123 HD1 PHE 123 -12.022 -0.354 0.170 953 HD2 PHE 123 HD2 PHE 123 -7.775 -0.589 0.203 954 HE1 PHE 123 HE1 PHE 123 -12.163 -2.794 0.441 955 HE2 PHE 123 HE2 PHE 123 -7.907 -3.020 0.478 956 HZ PHE 123 HZ PHE 123 -10.101 -4.132 0.597 957 H ARG 124 HN ARG 124 -8.862 2.896 2.301 958 HA ARG 124 HA ARG 124 -8.901 1.232 4.552 959 HB2 ARG 124 HB2 ARG 124 -6.951 2.505 4.157 960 HB3 ARG 124 HB1 ARG 124 -7.856 4.005 4.033 961 HG2 ARG 124 HG2 ARG 124 -8.385 3.763 6.479 962 HG3 ARG 124 HG1 ARG 124 -7.219 2.435 6.514 963 HD2 ARG 124 HD2 ARG 124 -5.453 3.893 5.799 964 HD3 ARG 124 HD1 ARG 124 -6.590 5.214 5.540 965 HE ARG 124 HE ARG 124 -6.097 4.093 8.221 966 HH11 ARG 124 HH11 ARG 124 -6.322 6.821 6.037 967 HH12 ARG 124 HH12 ARG 124 -6.078 8.002 7.280 968 HH21 ARG 124 HH21 ARG 124 -5.781 5.655 9.865 969 HH22 ARG 124 HH22 ARG 124 -5.782 7.342 9.451 970 H LYS 125 HN LYS 125 -10.579 4.263 3.850 971 HA LYS 125 HA LYS 125 -11.601 4.707 6.422 972 HB2 LYS 125 HB2 LYS 125 -12.737 5.525 3.748 973 HB3 LYS 125 HB1 LYS 125 -13.341 6.089 5.301 974 HG2 LYS 125 HG2 LYS 125 -11.215 7.146 5.778 975 HG3 LYS 125 HG1 LYS 125 -10.552 6.533 4.263 976 HD2 LYS 125 HD2 LYS 125 -11.213 8.867 4.038 977 HD3 LYS 125 HD1 LYS 125 -12.211 7.833 3.016 978 HE2 LYS 125 HE2 LYS 125 -13.976 7.883 4.722 979 HE3 LYS 125 HE1 LYS 125 -12.981 8.950 5.707 980 HZ1 LYS 125 HZ1 LYS 125 -13.970 9.583 2.981 981 HZ2 LYS 125 HZ2 LYS 125 -13.096 10.615 3.995 982 HZ3 LYS 125 HZ3 LYS 125 -14.661 10.144 4.418 983 H ILE 126 HN ILE 126 -12.699 2.625 3.842 984 HA ILE 126 HA ILE 126 -15.293 2.132 4.814 985 HB ILE 126 HB ILE 126 -13.502 0.253 3.265 986 HG12 ILE 126 HG12 ILE 126 -15.524 2.263 2.247 987 HG13 ILE 126 HG11 ILE 126 -13.777 2.471 2.181 988 HG21 ILE 126 HG21 ILE 126 -16.501 0.351 3.528 989 HG22 ILE 126 HG22 ILE 126 -15.435 -0.848 4.260 990 HG23 ILE 126 HG23 ILE 126 -15.587 -0.758 2.506 991 HD11 ILE 126 HD11 ILE 126 -14.661 1.754 0.043 992 HD12 ILE 126 HD12 ILE 126 -15.352 0.317 0.793 993 HD13 ILE 126 HD13 ILE 126 -13.604 0.526 0.731 994 H MET 127 HN MET 127 -12.161 0.856 5.710 995 HA MET 127 HA MET 127 -13.458 -1.196 7.366 996 HB2 MET 127 HB2 MET 127 -10.672 -0.999 6.228 997 HB3 MET 127 HB1 MET 127 -11.143 -2.218 7.406 998 HG2 MET 127 HG2 MET 127 -12.766 -3.127 5.878 999 HG3 MET 127 HG1 MET 127 -12.445 -1.839 4.720 1000 HE1 MET 127 HE1 MET 127 -8.849 -2.643 3.497 1001 HE2 MET 127 HE2 MET 127 -9.265 -1.571 4.834 1002 HE3 MET 127 HE3 MET 127 -10.244 -1.572 3.366 1003 H SER 128 HN SER 128 -10.988 1.343 7.498 1004 HA SER 128 HA SER 128 -10.575 0.843 10.343 1005 HB2 SER 128 HB2 SER 128 -8.608 1.179 8.880 1006 HB3 SER 128 HB1 SER 128 -9.188 2.793 8.483 1007 HG SER 128 HG SER 128 -8.035 1.832 10.839 1008 H MET 129 HN MET 129 -11.936 3.244 8.185 1009 HA MET 129 HA MET 129 -12.679 4.884 10.514 1010 HB2 MET 129 HB2 MET 129 -12.563 5.713 7.587 1011 HB3 MET 129 HB1 MET 129 -12.934 6.757 8.959 1012 HG2 MET 129 HG2 MET 129 -10.712 6.471 9.847 1013 HG3 MET 129 HG1 MET 129 -10.319 5.319 8.574 1014 HE1 MET 129 HE1 MET 129 -11.088 9.808 7.844 1015 HE2 MET 129 HE2 MET 129 -11.138 9.051 9.435 1016 HE3 MET 129 HE3 MET 129 -12.372 8.666 8.236 1017 H LYS 130 HN LYS 130 -13.976 2.502 9.828 1018 HA LYS 130 HA LYS 130 -16.154 2.764 8.088 1019 HB2 LYS 130 HB2 LYS 130 -15.107 0.641 9.032 1020 HB3 LYS 130 HB1 LYS 130 -16.050 0.937 10.484 1021 HG2 LYS 130 HG2 LYS 130 -18.094 0.943 9.010 1022 HG3 LYS 130 HG1 LYS 130 -17.051 0.359 7.714 1023 HD2 LYS 130 HD2 LYS 130 -17.574 -1.013 10.351 1024 HD3 LYS 130 HD1 LYS 130 -18.206 -1.493 8.781 1025 HE2 LYS 130 HE2 LYS 130 -16.430 -2.944 9.069 1026 HE3 LYS 130 HE1 LYS 130 -15.720 -1.662 8.092 1027 HZ1 LYS 130 HZ1 LYS 130 -15.481 -1.861 11.047 1028 HZ2 LYS 130 HZ2 LYS 130 -14.718 -0.729 10.054 1029 HZ3 LYS 130 HZ3 LYS 130 -14.295 -2.359 9.949 Start of MODEL 3 1 H1 SER 12 HT1 SER 12 -21.002 -7.247 -4.572 2 H2 SER 12 HT2 SER 12 -21.809 -8.672 -4.993 3 H3 SER 12 HT3 SER 12 -20.882 -8.616 -3.579 4 HA SER 12 HA SER 12 -23.203 -8.491 -3.041 5 HB2 SER 12 HB2 SER 12 -21.619 -7.240 -1.644 6 HB3 SER 12 HB1 SER 12 -21.777 -5.840 -2.699 7 HG SER 12 HG SER 12 -23.560 -6.885 -0.813 8 H ALA 13 HN ALA 13 -22.457 -5.318 -4.496 9 HA ALA 13 HA ALA 13 -24.584 -5.576 -6.406 10 HB1 ALA 13 HB1 ALA 13 -24.957 -3.585 -4.172 11 HB2 ALA 13 HB2 ALA 13 -25.872 -5.078 -4.371 12 HB3 ALA 13 HB3 ALA 13 -26.004 -3.797 -5.575 13 H LYS 14 HN LYS 14 -23.463 -2.637 -4.768 14 HA LYS 14 HA LYS 14 -21.851 -1.967 -7.119 15 HB2 LYS 14 HB2 LYS 14 -24.000 -0.220 -5.917 16 HB3 LYS 14 HB1 LYS 14 -22.742 0.396 -6.972 17 HG2 LYS 14 HG2 LYS 14 -24.454 0.107 -8.453 18 HG3 LYS 14 HG1 LYS 14 -23.624 -1.440 -8.609 19 HD2 LYS 14 HD2 LYS 14 -25.218 -2.462 -7.075 20 HD3 LYS 14 HD1 LYS 14 -26.032 -0.910 -6.869 21 HE2 LYS 14 HE2 LYS 14 -26.555 -0.892 -9.272 22 HE3 LYS 14 HE1 LYS 14 -25.789 -2.470 -9.435 23 HZ1 LYS 14 HZ1 LYS 14 -28.138 -1.887 -7.718 24 HZ2 LYS 14 HZ2 LYS 14 -27.428 -3.403 -7.955 25 HZ3 LYS 14 HZ3 LYS 14 -28.204 -2.626 -9.237 26 H ASP 15 HN ASP 15 -20.039 -2.368 -5.810 27 HA ASP 15 HA ASP 15 -18.175 -1.535 -4.795 28 HB2 ASP 15 HB2 ASP 15 -19.871 0.921 -4.674 29 HB3 ASP 15 HB1 ASP 15 -18.350 0.842 -3.797 30 H ILE 16 HN ILE 16 -20.460 -2.920 -3.231 31 HA ILE 16 HA ILE 16 -19.943 -1.673 -0.628 32 HB ILE 16 HB ILE 16 -21.871 -3.907 -1.296 33 HG12 ILE 16 HG12 ILE 16 -23.465 -2.002 -0.397 34 HG13 ILE 16 HG11 ILE 16 -22.149 -0.952 -0.909 35 HG21 ILE 16 HG21 ILE 16 -20.987 -4.137 0.979 36 HG22 ILE 16 HG22 ILE 16 -22.690 -3.681 0.988 37 HG23 ILE 16 HG23 ILE 16 -21.452 -2.472 1.325 38 HD11 ILE 16 HD11 ILE 16 -23.596 -2.913 -2.668 39 HD12 ILE 16 HD12 ILE 16 -22.327 -1.793 -3.168 40 HD13 ILE 16 HD13 ILE 16 -23.881 -1.174 -2.610 41 H LYS 17 HN LYS 17 -20.355 -5.177 -1.183 42 HA LYS 17 HA LYS 17 -18.283 -5.656 0.751 43 HB2 LYS 17 HB2 LYS 17 -19.937 -7.552 -0.908 44 HB3 LYS 17 HB1 LYS 17 -18.761 -8.072 0.281 45 HG2 LYS 17 HG2 LYS 17 -21.118 -6.320 0.921 46 HG3 LYS 17 HG1 LYS 17 -21.120 -8.076 1.073 47 HD2 LYS 17 HD2 LYS 17 -19.210 -6.224 2.498 48 HD3 LYS 17 HD1 LYS 17 -20.667 -6.912 3.212 49 HE2 LYS 17 HE2 LYS 17 -19.776 -9.166 2.861 50 HE3 LYS 17 HE1 LYS 17 -18.322 -8.480 2.140 51 HZ1 LYS 17 HZ1 LYS 17 -19.221 -8.036 4.934 52 HZ2 LYS 17 HZ2 LYS 17 -17.810 -7.420 4.237 53 HZ3 LYS 17 HZ3 LYS 17 -17.984 -9.087 4.455 54 H ASP 18 HN ASP 18 -18.693 -6.952 -2.516 55 HA ASP 18 HA ASP 18 -15.937 -7.821 -2.548 56 HB2 ASP 18 HB2 ASP 18 -17.938 -8.029 -4.795 57 HB3 ASP 18 HB1 ASP 18 -16.529 -9.041 -4.507 58 H GLU 19 HN GLU 19 -18.025 -5.702 -4.369 59 HA GLU 19 HA GLU 19 -16.436 -5.130 -6.531 60 HB2 GLU 19 HB2 GLU 19 -18.321 -3.182 -5.236 61 HB3 GLU 19 HB1 GLU 19 -17.865 -3.239 -6.928 62 HG2 GLU 19 HG2 GLU 19 -19.986 -4.147 -6.906 63 HG3 GLU 19 HG1 GLU 19 -18.951 -5.573 -6.896 64 H LYS 20 HN LYS 20 -16.549 -3.389 -3.425 65 HA LYS 20 HA LYS 20 -14.837 -1.292 -4.161 66 HB2 LYS 20 HB2 LYS 20 -14.566 -0.834 -1.819 67 HB3 LYS 20 HB1 LYS 20 -16.232 -1.310 -2.099 68 HG2 LYS 20 HG2 LYS 20 -15.859 -3.463 -1.143 69 HG3 LYS 20 HG1 LYS 20 -14.117 -3.189 -1.074 70 HD2 LYS 20 HD2 LYS 20 -14.515 -1.321 0.499 71 HD3 LYS 20 HD1 LYS 20 -16.237 -1.711 0.481 72 HE2 LYS 20 HE2 LYS 20 -14.030 -3.569 1.361 73 HE3 LYS 20 HE1 LYS 20 -15.078 -2.651 2.438 74 HZ1 LYS 20 HZ1 LYS 20 -15.921 -4.778 0.547 75 HZ2 LYS 20 HZ2 LYS 20 -16.980 -3.840 1.478 76 HZ3 LYS 20 HZ3 LYS 20 -15.883 -4.879 2.235 77 H ILE 21 HN ILE 21 -14.191 -4.497 -2.860 78 HA ILE 21 HA ILE 21 -11.392 -4.096 -2.484 79 HB ILE 21 HB ILE 21 -13.048 -6.622 -2.638 80 HG12 ILE 21 HG12 ILE 21 -11.770 -5.390 -0.197 81 HG13 ILE 21 HG11 ILE 21 -13.387 -4.936 -0.732 82 HG21 ILE 21 HG21 ILE 21 -10.800 -7.188 -3.245 83 HG22 ILE 21 HG22 ILE 21 -11.088 -7.729 -1.589 84 HG23 ILE 21 HG23 ILE 21 -10.153 -6.263 -1.889 85 HD11 ILE 21 HD11 ILE 21 -14.112 -7.248 -0.493 86 HD12 ILE 21 HD12 ILE 21 -13.474 -6.602 1.018 87 HD13 ILE 21 HD13 ILE 21 -12.493 -7.702 0.045 88 H GLN 22 HN GLN 22 -13.385 -5.661 -4.953 89 HA GLN 22 HA GLN 22 -11.360 -6.706 -6.555 90 HB2 GLN 22 HB2 GLN 22 -14.115 -5.709 -7.270 91 HB3 GLN 22 HB1 GLN 22 -13.072 -6.559 -8.400 92 HG2 GLN 22 HG2 GLN 22 -13.956 -7.701 -5.766 93 HG3 GLN 22 HG1 GLN 22 -14.811 -7.959 -7.287 94 HE21 GLN 22 HE21 GLN 22 -13.767 -9.135 -8.942 95 HE22 GLN 22 HE22 GLN 22 -12.490 -10.241 -8.578 96 H GLN 23 HN GLN 23 -13.028 -3.573 -6.852 97 HA GLN 23 HA GLN 23 -11.574 -2.802 -9.176 98 HB2 GLN 23 HB2 GLN 23 -13.847 -1.945 -8.429 99 HB3 GLN 23 HB1 GLN 23 -12.989 -0.945 -7.273 100 HG2 GLN 23 HG2 GLN 23 -13.548 0.305 -9.283 101 HG3 GLN 23 HG1 GLN 23 -11.804 0.174 -9.062 102 HE21 GLN 23 HE21 GLN 23 -13.850 -2.413 -10.257 103 HE22 GLN 23 HE22 GLN 23 -13.209 -2.425 -11.864 104 H TYR 24 HN TYR 24 -11.388 -1.784 -5.773 105 HA TYR 24 HA TYR 24 -9.277 0.014 -6.185 106 HB2 TYR 24 HB2 TYR 24 -10.356 -1.314 -3.733 107 HB3 TYR 24 HB1 TYR 24 -8.848 -0.402 -3.648 108 HD1 TYR 24 HD1 TYR 24 -12.194 -0.152 -3.045 109 HD2 TYR 24 HD2 TYR 24 -9.099 1.971 -5.043 110 HE1 TYR 24 HE1 TYR 24 -13.493 1.922 -2.833 111 HE2 TYR 24 HE2 TYR 24 -10.389 4.056 -4.832 112 HH TYR 24 HH TYR 24 -13.108 4.335 -2.806 113 H ARG 25 HN ARG 25 -9.230 -3.447 -5.420 114 HA ARG 25 HA ARG 25 -6.513 -3.643 -4.769 115 HB2 ARG 25 HB2 ARG 25 -8.278 -5.424 -4.517 116 HB3 ARG 25 HB1 ARG 25 -8.104 -5.733 -6.237 117 HG2 ARG 25 HG2 ARG 25 -5.781 -6.349 -5.920 118 HG3 ARG 25 HG1 ARG 25 -5.907 -5.975 -4.198 119 HD2 ARG 25 HD2 ARG 25 -6.094 -8.371 -4.563 120 HD3 ARG 25 HD1 ARG 25 -7.609 -7.716 -3.947 121 HE ARG 25 HE ARG 25 -7.158 -8.365 -6.791 122 HH11 ARG 25 HH11 ARG 25 -9.210 -8.283 -3.949 123 HH12 ARG 25 HH12 ARG 25 -10.558 -9.027 -4.747 124 HH21 ARG 25 HH21 ARG 25 -8.942 -9.341 -7.837 125 HH22 ARG 25 HH22 ARG 25 -10.409 -9.614 -6.945 126 H LYS 26 HN LYS 26 -8.145 -3.542 -7.849 127 HA LYS 26 HA LYS 26 -5.966 -4.237 -9.505 128 HB2 LYS 26 HB2 LYS 26 -8.269 -4.318 -10.280 129 HB3 LYS 26 HB1 LYS 26 -8.445 -2.594 -10.029 130 HG2 LYS 26 HG2 LYS 26 -6.358 -3.548 -11.923 131 HG3 LYS 26 HG1 LYS 26 -8.047 -3.602 -12.420 132 HD2 LYS 26 HD2 LYS 26 -6.568 -1.152 -11.454 133 HD3 LYS 26 HD1 LYS 26 -6.961 -1.523 -13.133 134 HE2 LYS 26 HE2 LYS 26 -8.970 -1.077 -10.917 135 HE3 LYS 26 HE1 LYS 26 -8.524 0.100 -12.148 136 HZ1 LYS 26 HZ1 LYS 26 -9.717 -2.548 -12.743 137 HZ2 LYS 26 HZ2 LYS 26 -9.438 -1.290 -13.835 138 HZ3 LYS 26 HZ3 LYS 26 -10.603 -1.111 -12.619 139 H THR 27 HN THR 27 -7.277 -1.076 -8.514 140 HA THR 27 HA THR 27 -5.257 0.349 -9.971 141 HB THR 27 HB THR 27 -7.552 1.249 -9.635 142 HG1 THR 27 HG1 THR 27 -6.506 3.017 -10.067 143 HG21 THR 27 HG21 THR 27 -7.848 0.557 -7.296 144 HG22 THR 27 HG22 THR 27 -8.171 2.274 -7.529 145 HG23 THR 27 HG23 THR 27 -6.650 1.753 -6.804 146 H LEU 28 HN LEU 28 -5.545 -0.986 -6.837 147 HA LEU 28 HA LEU 28 -3.655 0.704 -5.521 148 HB2 LEU 28 HB2 LEU 28 -5.236 -1.689 -4.885 149 HB3 LEU 28 HB1 LEU 28 -3.691 -1.608 -4.060 150 HG LEU 28 HG LEU 28 -5.624 -0.686 -2.759 151 HD11 LEU 28 HD11 LEU 28 -3.392 -0.045 -2.175 152 HD12 LEU 28 HD12 LEU 28 -4.444 1.366 -2.059 153 HD13 LEU 28 HD13 LEU 28 -3.369 1.181 -3.442 154 HD21 LEU 28 HD21 LEU 28 -5.521 1.528 -4.803 155 HD22 LEU 28 HD22 LEU 28 -6.490 1.510 -3.329 156 HD23 LEU 28 HD23 LEU 28 -6.829 0.359 -4.622 157 H THR 29 HN THR 29 -3.389 -1.978 -7.662 158 HA THR 29 HA THR 29 -0.853 -2.897 -6.698 159 HB THR 29 HB THR 29 -2.070 -3.432 -9.411 160 HG1 THR 29 HG1 THR 29 -3.489 -4.110 -7.738 161 HG21 THR 29 HG21 THR 29 -0.657 -5.445 -9.343 162 HG22 THR 29 HG22 THR 29 0.001 -4.937 -7.787 163 HG23 THR 29 HG23 THR 29 0.317 -3.980 -9.233 164 H LYS 30 HN LYS 30 0.896 -1.694 -6.823 165 HA LYS 30 HA LYS 30 1.535 -0.313 -9.324 166 HB2 LYS 30 HB2 LYS 30 1.423 0.983 -6.600 167 HB3 LYS 30 HB1 LYS 30 2.252 1.695 -7.973 168 HG2 LYS 30 HG2 LYS 30 -0.679 1.016 -7.970 169 HG3 LYS 30 HG1 LYS 30 -0.026 2.598 -7.534 170 HD2 LYS 30 HD2 LYS 30 1.092 2.651 -9.776 171 HD3 LYS 30 HD1 LYS 30 0.203 1.188 -10.188 172 HE2 LYS 30 HE2 LYS 30 -1.119 3.738 -9.302 173 HE3 LYS 30 HE1 LYS 30 -0.800 3.354 -10.991 174 HZ1 LYS 30 HZ1 LYS 30 -3.038 2.749 -10.441 175 HZ2 LYS 30 HZ2 LYS 30 -2.529 1.818 -9.124 176 HZ3 LYS 30 HZ3 LYS 30 -2.152 1.332 -10.699 177 H ILE 31 HN ILE 31 3.754 -0.002 -9.691 178 HA ILE 31 HA ILE 31 5.569 -1.552 -8.029 179 HB ILE 31 HB ILE 31 5.957 -0.056 -10.621 180 HG12 ILE 31 HG12 ILE 31 4.846 -2.259 -10.736 181 HG13 ILE 31 HG11 ILE 31 6.405 -2.260 -11.550 182 HG21 ILE 31 HG21 ILE 31 8.070 -1.423 -8.949 183 HG22 ILE 31 HG22 ILE 31 7.984 0.288 -9.377 184 HG23 ILE 31 HG23 ILE 31 8.286 -0.918 -10.628 185 HD11 ILE 31 HD11 ILE 31 6.114 -4.301 -10.312 186 HD12 ILE 31 HD12 ILE 31 5.806 -3.398 -8.830 187 HD13 ILE 31 HD13 ILE 31 7.402 -3.344 -9.579 188 H VAL 32 HN VAL 32 6.372 -0.639 -6.267 189 HA VAL 32 HA VAL 32 7.192 2.180 -6.386 190 HB VAL 32 HB VAL 32 6.190 2.696 -4.268 191 HG11 VAL 32 HG11 VAL 32 3.832 2.550 -4.821 192 HG12 VAL 32 HG12 VAL 32 4.170 1.282 -6.000 193 HG13 VAL 32 HG13 VAL 32 4.782 2.918 -6.261 194 HG21 VAL 32 HG21 VAL 32 4.774 1.088 -3.053 195 HG22 VAL 32 HG22 VAL 32 6.453 0.556 -3.145 196 HG23 VAL 32 HG23 VAL 32 5.238 -0.170 -4.199 197 H LYS 33 HN LYS 33 8.572 2.768 -4.512 198 HA LYS 33 HA LYS 33 10.318 0.528 -3.818 199 HB2 LYS 33 HB2 LYS 33 10.744 3.505 -3.444 200 HB3 LYS 33 HB1 LYS 33 11.920 2.245 -3.094 201 HG2 LYS 33 HG2 LYS 33 12.028 1.647 -5.438 202 HG3 LYS 33 HG1 LYS 33 10.792 2.848 -5.819 203 HD2 LYS 33 HD2 LYS 33 12.255 4.625 -5.051 204 HD3 LYS 33 HD1 LYS 33 13.482 3.446 -4.593 205 HE2 LYS 33 HE2 LYS 33 13.686 2.760 -6.936 206 HE3 LYS 33 HE1 LYS 33 12.458 3.941 -7.388 207 HZ1 LYS 33 HZ1 LYS 33 14.719 4.747 -7.780 208 HZ2 LYS 33 HZ2 LYS 33 15.065 4.599 -6.132 209 HZ3 LYS 33 HZ3 LYS 33 13.902 5.704 -6.654 210 H ILE 34 HN ILE 34 9.971 -0.457 -1.968 211 HA ILE 34 HA ILE 34 8.637 0.955 0.193 212 HB ILE 34 HB ILE 34 8.953 -1.849 -0.545 213 HG12 ILE 34 HG12 ILE 34 7.091 -0.330 1.272 214 HG13 ILE 34 HG11 ILE 34 6.823 -0.689 -0.429 215 HG21 ILE 34 HG21 ILE 34 10.485 -1.884 1.378 216 HG22 ILE 34 HG22 ILE 34 9.002 -2.780 1.706 217 HG23 ILE 34 HG23 ILE 34 9.224 -1.166 2.384 218 HD11 ILE 34 HD11 ILE 34 6.953 -2.657 1.841 219 HD12 ILE 34 HD12 ILE 34 6.801 -3.092 0.142 220 HD13 ILE 34 HD13 ILE 34 5.521 -2.175 0.933 221 H LYS 35 HN LYS 35 9.554 1.427 2.100 222 HA LYS 35 HA LYS 35 12.447 1.016 2.342 223 HB2 LYS 35 HB2 LYS 35 10.923 3.609 2.229 224 HB3 LYS 35 HB1 LYS 35 12.473 3.524 3.021 225 HG2 LYS 35 HG2 LYS 35 13.577 3.545 1.094 226 HG3 LYS 35 HG1 LYS 35 12.538 2.292 0.409 227 HD2 LYS 35 HD2 LYS 35 11.967 4.025 -0.960 228 HD3 LYS 35 HD1 LYS 35 10.820 4.273 0.359 229 HE2 LYS 35 HE2 LYS 35 11.929 6.349 -0.381 230 HE3 LYS 35 HE1 LYS 35 12.179 5.977 1.326 231 HZ1 LYS 35 HZ1 LYS 35 14.207 6.729 0.163 232 HZ2 LYS 35 HZ2 LYS 35 14.136 5.359 -0.825 233 HZ3 LYS 35 HZ3 LYS 35 14.374 5.189 0.841 234 H THR 36 HN THR 36 12.551 -0.127 4.168 235 HA THR 36 HA THR 36 11.084 0.840 6.534 236 HB THR 36 HB THR 36 10.693 -1.447 7.250 237 HG1 THR 36 HG1 THR 36 11.750 -2.383 4.782 238 HG21 THR 36 HG21 THR 36 9.892 -1.092 4.360 239 HG22 THR 36 HG22 THR 36 9.001 -0.499 5.763 240 HG23 THR 36 HG23 THR 36 9.169 -2.235 5.492 241 H ALA 37 HN ALA 37 12.096 -0.493 8.551 242 HA ALA 37 HA ALA 37 14.907 0.107 8.589 243 HB1 ALA 37 HB1 ALA 37 13.113 -1.216 10.622 244 HB2 ALA 37 HB2 ALA 37 13.647 0.465 10.604 245 HB3 ALA 37 HB3 ALA 37 14.810 -0.825 10.896 246 H ILE 38 HN ILE 38 12.922 -2.623 7.952 247 HA ILE 38 HA ILE 38 14.878 -4.632 8.502 248 HB ILE 38 HB ILE 38 12.424 -4.914 6.763 249 HG12 ILE 38 HG12 ILE 38 12.687 -5.320 9.754 250 HG13 ILE 38 HG11 ILE 38 11.833 -3.989 8.982 251 HG21 ILE 38 HG21 ILE 38 14.026 -6.922 8.347 252 HG22 ILE 38 HG22 ILE 38 14.031 -6.741 6.594 253 HG23 ILE 38 HG23 ILE 38 12.567 -7.272 7.422 254 HD11 ILE 38 HD11 ILE 38 10.258 -5.574 7.999 255 HD12 ILE 38 HD12 ILE 38 10.292 -5.691 9.759 256 HD13 ILE 38 HD13 ILE 38 11.114 -6.905 8.778 257 H PHE 39 HN PHE 39 13.431 -3.383 5.503 258 HA PHE 39 HA PHE 39 15.947 -3.365 4.157 259 HB2 PHE 39 HB2 PHE 39 15.096 -4.937 2.299 260 HB3 PHE 39 HB1 PHE 39 15.739 -5.656 3.767 261 HD1 PHE 39 HD1 PHE 39 14.638 -7.524 4.432 262 HD2 PHE 39 HD2 PHE 39 12.396 -4.385 2.640 263 HE1 PHE 39 HE1 PHE 39 12.579 -8.842 4.704 264 HE2 PHE 39 HE2 PHE 39 10.337 -5.693 2.910 265 HZ PHE 39 HZ PHE 39 10.426 -7.927 3.945 266 H HIS 40 HN HIS 40 15.914 -2.201 2.257 267 HA HIS 40 HA HIS 40 13.366 -0.861 1.634 268 HB2 HIS 40 HB2 HIS 40 16.124 -0.090 0.657 269 HB3 HIS 40 HB1 HIS 40 14.665 0.875 0.583 270 HD1 HIS 40 HD1 HIS 40 17.487 -0.039 2.822 271 HD2 HIS 40 HD2 HIS 40 13.943 2.112 3.027 272 HE1 HIS 40 HE1 HIS 40 17.642 1.319 4.928 273 HE2 HIS 40 HE2 HIS 40 15.588 2.772 4.910 274 H GLU 41 HN GLU 41 12.293 -1.823 -0.016 275 HA GLU 41 HA GLU 41 13.843 -3.162 -2.140 276 HB2 GLU 41 HB2 GLU 41 11.411 -4.276 -0.723 277 HB3 GLU 41 HB1 GLU 41 12.250 -5.037 -2.065 278 HG2 GLU 41 HG2 GLU 41 13.593 -4.442 0.552 279 HG3 GLU 41 HG1 GLU 41 12.717 -5.941 0.245 280 H THR 42 HN THR 42 13.098 -2.705 -4.191 281 HA THR 42 HA THR 42 10.701 -1.200 -4.596 282 HB THR 42 HB THR 42 12.133 -2.829 -6.703 283 HG1 THR 42 HG1 THR 42 13.536 -1.314 -5.536 284 HG21 THR 42 HG21 THR 42 9.913 -1.941 -7.308 285 HG22 THR 42 HG22 THR 42 11.208 -1.195 -8.245 286 HG23 THR 42 HG23 THR 42 10.473 -0.315 -6.904 287 H VAL 43 HN VAL 43 8.648 -1.943 -4.988 288 HA VAL 43 HA VAL 43 8.266 -4.838 -5.043 289 HB VAL 43 HB VAL 43 8.497 -3.865 -2.656 290 HG11 VAL 43 HG11 VAL 43 6.356 -3.063 -1.708 291 HG12 VAL 43 HG12 VAL 43 5.715 -2.952 -3.345 292 HG13 VAL 43 HG13 VAL 43 7.086 -1.949 -2.863 293 HG21 VAL 43 HG21 VAL 43 6.155 -5.588 -3.428 294 HG22 VAL 43 HG22 VAL 43 6.805 -5.426 -1.796 295 HG23 VAL 43 HG23 VAL 43 7.801 -6.124 -3.078 296 H LYS 44 HN LYS 44 6.149 -5.484 -5.635 297 HA LYS 44 HA LYS 44 4.499 -3.379 -6.829 298 HB2 LYS 44 HB2 LYS 44 5.089 -5.603 -8.024 299 HB3 LYS 44 HB1 LYS 44 3.948 -6.339 -6.906 300 HG2 LYS 44 HG2 LYS 44 2.175 -4.907 -7.746 301 HG3 LYS 44 HG1 LYS 44 3.310 -4.172 -8.882 302 HD2 LYS 44 HD2 LYS 44 1.961 -5.906 -9.967 303 HD3 LYS 44 HD1 LYS 44 3.670 -6.340 -9.943 304 HE2 LYS 44 HE2 LYS 44 3.270 -7.784 -7.999 305 HE3 LYS 44 HE1 LYS 44 1.562 -7.350 -8.030 306 HZ1 LYS 44 HZ1 LYS 44 1.405 -8.344 -10.235 307 HZ2 LYS 44 HZ2 LYS 44 1.930 -9.471 -9.092 308 HZ3 LYS 44 HZ3 LYS 44 3.037 -8.785 -10.171 309 H VAL 45 HN VAL 45 3.107 -2.487 -5.461 310 HA VAL 45 HA VAL 45 2.238 -4.020 -3.132 311 HB VAL 45 HB VAL 45 3.114 -1.792 -2.699 312 HG11 VAL 45 HG11 VAL 45 0.881 -0.787 -4.462 313 HG12 VAL 45 HG12 VAL 45 2.607 -0.720 -4.818 314 HG13 VAL 45 HG13 VAL 45 1.945 0.217 -3.479 315 HG21 VAL 45 HG21 VAL 45 0.132 -1.909 -2.263 316 HG22 VAL 45 HG22 VAL 45 1.266 -0.878 -1.389 317 HG23 VAL 45 HG23 VAL 45 1.362 -2.631 -1.226 318 H THR 46 HN THR 46 0.238 -4.807 -2.918 319 HA THR 46 HA THR 46 -1.920 -3.688 -4.544 320 HB THR 46 HB THR 46 -1.042 -5.711 -5.732 321 HG1 THR 46 HG1 THR 46 -3.101 -5.498 -6.260 322 HG21 THR 46 HG21 THR 46 -1.436 -7.926 -4.793 323 HG22 THR 46 HG22 THR 46 -2.040 -7.201 -3.303 324 HG23 THR 46 HG23 THR 46 -0.348 -7.001 -3.757 325 H CYS 47 HN CYS 47 -4.069 -4.794 -3.714 326 HA CYS 47 HA CYS 47 -3.895 -4.827 -0.791 327 HB2 CYS 47 HB2 CYS 47 -5.472 -3.230 -1.297 328 HB3 CYS 47 HB1 CYS 47 -6.071 -4.090 -2.704 329 HG CYS 47 HG CYS 47 -7.508 -5.970 -1.204 330 H SER 48 HN SER 48 -5.116 -6.378 0.368 331 HA SER 48 HA SER 48 -4.726 -9.014 -0.551 332 HB2 SER 48 HB2 SER 48 -6.070 -9.631 1.481 333 HB3 SER 48 HB1 SER 48 -4.720 -8.546 1.806 334 HG SER 48 HG SER 48 -6.460 -6.843 1.466 335 H LYS 49 HN LYS 49 -6.301 -10.652 -0.915 336 HA LYS 49 HA LYS 49 -8.444 -9.778 -2.623 337 HB2 LYS 49 HB2 LYS 49 -7.620 -12.537 -1.690 338 HB3 LYS 49 HB1 LYS 49 -8.908 -12.232 -2.842 339 HG2 LYS 49 HG2 LYS 49 -7.013 -12.848 -4.110 340 HG3 LYS 49 HG1 LYS 49 -7.183 -11.104 -4.302 341 HD2 LYS 49 HD2 LYS 49 -5.444 -10.744 -2.625 342 HD3 LYS 49 HD1 LYS 49 -5.288 -12.485 -2.402 343 HE2 LYS 49 HE2 LYS 49 -4.566 -12.717 -4.724 344 HE3 LYS 49 HE1 LYS 49 -4.743 -10.978 -4.957 345 HZ1 LYS 49 HZ1 LYS 49 -3.057 -10.666 -3.197 346 HZ2 LYS 49 HZ2 LYS 49 -2.454 -11.480 -4.553 347 HZ3 LYS 49 HZ3 LYS 49 -2.826 -12.341 -3.144 348 H ASP 50 HN ASP 50 -8.011 -10.578 0.658 349 HA ASP 50 HA ASP 50 -10.799 -11.025 1.235 350 HB2 ASP 50 HB2 ASP 50 -9.050 -12.071 2.614 351 HB3 ASP 50 HB1 ASP 50 -8.452 -10.482 3.072 352 H GLY 51 HN GLY 51 -8.592 -8.369 1.054 353 HA2 GLY 51 HA2 GLY 51 -9.192 -6.143 0.706 354 HA3 GLY 51 HA1 GLY 51 -10.826 -6.529 1.219 355 H LYS 52 HN LYS 52 -8.317 -7.597 3.281 356 HA LYS 52 HA LYS 52 -9.106 -5.535 5.219 357 HB2 LYS 52 HB2 LYS 52 -9.558 -7.872 5.832 358 HB3 LYS 52 HB1 LYS 52 -7.846 -8.240 5.674 359 HG2 LYS 52 HG2 LYS 52 -7.377 -6.614 7.484 360 HG3 LYS 52 HG1 LYS 52 -9.118 -6.400 7.687 361 HD2 LYS 52 HD2 LYS 52 -9.338 -8.796 8.178 362 HD3 LYS 52 HD1 LYS 52 -7.593 -8.982 8.007 363 HE2 LYS 52 HE2 LYS 52 -8.208 -8.819 10.350 364 HE3 LYS 52 HE1 LYS 52 -7.248 -7.425 9.862 365 HZ1 LYS 52 HZ1 LYS 52 -9.177 -6.847 11.248 366 HZ2 LYS 52 HZ2 LYS 52 -10.211 -7.434 10.044 367 HZ3 LYS 52 HZ3 LYS 52 -9.219 -6.100 9.733 368 H MET 53 HN MET 53 -6.371 -6.798 3.482 369 HA MET 53 HA MET 53 -4.637 -5.000 5.009 370 HB2 MET 53 HB2 MET 53 -2.912 -6.630 5.267 371 HB3 MET 53 HB1 MET 53 -4.402 -7.336 5.876 372 HG2 MET 53 HG2 MET 53 -4.638 -8.524 3.703 373 HG3 MET 53 HG1 MET 53 -3.051 -7.911 3.253 374 HE1 MET 53 HE1 MET 53 -0.790 -9.580 6.022 375 HE2 MET 53 HE2 MET 53 -1.638 -8.049 6.226 376 HE3 MET 53 HE3 MET 53 -0.847 -8.421 4.695 377 H LEU 54 HN LEU 54 -2.426 -4.882 3.964 378 HA LEU 54 HA LEU 54 -2.824 -4.506 1.073 379 HB2 LEU 54 HB2 LEU 54 -2.370 -2.535 2.636 380 HB3 LEU 54 HB1 LEU 54 -0.760 -3.196 2.832 381 HG LEU 54 HG LEU 54 -0.431 -2.967 0.363 382 HD11 LEU 54 HD11 LEU 54 -3.032 -1.443 0.521 383 HD12 LEU 54 HD12 LEU 54 -2.776 -2.970 -0.323 384 HD13 LEU 54 HD13 LEU 54 -1.958 -1.509 -0.875 385 HD21 LEU 54 HD21 LEU 54 -1.125 -0.420 1.820 386 HD22 LEU 54 HD22 LEU 54 -0.030 -0.585 0.447 387 HD23 LEU 54 HD23 LEU 54 0.385 -1.314 1.996 388 H GLU 55 HN GLU 55 -1.945 -6.200 0.032 389 HA GLU 55 HA GLU 55 0.381 -7.542 1.197 390 HB2 GLU 55 HB2 GLU 55 -1.238 -8.449 -1.180 391 HB3 GLU 55 HB1 GLU 55 -0.147 -9.408 -0.192 392 HG2 GLU 55 HG2 GLU 55 -1.727 -9.076 1.724 393 HG3 GLU 55 HG1 GLU 55 -2.840 -8.325 0.582 394 H TRP 56 HN TRP 56 2.348 -7.513 0.216 395 HA TRP 56 HA TRP 56 2.449 -6.338 -2.463 396 HB2 TRP 56 HB2 TRP 56 4.669 -5.257 -1.644 397 HB3 TRP 56 HB1 TRP 56 3.133 -4.486 -1.272 398 HD1 TRP 56 HD1 TRP 56 5.070 -7.284 0.621 399 HE1 TRP 56 HE1 TRP 56 5.335 -6.524 3.066 400 HE3 TRP 56 HE3 TRP 56 2.817 -2.720 0.299 401 HZ2 TRP 56 HZ2 TRP 56 4.672 -4.292 4.647 402 HZ3 TRP 56 HZ3 TRP 56 2.677 -1.337 2.319 403 HH2 TRP 56 HH2 TRP 56 3.581 -2.103 4.450 404 H TYR 57 HN TYR 57 3.801 -7.201 -3.864 405 HA TYR 57 HA TYR 57 5.504 -9.410 -2.913 406 HB2 TYR 57 HB2 TYR 57 4.136 -9.243 -5.609 407 HB3 TYR 57 HB1 TYR 57 5.041 -10.611 -4.958 408 HD1 TYR 57 HD1 TYR 57 1.866 -8.791 -4.897 409 HD2 TYR 57 HD2 TYR 57 4.050 -12.059 -3.274 410 HE1 TYR 57 HE1 TYR 57 -0.222 -9.727 -3.999 411 HE2 TYR 57 HE2 TYR 57 1.963 -13.007 -2.370 412 HH TYR 57 HH TYR 57 -0.264 -12.311 -1.750 413 H LYS 58 HN LYS 58 7.531 -9.424 -3.588 414 HA LYS 58 HA LYS 58 9.044 -7.360 -4.333 415 HB2 LYS 58 HB2 LYS 58 10.608 -9.030 -5.419 416 HB3 LYS 58 HB1 LYS 58 10.102 -9.405 -3.775 417 HG2 LYS 58 HG2 LYS 58 8.504 -10.549 -6.001 418 HG3 LYS 58 HG1 LYS 58 10.108 -11.222 -5.708 419 HD2 LYS 58 HD2 LYS 58 9.543 -11.952 -3.564 420 HD3 LYS 58 HD1 LYS 58 8.158 -10.866 -3.455 421 HE2 LYS 58 HE2 LYS 58 7.481 -13.201 -3.756 422 HE3 LYS 58 HE1 LYS 58 6.959 -12.181 -5.099 423 HZ1 LYS 58 HZ1 LYS 58 8.688 -13.037 -6.453 424 HZ2 LYS 58 HZ2 LYS 58 7.938 -14.371 -5.739 425 HZ3 LYS 58 HZ3 LYS 58 9.433 -13.829 -5.157 426 H GLY 59 HN GLY 59 9.088 -5.958 -5.954 427 HA2 GLY 59 HA2 GLY 59 7.951 -6.797 -8.548 428 HA3 GLY 59 HA1 GLY 59 7.813 -5.171 -7.894 429 H LYS 60 HN LYS 60 10.825 -6.433 -7.239 430 HA LYS 60 HA LYS 60 12.163 -4.689 -9.057 431 HB2 LYS 60 HB2 LYS 60 13.254 -6.933 -7.350 432 HB3 LYS 60 HB1 LYS 60 14.227 -5.738 -8.185 433 HG2 LYS 60 HG2 LYS 60 13.605 -4.035 -6.748 434 HG3 LYS 60 HG1 LYS 60 12.170 -4.897 -6.186 435 HD2 LYS 60 HD2 LYS 60 14.993 -5.815 -5.661 436 HD3 LYS 60 HD1 LYS 60 14.066 -4.810 -4.545 437 HE2 LYS 60 HE2 LYS 60 12.438 -6.515 -4.226 438 HE3 LYS 60 HE1 LYS 60 13.092 -7.477 -5.551 439 HZ1 LYS 60 HZ1 LYS 60 14.431 -6.913 -2.955 440 HZ2 LYS 60 HZ2 LYS 60 15.141 -7.749 -4.246 441 HZ3 LYS 60 HZ3 LYS 60 13.791 -8.395 -3.462 442 H ASN 61 HN ASN 61 12.807 -8.102 -8.617 443 HA ASN 61 HA ASN 61 12.241 -9.082 -11.163 444 HB2 ASN 61 HB2 ASN 61 14.189 -7.429 -11.658 445 HB3 ASN 61 HB1 ASN 61 15.208 -8.579 -10.803 446 HD21 ASN 61 HD21 ASN 61 13.392 -7.943 -13.682 447 HD22 ASN 61 HD22 ASN 61 13.967 -9.299 -14.589 448 H ASP 62 HN ASP 62 14.597 -10.910 -11.159 449 HA ASP 62 HA ASP 62 13.894 -12.543 -8.893 450 HB2 ASP 62 HB2 ASP 62 14.540 -13.538 -11.076 451 HB3 ASP 62 HB1 ASP 62 16.166 -12.898 -10.861 452 H SER 63 HN SER 63 14.374 -11.035 -7.240 453 HA SER 63 HA SER 63 17.085 -11.262 -6.262 454 HB2 SER 63 HB2 SER 63 17.236 -8.774 -5.856 455 HB3 SER 63 HB1 SER 63 17.347 -9.249 -7.549 456 HG SER 63 HG SER 63 15.870 -7.710 -7.662 457 H ASP 64 HN ASP 64 14.304 -12.061 -5.608 458 HA ASP 64 HA ASP 64 13.740 -10.558 -3.185 459 HB2 ASP 64 HB2 ASP 64 11.745 -12.145 -3.073 460 HB3 ASP 64 HB1 ASP 64 11.772 -10.983 -4.390 461 H GLY 65 HN GLY 65 14.921 -11.073 -1.489 462 HA2 GLY 65 HA2 GLY 65 15.945 -13.725 -1.056 463 HA3 GLY 65 HA1 GLY 65 16.093 -12.356 0.037 464 H LYS 66 HN LYS 66 12.911 -12.686 -0.817 465 HA LYS 66 HA LYS 66 12.305 -14.175 1.644 466 HB2 LYS 66 HB2 LYS 66 11.511 -11.808 1.478 467 HB3 LYS 66 HB1 LYS 66 10.537 -12.273 0.092 468 HG2 LYS 66 HG2 LYS 66 9.131 -12.212 1.998 469 HG3 LYS 66 HG1 LYS 66 9.371 -13.904 1.559 470 HD2 LYS 66 HD2 LYS 66 11.211 -13.980 3.264 471 HD3 LYS 66 HD1 LYS 66 10.691 -12.377 3.787 472 HE2 LYS 66 HE2 LYS 66 8.962 -14.827 3.706 473 HE3 LYS 66 HE1 LYS 66 9.742 -14.188 5.149 474 HZ1 LYS 66 HZ1 LYS 66 7.769 -12.698 3.500 475 HZ2 LYS 66 HZ2 LYS 66 8.452 -12.186 4.961 476 HZ3 LYS 66 HZ3 LYS 66 7.401 -13.508 4.938 477 H LYS 67 HN LYS 67 11.881 -13.984 -1.780 478 HA LYS 67 HA LYS 67 10.837 -15.208 -3.357 479 HB2 LYS 67 HB2 LYS 67 11.118 -17.414 -1.317 480 HB3 LYS 67 HB1 LYS 67 10.766 -17.643 -3.025 481 HG2 LYS 67 HG2 LYS 67 13.273 -16.455 -1.866 482 HG3 LYS 67 HG1 LYS 67 13.107 -18.060 -2.577 483 HD2 LYS 67 HD2 LYS 67 12.566 -17.046 -4.736 484 HD3 LYS 67 HD1 LYS 67 12.696 -15.435 -4.018 485 HE2 LYS 67 HE2 LYS 67 14.727 -15.981 -5.229 486 HE3 LYS 67 HE1 LYS 67 15.055 -15.870 -3.503 487 HZ1 LYS 67 HZ1 LYS 67 14.996 -18.282 -3.377 488 HZ2 LYS 67 HZ2 LYS 67 16.160 -17.766 -4.487 489 HZ3 LYS 67 HZ3 LYS 67 14.687 -18.384 -5.035 490 H LYS 68 HN LYS 68 9.323 -13.940 -1.134 491 HA LYS 68 HA LYS 68 6.669 -14.884 -1.758 492 HB2 LYS 68 HB2 LYS 68 7.948 -15.277 0.946 493 HB3 LYS 68 HB1 LYS 68 6.221 -15.016 0.821 494 HG2 LYS 68 HG2 LYS 68 7.715 -17.240 -0.541 495 HG3 LYS 68 HG1 LYS 68 6.850 -17.391 0.990 496 HD2 LYS 68 HD2 LYS 68 4.785 -16.641 -0.201 497 HD3 LYS 68 HD1 LYS 68 5.688 -16.736 -1.713 498 HE2 LYS 68 HE2 LYS 68 4.353 -18.755 -1.313 499 HE3 LYS 68 HE1 LYS 68 6.078 -19.104 -1.362 500 HZ1 LYS 68 HZ1 LYS 68 4.873 -20.231 0.461 501 HZ2 LYS 68 HZ2 LYS 68 4.535 -18.725 1.144 502 HZ3 LYS 68 HZ3 LYS 68 6.136 -19.250 1.003 503 HA PRO 69 HA PRO 69 5.537 -10.617 -0.576 504 HB2 PRO 69 HB2 PRO 69 4.273 -11.658 1.922 505 HB3 PRO 69 HB1 PRO 69 3.650 -10.489 0.750 506 HG2 PRO 69 HG2 PRO 69 2.769 -13.003 0.776 507 HG3 PRO 69 HG1 PRO 69 3.009 -12.128 -0.746 508 HD2 PRO 69 HD2 PRO 69 4.623 -14.301 0.462 509 HD3 PRO 69 HD1 PRO 69 4.376 -13.894 -1.244 510 H ILE 70 HN ILE 70 6.613 -9.065 0.508 511 HA ILE 70 HA ILE 70 8.836 -9.930 2.090 512 HB ILE 70 HB ILE 70 9.496 -7.509 2.095 513 HG12 ILE 70 HG12 ILE 70 7.216 -7.237 0.130 514 HG13 ILE 70 HG11 ILE 70 7.192 -6.590 1.773 515 HG21 ILE 70 HG21 ILE 70 9.004 -8.845 -0.566 516 HG22 ILE 70 HG22 ILE 70 10.383 -9.113 0.498 517 HG23 ILE 70 HG23 ILE 70 10.154 -7.543 -0.269 518 HD11 ILE 70 HD11 ILE 70 7.743 -4.855 0.197 519 HD12 ILE 70 HD12 ILE 70 9.082 -5.809 -0.436 520 HD13 ILE 70 HD13 ILE 70 9.138 -5.198 1.218 521 H GLY 71 HN GLY 71 5.865 -9.680 3.086 522 HA2 GLY 71 HA2 GLY 71 5.357 -9.782 5.434 523 HA3 GLY 71 HA1 GLY 71 6.636 -8.613 5.718 524 H SER 72 HN SER 72 3.616 -8.970 3.977 525 HA SER 72 HA SER 72 2.924 -6.262 3.775 526 HB2 SER 72 HB2 SER 72 1.057 -8.635 3.887 527 HB3 SER 72 HB1 SER 72 0.775 -7.092 3.080 528 HG SER 72 HG SER 72 1.825 -9.244 2.035 529 H PHE 73 HN PHE 73 0.887 -5.327 4.790 530 HA PHE 73 HA PHE 73 0.546 -6.151 7.588 531 HB2 PHE 73 HB2 PHE 73 0.990 -4.033 8.464 532 HB3 PHE 73 HB1 PHE 73 2.187 -4.144 7.178 533 HD1 PHE 73 HD1 PHE 73 1.807 -2.919 5.043 534 HD2 PHE 73 HD2 PHE 73 -0.720 -2.434 8.422 535 HE1 PHE 73 HE1 PHE 73 0.910 -0.841 4.072 536 HE2 PHE 73 HE2 PHE 73 -1.639 -0.378 7.465 537 HZ PHE 73 HZ PHE 73 -0.816 0.433 5.283 538 HA PRO 74 HA PRO 74 -3.730 -5.368 6.641 539 HB2 PRO 74 HB2 PRO 74 -4.599 -4.928 9.268 540 HB3 PRO 74 HB1 PRO 74 -4.523 -6.470 8.423 541 HG2 PRO 74 HG2 PRO 74 -2.942 -5.643 10.625 542 HG3 PRO 74 HG1 PRO 74 -2.780 -7.130 9.682 543 HD2 PRO 74 HD2 PRO 74 -1.196 -4.646 9.569 544 HD3 PRO 74 HD1 PRO 74 -0.765 -6.289 9.054 545 H LEU 75 HN LEU 75 -4.958 -3.697 6.053 546 HA LEU 75 HA LEU 75 -3.894 -1.084 6.240 547 HB2 LEU 75 HB2 LEU 75 -6.540 -2.098 5.220 548 HB3 LEU 75 HB1 LEU 75 -5.991 -0.443 5.037 549 HG LEU 75 HG LEU 75 -4.495 -2.823 3.936 550 HD11 LEU 75 HD11 LEU 75 -5.404 -2.180 1.760 551 HD12 LEU 75 HD12 LEU 75 -6.414 -0.962 2.539 552 HD13 LEU 75 HD13 LEU 75 -6.680 -2.674 2.872 553 HD21 LEU 75 HD21 LEU 75 -3.045 -0.966 4.225 554 HD22 LEU 75 HD22 LEU 75 -4.252 0.157 3.601 555 HD23 LEU 75 HD23 LEU 75 -3.486 -0.999 2.518 556 H ASN 76 HN ASN 76 -6.168 -2.792 8.163 557 HA ASN 76 HA ASN 76 -7.549 -0.561 9.257 558 HB2 ASN 76 HB2 ASN 76 -8.130 -2.235 11.092 559 HB3 ASN 76 HB1 ASN 76 -8.622 -2.661 9.455 560 HD21 ASN 76 HD21 ASN 76 -6.172 -3.222 11.916 561 HD22 ASN 76 HD22 ASN 76 -5.714 -4.792 11.358 562 H LYS 77 HN LYS 77 -4.371 -1.636 9.680 563 HA LYS 77 HA LYS 77 -4.181 -0.786 12.459 564 HB2 LYS 77 HB2 LYS 77 -2.034 -1.815 10.594 565 HB3 LYS 77 HB1 LYS 77 -1.846 -1.541 12.321 566 HG2 LYS 77 HG2 LYS 77 -3.754 -3.522 11.092 567 HG3 LYS 77 HG1 LYS 77 -2.150 -3.913 11.713 568 HD2 LYS 77 HD2 LYS 77 -4.291 -2.627 13.394 569 HD3 LYS 77 HD1 LYS 77 -4.091 -4.375 13.264 570 HE2 LYS 77 HE2 LYS 77 -1.788 -4.157 14.084 571 HE3 LYS 77 HE1 LYS 77 -2.016 -2.417 14.245 572 HZ1 LYS 77 HZ1 LYS 77 -3.546 -4.503 15.699 573 HZ2 LYS 77 HZ2 LYS 77 -3.768 -2.834 15.855 574 HZ3 LYS 77 HZ3 LYS 77 -2.319 -3.543 16.354 575 H ILE 78 HN ILE 78 -3.978 0.652 9.430 576 HA ILE 78 HA ILE 78 -1.729 2.313 9.651 577 HB ILE 78 HB ILE 78 -4.296 2.918 8.171 578 HG12 ILE 78 HG12 ILE 78 -1.759 1.571 7.226 579 HG13 ILE 78 HG11 ILE 78 -3.289 0.755 7.539 580 HG21 ILE 78 HG21 ILE 78 -2.871 4.881 8.470 581 HG22 ILE 78 HG22 ILE 78 -2.886 4.364 6.783 582 HG23 ILE 78 HG23 ILE 78 -1.497 3.993 7.807 583 HD11 ILE 78 HD11 ILE 78 -2.821 2.865 5.446 584 HD12 ILE 78 HD12 ILE 78 -4.335 2.009 5.743 585 HD13 ILE 78 HD13 ILE 78 -2.920 1.127 5.168 586 H THR 79 HN THR 79 -1.312 4.087 10.778 587 HA THR 79 HA THR 79 -3.446 5.214 12.411 588 HB THR 79 HB THR 79 -1.635 6.371 13.631 589 HG1 THR 79 HG1 THR 79 0.493 6.038 13.069 590 HG21 THR 79 HG21 THR 79 -1.164 3.409 13.276 591 HG22 THR 79 HG22 THR 79 -2.347 4.145 14.359 592 HG23 THR 79 HG23 THR 79 -0.622 4.381 14.644 593 H SER 80 HN SER 80 -1.107 6.093 9.923 594 HA SER 80 HA SER 80 -2.795 8.259 9.078 595 HB2 SER 80 HB2 SER 80 -0.967 9.985 9.309 596 HB3 SER 80 HB1 SER 80 -1.685 9.447 10.828 597 HG SER 80 HG SER 80 0.100 8.174 11.209 598 H ILE 81 HN ILE 81 -2.797 8.129 6.944 599 HA ILE 81 HA ILE 81 -0.334 7.335 5.545 600 HB ILE 81 HB ILE 81 -2.030 5.879 4.825 601 HG12 ILE 81 HG12 ILE 81 -2.037 8.133 2.801 602 HG13 ILE 81 HG11 ILE 81 -0.826 6.860 2.903 603 HG21 ILE 81 HG21 ILE 81 -3.928 6.978 5.844 604 HG22 ILE 81 HG22 ILE 81 -4.292 6.572 4.165 605 HG23 ILE 81 HG23 ILE 81 -3.896 8.233 4.605 606 HD11 ILE 81 HD11 ILE 81 -3.737 6.510 2.225 607 HD12 ILE 81 HD12 ILE 81 -2.568 5.202 2.408 608 HD13 ILE 81 HD13 ILE 81 -2.364 6.388 1.120 609 H ARG 82 HN ARG 82 0.852 9.050 4.975 610 HA ARG 82 HA ARG 82 -0.539 11.399 3.900 611 HB2 ARG 82 HB2 ARG 82 1.524 11.374 6.091 612 HB3 ARG 82 HB1 ARG 82 1.207 12.810 5.125 613 HG2 ARG 82 HG2 ARG 82 -0.675 11.376 6.979 614 HG3 ARG 82 HG1 ARG 82 -0.056 13.027 7.107 615 HD2 ARG 82 HD2 ARG 82 -1.217 13.531 4.942 616 HD3 ARG 82 HD1 ARG 82 -1.962 11.934 5.050 617 HE ARG 82 HE ARG 82 -2.337 13.736 7.313 618 HH11 ARG 82 HH11 ARG 82 -3.659 12.228 4.445 619 HH12 ARG 82 HH12 ARG 82 -5.303 12.588 4.857 620 HH21 ARG 82 HH21 ARG 82 -4.504 14.198 7.863 621 HH22 ARG 82 HH22 ARG 82 -5.787 13.706 6.804 622 H THR 83 HN THR 83 0.853 12.878 2.760 623 HA THR 83 HA THR 83 2.805 11.460 1.143 624 HB THR 83 HB THR 83 1.849 14.316 0.879 625 HG1 THR 83 HG1 THR 83 0.260 12.379 0.727 626 HG21 THR 83 HG21 THR 83 3.892 13.802 -0.343 627 HG22 THR 83 HG22 THR 83 2.544 14.030 -1.458 628 HG23 THR 83 HG23 THR 83 3.109 12.403 -1.080 629 H LYS 84 HN LYS 84 4.979 11.828 1.246 630 HA LYS 84 HA LYS 84 6.025 13.047 3.562 631 HB2 LYS 84 HB2 LYS 84 7.208 11.239 2.463 632 HB3 LYS 84 HB1 LYS 84 7.437 12.239 1.031 633 HG2 LYS 84 HG2 LYS 84 9.146 13.369 1.930 634 HG3 LYS 84 HG1 LYS 84 8.380 13.454 3.517 635 HD2 LYS 84 HD2 LYS 84 10.361 12.152 3.742 636 HD3 LYS 84 HD1 LYS 84 8.982 11.057 3.837 637 HE2 LYS 84 HE2 LYS 84 9.348 10.263 1.636 638 HE3 LYS 84 HE1 LYS 84 10.492 11.558 1.288 639 HZ1 LYS 84 HZ1 LYS 84 10.934 9.399 3.274 640 HZ2 LYS 84 HZ2 LYS 84 12.037 10.606 2.843 641 HZ3 LYS 84 HZ3 LYS 84 11.586 9.431 1.714 642 H VAL 85 HN VAL 85 6.338 15.073 3.988 643 HA VAL 85 HA VAL 85 5.694 17.154 2.227 644 HB VAL 85 HB VAL 85 5.539 17.295 4.701 645 HG11 VAL 85 HG11 VAL 85 7.643 16.233 5.286 646 HG12 VAL 85 HG12 VAL 85 7.546 17.840 6.004 647 HG13 VAL 85 HG13 VAL 85 8.543 17.570 4.571 648 HG21 VAL 85 HG21 VAL 85 5.451 19.326 3.367 649 HG22 VAL 85 HG22 VAL 85 7.209 19.449 3.408 650 HG23 VAL 85 HG23 VAL 85 6.278 19.626 4.896 651 H ASP 86 HN ASP 86 8.737 15.631 2.996 652 HA ASP 86 HA ASP 86 10.213 17.702 1.565 653 HB2 ASP 86 HB2 ASP 86 12.234 16.575 2.452 654 HB3 ASP 86 HB1 ASP 86 11.133 17.094 3.716 655 H ASN 87 HN ASN 87 8.506 15.265 0.558 656 HA ASN 87 HA ASN 87 9.891 14.999 -1.897 657 HB2 ASN 87 HB2 ASN 87 11.232 13.416 -0.459 658 HB3 ASN 87 HB1 ASN 87 9.767 12.467 -0.246 659 HD21 ASN 87 HD21 ASN 87 10.782 14.097 -3.201 660 HD22 ASN 87 HD22 ASN 87 11.018 12.652 -4.126 661 H LEU 88 HN LEU 88 7.927 15.586 -2.759 662 HA LEU 88 HA LEU 88 5.442 14.492 -1.991 663 HB2 LEU 88 HB2 LEU 88 6.332 16.050 -4.403 664 HB3 LEU 88 HB1 LEU 88 4.671 15.522 -4.206 665 HG LEU 88 HG LEU 88 6.175 17.364 -2.335 666 HD11 LEU 88 HD11 LEU 88 3.960 17.930 -4.299 667 HD12 LEU 88 HD12 LEU 88 5.648 18.411 -4.472 668 HD13 LEU 88 HD13 LEU 88 4.669 19.086 -3.171 669 HD21 LEU 88 HD21 LEU 88 3.317 16.408 -2.311 670 HD22 LEU 88 HD22 LEU 88 3.959 17.703 -1.303 671 HD23 LEU 88 HD23 LEU 88 4.561 16.058 -1.110 672 H LYS 89 HN LYS 89 7.911 13.182 -3.892 673 HA LYS 89 HA LYS 89 6.168 11.620 -5.584 674 HB2 LYS 89 HB2 LYS 89 9.060 11.022 -5.197 675 HB3 LYS 89 HB1 LYS 89 8.077 10.768 -6.620 676 HG2 LYS 89 HG2 LYS 89 9.162 13.338 -5.553 677 HG3 LYS 89 HG1 LYS 89 9.591 12.530 -7.059 678 HD2 LYS 89 HD2 LYS 89 7.254 12.876 -7.806 679 HD3 LYS 89 HD1 LYS 89 6.987 13.833 -6.353 680 HE2 LYS 89 HE2 LYS 89 8.938 15.261 -7.079 681 HE3 LYS 89 HE1 LYS 89 8.883 14.407 -8.617 682 HZ1 LYS 89 HZ1 LYS 89 7.690 16.461 -8.786 683 HZ2 LYS 89 HZ2 LYS 89 6.729 16.082 -7.449 684 HZ3 LYS 89 HZ3 LYS 89 6.583 15.187 -8.876 685 H SER 90 HN SER 90 7.128 11.540 -2.440 686 HA SER 90 HA SER 90 6.874 8.621 -2.234 687 HB2 SER 90 HB2 SER 90 9.118 9.577 -1.585 688 HB3 SER 90 HB1 SER 90 8.299 10.447 -0.291 689 HG SER 90 HG SER 90 8.707 7.673 -0.597 690 H LEU 91 HN LEU 91 5.981 7.920 -0.137 691 HA LEU 91 HA LEU 91 3.976 9.755 0.955 692 HB2 LEU 91 HB2 LEU 91 3.033 8.407 -0.938 693 HB3 LEU 91 HB1 LEU 91 3.403 6.961 -0.026 694 HG LEU 91 HG LEU 91 1.907 8.209 1.796 695 HD11 LEU 91 HD11 LEU 91 0.783 9.137 -0.841 696 HD12 LEU 91 HD12 LEU 91 1.560 10.171 0.358 697 HD13 LEU 91 HD13 LEU 91 0.048 9.350 0.749 698 HD21 LEU 91 HD21 LEU 91 0.012 6.875 0.927 699 HD22 LEU 91 HD22 LEU 91 1.529 5.974 1.016 700 HD23 LEU 91 HD23 LEU 91 0.945 6.571 -0.540 701 H GLU 92 HN GLU 92 4.228 9.703 3.103 702 HA GLU 92 HA GLU 92 5.588 7.412 4.305 703 HB2 GLU 92 HB2 GLU 92 6.434 9.718 4.719 704 HB3 GLU 92 HB1 GLU 92 4.917 10.094 5.525 705 HG2 GLU 92 HG2 GLU 92 5.388 8.322 7.168 706 HG3 GLU 92 HG1 GLU 92 6.939 8.038 6.382 707 H ILE 93 HN ILE 93 4.330 5.854 5.067 708 HA ILE 93 HA ILE 93 1.725 6.616 6.207 709 HB ILE 93 HB ILE 93 2.577 4.054 4.873 710 HG12 ILE 93 HG12 ILE 93 0.448 6.104 4.225 711 HG13 ILE 93 HG11 ILE 93 1.968 5.885 3.362 712 HG21 ILE 93 HG21 ILE 93 0.271 3.259 5.325 713 HG22 ILE 93 HG22 ILE 93 0.026 4.666 6.363 714 HG23 ILE 93 HG23 ILE 93 1.239 3.455 6.788 715 HD11 ILE 93 HD11 ILE 93 0.001 4.916 2.234 716 HD12 ILE 93 HD12 ILE 93 -0.162 3.780 3.574 717 HD13 ILE 93 HD13 ILE 93 1.286 3.755 2.565 718 H SER 94 HN SER 94 1.766 6.639 8.311 719 HA SER 94 HA SER 94 3.449 4.783 9.790 720 HB2 SER 94 HB2 SER 94 1.622 6.996 10.761 721 HB3 SER 94 HB1 SER 94 2.709 6.046 11.776 722 HG SER 94 HG SER 94 4.257 6.907 9.932 723 H VAL 95 HN VAL 95 2.689 3.077 10.882 724 HA VAL 95 HA VAL 95 -0.199 2.681 11.058 725 HB VAL 95 HB VAL 95 0.029 1.486 9.098 726 HG11 VAL 95 HG11 VAL 95 2.805 0.745 9.975 727 HG12 VAL 95 HG12 VAL 95 2.322 1.788 8.630 728 HG13 VAL 95 HG13 VAL 95 2.008 0.050 8.560 729 HG21 VAL 95 HG21 VAL 95 0.131 -0.910 9.559 730 HG22 VAL 95 HG22 VAL 95 -0.823 -0.056 10.774 731 HG23 VAL 95 HG23 VAL 95 0.820 -0.575 11.147 732 H SER 96 HN SER 96 -0.834 1.205 12.689 733 HA SER 96 HA SER 96 0.908 1.052 14.923 734 HB2 SER 96 HB2 SER 96 -1.596 1.147 15.077 735 HB3 SER 96 HB1 SER 96 -1.658 -0.492 14.435 736 HG SER 96 HG SER 96 -0.100 0.085 16.711 737 H SER 97 HN SER 97 2.598 -0.230 14.976 738 HA SER 97 HA SER 97 2.631 -2.543 13.172 739 HB2 SER 97 HB2 SER 97 4.997 -1.705 12.603 740 HB3 SER 97 HB1 SER 97 3.627 -0.840 11.907 741 HG SER 97 HG SER 97 3.856 0.747 13.473 742 H VAL 98 HN VAL 98 4.212 -4.078 13.535 743 HA VAL 98 HA VAL 98 5.361 -4.162 16.232 744 HB VAL 98 HB VAL 98 5.849 -6.566 15.680 745 HG11 VAL 98 HG11 VAL 98 2.955 -5.741 15.463 746 HG12 VAL 98 HG12 VAL 98 3.860 -5.973 16.958 747 HG13 VAL 98 HG13 VAL 98 3.534 -7.347 15.902 748 HG21 VAL 98 HG21 VAL 98 4.164 -5.997 13.238 749 HG22 VAL 98 HG22 VAL 98 4.738 -7.584 13.753 750 HG23 VAL 98 HG23 VAL 98 5.893 -6.353 13.241 751 H HIS 99 HN HIS 99 7.605 -5.721 15.761 752 HA HIS 99 HA HIS 99 9.576 -3.981 15.257 753 HB2 HIS 99 HB2 HIS 99 11.054 -5.880 14.649 754 HB3 HIS 99 HB1 HIS 99 10.061 -6.202 16.061 755 HD1 HIS 99 HD1 HIS 99 10.884 -7.480 12.725 756 HD2 HIS 99 HD2 HIS 99 7.896 -8.062 15.551 757 HE1 HIS 99 HE1 HIS 99 9.736 -9.610 12.063 758 HE2 HIS 99 HE2 HIS 99 8.059 -10.036 13.886 759 H ILE 100 HN ILE 100 9.432 -2.508 13.684 760 HA ILE 100 HA ILE 100 10.475 -2.812 11.189 761 HB ILE 100 HB ILE 100 8.375 -4.212 10.759 762 HG12 ILE 100 HG12 ILE 100 8.733 -1.761 9.025 763 HG13 ILE 100 HG11 ILE 100 9.782 -3.172 8.985 764 HG21 ILE 100 HG21 ILE 100 7.059 -1.501 10.893 765 HG22 ILE 100 HG22 ILE 100 6.746 -2.874 11.957 766 HG23 ILE 100 HG23 ILE 100 6.310 -2.962 10.250 767 HD11 ILE 100 HD11 ILE 100 6.851 -3.132 8.314 768 HD12 ILE 100 HD12 ILE 100 7.901 -4.549 8.276 769 HD13 ILE 100 HD13 ILE 100 8.187 -3.210 7.165 770 H SER 101 HN SER 101 10.367 -0.821 9.992 771 HA SER 101 HA SER 101 9.750 1.441 11.702 772 HB2 SER 101 HB2 SER 101 11.958 1.300 10.544 773 HB3 SER 101 HB1 SER 101 11.119 1.428 9.001 774 HG SER 101 HG SER 101 11.871 3.378 10.673 775 H THR 102 HN THR 102 8.966 3.438 10.378 776 HA THR 102 HA THR 102 6.306 2.955 9.604 777 HB THR 102 HB THR 102 8.136 5.337 9.239 778 HG1 THR 102 HG1 THR 102 7.640 5.275 11.327 779 HG21 THR 102 HG21 THR 102 6.125 6.671 8.756 780 HG22 THR 102 HG22 THR 102 5.168 5.191 8.701 781 HG23 THR 102 HG23 THR 102 6.434 5.467 7.505 782 H TYR 103 HN TYR 103 5.344 2.870 7.582 783 HA TYR 103 HA TYR 103 7.116 1.740 5.587 784 HB2 TYR 103 HB2 TYR 103 5.331 0.313 5.843 785 HB3 TYR 103 HB1 TYR 103 4.204 1.611 6.203 786 HD1 TYR 103 HD1 TYR 103 2.532 1.926 4.692 787 HD2 TYR 103 HD2 TYR 103 6.276 0.478 3.267 788 HE1 TYR 103 HE1 TYR 103 1.609 1.792 2.421 789 HE2 TYR 103 HE2 TYR 103 5.350 0.353 0.989 790 HH TYR 103 HH TYR 103 3.117 0.128 -0.079 791 H LEU 104 HN LEU 104 7.880 2.879 4.020 792 HA LEU 104 HA LEU 104 6.486 5.309 3.198 793 HB2 LEU 104 HB2 LEU 104 9.312 4.477 3.313 794 HB3 LEU 104 HB1 LEU 104 8.867 5.445 1.918 795 HG LEU 104 HG LEU 104 8.180 6.325 4.715 796 HD11 LEU 104 HD11 LEU 104 10.601 5.955 4.634 797 HD12 LEU 104 HD12 LEU 104 10.219 7.675 4.687 798 HD13 LEU 104 HD13 LEU 104 10.704 6.926 3.165 799 HD21 LEU 104 HD21 LEU 104 7.042 7.403 2.827 800 HD22 LEU 104 HD22 LEU 104 8.608 7.825 2.133 801 HD23 LEU 104 HD23 LEU 104 8.113 8.517 3.679 802 H PHE 105 HN PHE 105 5.276 5.181 1.538 803 HA PHE 105 HA PHE 105 5.734 3.187 -0.549 804 HB2 PHE 105 HB2 PHE 105 3.467 3.314 0.191 805 HB3 PHE 105 HB1 PHE 105 3.473 5.067 0.161 806 HD1 PHE 105 HD1 PHE 105 3.328 6.260 -1.983 807 HD2 PHE 105 HD2 PHE 105 2.957 2.033 -1.740 808 HE1 PHE 105 HE1 PHE 105 2.296 6.230 -4.201 809 HE2 PHE 105 HE2 PHE 105 1.926 2.002 -3.974 810 HZ PHE 105 HZ PHE 105 1.594 4.103 -5.207 811 H THR 106 HN THR 106 7.126 3.827 -2.126 812 HA THR 106 HA THR 106 7.217 6.709 -2.713 813 HB THR 106 HB THR 106 9.594 4.855 -2.708 814 HG1 THR 106 HG1 THR 106 8.834 5.165 -0.588 815 HG21 THR 106 HG21 THR 106 9.828 6.780 -4.196 816 HG22 THR 106 HG22 THR 106 10.882 6.946 -2.793 817 HG23 THR 106 HG23 THR 106 9.378 7.865 -2.879 818 H PHE 107 HN PHE 107 6.724 7.186 -4.705 819 HA PHE 107 HA PHE 107 7.178 5.198 -6.823 820 HB2 PHE 107 HB2 PHE 107 4.988 6.886 -6.236 821 HB3 PHE 107 HB1 PHE 107 5.709 7.506 -7.713 822 HD1 PHE 107 HD1 PHE 107 3.254 5.423 -6.516 823 HD2 PHE 107 HD2 PHE 107 6.394 5.481 -9.377 824 HE1 PHE 107 HE1 PHE 107 2.112 3.663 -7.788 825 HE2 PHE 107 HE2 PHE 107 5.260 3.720 -10.661 826 HZ PHE 107 HZ PHE 107 3.058 2.850 -9.870 827 H LYS 108 HN LYS 108 7.485 6.558 -9.016 828 HA LYS 108 HA LYS 108 9.934 8.024 -8.584 829 HB2 LYS 108 HB2 LYS 108 9.932 8.003 -11.188 830 HB3 LYS 108 HB1 LYS 108 10.313 6.542 -10.293 831 HG2 LYS 108 HG2 LYS 108 8.913 5.715 -11.887 832 HG3 LYS 108 HG1 LYS 108 7.755 6.049 -10.616 833 HD2 LYS 108 HD2 LYS 108 6.826 6.846 -12.643 834 HD3 LYS 108 HD1 LYS 108 7.331 8.258 -11.718 835 HE2 LYS 108 HE2 LYS 108 9.359 8.432 -13.027 836 HE3 LYS 108 HE1 LYS 108 8.957 6.953 -13.895 837 HZ1 LYS 108 HZ1 LYS 108 7.401 9.482 -13.985 838 HZ2 LYS 108 HZ2 LYS 108 7.028 8.065 -14.824 839 HZ3 LYS 108 HZ3 LYS 108 8.438 8.918 -15.195 840 H THR 109 HN THR 109 6.646 8.717 -9.159 841 HA THR 109 HA THR 109 7.368 11.552 -9.339 842 HB THR 109 HB THR 109 5.470 11.944 -10.896 843 HG1 THR 109 HG1 THR 109 4.864 9.862 -12.049 844 HG21 THR 109 HG21 THR 109 7.604 10.042 -11.856 845 HG22 THR 109 HG22 THR 109 7.678 11.805 -11.849 846 HG23 THR 109 HG23 THR 109 6.547 10.973 -12.917 847 H ARG 110 HN ARG 110 5.437 12.968 -8.770 848 HA ARG 110 HA ARG 110 4.181 12.060 -6.374 849 HB2 ARG 110 HB2 ARG 110 4.558 14.447 -6.677 850 HB3 ARG 110 HB1 ARG 110 3.552 14.442 -8.148 851 HG2 ARG 110 HG2 ARG 110 1.683 13.604 -6.605 852 HG3 ARG 110 HG1 ARG 110 2.715 14.133 -5.277 853 HD2 ARG 110 HD2 ARG 110 2.635 16.383 -5.986 854 HD3 ARG 110 HD1 ARG 110 1.961 15.934 -7.555 855 HE ARG 110 HE ARG 110 -0.110 15.432 -6.475 856 HH11 ARG 110 HH11 ARG 110 2.199 17.162 -4.493 857 HH12 ARG 110 HH12 ARG 110 1.015 17.691 -3.345 858 HH21 ARG 110 HH21 ARG 110 -1.679 16.137 -4.971 859 HH22 ARG 110 HH22 ARG 110 -1.192 17.107 -3.619 860 H GLU 111 HN GLU 111 3.163 12.555 -9.667 861 HA GLU 111 HA GLU 111 0.419 12.443 -9.226 862 HB2 GLU 111 HB2 GLU 111 1.819 11.701 -11.778 863 HB3 GLU 111 HB1 GLU 111 0.239 12.451 -11.579 864 HG2 GLU 111 HG2 GLU 111 1.370 14.355 -11.973 865 HG3 GLU 111 HG1 GLU 111 1.777 14.229 -10.282 866 H GLU 112 HN GLU 112 2.747 9.923 -9.937 867 HA GLU 112 HA GLU 112 0.840 7.854 -10.325 868 HB2 GLU 112 HB2 GLU 112 3.781 7.763 -9.646 869 HB3 GLU 112 HB1 GLU 112 2.810 6.334 -9.996 870 HG2 GLU 112 HG2 GLU 112 3.438 8.619 -11.843 871 HG3 GLU 112 HG1 GLU 112 4.018 6.962 -11.954 872 H ARG 113 HN ARG 113 2.716 8.939 -7.497 873 HA ARG 113 HA ARG 113 1.634 6.904 -5.796 874 HB2 ARG 113 HB2 ARG 113 2.655 8.140 -3.929 875 HB3 ARG 113 HB1 ARG 113 3.797 7.884 -5.231 876 HG2 ARG 113 HG2 ARG 113 4.281 10.036 -5.070 877 HG3 ARG 113 HG1 ARG 113 2.709 10.368 -5.792 878 HD2 ARG 113 HD2 ARG 113 3.414 10.283 -2.861 879 HD3 ARG 113 HD1 ARG 113 2.927 11.678 -3.812 880 HE ARG 113 HE ARG 113 1.078 9.458 -3.299 881 HH11 ARG 113 HH11 ARG 113 1.855 12.869 -3.312 882 HH12 ARG 113 HH12 ARG 113 0.291 13.363 -2.752 883 HH21 ARG 113 HH21 ARG 113 -0.995 10.113 -2.597 884 HH22 ARG 113 HH22 ARG 113 -1.327 11.792 -2.332 885 H GLU 114 HN GLU 114 0.667 10.032 -6.806 886 HA GLU 114 HA GLU 114 -0.822 10.857 -4.603 887 HB2 GLU 114 HB2 GLU 114 -0.118 11.971 -6.970 888 HB3 GLU 114 HB1 GLU 114 -1.817 11.645 -7.281 889 HG2 GLU 114 HG2 GLU 114 -0.819 13.167 -4.889 890 HG3 GLU 114 HG1 GLU 114 -1.317 13.925 -6.400 891 H SER 115 HN SER 115 -1.902 9.292 -7.611 892 HA SER 115 HA SER 115 -4.602 9.031 -7.044 893 HB2 SER 115 HB2 SER 115 -3.618 8.557 -9.258 894 HB3 SER 115 HB1 SER 115 -2.843 7.116 -8.606 895 HG SER 115 HG SER 115 -5.605 7.615 -8.991 896 H TRP 116 HN TRP 116 -1.903 6.947 -6.166 897 HA TRP 116 HA TRP 116 -3.322 4.727 -5.278 898 HB2 TRP 116 HB2 TRP 116 -0.835 4.933 -5.670 899 HB3 TRP 116 HB1 TRP 116 -0.727 5.736 -4.109 900 HD1 TRP 116 HD1 TRP 116 -1.173 2.327 -5.702 901 HE1 TRP 116 HE1 TRP 116 -0.939 0.517 -3.895 902 HE3 TRP 116 HE3 TRP 116 -1.153 5.322 -1.542 903 HZ2 TRP 116 HZ2 TRP 116 -0.772 0.374 -1.088 904 HZ3 TRP 116 HZ3 TRP 116 -0.953 4.256 0.662 905 HH2 TRP 116 HH2 TRP 116 -0.766 1.836 0.885 906 H GLN 117 HN GLN 117 -1.969 7.389 -3.275 907 HA GLN 117 HA GLN 117 -3.085 6.605 -0.857 908 HB2 GLN 117 HB2 GLN 117 -1.428 8.356 -0.899 909 HB3 GLN 117 HB1 GLN 117 -2.482 9.396 -1.852 910 HG2 GLN 117 HG2 GLN 117 -4.095 9.349 0.075 911 HG3 GLN 117 HG1 GLN 117 -2.839 8.543 1.009 912 HE21 GLN 117 HE21 GLN 117 -2.658 10.194 2.492 913 HE22 GLN 117 HE22 GLN 117 -1.972 11.732 2.097 914 H ASN 118 HN ASN 118 -4.488 8.565 -3.447 915 HA ASN 118 HA ASN 118 -6.778 9.433 -2.074 916 HB2 ASN 118 HB2 ASN 118 -6.277 8.924 -5.004 917 HB3 ASN 118 HB1 ASN 118 -7.807 9.549 -4.412 918 HD21 ASN 118 HD21 ASN 118 -4.712 10.422 -3.017 919 HD22 ASN 118 HD22 ASN 118 -4.677 12.051 -3.611 920 H ASN 119 HN ASN 119 -6.172 6.558 -4.003 921 HA ASN 119 HA ASN 119 -8.787 5.464 -3.772 922 HB2 ASN 119 HB2 ASN 119 -6.149 4.114 -4.388 923 HB3 ASN 119 HB1 ASN 119 -7.738 3.385 -4.613 924 HD21 ASN 119 HD21 ASN 119 -5.547 4.054 -6.491 925 HD22 ASN 119 HD22 ASN 119 -6.272 5.030 -7.714 926 H LEU 120 HN LEU 120 -5.708 4.750 -2.148 927 HA LEU 120 HA LEU 120 -6.729 2.656 -0.564 928 HB2 LEU 120 HB2 LEU 120 -4.300 3.155 -1.134 929 HB3 LEU 120 HB1 LEU 120 -4.350 4.372 0.121 930 HG LEU 120 HG LEU 120 -3.334 2.103 0.717 931 HD11 LEU 120 HD11 LEU 120 -5.564 3.170 2.437 932 HD12 LEU 120 HD12 LEU 120 -3.904 3.761 2.401 933 HD13 LEU 120 HD13 LEU 120 -4.245 2.130 2.976 934 HD21 LEU 120 HD21 LEU 120 -6.239 1.309 0.854 935 HD22 LEU 120 HD22 LEU 120 -4.856 0.342 1.367 936 HD23 LEU 120 HD23 LEU 120 -5.078 0.727 -0.338 937 H GLU 121 HN GLU 121 -6.395 6.131 0.028 938 HA GLU 121 HA GLU 121 -7.043 6.116 2.754 939 HB2 GLU 121 HB2 GLU 121 -6.164 8.108 1.658 940 HB3 GLU 121 HB1 GLU 121 -7.615 8.233 0.673 941 HG2 GLU 121 HG2 GLU 121 -8.949 8.640 2.667 942 HG3 GLU 121 HG1 GLU 121 -7.509 8.488 3.670 943 H SER 122 HN SER 122 -9.115 6.309 -0.111 944 HA SER 122 HA SER 122 -11.536 6.594 1.331 945 HB2 SER 122 HB2 SER 122 -11.198 5.418 -1.443 946 HB3 SER 122 HB1 SER 122 -12.635 6.197 -0.781 947 HG SER 122 HG SER 122 -10.289 7.315 -1.775 948 H PHE 123 HN PHE 123 -9.884 3.787 -0.090 949 HA PHE 123 HA PHE 123 -11.778 1.854 0.686 950 HB2 PHE 123 HB2 PHE 123 -9.952 1.483 -0.968 951 HB3 PHE 123 HB1 PHE 123 -8.787 1.513 0.349 952 HD1 PHE 123 HD1 PHE 123 -12.088 -0.170 -0.121 953 HD2 PHE 123 HD2 PHE 123 -7.932 -0.587 0.701 954 HE1 PHE 123 HE1 PHE 123 -12.394 -2.589 0.184 955 HE2 PHE 123 HE2 PHE 123 -8.235 -3.004 1.014 956 HZ PHE 123 HZ PHE 123 -10.468 -4.009 0.755 957 H ARG 124 HN ARG 124 -9.002 3.263 2.305 958 HA ARG 124 HA ARG 124 -9.076 1.757 4.676 959 HB2 ARG 124 HB2 ARG 124 -7.180 3.185 4.109 960 HB3 ARG 124 HB1 ARG 124 -8.198 4.615 4.197 961 HG2 ARG 124 HG2 ARG 124 -8.541 4.195 6.593 962 HG3 ARG 124 HG1 ARG 124 -7.444 2.814 6.488 963 HD2 ARG 124 HD2 ARG 124 -5.655 4.310 5.739 964 HD3 ARG 124 HD1 ARG 124 -6.754 5.682 5.865 965 HE ARG 124 HE ARG 124 -6.136 4.044 8.229 966 HH11 ARG 124 HH11 ARG 124 -6.161 7.140 6.593 967 HH12 ARG 124 HH12 ARG 124 -5.668 8.028 7.997 968 HH21 ARG 124 HH21 ARG 124 -5.475 5.200 10.067 969 HH22 ARG 124 HH22 ARG 124 -5.270 6.922 9.979 970 H LYS 125 HN LYS 125 -10.743 4.719 3.688 971 HA LYS 125 HA LYS 125 -11.983 5.242 6.160 972 HB2 LYS 125 HB2 LYS 125 -12.747 6.009 3.348 973 HB3 LYS 125 HB1 LYS 125 -13.641 6.548 4.763 974 HG2 LYS 125 HG2 LYS 125 -11.547 7.565 5.624 975 HG3 LYS 125 HG1 LYS 125 -10.766 7.136 4.102 976 HD2 LYS 125 HD2 LYS 125 -12.284 8.533 2.869 977 HD3 LYS 125 HD1 LYS 125 -13.233 8.854 4.321 978 HE2 LYS 125 HE2 LYS 125 -11.266 9.951 5.325 979 HE3 LYS 125 HE1 LYS 125 -10.377 9.684 3.827 980 HZ1 LYS 125 HZ1 LYS 125 -11.304 11.922 3.980 981 HZ2 LYS 125 HZ2 LYS 125 -12.865 11.281 4.063 982 HZ3 LYS 125 HZ3 LYS 125 -11.940 11.074 2.665 983 H ILE 126 HN ILE 126 -12.982 3.246 3.414 984 HA ILE 126 HA ILE 126 -15.580 2.688 4.302 985 HB ILE 126 HB ILE 126 -13.743 0.841 2.769 986 HG12 ILE 126 HG12 ILE 126 -15.774 2.811 1.698 987 HG13 ILE 126 HG11 ILE 126 -14.041 3.121 1.760 988 HG21 ILE 126 HG21 ILE 126 -16.754 0.920 2.943 989 HG22 ILE 126 HG22 ILE 126 -15.707 -0.277 3.705 990 HG23 ILE 126 HG23 ILE 126 -15.800 -0.179 1.946 991 HD11 ILE 126 HD11 ILE 126 -15.396 0.931 0.203 992 HD12 ILE 126 HD12 ILE 126 -13.659 1.221 0.276 993 HD13 ILE 126 HD13 ILE 126 -14.722 2.422 -0.454 994 H MET 127 HN MET 127 -12.501 1.535 5.393 995 HA MET 127 HA MET 127 -13.754 -0.680 6.846 996 HB2 MET 127 HB2 MET 127 -10.843 -0.069 6.325 997 HB3 MET 127 HB1 MET 127 -11.439 -1.478 7.189 998 HG2 MET 127 HG2 MET 127 -12.602 -2.223 5.179 999 HG3 MET 127 HG1 MET 127 -12.010 -0.808 4.311 1000 HE1 MET 127 HE1 MET 127 -8.199 -1.463 4.037 1001 HE2 MET 127 HE2 MET 127 -9.003 -0.512 5.286 1002 HE3 MET 127 HE3 MET 127 -9.549 -0.411 3.611 1003 H SER 128 HN SER 128 -11.684 2.151 7.384 1004 HA SER 128 HA SER 128 -11.719 1.621 10.261 1005 HB2 SER 128 HB2 SER 128 -9.564 2.105 9.075 1006 HB3 SER 128 HB1 SER 128 -10.166 3.729 8.746 1007 HG SER 128 HG SER 128 -10.207 2.814 11.392 1008 H MET 129 HN MET 129 -12.683 4.059 7.905 1009 HA MET 129 HA MET 129 -14.015 5.580 10.026 1010 HB2 MET 129 HB2 MET 129 -13.529 6.259 7.105 1011 HB3 MET 129 HB1 MET 129 -14.407 7.285 8.239 1012 HG2 MET 129 HG2 MET 129 -12.370 7.421 9.631 1013 HG3 MET 129 HG1 MET 129 -11.511 6.487 8.409 1014 HE1 MET 129 HE1 MET 129 -10.459 9.309 9.427 1015 HE2 MET 129 HE2 MET 129 -9.997 10.046 7.894 1016 HE3 MET 129 HE3 MET 129 -9.656 8.342 8.190 1017 H LYS 130 HN LYS 130 -14.866 3.004 9.266 1018 HA LYS 130 HA LYS 130 -16.899 2.937 7.341 1019 HB2 LYS 130 HB2 LYS 130 -15.716 0.957 8.290 1020 HB3 LYS 130 HB1 LYS 130 -16.601 1.188 9.790 1021 HG2 LYS 130 HG2 LYS 130 -18.714 0.912 8.481 1022 HG3 LYS 130 HG1 LYS 130 -17.716 0.459 7.098 1023 HD2 LYS 130 HD2 LYS 130 -17.782 -0.943 9.771 1024 HD3 LYS 130 HD1 LYS 130 -18.550 -1.510 8.289 1025 HE2 LYS 130 HE2 LYS 130 -15.589 -1.112 8.709 1026 HE3 LYS 130 HE1 LYS 130 -16.432 -2.659 8.710 1027 HZ1 LYS 130 HZ1 LYS 130 -15.425 -2.317 6.586 1028 HZ2 LYS 130 HZ2 LYS 130 -16.145 -0.796 6.416 1029 HZ3 LYS 130 HZ3 LYS 130 -17.101 -2.191 6.394 Start of MODEL 4 1 H1 SER 12 HT1 SER 12 -20.029 -8.045 -3.264 2 H2 SER 12 HT2 SER 12 -20.868 -6.587 -3.079 3 H3 SER 12 HT3 SER 12 -21.163 -7.560 -4.428 4 HA SER 12 HA SER 12 -22.102 -9.262 -3.081 5 HB2 SER 12 HB2 SER 12 -20.696 -8.915 -1.103 6 HB3 SER 12 HB1 SER 12 -21.504 -7.386 -0.782 7 HG SER 12 HG SER 12 -22.918 -9.837 -0.927 8 H ALA 13 HN ALA 13 -22.888 -6.175 -1.466 9 HA ALA 13 HA ALA 13 -25.575 -6.324 -2.471 10 HB1 ALA 13 HB1 ALA 13 -26.014 -4.317 -1.202 11 HB2 ALA 13 HB2 ALA 13 -24.288 -4.067 -0.941 12 HB3 ALA 13 HB3 ALA 13 -25.099 -5.454 -0.212 13 H LYS 14 HN LYS 14 -23.752 -3.307 -2.490 14 HA LYS 14 HA LYS 14 -23.595 -3.343 -5.380 15 HB2 LYS 14 HB2 LYS 14 -24.620 -1.116 -5.634 16 HB3 LYS 14 HB1 LYS 14 -25.761 -2.312 -5.051 17 HG2 LYS 14 HG2 LYS 14 -24.367 -0.445 -3.168 18 HG3 LYS 14 HG1 LYS 14 -25.823 0.032 -4.036 19 HD2 LYS 14 HD2 LYS 14 -26.907 -2.048 -3.090 20 HD3 LYS 14 HD1 LYS 14 -25.496 -2.193 -2.039 21 HE2 LYS 14 HE2 LYS 14 -27.400 0.144 -2.170 22 HE3 LYS 14 HE1 LYS 14 -27.305 -1.053 -0.883 23 HZ1 LYS 14 HZ1 LYS 14 -25.142 0.839 -1.627 24 HZ2 LYS 14 HZ2 LYS 14 -25.089 -0.284 -0.363 25 HZ3 LYS 14 HZ3 LYS 14 -26.175 1.005 -0.300 26 H ASP 15 HN ASP 15 -21.391 -3.613 -4.781 27 HA ASP 15 HA ASP 15 -19.257 -2.888 -4.571 28 HB2 ASP 15 HB2 ASP 15 -20.446 -0.142 -4.945 29 HB3 ASP 15 HB1 ASP 15 -18.729 -0.524 -5.005 30 H ILE 16 HN ILE 16 -20.367 -3.525 -2.175 31 HA ILE 16 HA ILE 16 -19.903 -1.224 -0.438 32 HB ILE 16 HB ILE 16 -20.850 -3.932 0.477 33 HG12 ILE 16 HG12 ILE 16 -22.373 -3.248 -1.257 34 HG13 ILE 16 HG11 ILE 16 -23.147 -3.034 0.308 35 HG21 ILE 16 HG21 ILE 16 -20.108 -2.451 2.234 36 HG22 ILE 16 HG22 ILE 16 -21.864 -2.610 2.291 37 HG23 ILE 16 HG23 ILE 16 -21.133 -1.158 1.612 38 HD11 ILE 16 HD11 ILE 16 -23.661 -1.192 -1.136 39 HD12 ILE 16 HD12 ILE 16 -21.945 -0.880 -1.406 40 HD13 ILE 16 HD13 ILE 16 -22.648 -0.635 0.196 41 H LYS 17 HN LYS 17 -19.284 -4.573 0.513 42 HA LYS 17 HA LYS 17 -16.736 -3.807 1.581 43 HB2 LYS 17 HB2 LYS 17 -18.104 -6.491 1.524 44 HB3 LYS 17 HB1 LYS 17 -16.631 -6.124 2.414 45 HG2 LYS 17 HG2 LYS 17 -17.917 -4.389 3.669 46 HG3 LYS 17 HG1 LYS 17 -19.376 -4.983 2.876 47 HD2 LYS 17 HD2 LYS 17 -17.530 -6.598 4.632 48 HD3 LYS 17 HD1 LYS 17 -19.104 -5.957 5.103 49 HE2 LYS 17 HE2 LYS 17 -20.200 -7.343 3.449 50 HE3 LYS 17 HE1 LYS 17 -18.641 -7.919 2.859 51 HZ1 LYS 17 HZ1 LYS 17 -19.661 -9.527 4.328 52 HZ2 LYS 17 HZ2 LYS 17 -19.744 -8.387 5.573 53 HZ3 LYS 17 HZ3 LYS 17 -18.241 -8.923 5.019 54 H ASP 18 HN ASP 18 -17.725 -6.350 -0.662 55 HA ASP 18 HA ASP 18 -15.009 -7.144 -1.095 56 HB2 ASP 18 HB2 ASP 18 -16.058 -8.864 -2.581 57 HB3 ASP 18 HB1 ASP 18 -16.673 -8.861 -0.930 58 H GLU 19 HN GLU 19 -17.564 -5.833 -3.147 59 HA GLU 19 HA GLU 19 -16.093 -5.826 -5.525 60 HB2 GLU 19 HB2 GLU 19 -18.516 -4.405 -4.552 61 HB3 GLU 19 HB1 GLU 19 -17.817 -3.938 -6.099 62 HG2 GLU 19 HG2 GLU 19 -18.828 -6.652 -5.290 63 HG3 GLU 19 HG1 GLU 19 -19.566 -5.543 -6.446 64 H LYS 20 HN LYS 20 -16.231 -3.481 -2.906 65 HA LYS 20 HA LYS 20 -14.755 -1.468 -4.257 66 HB2 LYS 20 HB2 LYS 20 -15.190 -2.040 -1.334 67 HB3 LYS 20 HB1 LYS 20 -14.189 -0.704 -1.892 68 HG2 LYS 20 HG2 LYS 20 -17.096 -1.106 -2.570 69 HG3 LYS 20 HG1 LYS 20 -16.471 0.001 -1.349 70 HD2 LYS 20 HD2 LYS 20 -15.207 1.179 -3.124 71 HD3 LYS 20 HD1 LYS 20 -15.945 0.111 -4.318 72 HE2 LYS 20 HE2 LYS 20 -17.124 2.231 -4.229 73 HE3 LYS 20 HE1 LYS 20 -18.160 0.922 -3.669 74 HZ1 LYS 20 HZ1 LYS 20 -16.694 2.825 -1.931 75 HZ2 LYS 20 HZ2 LYS 20 -17.685 1.569 -1.395 76 HZ3 LYS 20 HZ3 LYS 20 -18.351 2.860 -2.254 77 H ILE 21 HN ILE 21 -13.858 -4.185 -2.168 78 HA ILE 21 HA ILE 21 -11.102 -3.843 -2.052 79 HB ILE 21 HB ILE 21 -12.649 -6.434 -2.308 80 HG12 ILE 21 HG12 ILE 21 -11.535 -5.093 0.168 81 HG13 ILE 21 HG11 ILE 21 -13.221 -5.013 -0.334 82 HG21 ILE 21 HG21 ILE 21 -9.796 -5.979 -1.446 83 HG22 ILE 21 HG22 ILE 21 -10.338 -6.800 -2.910 84 HG23 ILE 21 HG23 ILE 21 -10.663 -7.511 -1.330 85 HD11 ILE 21 HD11 ILE 21 -12.943 -6.663 1.392 86 HD12 ILE 21 HD12 ILE 21 -11.695 -7.482 0.454 87 HD13 ILE 21 HD13 ILE 21 -13.359 -7.462 -0.124 88 H GLN 22 HN GLN 22 -13.030 -5.591 -4.465 89 HA GLN 22 HA GLN 22 -10.914 -6.409 -6.108 90 HB2 GLN 22 HB2 GLN 22 -13.761 -5.804 -6.918 91 HB3 GLN 22 HB1 GLN 22 -12.619 -6.784 -7.821 92 HG2 GLN 22 HG2 GLN 22 -13.753 -7.432 -5.105 93 HG3 GLN 22 HG1 GLN 22 -14.223 -8.164 -6.639 94 HE21 GLN 22 HE21 GLN 22 -11.866 -8.061 -4.122 95 HE22 GLN 22 HE22 GLN 22 -10.944 -9.422 -4.646 96 H GLN 23 HN GLN 23 -13.029 -3.573 -6.346 97 HA GLN 23 HA GLN 23 -11.983 -2.580 -8.769 98 HB2 GLN 23 HB2 GLN 23 -14.158 -1.949 -7.613 99 HB3 GLN 23 HB1 GLN 23 -13.198 -0.916 -6.571 100 HG2 GLN 23 HG2 GLN 23 -12.394 0.302 -8.550 101 HG3 GLN 23 HG1 GLN 23 -13.439 -0.698 -9.560 102 HE21 GLN 23 HE21 GLN 23 -13.304 1.860 -7.234 103 HE22 GLN 23 HE22 GLN 23 -14.939 2.385 -7.407 104 H TYR 24 HN TYR 24 -11.325 -1.673 -5.400 105 HA TYR 24 HA TYR 24 -9.397 0.285 -6.053 106 HB2 TYR 24 HB2 TYR 24 -10.087 -1.166 -3.525 107 HB3 TYR 24 HB1 TYR 24 -8.648 -0.151 -3.597 108 HD1 TYR 24 HD1 TYR 24 -12.109 -0.197 -2.922 109 HD2 TYR 24 HD2 TYR 24 -9.034 2.266 -4.518 110 HE1 TYR 24 HE1 TYR 24 -13.475 1.793 -2.469 111 HE2 TYR 24 HE2 TYR 24 -10.391 4.267 -4.070 112 HH TYR 24 HH TYR 24 -12.710 4.877 -3.730 113 H ARG 25 HN ARG 25 -9.091 -3.148 -5.207 114 HA ARG 25 HA ARG 25 -6.325 -3.293 -4.974 115 HB2 ARG 25 HB2 ARG 25 -7.927 -5.117 -4.441 116 HB3 ARG 25 HB1 ARG 25 -8.131 -5.392 -6.162 117 HG2 ARG 25 HG2 ARG 25 -5.748 -5.945 -6.344 118 HG3 ARG 25 HG1 ARG 25 -5.579 -5.711 -4.602 119 HD2 ARG 25 HD2 ARG 25 -5.825 -8.075 -5.147 120 HD3 ARG 25 HD1 ARG 25 -7.195 -7.497 -4.202 121 HE ARG 25 HE ARG 25 -7.698 -7.338 -7.001 122 HH11 ARG 25 HH11 ARG 25 -7.605 -9.563 -4.308 123 HH12 ARG 25 HH12 ARG 25 -8.759 -10.657 -5.001 124 HH21 ARG 25 HH21 ARG 25 -9.216 -8.773 -7.926 125 HH22 ARG 25 HH22 ARG 25 -9.679 -10.206 -7.061 126 H LYS 26 HN LYS 26 -8.336 -3.201 -7.821 127 HA LYS 26 HA LYS 26 -6.529 -3.928 -9.804 128 HB2 LYS 26 HB2 LYS 26 -8.935 -3.555 -10.160 129 HB3 LYS 26 HB1 LYS 26 -8.702 -1.833 -9.901 130 HG2 LYS 26 HG2 LYS 26 -7.277 -1.739 -11.897 131 HG3 LYS 26 HG1 LYS 26 -7.558 -3.459 -12.163 132 HD2 LYS 26 HD2 LYS 26 -9.056 -2.236 -13.577 133 HD3 LYS 26 HD1 LYS 26 -10.002 -2.971 -12.284 134 HE2 LYS 26 HE2 LYS 26 -10.780 -0.728 -12.587 135 HE3 LYS 26 HE1 LYS 26 -9.899 -0.796 -11.062 136 HZ1 LYS 26 HZ1 LYS 26 -9.307 1.172 -12.320 137 HZ2 LYS 26 HZ2 LYS 26 -8.834 0.230 -13.641 138 HZ3 LYS 26 HZ3 LYS 26 -7.969 0.146 -12.193 139 H THR 27 HN THR 27 -7.222 -0.685 -8.515 140 HA THR 27 HA THR 27 -5.079 0.467 -10.089 141 HB THR 27 HB THR 27 -7.148 1.735 -9.881 142 HG1 THR 27 HG1 THR 27 -4.691 2.674 -9.138 143 HG21 THR 27 HG21 THR 27 -6.527 1.823 -6.929 144 HG22 THR 27 HG22 THR 27 -7.890 0.999 -7.690 145 HG23 THR 27 HG23 THR 27 -7.788 2.761 -7.730 146 H LEU 28 HN LEU 28 -5.501 -0.837 -6.999 147 HA LEU 28 HA LEU 28 -3.623 0.758 -5.564 148 HB2 LEU 28 HB2 LEU 28 -5.366 -1.520 -5.076 149 HB3 LEU 28 HB1 LEU 28 -3.834 -1.671 -4.238 150 HG LEU 28 HG LEU 28 -5.663 -0.653 -2.876 151 HD11 LEU 28 HD11 LEU 28 -3.261 1.073 -3.413 152 HD12 LEU 28 HD12 LEU 28 -3.360 -0.277 -2.284 153 HD13 LEU 28 HD13 LEU 28 -4.304 1.184 -1.997 154 HD21 LEU 28 HD21 LEU 28 -6.771 0.623 -4.635 155 HD22 LEU 28 HD22 LEU 28 -5.352 1.657 -4.789 156 HD23 LEU 28 HD23 LEU 28 -6.291 1.667 -3.297 157 H THR 29 HN THR 29 -3.367 -1.954 -7.686 158 HA THR 29 HA THR 29 -0.877 -2.924 -6.661 159 HB THR 29 HB THR 29 -2.044 -3.448 -9.398 160 HG1 THR 29 HG1 THR 29 -3.609 -4.183 -8.056 161 HG21 THR 29 HG21 THR 29 -0.766 -5.562 -9.194 162 HG22 THR 29 HG22 THR 29 -0.086 -4.982 -7.672 163 HG23 THR 29 HG23 THR 29 0.275 -4.140 -9.179 164 H LYS 30 HN LYS 30 0.894 -1.750 -6.753 165 HA LYS 30 HA LYS 30 1.619 -0.374 -9.248 166 HB2 LYS 30 HB2 LYS 30 1.632 0.844 -6.481 167 HB3 LYS 30 HB1 LYS 30 2.405 1.569 -7.879 168 HG2 LYS 30 HG2 LYS 30 -0.533 0.962 -7.779 169 HG3 LYS 30 HG1 LYS 30 0.157 2.494 -7.243 170 HD2 LYS 30 HD2 LYS 30 1.200 2.699 -9.520 171 HD3 LYS 30 HD1 LYS 30 0.240 1.302 -10.007 172 HE2 LYS 30 HE2 LYS 30 -1.802 2.491 -9.499 173 HE3 LYS 30 HE1 LYS 30 -0.880 3.864 -8.888 174 HZ1 LYS 30 HZ1 LYS 30 0.043 4.175 -11.119 175 HZ2 LYS 30 HZ2 LYS 30 -1.651 4.287 -11.123 176 HZ3 LYS 30 HZ3 LYS 30 -0.899 2.883 -11.689 177 H ILE 31 HN ILE 31 3.864 -0.233 -9.633 178 HA ILE 31 HA ILE 31 5.584 -1.808 -7.880 179 HB ILE 31 HB ILE 31 6.175 -0.417 -10.502 180 HG12 ILE 31 HG12 ILE 31 4.771 -2.481 -10.610 181 HG13 ILE 31 HG11 ILE 31 6.313 -2.634 -11.446 182 HG21 ILE 31 HG21 ILE 31 8.363 -1.557 -10.428 183 HG22 ILE 31 HG22 ILE 31 8.007 -2.102 -8.788 184 HG23 ILE 31 HG23 ILE 31 8.171 -0.380 -9.129 185 HD11 ILE 31 HD11 ILE 31 5.777 -4.645 -10.205 186 HD12 ILE 31 HD12 ILE 31 5.677 -3.713 -8.711 187 HD13 ILE 31 HD13 ILE 31 7.220 -3.869 -9.552 188 H VAL 32 HN VAL 32 6.422 -0.846 -6.166 189 HA VAL 32 HA VAL 32 7.259 1.965 -6.389 190 HB VAL 32 HB VAL 32 6.352 2.492 -4.219 191 HG11 VAL 32 HG11 VAL 32 3.967 2.363 -4.703 192 HG12 VAL 32 HG12 VAL 32 4.278 1.142 -5.936 193 HG13 VAL 32 HG13 VAL 32 4.893 2.782 -6.145 194 HG21 VAL 32 HG21 VAL 32 4.921 0.887 -2.993 195 HG22 VAL 32 HG22 VAL 32 6.602 0.364 -3.098 196 HG23 VAL 32 HG23 VAL 32 5.384 -0.367 -4.145 197 H LYS 33 HN LYS 33 8.555 2.585 -4.392 198 HA LYS 33 HA LYS 33 10.411 0.394 -3.779 199 HB2 LYS 33 HB2 LYS 33 10.826 3.386 -3.560 200 HB3 LYS 33 HB1 LYS 33 12.042 2.146 -3.265 201 HG2 LYS 33 HG2 LYS 33 12.091 1.504 -5.545 202 HG3 LYS 33 HG1 LYS 33 10.659 2.465 -5.914 203 HD2 LYS 33 HD2 LYS 33 11.872 4.501 -5.478 204 HD3 LYS 33 HD1 LYS 33 13.301 3.588 -4.994 205 HE2 LYS 33 HE2 LYS 33 13.423 2.649 -7.275 206 HE3 LYS 33 HE1 LYS 33 12.038 3.637 -7.733 207 HZ1 LYS 33 HZ1 LYS 33 14.079 4.702 -8.400 208 HZ2 LYS 33 HZ2 LYS 33 14.676 4.644 -6.822 209 HZ3 LYS 33 HZ3 LYS 33 13.341 5.616 -7.183 210 H ILE 34 HN ILE 34 10.156 -0.497 -1.863 211 HA ILE 34 HA ILE 34 8.789 0.970 0.239 212 HB ILE 34 HB ILE 34 9.192 -1.862 -0.391 213 HG12 ILE 34 HG12 ILE 34 7.202 -0.316 1.256 214 HG13 ILE 34 HG11 ILE 34 7.036 -0.746 -0.442 215 HG21 ILE 34 HG21 ILE 34 10.610 -1.716 1.644 216 HG22 ILE 34 HG22 ILE 34 9.170 -2.710 1.871 217 HG23 ILE 34 HG23 ILE 34 9.220 -1.071 2.523 218 HD11 ILE 34 HD11 ILE 34 5.693 -2.230 0.853 219 HD12 ILE 34 HD12 ILE 34 7.044 -2.596 1.925 220 HD13 ILE 34 HD13 ILE 34 7.077 -3.140 0.248 221 H LYS 35 HN LYS 35 9.665 1.519 2.135 222 HA LYS 35 HA LYS 35 12.540 1.028 2.504 223 HB2 LYS 35 HB2 LYS 35 11.038 3.620 2.499 224 HB3 LYS 35 HB1 LYS 35 12.453 3.463 3.491 225 HG2 LYS 35 HG2 LYS 35 13.651 4.049 1.724 226 HG3 LYS 35 HG1 LYS 35 13.236 2.480 1.022 227 HD2 LYS 35 HD2 LYS 35 12.356 3.771 -0.613 228 HD3 LYS 35 HD1 LYS 35 11.002 3.804 0.522 229 HE2 LYS 35 HE2 LYS 35 11.518 6.041 -0.315 230 HE3 LYS 35 HE1 LYS 35 11.754 5.914 1.426 231 HZ1 LYS 35 HZ1 LYS 35 13.882 5.864 -0.645 232 HZ2 LYS 35 HZ2 LYS 35 14.144 5.639 1.009 233 HZ3 LYS 35 HZ3 LYS 35 13.563 7.120 0.442 234 H THR 36 HN THR 36 12.598 -0.244 4.259 235 HA THR 36 HA THR 36 11.126 0.640 6.651 236 HB THR 36 HB THR 36 10.724 -1.662 7.304 237 HG1 THR 36 HG1 THR 36 11.826 -2.498 4.809 238 HG21 THR 36 HG21 THR 36 9.184 -2.385 5.531 239 HG22 THR 36 HG22 THR 36 9.911 -1.215 4.431 240 HG23 THR 36 HG23 THR 36 9.032 -0.657 5.857 241 H ALA 37 HN ALA 37 12.134 -0.696 8.645 242 HA ALA 37 HA ALA 37 14.959 -0.125 8.666 243 HB1 ALA 37 HB1 ALA 37 13.143 -1.346 10.743 244 HB2 ALA 37 HB2 ALA 37 13.732 0.315 10.683 245 HB3 ALA 37 HB3 ALA 37 14.854 -1.006 10.999 246 H ILE 38 HN ILE 38 12.950 -2.795 7.984 247 HA ILE 38 HA ILE 38 14.874 -4.841 8.569 248 HB ILE 38 HB ILE 38 12.400 -5.054 6.847 249 HG12 ILE 38 HG12 ILE 38 12.726 -5.592 9.810 250 HG13 ILE 38 HG11 ILE 38 11.854 -4.233 9.111 251 HG21 ILE 38 HG21 ILE 38 13.972 -6.885 6.541 252 HG22 ILE 38 HG22 ILE 38 12.534 -7.442 7.397 253 HG23 ILE 38 HG23 ILE 38 14.030 -7.148 8.284 254 HD11 ILE 38 HD11 ILE 38 11.135 -7.139 8.809 255 HD12 ILE 38 HD12 ILE 38 10.260 -5.783 8.097 256 HD13 ILE 38 HD13 ILE 38 10.330 -5.966 9.850 257 H PHE 39 HN PHE 39 13.434 -3.575 5.569 258 HA PHE 39 HA PHE 39 15.961 -3.506 4.252 259 HB2 PHE 39 HB2 PHE 39 15.166 -5.069 2.365 260 HB3 PHE 39 HB1 PHE 39 15.799 -5.794 3.833 261 HD1 PHE 39 HD1 PHE 39 14.754 -7.759 4.297 262 HD2 PHE 39 HD2 PHE 39 12.421 -4.520 2.824 263 HE1 PHE 39 HE1 PHE 39 12.723 -9.133 4.500 264 HE2 PHE 39 HE2 PHE 39 10.390 -5.885 3.026 265 HZ PHE 39 HZ PHE 39 10.538 -8.195 3.865 266 H HIS 40 HN HIS 40 15.942 -2.321 2.363 267 HA HIS 40 HA HIS 40 13.388 -0.993 1.740 268 HB2 HIS 40 HB2 HIS 40 16.105 -0.201 0.693 269 HB3 HIS 40 HB1 HIS 40 14.649 0.772 0.755 270 HD1 HIS 40 HD1 HIS 40 17.627 -0.200 2.723 271 HD2 HIS 40 HD2 HIS 40 14.059 1.837 3.332 272 HE1 HIS 40 HE1 HIS 40 17.900 1.008 4.911 273 HE2 HIS 40 HE2 HIS 40 15.775 2.326 5.199 274 H GLU 41 HN GLU 41 12.309 -1.940 0.094 275 HA GLU 41 HA GLU 41 13.862 -3.343 -1.982 276 HB2 GLU 41 HB2 GLU 41 11.374 -4.382 -0.610 277 HB3 GLU 41 HB1 GLU 41 12.266 -5.196 -1.882 278 HG2 GLU 41 HG2 GLU 41 13.514 -4.504 0.752 279 HG3 GLU 41 HG1 GLU 41 12.621 -5.998 0.494 280 H THR 42 HN THR 42 13.096 -3.119 -4.063 281 HA THR 42 HA THR 42 10.800 -1.453 -4.575 282 HB THR 42 HB THR 42 12.195 -3.227 -6.578 283 HG1 THR 42 HG1 THR 42 13.259 -1.245 -5.168 284 HG21 THR 42 HG21 THR 42 10.674 -0.633 -6.862 285 HG22 THR 42 HG22 THR 42 10.082 -2.235 -7.309 286 HG23 THR 42 HG23 THR 42 11.446 -1.524 -8.175 287 H VAL 43 HN VAL 43 8.719 -2.152 -4.856 288 HA VAL 43 HA VAL 43 8.259 -5.031 -5.030 289 HB VAL 43 HB VAL 43 8.545 -4.266 -2.607 290 HG11 VAL 43 HG11 VAL 43 6.493 -3.334 -1.572 291 HG12 VAL 43 HG12 VAL 43 5.867 -3.031 -3.190 292 HG13 VAL 43 HG13 VAL 43 7.334 -2.214 -2.643 293 HG21 VAL 43 HG21 VAL 43 7.590 -6.409 -3.205 294 HG22 VAL 43 HG22 VAL 43 6.004 -5.664 -3.406 295 HG23 VAL 43 HG23 VAL 43 6.756 -5.721 -1.811 296 H LYS 44 HN LYS 44 6.115 -5.616 -5.590 297 HA LYS 44 HA LYS 44 4.516 -3.452 -6.747 298 HB2 LYS 44 HB2 LYS 44 5.060 -5.714 -7.934 299 HB3 LYS 44 HB1 LYS 44 3.841 -6.382 -6.859 300 HG2 LYS 44 HG2 LYS 44 2.163 -4.918 -7.765 301 HG3 LYS 44 HG1 LYS 44 3.366 -4.133 -8.792 302 HD2 LYS 44 HD2 LYS 44 2.110 -5.743 -10.093 303 HD3 LYS 44 HD1 LYS 44 3.776 -6.294 -9.914 304 HE2 LYS 44 HE2 LYS 44 3.069 -7.784 -8.089 305 HE3 LYS 44 HE1 LYS 44 1.405 -7.246 -8.307 306 HZ1 LYS 44 HZ1 LYS 44 3.036 -8.631 -10.365 307 HZ2 LYS 44 HZ2 LYS 44 1.419 -8.163 -10.526 308 HZ3 LYS 44 HZ3 LYS 44 1.845 -9.360 -9.413 309 H VAL 45 HN VAL 45 3.141 -2.546 -5.389 310 HA VAL 45 HA VAL 45 2.235 -4.056 -3.063 311 HB VAL 45 HB VAL 45 3.167 -1.872 -2.592 312 HG11 VAL 45 HG11 VAL 45 2.754 -0.798 -4.746 313 HG12 VAL 45 HG12 VAL 45 2.156 0.192 -3.415 314 HG13 VAL 45 HG13 VAL 45 1.027 -0.742 -4.394 315 HG21 VAL 45 HG21 VAL 45 0.171 -1.842 -2.255 316 HG22 VAL 45 HG22 VAL 45 1.325 -0.868 -1.343 317 HG23 VAL 45 HG23 VAL 45 1.329 -2.624 -1.179 318 H THR 46 HN THR 46 0.267 -4.875 -2.926 319 HA THR 46 HA THR 46 -1.906 -3.677 -4.469 320 HB THR 46 HB THR 46 -0.981 -5.625 -5.766 321 HG1 THR 46 HG1 THR 46 -3.032 -5.327 -6.313 322 HG21 THR 46 HG21 THR 46 -2.050 -7.252 -3.457 323 HG22 THR 46 HG22 THR 46 -0.345 -7.035 -3.851 324 HG23 THR 46 HG23 THR 46 -1.406 -7.888 -4.971 325 H CYS 47 HN CYS 47 -4.047 -4.866 -3.685 326 HA CYS 47 HA CYS 47 -3.826 -5.059 -0.770 327 HB2 CYS 47 HB2 CYS 47 -5.411 -3.432 -1.268 328 HB3 CYS 47 HB1 CYS 47 -6.121 -4.357 -2.583 329 HG CYS 47 HG CYS 47 -6.882 -4.273 0.652 330 H SER 48 HN SER 48 -5.052 -6.668 0.324 331 HA SER 48 HA SER 48 -4.532 -9.234 -0.838 332 HB2 SER 48 HB2 SER 48 -4.213 -8.693 1.582 333 HB3 SER 48 HB1 SER 48 -5.963 -8.579 1.747 334 HG SER 48 HG SER 48 -4.379 -10.846 1.135 335 H LYS 49 HN LYS 49 -6.226 -10.985 -0.674 336 HA LYS 49 HA LYS 49 -8.490 -10.229 -2.253 337 HB2 LYS 49 HB2 LYS 49 -7.937 -12.869 -0.886 338 HB3 LYS 49 HB1 LYS 49 -9.039 -12.591 -2.227 339 HG2 LYS 49 HG2 LYS 49 -7.193 -12.044 -3.684 340 HG3 LYS 49 HG1 LYS 49 -6.059 -12.192 -2.342 341 HD2 LYS 49 HD2 LYS 49 -6.716 -14.570 -2.113 342 HD3 LYS 49 HD1 LYS 49 -7.738 -14.391 -3.541 343 HE2 LYS 49 HE2 LYS 49 -5.776 -13.792 -4.871 344 HE3 LYS 49 HE1 LYS 49 -4.754 -13.960 -3.443 345 HZ1 LYS 49 HZ1 LYS 49 -4.661 -15.928 -4.823 346 HZ2 LYS 49 HZ2 LYS 49 -6.334 -16.131 -4.708 347 HZ3 LYS 49 HZ3 LYS 49 -5.366 -16.295 -3.330 348 H ASP 50 HN ASP 50 -7.806 -10.595 1.084 349 HA ASP 50 HA ASP 50 -10.565 -10.662 1.937 350 HB2 ASP 50 HB2 ASP 50 -7.981 -10.207 3.442 351 HB3 ASP 50 HB1 ASP 50 -9.564 -10.226 4.209 352 H GLY 51 HN GLY 51 -8.281 -8.312 0.982 353 HA2 GLY 51 HA2 GLY 51 -8.516 -6.025 0.729 354 HA3 GLY 51 HA1 GLY 51 -10.104 -6.142 1.472 355 H LYS 52 HN LYS 52 -8.613 -7.660 3.688 356 HA LYS 52 HA LYS 52 -8.700 -5.452 5.470 357 HB2 LYS 52 HB2 LYS 52 -9.508 -7.682 6.049 358 HB3 LYS 52 HB1 LYS 52 -7.890 -8.334 5.879 359 HG2 LYS 52 HG2 LYS 52 -8.272 -6.141 7.834 360 HG3 LYS 52 HG1 LYS 52 -8.952 -7.720 8.229 361 HD2 LYS 52 HD2 LYS 52 -6.686 -8.699 7.726 362 HD3 LYS 52 HD1 LYS 52 -6.077 -7.046 7.628 363 HE2 LYS 52 HE2 LYS 52 -5.651 -7.939 9.831 364 HE3 LYS 52 HE1 LYS 52 -6.855 -6.656 9.934 365 HZ1 LYS 52 HZ1 LYS 52 -7.451 -9.565 9.917 366 HZ2 LYS 52 HZ2 LYS 52 -8.584 -8.321 10.072 367 HZ3 LYS 52 HZ3 LYS 52 -7.441 -8.577 11.290 368 H MET 53 HN MET 53 -6.147 -6.909 3.674 369 HA MET 53 HA MET 53 -4.262 -5.231 5.135 370 HB2 MET 53 HB2 MET 53 -2.591 -6.913 5.339 371 HB3 MET 53 HB1 MET 53 -4.074 -7.582 6.000 372 HG2 MET 53 HG2 MET 53 -4.422 -8.894 4.015 373 HG3 MET 53 HG1 MET 53 -3.039 -8.136 3.232 374 HE1 MET 53 HE1 MET 53 -3.261 -9.279 7.015 375 HE2 MET 53 HE2 MET 53 -2.701 -10.946 6.882 376 HE3 MET 53 HE3 MET 53 -4.228 -10.467 6.143 377 H LEU 54 HN LEU 54 -2.244 -4.911 3.979 378 HA LEU 54 HA LEU 54 -2.776 -4.682 1.098 379 HB2 LEU 54 HB2 LEU 54 -2.361 -2.658 2.594 380 HB3 LEU 54 HB1 LEU 54 -0.715 -3.228 2.748 381 HG LEU 54 HG LEU 54 -0.474 -3.025 0.271 382 HD11 LEU 54 HD11 LEU 54 -3.159 -1.664 0.492 383 HD12 LEU 54 HD12 LEU 54 -2.820 -3.171 -0.359 384 HD13 LEU 54 HD13 LEU 54 -2.120 -1.657 -0.932 385 HD21 LEU 54 HD21 LEU 54 0.301 -1.298 1.840 386 HD22 LEU 54 HD22 LEU 54 -1.267 -0.498 1.712 387 HD23 LEU 54 HD23 LEU 54 -0.219 -0.618 0.300 388 H GLU 55 HN GLU 55 -1.877 -6.392 0.084 389 HA GLU 55 HA GLU 55 0.581 -7.543 1.163 390 HB2 GLU 55 HB2 GLU 55 -1.502 -8.596 -0.730 391 HB3 GLU 55 HB1 GLU 55 0.069 -9.370 -0.567 392 HG2 GLU 55 HG2 GLU 55 -0.361 -9.651 1.845 393 HG3 GLU 55 HG1 GLU 55 -1.971 -8.975 1.614 394 H TRP 56 HN TRP 56 2.461 -7.541 0.127 395 HA TRP 56 HA TRP 56 2.481 -6.398 -2.569 396 HB2 TRP 56 HB2 TRP 56 4.743 -5.363 -1.814 397 HB3 TRP 56 HB1 TRP 56 3.238 -4.576 -1.365 398 HD1 TRP 56 HD1 TRP 56 5.244 -7.424 0.378 399 HE1 TRP 56 HE1 TRP 56 5.614 -6.724 2.827 400 HE3 TRP 56 HE3 TRP 56 2.952 -2.864 0.272 401 HZ2 TRP 56 HZ2 TRP 56 5.007 -4.539 4.491 402 HZ3 TRP 56 HZ3 TRP 56 2.890 -1.533 2.336 403 HH2 TRP 56 HH2 TRP 56 3.894 -2.352 4.402 404 H TYR 57 HN TYR 57 3.820 -7.262 -4.019 405 HA TYR 57 HA TYR 57 5.437 -9.567 -3.128 406 HB2 TYR 57 HB2 TYR 57 4.075 -9.201 -5.813 407 HB3 TYR 57 HB1 TYR 57 5.015 -10.605 -5.305 408 HD1 TYR 57 HD1 TYR 57 1.827 -8.826 -4.960 409 HD2 TYR 57 HD2 TYR 57 4.080 -12.237 -3.786 410 HE1 TYR 57 HE1 TYR 57 -0.224 -9.875 -4.103 411 HE2 TYR 57 HE2 TYR 57 2.033 -13.294 -2.928 412 HH TYR 57 HH TYR 57 -0.175 -12.663 -2.132 413 H LYS 58 HN LYS 58 7.495 -9.600 -3.736 414 HA LYS 58 HA LYS 58 9.093 -7.586 -4.385 415 HB2 LYS 58 HB2 LYS 58 10.623 -9.229 -5.493 416 HB3 LYS 58 HB1 LYS 58 10.002 -9.755 -3.930 417 HG2 LYS 58 HG2 LYS 58 8.504 -10.574 -6.358 418 HG3 LYS 58 HG1 LYS 58 10.054 -11.353 -6.046 419 HD2 LYS 58 HD2 LYS 58 9.318 -12.256 -4.016 420 HD3 LYS 58 HD1 LYS 58 7.951 -11.148 -3.914 421 HE2 LYS 58 HE2 LYS 58 7.355 -13.494 -4.524 422 HE3 LYS 58 HE1 LYS 58 6.805 -12.269 -5.671 423 HZ1 LYS 58 HZ1 LYS 58 8.563 -12.838 -7.149 424 HZ2 LYS 58 HZ2 LYS 58 7.809 -14.284 -6.700 425 HZ3 LYS 58 HZ3 LYS 58 9.301 -13.854 -6.014 426 H GLY 59 HN GLY 59 9.191 -6.102 -5.923 427 HA2 GLY 59 HA2 GLY 59 8.183 -6.801 -8.613 428 HA3 GLY 59 HA1 GLY 59 7.902 -5.236 -7.861 429 H LYS 60 HN LYS 60 10.915 -6.791 -7.394 430 HA LYS 60 HA LYS 60 12.336 -4.601 -8.545 431 HB2 LYS 60 HB2 LYS 60 13.511 -7.263 -7.754 432 HB3 LYS 60 HB1 LYS 60 14.344 -5.727 -7.896 433 HG2 LYS 60 HG2 LYS 60 14.169 -5.844 -5.652 434 HG3 LYS 60 HG1 LYS 60 12.638 -5.044 -6.000 435 HD2 LYS 60 HD2 LYS 60 11.405 -6.996 -5.664 436 HD3 LYS 60 HD1 LYS 60 12.821 -8.032 -5.861 437 HE2 LYS 60 HE2 LYS 60 12.300 -6.155 -3.557 438 HE3 LYS 60 HE1 LYS 60 12.133 -7.910 -3.519 439 HZ1 LYS 60 HZ1 LYS 60 14.657 -6.412 -4.000 440 HZ2 LYS 60 HZ2 LYS 60 14.510 -8.097 -4.013 441 HZ3 LYS 60 HZ3 LYS 60 14.248 -7.234 -2.575 442 H ASN 61 HN ASN 61 13.970 -4.790 -10.199 443 HA ASN 61 HA ASN 61 13.430 -6.876 -12.194 444 HB2 ASN 61 HB2 ASN 61 14.645 -5.492 -13.785 445 HB3 ASN 61 HB1 ASN 61 13.407 -4.520 -13.001 446 HD21 ASN 61 HD21 ASN 61 15.870 -3.727 -14.358 447 HD22 ASN 61 HD22 ASN 61 16.774 -2.809 -13.204 448 H ASP 62 HN ASP 62 14.832 -7.139 -9.629 449 HA ASP 62 HA ASP 62 17.455 -8.053 -10.594 450 HB2 ASP 62 HB2 ASP 62 17.819 -6.210 -9.089 451 HB3 ASP 62 HB1 ASP 62 16.706 -6.885 -7.906 452 H SER 63 HN SER 63 15.775 -8.600 -7.508 453 HA SER 63 HA SER 63 14.916 -11.232 -8.104 454 HB2 SER 63 HB2 SER 63 16.541 -12.439 -6.643 455 HB3 SER 63 HB1 SER 63 17.289 -11.760 -8.088 456 HG SER 63 HG SER 63 17.901 -9.938 -6.731 457 H ASP 64 HN ASP 64 14.397 -12.433 -5.968 458 HA ASP 64 HA ASP 64 13.496 -10.486 -3.961 459 HB2 ASP 64 HB2 ASP 64 11.840 -12.431 -3.418 460 HB3 ASP 64 HB1 ASP 64 11.510 -11.372 -4.780 461 H GLY 65 HN GLY 65 14.006 -10.831 -1.867 462 HA2 GLY 65 HA2 GLY 65 16.086 -12.755 -1.328 463 HA3 GLY 65 HA1 GLY 65 15.443 -11.566 -0.204 464 H LYS 66 HN LYS 66 12.676 -12.575 -0.888 465 HA LYS 66 HA LYS 66 12.766 -14.915 0.897 466 HB2 LYS 66 HB2 LYS 66 11.682 -12.917 1.859 467 HB3 LYS 66 HB1 LYS 66 10.552 -12.884 0.518 468 HG2 LYS 66 HG2 LYS 66 9.408 -13.838 2.341 469 HG3 LYS 66 HG1 LYS 66 9.789 -15.165 1.246 470 HD2 LYS 66 HD2 LYS 66 10.272 -15.955 3.415 471 HD3 LYS 66 HD1 LYS 66 11.830 -15.589 2.676 472 HE2 LYS 66 HE2 LYS 66 11.809 -14.784 4.950 473 HE3 LYS 66 HE1 LYS 66 11.832 -13.413 3.844 474 HZ1 LYS 66 HZ1 LYS 66 10.271 -13.047 5.634 475 HZ2 LYS 66 HZ2 LYS 66 9.441 -14.469 5.254 476 HZ3 LYS 66 HZ3 LYS 66 9.439 -13.175 4.169 477 H LYS 67 HN LYS 67 12.020 -13.881 -2.241 478 HA LYS 67 HA LYS 67 10.971 -14.787 -4.036 479 HB2 LYS 67 HB2 LYS 67 11.314 -17.269 -2.367 480 HB3 LYS 67 HB1 LYS 67 10.524 -17.318 -3.934 481 HG2 LYS 67 HG2 LYS 67 12.801 -17.958 -4.216 482 HG3 LYS 67 HG1 LYS 67 12.584 -16.366 -4.941 483 HD2 LYS 67 HD2 LYS 67 13.544 -15.327 -2.945 484 HD3 LYS 67 HD1 LYS 67 13.759 -16.923 -2.217 485 HE2 LYS 67 HE2 LYS 67 15.848 -16.114 -3.178 486 HE3 LYS 67 HE1 LYS 67 15.275 -17.547 -4.029 487 HZ1 LYS 67 HZ1 LYS 67 14.602 -16.273 -5.850 488 HZ2 LYS 67 HZ2 LYS 67 16.112 -15.636 -5.429 489 HZ3 LYS 67 HZ3 LYS 67 14.695 -14.814 -4.998 490 H LYS 68 HN LYS 68 9.488 -13.884 -1.550 491 HA LYS 68 HA LYS 68 6.816 -14.683 -2.343 492 HB2 LYS 68 HB2 LYS 68 8.051 -15.313 0.343 493 HB3 LYS 68 HB1 LYS 68 6.318 -15.162 0.151 494 HG2 LYS 68 HG2 LYS 68 8.007 -17.085 -1.417 495 HG3 LYS 68 HG1 LYS 68 7.170 -17.493 0.084 496 HD2 LYS 68 HD2 LYS 68 5.050 -17.154 -0.889 497 HD3 LYS 68 HD1 LYS 68 5.739 -16.335 -2.291 498 HE2 LYS 68 HE2 LYS 68 6.138 -19.241 -1.600 499 HE3 LYS 68 HE1 LYS 68 5.003 -18.629 -2.800 500 HZ1 LYS 68 HZ1 LYS 68 6.993 -19.341 -3.889 501 HZ2 LYS 68 HZ2 LYS 68 7.959 -18.395 -2.879 502 HZ3 LYS 68 HZ3 LYS 68 6.915 -17.654 -3.984 503 HA PRO 69 HA PRO 69 5.590 -10.592 -0.844 504 HB2 PRO 69 HB2 PRO 69 4.295 -11.838 1.544 505 HB3 PRO 69 HB1 PRO 69 3.673 -10.605 0.439 506 HG2 PRO 69 HG2 PRO 69 2.856 -13.135 0.261 507 HG3 PRO 69 HG1 PRO 69 3.118 -12.148 -1.189 508 HD2 PRO 69 HD2 PRO 69 4.756 -14.356 -0.079 509 HD3 PRO 69 HD1 PRO 69 4.540 -13.848 -1.762 510 H ILE 70 HN ILE 70 6.660 -9.111 0.305 511 HA ILE 70 HA ILE 70 8.821 -10.079 1.919 512 HB ILE 70 HB ILE 70 9.607 -7.701 1.934 513 HG12 ILE 70 HG12 ILE 70 7.370 -7.321 -0.061 514 HG13 ILE 70 HG11 ILE 70 7.395 -6.633 1.564 515 HG21 ILE 70 HG21 ILE 70 10.429 -9.363 0.362 516 HG22 ILE 70 HG22 ILE 70 10.315 -7.783 -0.412 517 HG23 ILE 70 HG23 ILE 70 9.094 -9.012 -0.735 518 HD11 ILE 70 HD11 ILE 70 9.365 -6.046 -0.636 519 HD12 ILE 70 HD12 ILE 70 9.395 -5.366 0.993 520 HD13 ILE 70 HD13 ILE 70 8.053 -4.995 -0.092 521 H GLY 71 HN GLY 71 5.847 -9.728 2.840 522 HA2 GLY 71 HA2 GLY 71 5.322 -9.935 5.173 523 HA3 GLY 71 HA1 GLY 71 6.633 -8.824 5.526 524 H SER 72 HN SER 72 3.608 -8.990 3.775 525 HA SER 72 HA SER 72 2.993 -6.269 3.666 526 HB2 SER 72 HB2 SER 72 1.002 -8.535 3.777 527 HB3 SER 72 HB1 SER 72 0.858 -6.997 2.925 528 HG SER 72 HG SER 72 2.118 -9.316 2.173 529 H PHE 73 HN PHE 73 1.069 -5.225 4.726 530 HA PHE 73 HA PHE 73 0.808 -6.013 7.553 531 HB2 PHE 73 HB2 PHE 73 1.151 -3.802 8.311 532 HB3 PHE 73 HB1 PHE 73 2.390 -4.030 7.081 533 HD1 PHE 73 HD1 PHE 73 2.022 -3.034 4.798 534 HD2 PHE 73 HD2 PHE 73 -0.462 -2.135 8.125 535 HE1 PHE 73 HE1 PHE 73 1.212 -1.017 3.645 536 HE2 PHE 73 HE2 PHE 73 -1.283 -0.127 6.983 537 HZ PHE 73 HZ PHE 73 -0.445 0.440 4.735 538 HA PRO 74 HA PRO 74 -3.526 -5.387 6.851 539 HB2 PRO 74 HB2 PRO 74 -4.215 -4.745 9.505 540 HB3 PRO 74 HB1 PRO 74 -4.196 -6.341 8.765 541 HG2 PRO 74 HG2 PRO 74 -2.476 -5.404 10.788 542 HG3 PRO 74 HG1 PRO 74 -2.329 -6.914 9.881 543 HD2 PRO 74 HD2 PRO 74 -0.864 -4.366 9.558 544 HD3 PRO 74 HD1 PRO 74 -0.382 -6.018 9.126 545 H LEU 75 HN LEU 75 -4.804 -3.791 6.162 546 HA LEU 75 HA LEU 75 -3.842 -1.130 6.173 547 HB2 LEU 75 HB2 LEU 75 -6.450 -2.315 5.251 548 HB3 LEU 75 HB1 LEU 75 -6.017 -0.635 5.013 549 HG LEU 75 HG LEU 75 -4.437 -2.964 3.919 550 HD11 LEU 75 HD11 LEU 75 -6.435 -1.158 2.562 551 HD12 LEU 75 HD12 LEU 75 -6.614 -2.887 2.864 552 HD13 LEU 75 HD13 LEU 75 -5.380 -2.310 1.746 553 HD21 LEU 75 HD21 LEU 75 -3.481 -1.123 2.486 554 HD22 LEU 75 HD22 LEU 75 -3.024 -1.079 4.188 555 HD23 LEU 75 HD23 LEU 75 -4.260 0.022 3.578 556 H ASN 76 HN ASN 76 -6.102 -2.787 8.219 557 HA ASN 76 HA ASN 76 -7.430 -0.422 9.127 558 HB2 ASN 76 HB2 ASN 76 -8.349 -1.911 10.920 559 HB3 ASN 76 HB1 ASN 76 -8.665 -2.451 9.281 560 HD21 ASN 76 HD21 ASN 76 -5.595 -2.860 10.990 561 HD22 ASN 76 HD22 ASN 76 -5.692 -4.585 11.098 562 H LYS 77 HN LYS 77 -4.358 -1.482 9.612 563 HA LYS 77 HA LYS 77 -4.153 -0.571 12.375 564 HB2 LYS 77 HB2 LYS 77 -2.154 -1.790 10.472 565 HB3 LYS 77 HB1 LYS 77 -1.718 -1.194 12.067 566 HG2 LYS 77 HG2 LYS 77 -3.779 -3.331 11.581 567 HG3 LYS 77 HG1 LYS 77 -2.078 -3.651 11.927 568 HD2 LYS 77 HD2 LYS 77 -2.338 -2.365 14.045 569 HD3 LYS 77 HD1 LYS 77 -4.065 -2.248 13.708 570 HE2 LYS 77 HE2 LYS 77 -4.279 -4.650 13.772 571 HE3 LYS 77 HE1 LYS 77 -2.537 -4.833 13.973 572 HZ1 LYS 77 HZ1 LYS 77 -4.362 -3.513 15.911 573 HZ2 LYS 77 HZ2 LYS 77 -2.696 -3.727 16.104 574 HZ3 LYS 77 HZ3 LYS 77 -3.719 -5.070 16.069 575 H ILE 78 HN ILE 78 -4.006 0.757 9.282 576 HA ILE 78 HA ILE 78 -1.836 2.545 9.539 577 HB ILE 78 HB ILE 78 -4.348 2.964 7.910 578 HG12 ILE 78 HG12 ILE 78 -1.704 1.775 7.044 579 HG13 ILE 78 HG11 ILE 78 -3.132 0.818 7.433 580 HG21 ILE 78 HG21 ILE 78 -3.012 4.987 8.254 581 HG22 ILE 78 HG22 ILE 78 -2.946 4.453 6.571 582 HG23 ILE 78 HG23 ILE 78 -1.581 4.145 7.651 583 HD11 ILE 78 HD11 ILE 78 -2.848 1.121 5.028 584 HD12 ILE 78 HD12 ILE 78 -2.952 2.869 5.238 585 HD13 ILE 78 HD13 ILE 78 -4.345 1.851 5.607 586 H THR 79 HN THR 79 -1.604 4.250 10.811 587 HA THR 79 HA THR 79 -3.944 5.297 12.189 588 HB THR 79 HB THR 79 -2.397 6.396 13.702 589 HG1 THR 79 HG1 THR 79 -0.024 5.527 13.020 590 HG21 THR 79 HG21 THR 79 -1.493 3.570 13.103 591 HG22 THR 79 HG22 THR 79 -2.843 4.032 14.142 592 HG23 THR 79 HG23 THR 79 -1.192 4.446 14.604 593 H SER 80 HN SER 80 -1.526 6.195 9.837 594 HA SER 80 HA SER 80 -3.185 8.352 8.926 595 HB2 SER 80 HB2 SER 80 -1.878 9.399 10.794 596 HB3 SER 80 HB1 SER 80 -0.402 9.030 9.902 597 HG SER 80 HG SER 80 -2.531 10.721 9.076 598 H ILE 81 HN ILE 81 -2.948 8.610 6.780 599 HA ILE 81 HA ILE 81 -0.510 7.553 5.511 600 HB ILE 81 HB ILE 81 -2.202 6.082 4.812 601 HG12 ILE 81 HG12 ILE 81 -2.048 8.214 2.664 602 HG13 ILE 81 HG11 ILE 81 -0.879 6.922 2.907 603 HG21 ILE 81 HG21 ILE 81 -4.125 7.254 5.667 604 HG22 ILE 81 HG22 ILE 81 -4.411 6.784 3.989 605 HG23 ILE 81 HG23 ILE 81 -4.002 8.455 4.380 606 HD11 ILE 81 HD11 ILE 81 -2.331 6.389 1.069 607 HD12 ILE 81 HD12 ILE 81 -3.754 6.595 2.091 608 HD13 ILE 81 HD13 ILE 81 -2.627 5.276 2.405 609 H ARG 82 HN ARG 82 0.696 9.259 4.946 610 HA ARG 82 HA ARG 82 -0.611 11.474 3.559 611 HB2 ARG 82 HB2 ARG 82 1.080 11.723 6.029 612 HB3 ARG 82 HB1 ARG 82 0.915 13.056 4.894 613 HG2 ARG 82 HG2 ARG 82 -1.237 11.749 6.539 614 HG3 ARG 82 HG1 ARG 82 -0.669 13.420 6.612 615 HD2 ARG 82 HD2 ARG 82 -1.484 13.753 4.297 616 HD3 ARG 82 HD1 ARG 82 -2.124 12.113 4.322 617 HE ARG 82 HE ARG 82 -3.080 14.244 6.124 618 HH11 ARG 82 HH11 ARG 82 -3.601 11.388 4.171 619 HH12 ARG 82 HH12 ARG 82 -5.335 11.442 4.294 620 HH21 ARG 82 HH21 ARG 82 -5.359 14.309 6.343 621 HH22 ARG 82 HH22 ARG 82 -6.333 13.104 5.562 622 H THR 83 HN THR 83 0.785 12.869 2.427 623 HA THR 83 HA THR 83 2.856 11.448 1.044 624 HB THR 83 HB THR 83 2.313 14.377 0.716 625 HG1 THR 83 HG1 THR 83 0.284 13.926 0.320 626 HG21 THR 83 HG21 THR 83 2.723 13.831 -1.643 627 HG22 THR 83 HG22 THR 83 2.931 12.133 -1.205 628 HG23 THR 83 HG23 THR 83 4.073 13.345 -0.617 629 H LYS 84 HN LYS 84 5.053 11.818 1.158 630 HA LYS 84 HA LYS 84 6.065 13.035 3.510 631 HB2 LYS 84 HB2 LYS 84 7.291 11.217 2.506 632 HB3 LYS 84 HB1 LYS 84 7.476 12.126 1.011 633 HG2 LYS 84 HG2 LYS 84 9.211 13.288 1.787 634 HG3 LYS 84 HG1 LYS 84 8.456 13.543 3.359 635 HD2 LYS 84 HD2 LYS 84 10.474 12.252 3.625 636 HD3 LYS 84 HD1 LYS 84 9.069 11.251 3.994 637 HE2 LYS 84 HE2 LYS 84 9.217 10.151 1.875 638 HE3 LYS 84 HE1 LYS 84 10.469 11.266 1.327 639 HZ1 LYS 84 HZ1 LYS 84 11.969 10.389 2.964 640 HZ2 LYS 84 HZ2 LYS 84 11.359 9.107 2.043 641 HZ3 LYS 84 HZ3 LYS 84 10.770 9.385 3.606 642 H VAL 85 HN VAL 85 6.403 15.083 3.888 643 HA VAL 85 HA VAL 85 5.881 17.090 1.964 644 HB VAL 85 HB VAL 85 5.426 17.401 4.344 645 HG11 VAL 85 HG11 VAL 85 7.225 17.788 5.948 646 HG12 VAL 85 HG12 VAL 85 8.420 17.436 4.700 647 HG13 VAL 85 HG13 VAL 85 7.323 16.169 5.251 648 HG21 VAL 85 HG21 VAL 85 7.469 19.368 3.310 649 HG22 VAL 85 HG22 VAL 85 6.319 19.666 4.613 650 HG23 VAL 85 HG23 VAL 85 5.739 19.392 2.970 651 H ASP 86 HN ASP 86 8.749 15.435 2.942 652 HA ASP 86 HA ASP 86 10.568 17.343 1.811 653 HB2 ASP 86 HB2 ASP 86 11.327 16.051 3.673 654 HB3 ASP 86 HB1 ASP 86 10.967 14.578 2.809 655 H ASN 87 HN ASN 87 8.673 14.776 0.637 656 HA ASN 87 HA ASN 87 9.819 14.967 -1.998 657 HB2 ASN 87 HB2 ASN 87 11.314 13.319 -0.853 658 HB3 ASN 87 HB1 ASN 87 9.906 12.303 -0.558 659 HD21 ASN 87 HD21 ASN 87 12.142 13.483 -2.932 660 HD22 ASN 87 HD22 ASN 87 11.677 12.402 -4.196 661 H LEU 88 HN LEU 88 7.916 15.394 -2.931 662 HA LEU 88 HA LEU 88 5.450 14.348 -2.014 663 HB2 LEU 88 HB2 LEU 88 6.223 15.905 -4.465 664 HB3 LEU 88 HB1 LEU 88 4.571 15.393 -4.170 665 HG LEU 88 HG LEU 88 6.200 17.207 -2.380 666 HD11 LEU 88 HD11 LEU 88 4.622 18.937 -3.113 667 HD12 LEU 88 HD12 LEU 88 3.890 17.787 -4.233 668 HD13 LEU 88 HD13 LEU 88 5.564 18.295 -4.458 669 HD21 LEU 88 HD21 LEU 88 4.070 17.539 -1.193 670 HD22 LEU 88 HD22 LEU 88 4.638 15.872 -1.093 671 HD23 LEU 88 HD23 LEU 88 3.330 16.294 -2.200 672 H LYS 89 HN LYS 89 7.799 12.978 -3.978 673 HA LYS 89 HA LYS 89 5.931 11.365 -5.512 674 HB2 LYS 89 HB2 LYS 89 8.949 11.245 -5.335 675 HB3 LYS 89 HB1 LYS 89 7.965 10.264 -6.409 676 HG2 LYS 89 HG2 LYS 89 8.766 11.977 -7.760 677 HG3 LYS 89 HG1 LYS 89 7.121 12.473 -7.369 678 HD2 LYS 89 HD2 LYS 89 7.945 13.991 -5.674 679 HD3 LYS 89 HD1 LYS 89 9.599 13.438 -5.944 680 HE2 LYS 89 HE2 LYS 89 9.507 14.285 -8.235 681 HE3 LYS 89 HE1 LYS 89 7.852 14.833 -7.968 682 HZ1 LYS 89 HZ1 LYS 89 9.537 16.602 -7.732 683 HZ2 LYS 89 HZ2 LYS 89 10.190 15.780 -6.408 684 HZ3 LYS 89 HZ3 LYS 89 8.612 16.381 -6.334 685 H SER 90 HN SER 90 7.181 11.401 -2.456 686 HA SER 90 HA SER 90 6.939 8.490 -2.171 687 HB2 SER 90 HB2 SER 90 9.183 9.543 -1.609 688 HB3 SER 90 HB1 SER 90 8.366 10.358 -0.279 689 HG SER 90 HG SER 90 8.800 7.587 -0.653 690 H LEU 91 HN LEU 91 6.027 7.775 -0.157 691 HA LEU 91 HA LEU 91 4.028 9.615 0.958 692 HB2 LEU 91 HB2 LEU 91 3.072 8.193 -0.854 693 HB3 LEU 91 HB1 LEU 91 3.549 6.776 0.054 694 HG LEU 91 HG LEU 91 2.055 7.853 1.930 695 HD11 LEU 91 HD11 LEU 91 1.687 9.921 0.588 696 HD12 LEU 91 HD12 LEU 91 0.206 9.109 1.098 697 HD13 LEU 91 HD13 LEU 91 0.774 8.942 -0.563 698 HD21 LEU 91 HD21 LEU 91 0.111 6.626 0.945 699 HD22 LEU 91 HD22 LEU 91 1.613 5.703 1.027 700 HD23 LEU 91 HD23 LEU 91 1.079 6.389 -0.512 701 H GLU 92 HN GLU 92 4.377 9.671 3.089 702 HA GLU 92 HA GLU 92 5.667 7.377 4.367 703 HB2 GLU 92 HB2 GLU 92 6.630 9.663 4.668 704 HB3 GLU 92 HB1 GLU 92 5.147 10.142 5.482 705 HG2 GLU 92 HG2 GLU 92 5.571 8.418 7.191 706 HG3 GLU 92 HG1 GLU 92 7.092 8.036 6.390 707 H ILE 93 HN ILE 93 4.334 5.927 5.208 708 HA ILE 93 HA ILE 93 1.731 6.871 6.204 709 HB ILE 93 HB ILE 93 2.539 4.213 5.045 710 HG12 ILE 93 HG12 ILE 93 0.484 6.287 4.248 711 HG13 ILE 93 HG11 ILE 93 1.993 5.928 3.408 712 HG21 ILE 93 HG21 ILE 93 -0.052 4.934 6.410 713 HG22 ILE 93 HG22 ILE 93 1.145 3.768 6.979 714 HG23 ILE 93 HG23 ILE 93 0.242 3.453 5.497 715 HD11 ILE 93 HD11 ILE 93 1.214 3.773 2.785 716 HD12 ILE 93 HD12 ILE 93 -0.017 4.961 2.348 717 HD13 ILE 93 HD13 ILE 93 -0.231 3.949 3.778 718 H SER 94 HN SER 94 1.555 6.934 8.282 719 HA SER 94 HA SER 94 3.247 5.280 9.970 720 HB2 SER 94 HB2 SER 94 1.176 7.347 10.774 721 HB3 SER 94 HB1 SER 94 2.436 6.657 11.797 722 HG SER 94 HG SER 94 3.962 7.795 10.722 723 H VAL 95 HN VAL 95 2.571 3.337 10.431 724 HA VAL 95 HA VAL 95 -0.308 2.882 10.826 725 HB VAL 95 HB VAL 95 0.070 1.741 8.827 726 HG11 VAL 95 HG11 VAL 95 2.409 2.057 8.573 727 HG12 VAL 95 HG12 VAL 95 2.077 0.330 8.399 728 HG13 VAL 95 HG13 VAL 95 2.765 0.950 9.901 729 HG21 VAL 95 HG21 VAL 95 0.143 -0.663 9.311 730 HG22 VAL 95 HG22 VAL 95 -0.917 0.207 10.422 731 HG23 VAL 95 HG23 VAL 95 0.685 -0.307 10.951 732 H SER 96 HN SER 96 -0.841 1.319 12.462 733 HA SER 96 HA SER 96 0.933 1.310 14.675 734 HB2 SER 96 HB2 SER 96 -1.564 1.176 14.864 735 HB3 SER 96 HB1 SER 96 -1.485 -0.459 14.213 736 HG SER 96 HG SER 96 -0.122 0.396 16.554 737 H SER 97 HN SER 97 2.767 0.194 14.622 738 HA SER 97 HA SER 97 2.913 -2.051 12.746 739 HB2 SER 97 HB2 SER 97 5.171 -0.286 13.694 740 HB3 SER 97 HB1 SER 97 5.209 -1.444 12.367 741 HG SER 97 HG SER 97 3.353 0.679 12.353 742 H VAL 98 HN VAL 98 4.116 -3.823 13.174 743 HA VAL 98 HA VAL 98 4.989 -4.284 15.939 744 HB VAL 98 HB VAL 98 3.426 -5.946 14.802 745 HG11 VAL 98 HG11 VAL 98 4.325 -5.862 12.566 746 HG12 VAL 98 HG12 VAL 98 4.399 -7.512 13.185 747 HG13 VAL 98 HG13 VAL 98 5.860 -6.526 13.128 748 HG21 VAL 98 HG21 VAL 98 6.070 -7.158 15.578 749 HG22 VAL 98 HG22 VAL 98 4.471 -7.889 15.695 750 HG23 VAL 98 HG23 VAL 98 4.895 -6.528 16.732 751 H HIS 99 HN HIS 99 7.170 -5.986 15.492 752 HA HIS 99 HA HIS 99 9.277 -4.348 15.148 753 HB2 HIS 99 HB2 HIS 99 9.429 -6.709 15.863 754 HB3 HIS 99 HB1 HIS 99 9.242 -7.212 14.188 755 HD1 HIS 99 HD1 HIS 99 11.402 -7.800 13.159 756 HD2 HIS 99 HD2 HIS 99 11.823 -4.799 16.003 757 HE1 HIS 99 HE1 HIS 99 13.863 -7.293 13.251 758 HE2 HIS 99 HE2 HIS 99 14.105 -5.532 15.033 759 H ILE 100 HN ILE 100 9.318 -2.840 13.600 760 HA ILE 100 HA ILE 100 10.429 -3.138 11.137 761 HB ILE 100 HB ILE 100 8.268 -4.439 10.628 762 HG12 ILE 100 HG12 ILE 100 8.854 -2.028 8.894 763 HG13 ILE 100 HG11 ILE 100 9.800 -3.512 8.898 764 HG21 ILE 100 HG21 ILE 100 6.300 -3.095 10.041 765 HG22 ILE 100 HG22 ILE 100 7.105 -1.656 10.666 766 HG23 ILE 100 HG23 ILE 100 6.689 -2.978 11.757 767 HD11 ILE 100 HD11 ILE 100 6.907 -3.253 8.115 768 HD12 ILE 100 HD12 ILE 100 7.833 -4.754 8.140 769 HD13 ILE 100 HD13 ILE 100 8.275 -3.463 7.024 770 H SER 101 HN SER 101 10.117 -1.097 9.814 771 HA SER 101 HA SER 101 9.785 1.139 11.658 772 HB2 SER 101 HB2 SER 101 11.926 0.900 10.390 773 HB3 SER 101 HB1 SER 101 11.025 1.139 8.897 774 HG SER 101 HG SER 101 11.367 2.978 11.036 775 H THR 102 HN THR 102 9.042 3.223 10.430 776 HA THR 102 HA THR 102 6.329 2.942 9.760 777 HB THR 102 HB THR 102 8.202 5.221 9.040 778 HG1 THR 102 HG1 THR 102 7.771 6.028 11.074 779 HG21 THR 102 HG21 THR 102 6.011 5.373 7.959 780 HG22 THR 102 HG22 THR 102 6.201 6.624 9.187 781 HG23 THR 102 HG23 THR 102 5.222 5.197 9.526 782 H TYR 103 HN TYR 103 5.284 3.029 7.712 783 HA TYR 103 HA TYR 103 6.921 1.707 5.704 784 HB2 TYR 103 HB2 TYR 103 4.975 0.494 6.102 785 HB3 TYR 103 HB1 TYR 103 3.976 1.935 6.220 786 HD1 TYR 103 HD1 TYR 103 2.462 2.223 4.540 787 HD2 TYR 103 HD2 TYR 103 6.144 0.286 3.610 788 HE1 TYR 103 HE1 TYR 103 1.714 1.928 2.219 789 HE2 TYR 103 HE2 TYR 103 5.390 -0.003 1.286 790 HH TYR 103 HH TYR 103 3.236 -0.132 0.045 791 H LEU 104 HN LEU 104 7.759 2.734 4.082 792 HA LEU 104 HA LEU 104 6.513 5.224 3.178 793 HB2 LEU 104 HB2 LEU 104 9.301 4.290 3.378 794 HB3 LEU 104 HB1 LEU 104 8.915 5.238 1.948 795 HG LEU 104 HG LEU 104 8.207 6.209 4.715 796 HD11 LEU 104 HD11 LEU 104 10.629 5.733 4.643 797 HD12 LEU 104 HD12 LEU 104 10.290 7.460 4.734 798 HD13 LEU 104 HD13 LEU 104 10.769 6.736 3.201 799 HD21 LEU 104 HD21 LEU 104 8.241 8.382 3.620 800 HD22 LEU 104 HD22 LEU 104 7.137 7.285 2.788 801 HD23 LEU 104 HD23 LEU 104 8.725 7.628 2.102 802 H PHE 105 HN PHE 105 5.307 5.044 1.531 803 HA PHE 105 HA PHE 105 5.797 3.049 -0.549 804 HB2 PHE 105 HB2 PHE 105 3.530 3.115 0.145 805 HB3 PHE 105 HB1 PHE 105 3.508 4.865 0.200 806 HD1 PHE 105 HD1 PHE 105 3.334 6.157 -1.886 807 HD2 PHE 105 HD2 PHE 105 3.006 1.919 -1.841 808 HE1 PHE 105 HE1 PHE 105 2.253 6.224 -4.078 809 HE2 PHE 105 HE2 PHE 105 1.926 1.987 -4.054 810 HZ PHE 105 HZ PHE 105 1.539 4.148 -5.173 811 H THR 106 HN THR 106 7.190 3.706 -2.126 812 HA THR 106 HA THR 106 7.296 6.599 -2.663 813 HB THR 106 HB THR 106 9.636 4.704 -2.809 814 HG1 THR 106 HG1 THR 106 8.943 4.935 -0.655 815 HG21 THR 106 HG21 THR 106 10.958 6.773 -2.848 816 HG22 THR 106 HG22 THR 106 9.469 7.723 -2.833 817 HG23 THR 106 HG23 THR 106 9.849 6.696 -4.216 818 H PHE 107 HN PHE 107 7.054 7.256 -4.661 819 HA PHE 107 HA PHE 107 7.256 5.289 -6.840 820 HB2 PHE 107 HB2 PHE 107 5.028 6.853 -6.040 821 HB3 PHE 107 HB1 PHE 107 5.603 7.515 -7.565 822 HD1 PHE 107 HD1 PHE 107 3.330 5.352 -6.242 823 HD2 PHE 107 HD2 PHE 107 6.316 5.478 -9.263 824 HE1 PHE 107 HE1 PHE 107 2.181 3.550 -7.457 825 HE2 PHE 107 HE2 PHE 107 5.177 3.680 -10.483 826 HZ PHE 107 HZ PHE 107 3.107 2.712 -9.581 827 H LYS 108 HN LYS 108 7.278 6.704 -9.011 828 HA LYS 108 HA LYS 108 9.687 8.296 -8.851 829 HB2 LYS 108 HB2 LYS 108 9.614 8.256 -11.298 830 HB3 LYS 108 HB1 LYS 108 9.440 6.632 -10.636 831 HG2 LYS 108 HG2 LYS 108 6.857 7.820 -10.973 832 HG3 LYS 108 HG1 LYS 108 7.774 7.950 -12.475 833 HD2 LYS 108 HD2 LYS 108 7.445 5.391 -10.925 834 HD3 LYS 108 HD1 LYS 108 6.398 5.880 -12.258 835 HE2 LYS 108 HE2 LYS 108 8.333 5.969 -13.746 836 HE3 LYS 108 HE1 LYS 108 9.383 5.482 -12.417 837 HZ1 LYS 108 HZ1 LYS 108 7.180 3.856 -13.566 838 HZ2 LYS 108 HZ2 LYS 108 8.175 3.389 -12.282 839 HZ3 LYS 108 HZ3 LYS 108 8.833 3.607 -13.823 840 H THR 109 HN THR 109 6.257 8.726 -9.334 841 HA THR 109 HA THR 109 6.673 11.619 -9.685 842 HB THR 109 HB THR 109 4.759 11.672 -11.222 843 HG1 THR 109 HG1 THR 109 4.006 9.553 -11.992 844 HG21 THR 109 HG21 THR 109 7.012 11.340 -12.165 845 HG22 THR 109 HG22 THR 109 5.773 10.545 -13.136 846 HG23 THR 109 HG23 THR 109 6.790 9.591 -12.052 847 H ARG 110 HN ARG 110 4.995 12.968 -8.792 848 HA ARG 110 HA ARG 110 3.739 11.993 -6.456 849 HB2 ARG 110 HB2 ARG 110 4.122 14.344 -6.557 850 HB3 ARG 110 HB1 ARG 110 3.240 14.493 -8.078 851 HG2 ARG 110 HG2 ARG 110 1.234 13.566 -6.652 852 HG3 ARG 110 HG1 ARG 110 2.200 14.159 -5.299 853 HD2 ARG 110 HD2 ARG 110 2.259 16.386 -6.349 854 HD3 ARG 110 HD1 ARG 110 1.247 15.766 -7.664 855 HE ARG 110 HE ARG 110 -0.202 15.174 -5.456 856 HH11 ARG 110 HH11 ARG 110 1.271 18.157 -6.564 857 HH12 ARG 110 HH12 ARG 110 0.072 19.163 -5.818 858 HH21 ARG 110 HH21 ARG 110 -1.774 16.472 -4.504 859 HH22 ARG 110 HH22 ARG 110 -1.668 18.201 -4.647 860 H GLU 111 HN GLU 111 2.663 12.412 -9.766 861 HA GLU 111 HA GLU 111 -0.074 12.257 -9.447 862 HB2 GLU 111 HB2 GLU 111 1.522 11.010 -11.688 863 HB3 GLU 111 HB1 GLU 111 -0.165 11.496 -11.748 864 HG2 GLU 111 HG2 GLU 111 0.465 13.824 -11.516 865 HG3 GLU 111 HG1 GLU 111 2.160 13.363 -11.356 866 H GLU 112 HN GLU 112 2.263 9.637 -9.830 867 HA GLU 112 HA GLU 112 0.425 7.520 -9.873 868 HB2 GLU 112 HB2 GLU 112 3.361 7.700 -9.241 869 HB3 GLU 112 HB1 GLU 112 2.495 6.171 -9.128 870 HG2 GLU 112 HG2 GLU 112 2.834 7.893 -11.571 871 HG3 GLU 112 HG1 GLU 112 3.579 6.324 -11.255 872 H ARG 113 HN ARG 113 2.324 8.866 -7.160 873 HA ARG 113 HA ARG 113 1.153 7.014 -5.326 874 HB2 ARG 113 HB2 ARG 113 2.306 8.394 -3.558 875 HB3 ARG 113 HB1 ARG 113 3.341 7.670 -4.768 876 HG2 ARG 113 HG2 ARG 113 4.176 9.821 -4.358 877 HG3 ARG 113 HG1 ARG 113 3.392 9.900 -5.924 878 HD2 ARG 113 HD2 ARG 113 3.060 11.799 -4.190 879 HD3 ARG 113 HD1 ARG 113 1.698 11.231 -5.147 880 HE ARG 113 HE ARG 113 1.810 9.811 -2.717 881 HH11 ARG 113 HH11 ARG 113 1.240 13.035 -3.878 882 HH12 ARG 113 HH12 ARG 113 -0.053 13.363 -2.774 883 HH21 ARG 113 HH21 ARG 113 0.086 10.223 -1.247 884 HH22 ARG 113 HH22 ARG 113 -0.681 11.771 -1.254 885 H GLU 114 HN GLU 114 0.483 10.279 -6.270 886 HA GLU 114 HA GLU 114 -1.246 11.076 -4.225 887 HB2 GLU 114 HB2 GLU 114 -0.346 12.460 -6.153 888 HB3 GLU 114 HB1 GLU 114 -1.601 11.746 -7.143 889 HG2 GLU 114 HG2 GLU 114 -2.246 13.935 -6.349 890 HG3 GLU 114 HG1 GLU 114 -3.293 12.685 -5.705 891 H SER 115 HN SER 115 -2.025 9.577 -7.339 892 HA SER 115 HA SER 115 -4.750 9.191 -6.916 893 HB2 SER 115 HB2 SER 115 -3.535 8.852 -9.088 894 HB3 SER 115 HB1 SER 115 -2.914 7.332 -8.448 895 HG SER 115 HG SER 115 -5.610 8.037 -8.973 896 H TRP 116 HN TRP 116 -2.004 7.063 -6.163 897 HA TRP 116 HA TRP 116 -3.404 4.849 -5.255 898 HB2 TRP 116 HB2 TRP 116 -0.922 5.079 -5.700 899 HB3 TRP 116 HB1 TRP 116 -0.788 5.835 -4.118 900 HD1 TRP 116 HD1 TRP 116 -1.304 2.473 -5.800 901 HE1 TRP 116 HE1 TRP 116 -1.013 0.608 -4.059 902 HE3 TRP 116 HE3 TRP 116 -1.103 5.346 -1.566 903 HZ2 TRP 116 HZ2 TRP 116 -0.736 0.385 -1.264 904 HZ3 TRP 116 HZ3 TRP 116 -0.822 4.219 0.600 905 HH2 TRP 116 HH2 TRP 116 -0.644 1.790 0.749 906 H GLN 117 HN GLN 117 -1.999 7.475 -3.259 907 HA GLN 117 HA GLN 117 -3.002 6.714 -0.805 908 HB2 GLN 117 HB2 GLN 117 -1.482 8.453 -0.673 909 HB3 GLN 117 HB1 GLN 117 -2.232 9.355 -1.981 910 HG2 GLN 117 HG2 GLN 117 -4.090 9.949 -0.521 911 HG3 GLN 117 HG1 GLN 117 -3.367 9.018 0.793 912 HE21 GLN 117 HE21 GLN 117 -3.167 11.900 -1.139 913 HE22 GLN 117 HE22 GLN 117 -2.061 12.747 -0.115 914 H ASN 118 HN ASN 118 -4.563 8.828 -3.208 915 HA ASN 118 HA ASN 118 -6.821 9.419 -1.641 916 HB2 ASN 118 HB2 ASN 118 -6.218 9.569 -4.566 917 HB3 ASN 118 HB1 ASN 118 -7.871 9.809 -4.012 918 HD21 ASN 118 HD21 ASN 118 -4.594 11.027 -3.876 919 HD22 ASN 118 HD22 ASN 118 -5.005 12.624 -3.347 920 H ASN 119 HN ASN 119 -6.161 6.796 -3.892 921 HA ASN 119 HA ASN 119 -8.760 5.649 -3.796 922 HB2 ASN 119 HB2 ASN 119 -6.075 4.389 -4.403 923 HB3 ASN 119 HB1 ASN 119 -7.626 3.595 -4.647 924 HD21 ASN 119 HD21 ASN 119 -5.509 4.289 -6.534 925 HD22 ASN 119 HD22 ASN 119 -6.249 5.271 -7.744 926 H LEU 120 HN LEU 120 -5.717 4.838 -2.144 927 HA LEU 120 HA LEU 120 -6.795 2.660 -0.719 928 HB2 LEU 120 HB2 LEU 120 -4.366 3.078 -1.234 929 HB3 LEU 120 HB1 LEU 120 -4.368 4.279 0.037 930 HG LEU 120 HG LEU 120 -3.459 1.911 0.553 931 HD11 LEU 120 HD11 LEU 120 -4.215 2.038 2.855 932 HD12 LEU 120 HD12 LEU 120 -5.492 3.159 2.388 933 HD13 LEU 120 HD13 LEU 120 -3.802 3.638 2.241 934 HD21 LEU 120 HD21 LEU 120 -5.086 0.294 1.298 935 HD22 LEU 120 HD22 LEU 120 -5.377 0.696 -0.394 936 HD23 LEU 120 HD23 LEU 120 -6.405 1.379 0.866 937 H GLU 121 HN GLU 121 -6.420 6.086 0.134 938 HA GLU 121 HA GLU 121 -6.975 5.800 2.871 939 HB2 GLU 121 HB2 GLU 121 -6.102 7.888 1.750 940 HB3 GLU 121 HB1 GLU 121 -7.744 8.191 1.194 941 HG2 GLU 121 HG2 GLU 121 -8.473 8.139 3.584 942 HG3 GLU 121 HG1 GLU 121 -6.773 8.070 4.037 943 H SER 122 HN SER 122 -9.144 6.346 0.115 944 HA SER 122 HA SER 122 -11.511 6.506 1.694 945 HB2 SER 122 HB2 SER 122 -11.260 5.758 -1.236 946 HB3 SER 122 HB1 SER 122 -12.696 6.383 -0.423 947 HG SER 122 HG SER 122 -10.379 7.712 -1.241 948 H PHE 123 HN PHE 123 -9.874 3.888 -0.019 949 HA PHE 123 HA PHE 123 -11.758 1.859 0.519 950 HB2 PHE 123 HB2 PHE 123 -9.947 1.650 -1.139 951 HB3 PHE 123 HB1 PHE 123 -8.757 1.681 0.154 952 HD1 PHE 123 HD1 PHE 123 -11.966 -0.199 -0.145 953 HD2 PHE 123 HD2 PHE 123 -7.723 -0.361 0.135 954 HE1 PHE 123 HE1 PHE 123 -12.069 -2.653 -0.004 955 HE2 PHE 123 HE2 PHE 123 -7.821 -2.807 0.281 956 HZ PHE 123 HZ PHE 123 -9.991 -3.958 0.210 957 H ARG 124 HN ARG 124 -8.984 3.091 2.271 958 HA ARG 124 HA ARG 124 -9.019 1.418 4.508 959 HB2 ARG 124 HB2 ARG 124 -7.164 2.874 4.108 960 HB3 ARG 124 HB1 ARG 124 -8.195 4.294 4.107 961 HG2 ARG 124 HG2 ARG 124 -8.625 3.893 6.529 962 HG3 ARG 124 HG1 ARG 124 -7.414 2.606 6.469 963 HD2 ARG 124 HD2 ARG 124 -5.728 4.187 5.739 964 HD3 ARG 124 HD1 ARG 124 -6.926 5.477 5.686 965 HE ARG 124 HE ARG 124 -6.391 4.146 8.239 966 HH11 ARG 124 HH11 ARG 124 -6.233 7.005 6.230 967 HH12 ARG 124 HH12 ARG 124 -5.756 8.050 7.528 968 HH21 ARG 124 HH21 ARG 124 -5.741 5.514 9.949 969 HH22 ARG 124 HH22 ARG 124 -5.472 7.204 9.640 970 H LYS 125 HN LYS 125 -10.867 4.337 3.748 971 HA LYS 125 HA LYS 125 -12.067 4.646 6.281 972 HB2 LYS 125 HB2 LYS 125 -13.243 5.437 3.613 973 HB3 LYS 125 HB1 LYS 125 -13.705 6.062 5.189 974 HG2 LYS 125 HG2 LYS 125 -11.558 7.127 5.441 975 HG3 LYS 125 HG1 LYS 125 -11.001 6.423 3.921 976 HD2 LYS 125 HD2 LYS 125 -12.954 7.621 2.823 977 HD3 LYS 125 HD1 LYS 125 -13.132 8.504 4.340 978 HE2 LYS 125 HE2 LYS 125 -10.660 8.429 2.615 979 HE3 LYS 125 HE1 LYS 125 -11.806 9.764 2.716 980 HZ1 LYS 125 HZ1 LYS 125 -11.214 10.119 4.988 981 HZ2 LYS 125 HZ2 LYS 125 -9.786 10.074 4.073 982 HZ3 LYS 125 HZ3 LYS 125 -10.233 8.739 5.013 983 H ILE 126 HN ILE 126 -12.965 2.773 3.448 984 HA ILE 126 HA ILE 126 -15.574 2.099 4.212 985 HB ILE 126 HB ILE 126 -13.638 0.537 2.497 986 HG12 ILE 126 HG12 ILE 126 -15.777 2.515 1.684 987 HG13 ILE 126 HG11 ILE 126 -14.063 2.896 1.786 988 HG21 ILE 126 HG21 ILE 126 -15.498 -0.851 3.205 989 HG22 ILE 126 HG22 ILE 126 -15.647 -0.461 1.492 990 HG23 ILE 126 HG23 ILE 126 -16.644 0.379 2.679 991 HD11 ILE 126 HD11 ILE 126 -15.302 0.856 -0.042 992 HD12 ILE 126 HD12 ILE 126 -13.592 1.263 0.050 993 HD13 ILE 126 HD13 ILE 126 -14.754 2.467 -0.502 994 H MET 127 HN MET 127 -12.470 0.783 5.132 995 HA MET 127 HA MET 127 -13.796 -1.494 6.430 996 HB2 MET 127 HB2 MET 127 -10.877 -1.068 5.794 997 HB3 MET 127 HB1 MET 127 -11.572 -2.522 6.499 998 HG2 MET 127 HG2 MET 127 -12.841 -2.939 4.498 999 HG3 MET 127 HG1 MET 127 -12.289 -1.421 3.793 1000 HE1 MET 127 HE1 MET 127 -8.490 -2.090 3.217 1001 HE2 MET 127 HE2 MET 127 -9.186 -1.395 4.679 1002 HE3 MET 127 HE3 MET 127 -9.810 -0.927 3.098 1003 H SER 128 HN SER 128 -11.478 1.116 7.087 1004 HA SER 128 HA SER 128 -11.323 0.294 9.879 1005 HB2 SER 128 HB2 SER 128 -9.277 0.947 8.539 1006 HB3 SER 128 HB1 SER 128 -9.890 2.600 8.547 1007 HG SER 128 HG SER 128 -8.962 2.774 10.410 1008 H MET 129 HN MET 129 -12.472 2.983 7.902 1009 HA MET 129 HA MET 129 -13.665 4.228 10.274 1010 HB2 MET 129 HB2 MET 129 -13.441 5.197 7.402 1011 HB3 MET 129 HB1 MET 129 -14.307 6.057 8.672 1012 HG2 MET 129 HG2 MET 129 -12.273 6.349 9.929 1013 HG3 MET 129 HG1 MET 129 -11.379 5.383 8.757 1014 HE1 MET 129 HE1 MET 129 -14.197 8.001 7.843 1015 HE2 MET 129 HE2 MET 129 -13.251 9.486 7.758 1016 HE3 MET 129 HE3 MET 129 -13.456 8.660 9.302 1017 H LYS 130 HN LYS 130 -14.533 1.703 9.318 1018 HA LYS 130 HA LYS 130 -16.640 1.714 7.507 1019 HB2 LYS 130 HB2 LYS 130 -15.404 -0.286 8.365 1020 HB3 LYS 130 HB1 LYS 130 -16.295 -0.140 9.872 1021 HG2 LYS 130 HG2 LYS 130 -18.402 -0.422 8.574 1022 HG3 LYS 130 HG1 LYS 130 -17.415 -0.750 7.148 1023 HD2 LYS 130 HD2 LYS 130 -17.403 -2.323 9.725 1024 HD3 LYS 130 HD1 LYS 130 -18.137 -2.829 8.203 1025 HE2 LYS 130 HE2 LYS 130 -15.946 -2.852 7.140 1026 HE3 LYS 130 HE1 LYS 130 -15.200 -2.287 8.632 1027 HZ1 LYS 130 HZ1 LYS 130 -15.913 -4.325 9.715 1028 HZ2 LYS 130 HZ2 LYS 130 -14.948 -4.667 8.372 1029 HZ3 LYS 130 HZ3 LYS 130 -16.623 -4.868 8.280 Start of MODEL 5 1 H1 SER 12 HT1 SER 12 -20.994 -8.502 -3.327 2 H2 SER 12 HT2 SER 12 -21.217 -7.008 -4.081 3 H3 SER 12 HT3 SER 12 -21.978 -8.390 -4.697 4 HA SER 12 HA SER 12 -23.252 -8.592 -2.640 5 HB2 SER 12 HB2 SER 12 -21.587 -7.314 -1.266 6 HB3 SER 12 HB1 SER 12 -22.126 -5.843 -2.072 7 HG SER 12 HG SER 12 -23.779 -7.583 -0.550 8 H ALA 13 HN ALA 13 -22.574 -5.508 -4.276 9 HA ALA 13 HA ALA 13 -25.121 -5.747 -5.663 10 HB1 ALA 13 HB1 ALA 13 -25.656 -4.406 -3.680 11 HB2 ALA 13 HB2 ALA 13 -25.799 -3.461 -5.161 12 HB3 ALA 13 HB3 ALA 13 -24.390 -3.260 -4.120 13 H LYS 14 HN LYS 14 -22.771 -3.139 -5.193 14 HA LYS 14 HA LYS 14 -21.324 -3.653 -7.567 15 HB2 LYS 14 HB2 LYS 14 -21.971 -1.764 -8.929 16 HB3 LYS 14 HB1 LYS 14 -23.390 -2.743 -8.609 17 HG2 LYS 14 HG2 LYS 14 -22.737 -0.273 -7.025 18 HG3 LYS 14 HG1 LYS 14 -23.683 -0.233 -8.511 19 HD2 LYS 14 HD2 LYS 14 -25.264 -1.853 -7.457 20 HD3 LYS 14 HD1 LYS 14 -24.357 -1.681 -5.954 21 HE2 LYS 14 HE2 LYS 14 -26.276 -0.238 -5.874 22 HE3 LYS 14 HE1 LYS 14 -24.825 0.751 -6.006 23 HZ1 LYS 14 HZ1 LYS 14 -25.255 1.020 -8.361 24 HZ2 LYS 14 HZ2 LYS 14 -26.591 1.536 -7.460 25 HZ3 LYS 14 HZ3 LYS 14 -26.632 0.044 -8.252 26 H ASP 15 HN ASP 15 -20.908 -3.093 -4.735 27 HA ASP 15 HA ASP 15 -18.955 -1.025 -4.859 28 HB2 ASP 15 HB2 ASP 15 -20.929 0.404 -4.917 29 HB3 ASP 15 HB1 ASP 15 -21.553 -0.382 -3.469 30 H ILE 16 HN ILE 16 -20.839 -3.298 -2.930 31 HA ILE 16 HA ILE 16 -19.782 -2.158 -0.497 32 HB ILE 16 HB ILE 16 -21.717 -4.451 -0.803 33 HG12 ILE 16 HG12 ILE 16 -23.277 -2.612 0.184 34 HG13 ILE 16 HG11 ILE 16 -22.064 -1.488 -0.414 35 HG21 ILE 16 HG21 ILE 16 -22.193 -4.019 1.596 36 HG22 ILE 16 HG22 ILE 16 -20.829 -2.903 1.629 37 HG23 ILE 16 HG23 ILE 16 -20.558 -4.615 1.303 38 HD11 ILE 16 HD11 ILE 16 -22.395 -2.320 -2.674 39 HD12 ILE 16 HD12 ILE 16 -23.908 -1.744 -1.976 40 HD13 ILE 16 HD13 ILE 16 -23.589 -3.475 -2.081 41 H LYS 17 HN LYS 17 -20.097 -5.685 -1.179 42 HA LYS 17 HA LYS 17 -18.061 -6.107 0.797 43 HB2 LYS 17 HB2 LYS 17 -19.616 -7.986 -0.962 44 HB3 LYS 17 HB1 LYS 17 -18.389 -8.546 0.160 45 HG2 LYS 17 HG2 LYS 17 -20.825 -6.961 0.947 46 HG3 LYS 17 HG1 LYS 17 -20.694 -8.719 1.035 47 HD2 LYS 17 HD2 LYS 17 -18.706 -8.407 2.528 48 HD3 LYS 17 HD1 LYS 17 -19.067 -6.682 2.551 49 HE2 LYS 17 HE2 LYS 17 -20.923 -8.877 3.458 50 HE3 LYS 17 HE1 LYS 17 -19.964 -7.846 4.518 51 HZ1 LYS 17 HZ1 LYS 17 -22.202 -7.034 4.385 52 HZ2 LYS 17 HZ2 LYS 17 -22.138 -6.966 2.700 53 HZ3 LYS 17 HZ3 LYS 17 -21.175 -5.929 3.625 54 H ASP 18 HN ASP 18 -18.225 -7.464 -2.482 55 HA ASP 18 HA ASP 18 -15.353 -7.867 -2.459 56 HB2 ASP 18 HB2 ASP 18 -17.483 -8.640 -4.460 57 HB3 ASP 18 HB1 ASP 18 -15.772 -8.995 -4.667 58 H GLU 19 HN GLU 19 -17.741 -5.913 -3.990 59 HA GLU 19 HA GLU 19 -16.420 -5.187 -6.311 60 HB2 GLU 19 HB2 GLU 19 -18.321 -3.417 -4.788 61 HB3 GLU 19 HB1 GLU 19 -18.030 -3.436 -6.521 62 HG2 GLU 19 HG2 GLU 19 -19.960 -4.614 -6.487 63 HG3 GLU 19 HG1 GLU 19 -18.838 -5.948 -6.247 64 H LYS 20 HN LYS 20 -16.335 -3.615 -3.128 65 HA LYS 20 HA LYS 20 -14.781 -1.404 -3.931 66 HB2 LYS 20 HB2 LYS 20 -14.264 -1.103 -1.552 67 HB3 LYS 20 HB1 LYS 20 -15.973 -1.413 -1.796 68 HG2 LYS 20 HG2 LYS 20 -15.721 -3.680 -1.030 69 HG3 LYS 20 HG1 LYS 20 -13.971 -3.475 -0.908 70 HD2 LYS 20 HD2 LYS 20 -14.165 -1.957 0.875 71 HD3 LYS 20 HD1 LYS 20 -15.884 -1.709 0.575 72 HE2 LYS 20 HE2 LYS 20 -15.598 -3.067 2.534 73 HE3 LYS 20 HE1 LYS 20 -16.313 -4.026 1.244 74 HZ1 LYS 20 HZ1 LYS 20 -14.217 -5.063 0.836 75 HZ2 LYS 20 HZ2 LYS 20 -14.556 -5.191 2.486 76 HZ3 LYS 20 HZ3 LYS 20 -13.431 -4.056 1.944 77 H ILE 21 HN ILE 21 -13.912 -4.587 -2.701 78 HA ILE 21 HA ILE 21 -11.148 -4.069 -2.418 79 HB ILE 21 HB ILE 21 -12.622 -6.690 -2.731 80 HG12 ILE 21 HG12 ILE 21 -11.518 -5.428 -0.212 81 HG13 ILE 21 HG11 ILE 21 -13.175 -5.184 -0.759 82 HG21 ILE 21 HG21 ILE 21 -10.269 -6.941 -3.315 83 HG22 ILE 21 HG22 ILE 21 -10.627 -7.737 -1.782 84 HG23 ILE 21 HG23 ILE 21 -9.801 -6.179 -1.794 85 HD11 ILE 21 HD11 ILE 21 -13.142 -6.882 0.901 86 HD12 ILE 21 HD12 ILE 21 -11.883 -7.769 0.040 87 HD13 ILE 21 HD13 ILE 21 -13.502 -7.632 -0.654 88 H GLN 22 HN GLN 22 -13.085 -5.557 -4.992 89 HA GLN 22 HA GLN 22 -10.948 -6.287 -6.663 90 HB2 GLN 22 HB2 GLN 22 -13.774 -5.520 -7.407 91 HB3 GLN 22 HB1 GLN 22 -12.626 -6.301 -8.483 92 HG2 GLN 22 HG2 GLN 22 -12.542 -8.224 -6.940 93 HG3 GLN 22 HG1 GLN 22 -13.778 -7.443 -5.952 94 HE21 GLN 22 HE21 GLN 22 -13.740 -7.229 -9.429 95 HE22 GLN 22 HE22 GLN 22 -15.134 -8.211 -9.704 96 H GLN 23 HN GLN 23 -12.996 -3.385 -6.704 97 HA GLN 23 HA GLN 23 -11.806 -2.130 -8.907 98 HB2 GLN 23 HB2 GLN 23 -13.953 -1.445 -7.915 99 HB3 GLN 23 HB1 GLN 23 -13.108 -0.853 -6.500 100 HG2 GLN 23 HG2 GLN 23 -11.973 0.816 -7.825 101 HG3 GLN 23 HG1 GLN 23 -12.722 0.193 -9.293 102 HE21 GLN 23 HE21 GLN 23 -13.683 2.165 -9.747 103 HE22 GLN 23 HE22 GLN 23 -15.036 2.758 -8.849 104 H TYR 24 HN TYR 24 -11.289 -1.544 -5.447 105 HA TYR 24 HA TYR 24 -9.215 0.301 -5.823 106 HB2 TYR 24 HB2 TYR 24 -10.021 -1.361 -3.453 107 HB3 TYR 24 HB1 TYR 24 -8.613 -0.302 -3.401 108 HD1 TYR 24 HD1 TYR 24 -12.037 -0.503 -2.766 109 HD2 TYR 24 HD2 TYR 24 -9.100 2.189 -4.244 110 HE1 TYR 24 HE1 TYR 24 -13.515 1.387 -2.238 111 HE2 TYR 24 HE2 TYR 24 -10.568 4.090 -3.716 112 HH TYR 24 HH TYR 24 -13.260 3.834 -1.733 113 H ARG 25 HN ARG 25 -9.043 -3.222 -5.194 114 HA ARG 25 HA ARG 25 -6.264 -3.418 -5.015 115 HB2 ARG 25 HB2 ARG 25 -7.870 -5.263 -4.536 116 HB3 ARG 25 HB1 ARG 25 -8.102 -5.453 -6.266 117 HG2 ARG 25 HG2 ARG 25 -5.736 -6.006 -6.526 118 HG3 ARG 25 HG1 ARG 25 -5.509 -5.821 -4.786 119 HD2 ARG 25 HD2 ARG 25 -7.104 -7.633 -4.388 120 HD3 ARG 25 HD1 ARG 25 -7.322 -7.820 -6.126 121 HE ARG 25 HE ARG 25 -4.627 -8.100 -5.713 122 HH11 ARG 25 HH11 ARG 25 -7.530 -9.702 -4.593 123 HH12 ARG 25 HH12 ARG 25 -6.732 -11.213 -4.295 124 HH21 ARG 25 HH21 ARG 25 -3.577 -10.095 -5.336 125 HH22 ARG 25 HH22 ARG 25 -4.491 -11.438 -4.719 126 H LYS 26 HN LYS 26 -8.350 -3.267 -7.813 127 HA LYS 26 HA LYS 26 -6.527 -3.980 -9.810 128 HB2 LYS 26 HB2 LYS 26 -8.969 -3.808 -10.117 129 HB3 LYS 26 HB1 LYS 26 -8.862 -2.066 -9.938 130 HG2 LYS 26 HG2 LYS 26 -7.243 -3.331 -12.075 131 HG3 LYS 26 HG1 LYS 26 -8.990 -3.243 -12.302 132 HD2 LYS 26 HD2 LYS 26 -7.211 -0.892 -11.657 133 HD3 LYS 26 HD1 LYS 26 -7.777 -1.313 -13.273 134 HE2 LYS 26 HE2 LYS 26 -9.520 -0.580 -10.918 135 HE3 LYS 26 HE1 LYS 26 -9.142 0.457 -12.292 136 HZ1 LYS 26 HZ1 LYS 26 -10.653 -2.095 -12.387 137 HZ2 LYS 26 HZ2 LYS 26 -10.235 -1.170 -13.736 138 HZ3 LYS 26 HZ3 LYS 26 -11.291 -0.543 -12.578 139 H THR 27 HN THR 27 -7.324 -0.796 -8.452 140 HA THR 27 HA THR 27 -5.344 0.478 -10.143 141 HB THR 27 HB THR 27 -7.465 1.624 -9.786 142 HG1 THR 27 HG1 THR 27 -5.024 2.709 -9.251 143 HG21 THR 27 HG21 THR 27 -8.037 2.586 -7.605 144 HG22 THR 27 HG22 THR 27 -6.651 1.764 -6.886 145 HG23 THR 27 HG23 THR 27 -7.989 0.824 -7.547 146 H LEU 28 HN LEU 28 -5.530 -0.859 -7.023 147 HA LEU 28 HA LEU 28 -3.627 0.804 -5.698 148 HB2 LEU 28 HB2 LEU 28 -5.278 -1.519 -5.094 149 HB3 LEU 28 HB1 LEU 28 -3.707 -1.599 -4.322 150 HG LEU 28 HG LEU 28 -5.547 -0.608 -2.922 151 HD11 LEU 28 HD11 LEU 28 -3.215 -0.224 -2.402 152 HD12 LEU 28 HD12 LEU 28 -4.177 1.212 -2.061 153 HD13 LEU 28 HD13 LEU 28 -3.176 1.146 -3.510 154 HD21 LEU 28 HD21 LEU 28 -6.670 0.661 -4.698 155 HD22 LEU 28 HD22 LEU 28 -5.265 1.721 -4.818 156 HD23 LEU 28 HD23 LEU 28 -6.218 1.685 -3.335 157 H THR 29 HN THR 29 -3.380 -1.979 -7.751 158 HA THR 29 HA THR 29 -0.881 -2.916 -6.756 159 HB THR 29 HB THR 29 -1.973 -3.416 -9.524 160 HG1 THR 29 HG1 THR 29 -3.543 -3.932 -7.886 161 HG21 THR 29 HG21 THR 29 0.336 -4.140 -9.175 162 HG22 THR 29 HG22 THR 29 -0.730 -5.538 -9.295 163 HG23 THR 29 HG23 THR 29 -0.138 -5.014 -7.718 164 H LYS 30 HN LYS 30 0.878 -1.716 -6.820 165 HA LYS 30 HA LYS 30 1.606 -0.351 -9.315 166 HB2 LYS 30 HB2 LYS 30 1.577 0.882 -6.558 167 HB3 LYS 30 HB1 LYS 30 2.380 1.601 -7.943 168 HG2 LYS 30 HG2 LYS 30 -0.561 0.991 -7.889 169 HG3 LYS 30 HG1 LYS 30 0.124 2.533 -7.376 170 HD2 LYS 30 HD2 LYS 30 1.204 2.682 -9.646 171 HD3 LYS 30 HD1 LYS 30 0.235 1.284 -10.114 172 HE2 LYS 30 HE2 LYS 30 -1.801 2.499 -9.673 173 HE3 LYS 30 HE1 LYS 30 -0.882 3.869 -9.048 174 HZ1 LYS 30 HZ1 LYS 30 -1.652 4.208 -11.334 175 HZ2 LYS 30 HZ2 LYS 30 -0.746 2.877 -11.843 176 HZ3 LYS 30 HZ3 LYS 30 0.039 4.246 -11.225 177 H ILE 31 HN ILE 31 3.817 -0.237 -9.715 178 HA ILE 31 HA ILE 31 5.568 -1.778 -7.973 179 HB ILE 31 HB ILE 31 6.126 -0.353 -10.588 180 HG12 ILE 31 HG12 ILE 31 4.682 -2.392 -10.708 181 HG13 ILE 31 HG11 ILE 31 6.199 -2.543 -11.586 182 HG21 ILE 31 HG21 ILE 31 7.947 -2.128 -8.963 183 HG22 ILE 31 HG22 ILE 31 8.131 -0.392 -9.212 184 HG23 ILE 31 HG23 ILE 31 8.295 -1.499 -10.574 185 HD11 ILE 31 HD11 ILE 31 7.132 -3.842 -9.736 186 HD12 ILE 31 HD12 ILE 31 5.673 -4.584 -10.397 187 HD13 ILE 31 HD13 ILE 31 5.600 -3.698 -8.873 188 H VAL 32 HN VAL 32 6.376 -0.787 -6.243 189 HA VAL 32 HA VAL 32 7.195 2.032 -6.473 190 HB VAL 32 HB VAL 32 6.233 2.569 -4.327 191 HG11 VAL 32 HG11 VAL 32 3.871 2.421 -4.853 192 HG12 VAL 32 HG12 VAL 32 4.195 1.146 -6.028 193 HG13 VAL 32 HG13 VAL 32 4.804 2.778 -6.307 194 HG21 VAL 32 HG21 VAL 32 5.254 -0.287 -4.234 195 HG22 VAL 32 HG22 VAL 32 4.847 0.978 -3.076 196 HG23 VAL 32 HG23 VAL 32 6.512 0.415 -3.215 197 H LYS 33 HN LYS 33 8.524 2.669 -4.488 198 HA LYS 33 HA LYS 33 10.335 0.444 -3.861 199 HB2 LYS 33 HB2 LYS 33 10.933 3.372 -3.353 200 HB3 LYS 33 HB1 LYS 33 12.057 2.024 -3.506 201 HG2 LYS 33 HG2 LYS 33 11.796 1.879 -5.829 202 HG3 LYS 33 HG1 LYS 33 10.341 2.871 -5.819 203 HD2 LYS 33 HD2 LYS 33 11.776 4.762 -4.996 204 HD3 LYS 33 HD1 LYS 33 13.179 3.745 -5.311 205 HE2 LYS 33 HE2 LYS 33 11.137 4.666 -7.337 206 HE3 LYS 33 HE1 LYS 33 12.782 5.273 -7.165 207 HZ1 LYS 33 HZ1 LYS 33 11.994 2.525 -7.970 208 HZ2 LYS 33 HZ2 LYS 33 13.586 3.025 -7.698 209 HZ3 LYS 33 HZ3 LYS 33 12.689 3.707 -8.957 210 H ILE 34 HN ILE 34 10.026 -0.494 -1.990 211 HA ILE 34 HA ILE 34 8.653 0.936 0.135 212 HB ILE 34 HB ILE 34 8.958 -1.868 -0.597 213 HG12 ILE 34 HG12 ILE 34 7.070 -0.301 1.145 214 HG13 ILE 34 HG11 ILE 34 6.834 -0.730 -0.545 215 HG21 ILE 34 HG21 ILE 34 9.142 -1.204 2.341 216 HG22 ILE 34 HG22 ILE 34 10.438 -1.908 1.374 217 HG23 ILE 34 HG23 ILE 34 8.948 -2.813 1.642 218 HD11 ILE 34 HD11 ILE 34 5.494 -2.165 0.803 219 HD12 ILE 34 HD12 ILE 34 6.870 -2.577 1.823 220 HD13 ILE 34 HD13 ILE 34 6.822 -3.119 0.148 221 H LYS 35 HN LYS 35 9.495 1.334 2.106 222 HA LYS 35 HA LYS 35 12.365 0.869 2.471 223 HB2 LYS 35 HB2 LYS 35 10.935 3.527 2.564 224 HB3 LYS 35 HB1 LYS 35 12.566 3.280 3.146 225 HG2 LYS 35 HG2 LYS 35 13.412 3.415 1.103 226 HG3 LYS 35 HG1 LYS 35 12.258 2.232 0.484 227 HD2 LYS 35 HD2 LYS 35 11.415 3.953 -0.684 228 HD3 LYS 35 HD1 LYS 35 10.698 4.422 0.860 229 HE2 LYS 35 HE2 LYS 35 12.398 5.952 1.319 230 HE3 LYS 35 HE1 LYS 35 13.431 5.299 0.041 231 HZ1 LYS 35 HZ1 LYS 35 12.132 6.281 -1.598 232 HZ2 LYS 35 HZ2 LYS 35 12.268 7.479 -0.415 233 HZ3 LYS 35 HZ3 LYS 35 10.840 6.579 -0.549 234 H THR 36 HN THR 36 12.454 -0.249 4.285 235 HA THR 36 HA THR 36 10.759 0.549 6.557 236 HB THR 36 HB THR 36 10.489 -1.798 7.164 237 HG1 THR 36 HG1 THR 36 11.711 -2.535 4.706 238 HG21 THR 36 HG21 THR 36 9.092 -2.562 5.307 239 HG22 THR 36 HG22 THR 36 9.823 -1.349 4.255 240 HG23 THR 36 HG23 THR 36 8.832 -0.846 5.626 241 H ALA 37 HN ALA 37 11.721 -1.041 8.510 242 HA ALA 37 HA ALA 37 14.447 -0.180 8.899 243 HB1 ALA 37 HB1 ALA 37 12.867 -0.226 10.784 244 HB2 ALA 37 HB2 ALA 37 14.270 -1.252 11.083 245 HB3 ALA 37 HB3 ALA 37 12.730 -1.977 10.617 246 H ILE 38 HN ILE 38 12.776 -2.956 7.777 247 HA ILE 38 HA ILE 38 14.883 -4.830 8.336 248 HB ILE 38 HB ILE 38 12.468 -5.221 6.562 249 HG12 ILE 38 HG12 ILE 38 12.787 -5.835 9.512 250 HG13 ILE 38 HG11 ILE 38 11.831 -4.513 8.855 251 HG21 ILE 38 HG21 ILE 38 14.286 -7.174 7.969 252 HG22 ILE 38 HG22 ILE 38 14.194 -6.888 6.231 253 HG23 ILE 38 HG23 ILE 38 12.825 -7.604 7.080 254 HD11 ILE 38 HD11 ILE 38 11.329 -7.443 8.390 255 HD12 ILE 38 HD12 ILE 38 10.360 -6.112 7.758 256 HD13 ILE 38 HD13 ILE 38 10.437 -6.399 9.497 257 H PHE 39 HN PHE 39 13.436 -3.448 5.393 258 HA PHE 39 HA PHE 39 15.971 -3.220 4.115 259 HB2 PHE 39 HB2 PHE 39 15.252 -4.715 2.135 260 HB3 PHE 39 HB1 PHE 39 15.919 -5.484 3.566 261 HD1 PHE 39 HD1 PHE 39 14.934 -7.465 4.077 262 HD2 PHE 39 HD2 PHE 39 12.508 -4.360 2.470 263 HE1 PHE 39 HE1 PHE 39 12.963 -8.926 4.233 264 HE2 PHE 39 HE2 PHE 39 10.538 -5.816 2.629 265 HZ PHE 39 HZ PHE 39 10.763 -8.105 3.511 266 H HIS 40 HN HIS 40 15.937 -1.885 2.355 267 HA HIS 40 HA HIS 40 13.334 -0.744 1.601 268 HB2 HIS 40 HB2 HIS 40 16.131 0.167 0.860 269 HB3 HIS 40 HB1 HIS 40 14.648 1.001 0.448 270 HD1 HIS 40 HD1 HIS 40 15.972 3.008 1.688 271 HD2 HIS 40 HD2 HIS 40 14.583 -0.073 4.103 272 HE1 HIS 40 HE1 HIS 40 16.017 3.912 4.031 273 HE2 HIS 40 HE2 HIS 40 15.369 1.963 5.487 274 H GLU 41 HN GLU 41 12.377 -1.743 -0.086 275 HA GLU 41 HA GLU 41 14.036 -2.821 -2.249 276 HB2 GLU 41 HB2 GLU 41 11.961 -4.380 -0.699 277 HB3 GLU 41 HB1 GLU 41 12.704 -4.930 -2.193 278 HG2 GLU 41 HG2 GLU 41 14.322 -4.252 0.238 279 HG3 GLU 41 HG1 GLU 41 13.625 -5.851 -0.017 280 H THR 42 HN THR 42 13.144 -2.556 -4.243 281 HA THR 42 HA THR 42 10.691 -1.228 -4.656 282 HB THR 42 HB THR 42 11.957 -3.049 -6.694 283 HG1 THR 42 HG1 THR 42 13.571 -1.653 -6.975 284 HG21 THR 42 HG21 THR 42 10.551 -0.382 -6.928 285 HG22 THR 42 HG22 THR 42 9.820 -1.960 -7.249 286 HG23 THR 42 HG23 THR 42 11.140 -1.377 -8.265 287 H VAL 43 HN VAL 43 8.622 -2.024 -4.934 288 HA VAL 43 HA VAL 43 8.252 -4.916 -4.949 289 HB VAL 43 HB VAL 43 8.452 -3.925 -2.562 290 HG11 VAL 43 HG11 VAL 43 6.278 -3.167 -1.650 291 HG12 VAL 43 HG12 VAL 43 5.665 -3.074 -3.299 292 HG13 VAL 43 HG13 VAL 43 7.006 -2.040 -2.796 293 HG21 VAL 43 HG21 VAL 43 6.156 -5.698 -3.359 294 HG22 VAL 43 HG22 VAL 43 6.777 -5.517 -1.718 295 HG23 VAL 43 HG23 VAL 43 7.805 -6.202 -2.980 296 H LYS 44 HN LYS 44 6.101 -5.589 -5.489 297 HA LYS 44 HA LYS 44 4.476 -3.488 -6.736 298 HB2 LYS 44 HB2 LYS 44 5.063 -5.750 -7.902 299 HB3 LYS 44 HB1 LYS 44 3.848 -6.429 -6.825 300 HG2 LYS 44 HG2 LYS 44 2.173 -4.916 -7.728 301 HG3 LYS 44 HG1 LYS 44 3.378 -4.235 -8.822 302 HD2 LYS 44 HD2 LYS 44 2.038 -5.861 -10.004 303 HD3 LYS 44 HD1 LYS 44 3.683 -6.472 -9.826 304 HE2 LYS 44 HE2 LYS 44 2.967 -7.851 -7.936 305 HE3 LYS 44 HE1 LYS 44 1.327 -7.225 -8.094 306 HZ1 LYS 44 HZ1 LYS 44 2.784 -8.827 -10.127 307 HZ2 LYS 44 HZ2 LYS 44 1.221 -8.207 -10.308 308 HZ3 LYS 44 HZ3 LYS 44 1.532 -9.383 -9.134 309 H VAL 45 HN VAL 45 3.061 -2.586 -5.419 310 HA VAL 45 HA VAL 45 2.148 -4.074 -3.080 311 HB VAL 45 HB VAL 45 3.027 -1.869 -2.633 312 HG11 VAL 45 HG11 VAL 45 2.673 -0.830 -4.795 313 HG12 VAL 45 HG12 VAL 45 1.967 0.161 -3.518 314 HG13 VAL 45 HG13 VAL 45 0.928 -0.836 -4.537 315 HG21 VAL 45 HG21 VAL 45 0.026 -1.875 -2.356 316 HG22 VAL 45 HG22 VAL 45 1.147 -0.862 -1.446 317 HG23 VAL 45 HG23 VAL 45 1.173 -2.614 -1.240 318 H THR 46 HN THR 46 0.172 -4.936 -2.943 319 HA THR 46 HA THR 46 -1.977 -3.792 -4.563 320 HB THR 46 HB THR 46 -0.959 -5.821 -5.734 321 HG1 THR 46 HG1 THR 46 -2.919 -5.459 -6.509 322 HG21 THR 46 HG21 THR 46 -1.652 -8.026 -4.931 323 HG22 THR 46 HG22 THR 46 -2.350 -7.290 -3.489 324 HG23 THR 46 HG23 THR 46 -0.604 -7.231 -3.756 325 H CYS 47 HN CYS 47 -4.112 -4.971 -3.856 326 HA CYS 47 HA CYS 47 -4.101 -4.986 -0.926 327 HB2 CYS 47 HB2 CYS 47 -5.704 -3.454 -1.398 328 HB3 CYS 47 HB1 CYS 47 -6.038 -4.121 -2.989 329 HG CYS 47 HG CYS 47 -7.439 -6.365 -1.650 330 H SER 48 HN SER 48 -5.386 -6.568 0.181 331 HA SER 48 HA SER 48 -4.878 -9.182 -0.867 332 HB2 SER 48 HB2 SER 48 -4.673 -8.535 1.546 333 HB3 SER 48 HB1 SER 48 -6.429 -8.414 1.616 334 HG SER 48 HG SER 48 -4.830 -10.708 1.154 335 H LYS 49 HN LYS 49 -6.606 -10.908 -0.819 336 HA LYS 49 HA LYS 49 -8.823 -10.274 -2.436 337 HB2 LYS 49 HB2 LYS 49 -7.920 -12.558 -2.262 338 HB3 LYS 49 HB1 LYS 49 -8.418 -12.630 -0.577 339 HG2 LYS 49 HG2 LYS 49 -10.776 -12.318 -1.353 340 HG3 LYS 49 HG1 LYS 49 -10.186 -12.514 -3.003 341 HD2 LYS 49 HD2 LYS 49 -9.380 -14.734 -2.492 342 HD3 LYS 49 HD1 LYS 49 -9.828 -14.537 -0.797 343 HE2 LYS 49 HE2 LYS 49 -11.714 -14.576 -3.150 344 HE3 LYS 49 HE1 LYS 49 -11.484 -15.873 -1.980 345 HZ1 LYS 49 HZ1 LYS 49 -12.567 -13.168 -1.407 346 HZ2 LYS 49 HZ2 LYS 49 -12.280 -14.356 -0.242 347 HZ3 LYS 49 HZ3 LYS 49 -13.445 -14.613 -1.439 348 H ASP 50 HN ASP 50 -8.410 -10.641 1.027 349 HA ASP 50 HA ASP 50 -11.175 -10.242 1.663 350 HB2 ASP 50 HB2 ASP 50 -8.689 -10.205 3.388 351 HB3 ASP 50 HB1 ASP 50 -10.327 -10.071 4.018 352 H GLY 51 HN GLY 51 -8.622 -8.223 0.804 353 HA2 GLY 51 HA2 GLY 51 -8.598 -5.935 0.506 354 HA3 GLY 51 HA1 GLY 51 -10.206 -5.873 1.202 355 H LYS 52 HN LYS 52 -8.962 -7.443 3.520 356 HA LYS 52 HA LYS 52 -8.894 -5.225 5.249 357 HB2 LYS 52 HB2 LYS 52 -9.758 -7.356 5.957 358 HB3 LYS 52 HB1 LYS 52 -8.208 -8.130 5.668 359 HG2 LYS 52 HG2 LYS 52 -7.219 -6.747 7.462 360 HG3 LYS 52 HG1 LYS 52 -8.820 -6.082 7.789 361 HD2 LYS 52 HD2 LYS 52 -9.656 -8.258 8.392 362 HD3 LYS 52 HD1 LYS 52 -8.138 -9.017 7.908 363 HE2 LYS 52 HE2 LYS 52 -6.963 -7.791 9.666 364 HE3 LYS 52 HE1 LYS 52 -8.475 -7.021 10.147 365 HZ1 LYS 52 HZ1 LYS 52 -9.353 -9.216 10.692 366 HZ2 LYS 52 HZ2 LYS 52 -7.960 -8.877 11.582 367 HZ3 LYS 52 HZ3 LYS 52 -7.882 -9.928 10.266 368 H MET 53 HN MET 53 -6.363 -6.877 3.549 369 HA MET 53 HA MET 53 -4.433 -5.256 5.033 370 HB2 MET 53 HB2 MET 53 -2.878 -6.999 5.294 371 HB3 MET 53 HB1 MET 53 -4.418 -7.703 5.761 372 HG2 MET 53 HG2 MET 53 -4.584 -8.726 3.519 373 HG3 MET 53 HG1 MET 53 -2.996 -8.075 3.138 374 HE1 MET 53 HE1 MET 53 -4.234 -9.586 6.588 375 HE2 MET 53 HE2 MET 53 -3.781 -11.277 6.369 376 HE3 MET 53 HE3 MET 53 -5.039 -10.562 5.360 377 H LEU 54 HN LEU 54 -2.451 -4.870 3.928 378 HA LEU 54 HA LEU 54 -2.867 -4.660 1.032 379 HB2 LEU 54 HB2 LEU 54 -2.446 -2.634 2.517 380 HB3 LEU 54 HB1 LEU 54 -0.824 -3.251 2.743 381 HG LEU 54 HG LEU 54 -0.504 -3.106 0.262 382 HD11 LEU 54 HD11 LEU 54 -2.832 -3.139 -0.436 383 HD12 LEU 54 HD12 LEU 54 -2.045 -1.661 -0.993 384 HD13 LEU 54 HD13 LEU 54 -3.122 -1.613 0.402 385 HD21 LEU 54 HD21 LEU 54 0.346 -1.418 1.808 386 HD22 LEU 54 HD22 LEU 54 -1.184 -0.547 1.702 387 HD23 LEU 54 HD23 LEU 54 -0.153 -0.697 0.281 388 H GLU 55 HN GLU 55 -1.977 -6.381 0.039 389 HA GLU 55 HA GLU 55 0.413 -7.596 1.216 390 HB2 GLU 55 HB2 GLU 55 -1.392 -8.668 -0.959 391 HB3 GLU 55 HB1 GLU 55 -0.068 -9.533 -0.191 392 HG2 GLU 55 HG2 GLU 55 -1.358 -9.189 1.998 393 HG3 GLU 55 HG1 GLU 55 -2.715 -8.748 0.966 394 H TRP 56 HN TRP 56 2.335 -7.611 0.211 395 HA TRP 56 HA TRP 56 2.407 -6.563 -2.522 396 HB2 TRP 56 HB2 TRP 56 4.617 -5.430 -1.783 397 HB3 TRP 56 HB1 TRP 56 3.085 -4.664 -1.393 398 HD1 TRP 56 HD1 TRP 56 5.104 -7.381 0.529 399 HE1 TRP 56 HE1 TRP 56 5.432 -6.538 2.938 400 HE3 TRP 56 HE3 TRP 56 2.789 -2.851 0.128 401 HZ2 TRP 56 HZ2 TRP 56 4.795 -4.265 4.464 402 HZ3 TRP 56 HZ3 TRP 56 2.696 -1.403 2.108 403 HH2 TRP 56 HH2 TRP 56 3.675 -2.095 4.233 404 H TYR 57 HN TYR 57 3.833 -7.418 -3.883 405 HA TYR 57 HA TYR 57 5.508 -9.618 -2.857 406 HB2 TYR 57 HB2 TYR 57 4.150 -9.399 -5.559 407 HB3 TYR 57 HB1 TYR 57 5.244 -10.695 -5.076 408 HD1 TYR 57 HD1 TYR 57 1.902 -9.246 -4.620 409 HD2 TYR 57 HD2 TYR 57 4.493 -12.470 -3.610 410 HE1 TYR 57 HE1 TYR 57 -0.011 -10.495 -3.718 411 HE2 TYR 57 HE2 TYR 57 2.580 -13.728 -2.709 412 HH TYR 57 HH TYR 57 -0.564 -13.000 -3.341 413 H LYS 58 HN LYS 58 7.577 -9.661 -3.482 414 HA LYS 58 HA LYS 58 9.172 -7.660 -4.112 415 HB2 LYS 58 HB2 LYS 58 10.668 -9.278 -5.331 416 HB3 LYS 58 HB1 LYS 58 10.122 -9.809 -3.746 417 HG2 LYS 58 HG2 LYS 58 8.562 -10.648 -6.139 418 HG3 LYS 58 HG1 LYS 58 10.110 -11.431 -5.817 419 HD2 LYS 58 HD2 LYS 58 9.375 -12.225 -3.710 420 HD3 LYS 58 HD1 LYS 58 7.951 -11.187 -3.733 421 HE2 LYS 58 HE2 LYS 58 7.462 -13.566 -4.221 422 HE3 LYS 58 HE1 LYS 58 6.967 -12.458 -5.503 423 HZ1 LYS 58 HZ1 LYS 58 8.105 -14.505 -6.292 424 HZ2 LYS 58 HZ2 LYS 58 9.525 -13.985 -5.522 425 HZ3 LYS 58 HZ3 LYS 58 8.858 -13.078 -6.788 426 H GLY 59 HN GLY 59 9.055 -6.088 -5.527 427 HA2 GLY 59 HA2 GLY 59 7.753 -6.582 -8.115 428 HA3 GLY 59 HA1 GLY 59 7.929 -5.012 -7.339 429 H LYS 60 HN LYS 60 10.720 -6.638 -6.930 430 HA LYS 60 HA LYS 60 12.124 -5.117 -8.932 431 HB2 LYS 60 HB2 LYS 60 13.171 -7.261 -7.072 432 HB3 LYS 60 HB1 LYS 60 14.128 -6.083 -7.951 433 HG2 LYS 60 HG2 LYS 60 13.479 -4.334 -6.561 434 HG3 LYS 60 HG1 LYS 60 12.089 -5.224 -5.934 435 HD2 LYS 60 HD2 LYS 60 14.940 -6.072 -5.475 436 HD3 LYS 60 HD1 LYS 60 14.054 -5.025 -4.366 437 HE2 LYS 60 HE2 LYS 60 12.506 -6.715 -3.835 438 HE3 LYS 60 HE1 LYS 60 12.981 -7.699 -5.217 439 HZ1 LYS 60 HZ1 LYS 60 13.843 -8.558 -3.111 440 HZ2 LYS 60 HZ2 LYS 60 14.719 -7.129 -2.871 441 HZ3 LYS 60 HZ3 LYS 60 15.088 -8.146 -4.177 442 H ASN 61 HN ASN 61 13.217 -5.979 -10.699 443 HA ASN 61 HA ASN 61 12.430 -8.651 -11.553 444 HB2 ASN 61 HB2 ASN 61 12.463 -6.667 -13.125 445 HB3 ASN 61 HB1 ASN 61 14.215 -6.666 -12.982 446 HD21 ASN 61 HD21 ASN 61 12.193 -9.546 -13.112 447 HD22 ASN 61 HD22 ASN 61 12.776 -10.095 -14.643 448 H ASP 62 HN ASP 62 14.014 -8.390 -9.237 449 HA ASP 62 HA ASP 62 16.558 -9.596 -10.067 450 HB2 ASP 62 HB2 ASP 62 16.164 -7.578 -7.841 451 HB3 ASP 62 HB1 ASP 62 17.671 -8.414 -8.200 452 H SER 63 HN SER 63 17.382 -9.863 -7.284 453 HA SER 63 HA SER 63 16.207 -12.396 -6.793 454 HB2 SER 63 HB2 SER 63 17.664 -12.181 -4.660 455 HB3 SER 63 HB1 SER 63 18.469 -12.220 -6.228 456 HG SER 63 HG SER 63 18.074 -10.067 -4.470 457 H ASP 64 HN ASP 64 14.897 -13.102 -5.134 458 HA ASP 64 HA ASP 64 13.824 -11.124 -3.266 459 HB2 ASP 64 HB2 ASP 64 11.636 -12.393 -3.399 460 HB3 ASP 64 HB1 ASP 64 12.029 -11.414 -4.801 461 H GLY 65 HN GLY 65 14.813 -11.713 -1.474 462 HA2 GLY 65 HA2 GLY 65 15.900 -14.225 -0.935 463 HA3 GLY 65 HA1 GLY 65 15.620 -12.970 0.257 464 H LYS 66 HN LYS 66 12.729 -12.934 -0.139 465 HA LYS 66 HA LYS 66 12.094 -15.105 1.647 466 HB2 LYS 66 HB2 LYS 66 9.989 -13.440 0.330 467 HB3 LYS 66 HB1 LYS 66 10.014 -14.113 1.947 468 HG2 LYS 66 HG2 LYS 66 11.929 -11.973 1.196 469 HG3 LYS 66 HG1 LYS 66 10.257 -11.577 1.564 470 HD2 LYS 66 HD2 LYS 66 11.440 -11.315 3.599 471 HD3 LYS 66 HD1 LYS 66 10.578 -12.845 3.737 472 HE2 LYS 66 HE2 LYS 66 12.605 -14.065 3.205 473 HE3 LYS 66 HE1 LYS 66 13.478 -12.553 2.968 474 HZ1 LYS 66 HZ1 LYS 66 13.924 -13.493 5.142 475 HZ2 LYS 66 HZ2 LYS 66 12.278 -13.477 5.521 476 HZ3 LYS 66 HZ3 LYS 66 13.108 -12.022 5.297 477 H LYS 67 HN LYS 67 11.913 -14.491 -1.761 478 HA LYS 67 HA LYS 67 10.735 -15.346 -3.492 479 HB2 LYS 67 HB2 LYS 67 10.713 -17.815 -1.752 480 HB3 LYS 67 HB1 LYS 67 10.232 -17.781 -3.443 481 HG2 LYS 67 HG2 LYS 67 12.961 -17.157 -2.347 482 HG3 LYS 67 HG1 LYS 67 12.489 -18.608 -3.234 483 HD2 LYS 67 HD2 LYS 67 11.952 -17.196 -5.185 484 HD3 LYS 67 HD1 LYS 67 12.502 -15.775 -4.289 485 HE2 LYS 67 HE2 LYS 67 14.155 -18.169 -5.090 486 HE3 LYS 67 HE1 LYS 67 14.253 -16.542 -5.766 487 HZ1 LYS 67 HZ1 LYS 67 14.908 -15.744 -3.553 488 HZ2 LYS 67 HZ2 LYS 67 16.007 -16.860 -4.188 489 HZ3 LYS 67 HZ3 LYS 67 14.918 -17.340 -2.989 490 H LYS 68 HN LYS 68 9.383 -14.202 -1.022 491 HA LYS 68 HA LYS 68 6.632 -14.952 -1.667 492 HB2 LYS 68 HB2 LYS 68 7.950 -15.224 1.041 493 HB3 LYS 68 HB1 LYS 68 6.214 -15.080 0.870 494 HG2 LYS 68 HG2 LYS 68 7.928 -17.273 -0.270 495 HG3 LYS 68 HG1 LYS 68 6.873 -17.394 1.139 496 HD2 LYS 68 HD2 LYS 68 4.969 -16.744 -0.403 497 HD3 LYS 68 HD1 LYS 68 6.090 -17.000 -1.740 498 HE2 LYS 68 HE2 LYS 68 5.291 -19.048 0.323 499 HE3 LYS 68 HE1 LYS 68 4.715 -18.978 -1.340 500 HZ1 LYS 68 HZ1 LYS 68 6.495 -20.605 -1.016 501 HZ2 LYS 68 HZ2 LYS 68 7.549 -19.367 -0.548 502 HZ3 LYS 68 HZ3 LYS 68 6.931 -19.403 -2.121 503 HA PRO 69 HA PRO 69 5.628 -10.642 -0.607 504 HB2 PRO 69 HB2 PRO 69 4.370 -11.589 1.935 505 HB3 PRO 69 HB1 PRO 69 3.758 -10.442 0.736 506 HG2 PRO 69 HG2 PRO 69 2.824 -12.928 0.824 507 HG3 PRO 69 HG1 PRO 69 3.098 -12.112 -0.726 508 HD2 PRO 69 HD2 PRO 69 4.668 -14.259 0.590 509 HD3 PRO 69 HD1 PRO 69 4.414 -13.942 -1.134 510 H ILE 70 HN ILE 70 6.684 -9.050 0.457 511 HA ILE 70 HA ILE 70 8.917 -9.884 2.045 512 HB ILE 70 HB ILE 70 9.596 -7.481 1.997 513 HG12 ILE 70 HG12 ILE 70 7.297 -7.194 0.063 514 HG13 ILE 70 HG11 ILE 70 7.286 -6.556 1.707 515 HG21 ILE 70 HG21 ILE 70 10.423 -9.118 0.390 516 HG22 ILE 70 HG22 ILE 70 10.216 -7.542 -0.372 517 HG23 ILE 70 HG23 ILE 70 9.030 -8.816 -0.651 518 HD11 ILE 70 HD11 ILE 70 9.192 -5.138 1.171 519 HD12 ILE 70 HD12 ILE 70 7.834 -4.835 0.084 520 HD13 ILE 70 HD13 ILE 70 9.214 -5.782 -0.471 521 H GLY 71 HN GLY 71 5.950 -9.636 3.030 522 HA2 GLY 71 HA2 GLY 71 5.446 -9.727 5.377 523 HA3 GLY 71 HA1 GLY 71 6.720 -8.550 5.655 524 H SER 72 HN SER 72 3.682 -8.930 3.941 525 HA SER 72 HA SER 72 2.963 -6.246 3.670 526 HB2 SER 72 HB2 SER 72 1.084 -8.588 3.994 527 HB3 SER 72 HB1 SER 72 0.803 -7.101 3.088 528 HG SER 72 HG SER 72 1.778 -9.340 2.164 529 H PHE 73 HN PHE 73 0.869 -5.351 4.703 530 HA PHE 73 HA PHE 73 0.652 -6.038 7.542 531 HB2 PHE 73 HB2 PHE 73 0.995 -3.839 8.319 532 HB3 PHE 73 HB1 PHE 73 2.255 -4.055 7.111 533 HD1 PHE 73 HD1 PHE 73 1.890 -3.065 4.809 534 HD2 PHE 73 HD2 PHE 73 -0.570 -2.138 8.145 535 HE1 PHE 73 HE1 PHE 73 1.106 -1.035 3.662 536 HE2 PHE 73 HE2 PHE 73 -1.364 -0.118 7.009 537 HZ PHE 73 HZ PHE 73 -0.528 0.444 4.761 538 HA PRO 74 HA PRO 74 -3.648 -5.402 6.673 539 HB2 PRO 74 HB2 PRO 74 -4.417 -4.846 9.332 540 HB3 PRO 74 HB1 PRO 74 -4.421 -6.408 8.521 541 HG2 PRO 74 HG2 PRO 74 -2.748 -5.632 10.639 542 HG3 PRO 74 HG1 PRO 74 -2.592 -7.085 9.643 543 HD2 PRO 74 HD2 PRO 74 -1.084 -4.541 9.524 544 HD3 PRO 74 HD1 PRO 74 -0.603 -6.174 9.022 545 H LEU 75 HN LEU 75 -4.909 -3.773 6.032 546 HA LEU 75 HA LEU 75 -3.899 -1.130 6.170 547 HB2 LEU 75 HB2 LEU 75 -6.482 -2.251 5.109 548 HB3 LEU 75 HB1 LEU 75 -6.023 -0.568 4.947 549 HG LEU 75 HG LEU 75 -4.390 -2.858 3.856 550 HD11 LEU 75 HD11 LEU 75 -6.354 -1.060 2.444 551 HD12 LEU 75 HD12 LEU 75 -6.547 -2.789 2.737 552 HD13 LEU 75 HD13 LEU 75 -5.270 -2.214 1.664 553 HD21 LEU 75 HD21 LEU 75 -4.262 0.132 3.553 554 HD22 LEU 75 HD22 LEU 75 -3.406 -0.987 2.499 555 HD23 LEU 75 HD23 LEU 75 -3.032 -0.941 4.222 556 H ASN 76 HN ASN 76 -6.143 -2.855 8.132 557 HA ASN 76 HA ASN 76 -7.466 -0.525 9.150 558 HB2 ASN 76 HB2 ASN 76 -8.373 -2.080 10.888 559 HB3 ASN 76 HB1 ASN 76 -8.700 -2.567 9.233 560 HD21 ASN 76 HD21 ASN 76 -5.618 -3.041 10.917 561 HD22 ASN 76 HD22 ASN 76 -5.721 -4.768 10.960 562 H LYS 77 HN LYS 77 -4.386 -1.655 9.555 563 HA LYS 77 HA LYS 77 -4.150 -0.890 12.357 564 HB2 LYS 77 HB2 LYS 77 -2.183 -2.012 10.369 565 HB3 LYS 77 HB1 LYS 77 -1.695 -1.456 11.965 566 HG2 LYS 77 HG2 LYS 77 -3.673 -3.656 11.396 567 HG3 LYS 77 HG1 LYS 77 -1.993 -3.871 11.900 568 HD2 LYS 77 HD2 LYS 77 -2.566 -2.511 13.949 569 HD3 LYS 77 HD1 LYS 77 -4.257 -2.650 13.464 570 HE2 LYS 77 HE2 LYS 77 -4.143 -5.056 13.609 571 HE3 LYS 77 HE1 LYS 77 -2.417 -4.985 13.963 572 HZ1 LYS 77 HZ1 LYS 77 -2.908 -3.842 16.020 573 HZ2 LYS 77 HZ2 LYS 77 -3.748 -5.308 15.962 574 HZ3 LYS 77 HZ3 LYS 77 -4.564 -3.855 15.675 575 H ILE 78 HN ILE 78 -3.914 0.582 9.311 576 HA ILE 78 HA ILE 78 -1.762 2.328 9.588 577 HB ILE 78 HB ILE 78 -4.372 2.894 8.168 578 HG12 ILE 78 HG12 ILE 78 -1.806 1.726 7.073 579 HG13 ILE 78 HG11 ILE 78 -3.239 0.780 7.470 580 HG21 ILE 78 HG21 ILE 78 -3.006 4.413 6.783 581 HG22 ILE 78 HG22 ILE 78 -1.626 4.104 7.840 582 HG23 ILE 78 HG23 ILE 78 -3.063 4.909 8.475 583 HD11 ILE 78 HD11 ILE 78 -3.127 2.974 5.417 584 HD12 ILE 78 HD12 ILE 78 -4.511 1.940 5.779 585 HD13 ILE 78 HD13 ILE 78 -3.051 1.246 5.078 586 H THR 79 HN THR 79 -1.453 4.277 10.564 587 HA THR 79 HA THR 79 -3.649 5.252 12.255 588 HB THR 79 HB THR 79 -1.900 6.362 13.611 589 HG1 THR 79 HG1 THR 79 0.075 6.471 12.872 590 HG21 THR 79 HG21 THR 79 -1.448 3.406 13.190 591 HG22 THR 79 HG22 THR 79 -2.665 4.129 14.244 592 HG23 THR 79 HG23 THR 79 -0.950 4.327 14.609 593 H SER 80 HN SER 80 -1.275 6.139 9.833 594 HA SER 80 HA SER 80 -2.848 8.429 9.080 595 HB2 SER 80 HB2 SER 80 -1.493 9.315 10.971 596 HB3 SER 80 HB1 SER 80 -0.032 8.893 10.080 597 HG SER 80 HG SER 80 -0.320 10.929 9.487 598 H ILE 81 HN ILE 81 -2.922 8.130 6.940 599 HA ILE 81 HA ILE 81 -0.440 7.520 5.495 600 HB ILE 81 HB ILE 81 -2.158 6.057 4.769 601 HG12 ILE 81 HG12 ILE 81 -2.012 8.310 2.748 602 HG13 ILE 81 HG11 ILE 81 -0.852 6.995 2.898 603 HG21 ILE 81 HG21 ILE 81 -4.090 7.131 5.677 604 HG22 ILE 81 HG22 ILE 81 -4.364 6.842 3.960 605 HG23 ILE 81 HG23 ILE 81 -3.953 8.461 4.528 606 HD11 ILE 81 HD11 ILE 81 -2.321 6.574 1.052 607 HD12 ILE 81 HD12 ILE 81 -3.737 6.748 2.090 608 HD13 ILE 81 HD13 ILE 81 -2.629 5.398 2.329 609 H ARG 82 HN ARG 82 0.691 9.261 4.982 610 HA ARG 82 HA ARG 82 -0.685 11.513 3.738 611 HB2 ARG 82 HB2 ARG 82 0.866 13.067 5.081 612 HB3 ARG 82 HB1 ARG 82 -0.555 12.409 5.884 613 HG2 ARG 82 HG2 ARG 82 1.183 12.246 7.442 614 HG3 ARG 82 HG1 ARG 82 0.982 10.613 6.806 615 HD2 ARG 82 HD2 ARG 82 3.334 11.165 6.965 616 HD3 ARG 82 HD1 ARG 82 2.855 10.995 5.275 617 HE ARG 82 HE ARG 82 2.749 13.490 5.239 618 HH11 ARG 82 HH11 ARG 82 4.811 11.829 7.541 619 HH12 ARG 82 HH12 ARG 82 5.872 13.183 7.738 620 HH21 ARG 82 HH21 ARG 82 4.163 15.242 5.480 621 HH22 ARG 82 HH22 ARG 82 5.523 15.114 6.554 622 H THR 83 HN THR 83 0.878 13.057 2.734 623 HA THR 83 HA THR 83 2.738 11.489 1.164 624 HB THR 83 HB THR 83 2.123 14.428 0.887 625 HG1 THR 83 HG1 THR 83 0.156 13.516 0.622 626 HG21 THR 83 HG21 THR 83 4.092 13.626 -0.326 627 HG22 THR 83 HG22 THR 83 2.794 14.046 -1.445 628 HG23 THR 83 HG23 THR 83 3.122 12.353 -1.070 629 H LYS 84 HN LYS 84 4.944 11.785 1.084 630 HA LYS 84 HA LYS 84 6.226 12.903 3.326 631 HB2 LYS 84 HB2 LYS 84 7.235 11.121 1.971 632 HB3 LYS 84 HB1 LYS 84 7.379 12.243 0.624 633 HG2 LYS 84 HG2 LYS 84 9.472 12.373 1.479 634 HG3 LYS 84 HG1 LYS 84 8.704 13.678 2.367 635 HD2 LYS 84 HD2 LYS 84 9.049 10.869 3.409 636 HD3 LYS 84 HD1 LYS 84 10.128 12.215 3.779 637 HE2 LYS 84 HE2 LYS 84 7.988 13.419 4.554 638 HE3 LYS 84 HE1 LYS 84 7.273 11.808 4.570 639 HZ1 LYS 84 HZ1 LYS 84 8.190 12.497 6.741 640 HZ2 LYS 84 HZ2 LYS 84 9.734 12.546 6.060 641 HZ3 LYS 84 HZ3 LYS 84 8.895 11.075 6.155 642 H VAL 85 HN VAL 85 6.960 14.853 3.708 643 HA VAL 85 HA VAL 85 5.779 16.967 2.210 644 HB VAL 85 HB VAL 85 5.872 16.934 4.670 645 HG11 VAL 85 HG11 VAL 85 8.110 15.956 4.895 646 HG12 VAL 85 HG12 VAL 85 7.943 17.436 5.844 647 HG13 VAL 85 HG13 VAL 85 8.824 17.461 4.313 648 HG21 VAL 85 HG21 VAL 85 5.559 19.059 3.499 649 HG22 VAL 85 HG22 VAL 85 7.306 19.294 3.449 650 HG23 VAL 85 HG23 VAL 85 6.463 19.281 4.997 651 H ASP 86 HN ASP 86 9.029 15.670 2.473 652 HA ASP 86 HA ASP 86 10.102 17.974 1.021 653 HB2 ASP 86 HB2 ASP 86 12.263 17.283 1.683 654 HB3 ASP 86 HB1 ASP 86 11.247 17.036 3.094 655 H ASN 87 HN ASN 87 9.144 14.738 0.591 656 HA ASN 87 HA ASN 87 10.074 14.820 -2.192 657 HB2 ASN 87 HB2 ASN 87 11.474 13.247 -0.784 658 HB3 ASN 87 HB1 ASN 87 10.014 12.307 -0.501 659 HD21 ASN 87 HD21 ASN 87 12.388 11.380 -1.727 660 HD22 ASN 87 HD22 ASN 87 11.995 10.921 -3.347 661 H LEU 88 HN LEU 88 8.065 15.418 -2.923 662 HA LEU 88 HA LEU 88 5.651 14.350 -1.918 663 HB2 LEU 88 HB2 LEU 88 6.326 15.935 -4.391 664 HB3 LEU 88 HB1 LEU 88 4.685 15.443 -4.025 665 HG LEU 88 HG LEU 88 6.373 17.123 -2.167 666 HD11 LEU 88 HD11 LEU 88 6.039 18.314 -4.268 667 HD12 LEU 88 HD12 LEU 88 5.080 19.035 -2.977 668 HD13 LEU 88 HD13 LEU 88 4.305 18.004 -4.180 669 HD21 LEU 88 HD21 LEU 88 3.412 16.554 -2.275 670 HD22 LEU 88 HD22 LEU 88 4.206 17.653 -1.148 671 HD23 LEU 88 HD23 LEU 88 4.551 15.925 -1.083 672 H LYS 89 HN LYS 89 7.921 13.048 -4.060 673 HA LYS 89 HA LYS 89 6.037 11.418 -5.537 674 HB2 LYS 89 HB2 LYS 89 9.054 11.287 -5.338 675 HB3 LYS 89 HB1 LYS 89 8.085 10.244 -6.365 676 HG2 LYS 89 HG2 LYS 89 8.840 11.872 -7.820 677 HG3 LYS 89 HG1 LYS 89 7.218 12.427 -7.407 678 HD2 LYS 89 HD2 LYS 89 8.138 13.997 -5.799 679 HD3 LYS 89 HD1 LYS 89 9.768 13.403 -6.124 680 HE2 LYS 89 HE2 LYS 89 9.531 14.117 -8.467 681 HE3 LYS 89 HE1 LYS 89 7.935 14.763 -8.092 682 HZ1 LYS 89 HZ1 LYS 89 8.958 16.295 -6.533 683 HZ2 LYS 89 HZ2 LYS 89 9.624 16.490 -8.076 684 HZ3 LYS 89 HZ3 LYS 89 10.491 15.667 -6.880 685 H SER 90 HN SER 90 7.397 11.441 -2.497 686 HA SER 90 HA SER 90 7.058 8.548 -2.167 687 HB2 SER 90 HB2 SER 90 9.283 9.655 -1.558 688 HB3 SER 90 HB1 SER 90 8.414 10.418 -0.229 689 HG SER 90 HG SER 90 8.663 7.624 -0.684 690 H LEU 91 HN LEU 91 6.067 7.862 -0.174 691 HA LEU 91 HA LEU 91 4.090 9.729 0.924 692 HB2 LEU 91 HB2 LEU 91 3.125 8.403 -0.966 693 HB3 LEU 91 HB1 LEU 91 3.504 6.943 -0.079 694 HG LEU 91 HG LEU 91 2.019 8.152 1.774 695 HD11 LEU 91 HD11 LEU 91 0.875 9.141 -0.831 696 HD12 LEU 91 HD12 LEU 91 1.659 10.144 0.387 697 HD13 LEU 91 HD13 LEU 91 0.151 9.313 0.767 698 HD21 LEU 91 HD21 LEU 91 1.029 6.574 -0.592 699 HD22 LEU 91 HD22 LEU 91 0.116 6.840 0.894 700 HD23 LEU 91 HD23 LEU 91 1.633 5.935 0.941 701 H GLU 92 HN GLU 92 4.242 9.647 3.085 702 HA GLU 92 HA GLU 92 5.583 7.328 4.275 703 HB2 GLU 92 HB2 GLU 92 6.523 9.585 4.717 704 HB3 GLU 92 HB1 GLU 92 5.017 10.032 5.505 705 HG2 GLU 92 HG2 GLU 92 5.372 8.274 7.167 706 HG3 GLU 92 HG1 GLU 92 6.890 7.846 6.380 707 H ILE 93 HN ILE 93 4.286 5.815 5.063 708 HA ILE 93 HA ILE 93 1.680 6.672 6.121 709 HB ILE 93 HB ILE 93 2.503 4.078 4.840 710 HG12 ILE 93 HG12 ILE 93 0.390 6.139 4.194 711 HG13 ILE 93 HG11 ILE 93 1.904 5.908 3.327 712 HG21 ILE 93 HG21 ILE 93 -0.070 4.712 6.287 713 HG22 ILE 93 HG22 ILE 93 1.148 3.532 6.781 714 HG23 ILE 93 HG23 ILE 93 0.219 3.276 5.301 715 HD11 ILE 93 HD11 ILE 93 -0.193 3.782 3.558 716 HD12 ILE 93 HD12 ILE 93 1.199 3.835 2.474 717 HD13 ILE 93 HD13 ILE 93 -0.138 4.967 2.255 718 H SER 94 HN SER 94 1.611 6.741 8.188 719 HA SER 94 HA SER 94 3.302 5.026 9.817 720 HB2 SER 94 HB2 SER 94 1.327 7.157 10.683 721 HB3 SER 94 HB1 SER 94 2.607 6.434 11.660 722 HG SER 94 HG SER 94 3.585 7.454 9.353 723 H VAL 95 HN VAL 95 2.567 3.275 10.838 724 HA VAL 95 HA VAL 95 -0.314 2.800 10.977 725 HB VAL 95 HB VAL 95 0.019 1.678 8.973 726 HG11 VAL 95 HG11 VAL 95 2.332 2.002 8.639 727 HG12 VAL 95 HG12 VAL 95 2.023 0.269 8.486 728 HG13 VAL 95 HG13 VAL 95 2.749 0.909 9.964 729 HG21 VAL 95 HG21 VAL 95 -0.919 0.087 10.541 730 HG22 VAL 95 HG22 VAL 95 0.699 -0.421 11.023 731 HG23 VAL 95 HG23 VAL 95 0.129 -0.735 9.385 732 H SER 96 HN SER 96 -0.907 1.185 12.539 733 HA SER 96 HA SER 96 0.770 1.100 14.821 734 HB2 SER 96 HB2 SER 96 -1.702 0.992 14.960 735 HB3 SER 96 HB1 SER 96 -1.669 -0.577 14.156 736 HG SER 96 HG SER 96 -1.677 -0.303 16.653 737 H SER 97 HN SER 97 2.583 -0.015 14.840 738 HA SER 97 HA SER 97 2.791 -2.359 13.091 739 HB2 SER 97 HB2 SER 97 5.137 -1.401 12.589 740 HB3 SER 97 HB1 SER 97 3.747 -0.635 11.824 741 HG SER 97 HG SER 97 3.802 0.934 13.516 742 H VAL 98 HN VAL 98 4.428 -3.818 13.545 743 HA VAL 98 HA VAL 98 5.378 -3.851 16.321 744 HB VAL 98 HB VAL 98 5.937 -6.253 15.838 745 HG11 VAL 98 HG11 VAL 98 3.865 -5.698 16.969 746 HG12 VAL 98 HG12 VAL 98 3.615 -7.067 15.886 747 HG13 VAL 98 HG13 VAL 98 3.058 -5.459 15.421 748 HG21 VAL 98 HG21 VAL 98 4.408 -5.761 13.279 749 HG22 VAL 98 HG22 VAL 98 4.993 -7.322 13.856 750 HG23 VAL 98 HG23 VAL 98 6.142 -6.064 13.399 751 H HIS 99 HN HIS 99 7.697 -5.388 16.010 752 HA HIS 99 HA HIS 99 9.631 -3.537 15.610 753 HB2 HIS 99 HB2 HIS 99 10.082 -5.770 16.510 754 HB3 HIS 99 HB1 HIS 99 9.891 -6.466 14.906 755 HD1 HIS 99 HD1 HIS 99 11.969 -6.694 13.569 756 HD2 HIS 99 HD2 HIS 99 12.392 -3.921 16.634 757 HE1 HIS 99 HE1 HIS 99 14.388 -6.014 13.533 758 HE2 HIS 99 HE2 HIS 99 14.648 -4.441 15.483 759 H ILE 100 HN ILE 100 9.436 -2.145 13.964 760 HA ILE 100 HA ILE 100 10.701 -2.498 11.554 761 HB ILE 100 HB ILE 100 8.688 -4.018 11.076 762 HG12 ILE 100 HG12 ILE 100 9.142 -1.643 9.254 763 HG13 ILE 100 HG11 ILE 100 10.132 -3.097 9.308 764 HG21 ILE 100 HG21 ILE 100 6.942 -2.684 12.098 765 HG22 ILE 100 HG22 ILE 100 6.612 -2.887 10.378 766 HG23 ILE 100 HG23 ILE 100 7.263 -1.361 10.975 767 HD11 ILE 100 HD11 ILE 100 8.218 -4.421 8.564 768 HD12 ILE 100 HD12 ILE 100 8.616 -3.141 7.419 769 HD13 ILE 100 HD13 ILE 100 7.236 -2.958 8.501 770 H SER 101 HN SER 101 10.561 -0.554 10.264 771 HA SER 101 HA SER 101 9.764 1.740 11.822 772 HB2 SER 101 HB2 SER 101 11.195 1.579 9.184 773 HB3 SER 101 HB1 SER 101 10.953 3.049 10.120 774 HG SER 101 HG SER 101 12.010 1.528 11.838 775 H THR 102 HN THR 102 8.874 3.633 10.452 776 HA THR 102 HA THR 102 6.250 3.035 9.661 777 HB THR 102 HB THR 102 8.010 5.449 9.142 778 HG1 THR 102 HG1 THR 102 6.724 4.517 11.311 779 HG21 THR 102 HG21 THR 102 5.023 5.193 8.806 780 HG22 THR 102 HG22 THR 102 6.202 5.462 7.521 781 HG23 THR 102 HG23 THR 102 5.931 6.703 8.744 782 H TYR 103 HN TYR 103 5.303 2.974 7.585 783 HA TYR 103 HA TYR 103 7.089 1.752 5.653 784 HB2 TYR 103 HB2 TYR 103 5.259 0.384 5.899 785 HB3 TYR 103 HB1 TYR 103 4.165 1.719 6.215 786 HD1 TYR 103 HD1 TYR 103 2.513 2.013 4.681 787 HD2 TYR 103 HD2 TYR 103 6.254 0.496 3.323 788 HE1 TYR 103 HE1 TYR 103 1.610 1.849 2.403 789 HE2 TYR 103 HE2 TYR 103 5.348 0.341 1.036 790 HH TYR 103 HH TYR 103 3.126 0.124 -0.054 791 H LEU 104 HN LEU 104 7.917 2.834 4.058 792 HA LEU 104 HA LEU 104 6.610 5.297 3.187 793 HB2 LEU 104 HB2 LEU 104 9.405 4.445 3.481 794 HB3 LEU 104 HB1 LEU 104 9.087 5.377 2.024 795 HG LEU 104 HG LEU 104 8.184 6.326 4.740 796 HD11 LEU 104 HD11 LEU 104 10.591 5.954 4.874 797 HD12 LEU 104 HD12 LEU 104 10.219 7.678 4.845 798 HD13 LEU 104 HD13 LEU 104 10.828 6.881 3.393 799 HD21 LEU 104 HD21 LEU 104 8.789 7.759 2.156 800 HD22 LEU 104 HD22 LEU 104 8.230 8.510 3.652 801 HD23 LEU 104 HD23 LEU 104 7.183 7.386 2.783 802 H PHE 105 HN PHE 105 5.423 5.148 1.536 803 HA PHE 105 HA PHE 105 5.872 3.152 -0.548 804 HB2 PHE 105 HB2 PHE 105 3.609 3.256 0.178 805 HB3 PHE 105 HB1 PHE 105 3.611 5.010 0.195 806 HD1 PHE 105 HD1 PHE 105 3.516 6.255 -1.950 807 HD2 PHE 105 HD2 PHE 105 3.004 2.038 -1.759 808 HE1 PHE 105 HE1 PHE 105 2.447 6.293 -4.149 809 HE2 PHE 105 HE2 PHE 105 1.936 2.075 -3.977 810 HZ PHE 105 HZ PHE 105 1.646 4.212 -5.173 811 H THR 106 HN THR 106 7.198 3.777 -2.182 812 HA THR 106 HA THR 106 7.298 6.661 -2.753 813 HB THR 106 HB THR 106 9.621 4.747 -2.852 814 HG1 THR 106 HG1 THR 106 8.908 5.171 -0.712 815 HG21 THR 106 HG21 THR 106 9.771 6.664 -4.411 816 HG22 THR 106 HG22 THR 106 10.979 6.738 -3.131 817 HG23 THR 106 HG23 THR 106 9.546 7.762 -3.048 818 H PHE 107 HN PHE 107 6.850 7.231 -4.725 819 HA PHE 107 HA PHE 107 7.190 5.271 -6.892 820 HB2 PHE 107 HB2 PHE 107 4.959 6.884 -6.180 821 HB3 PHE 107 HB1 PHE 107 5.593 7.498 -7.702 822 HD1 PHE 107 HD1 PHE 107 3.201 5.451 -6.455 823 HD2 PHE 107 HD2 PHE 107 6.384 5.358 -9.272 824 HE1 PHE 107 HE1 PHE 107 2.081 3.620 -7.643 825 HE2 PHE 107 HE2 PHE 107 5.266 3.526 -10.472 826 HZ PHE 107 HZ PHE 107 3.109 2.683 -9.696 827 H LYS 108 HN LYS 108 7.317 6.665 -9.063 828 HA LYS 108 HA LYS 108 9.698 8.259 -8.722 829 HB2 LYS 108 HB2 LYS 108 9.628 8.214 -11.312 830 HB3 LYS 108 HB1 LYS 108 10.069 6.759 -10.433 831 HG2 LYS 108 HG2 LYS 108 8.656 6.063 -12.147 832 HG3 LYS 108 HG1 LYS 108 7.633 6.077 -10.715 833 HD2 LYS 108 HD2 LYS 108 6.614 8.125 -11.367 834 HD3 LYS 108 HD1 LYS 108 7.798 8.367 -12.654 835 HE2 LYS 108 HE2 LYS 108 6.970 6.330 -13.744 836 HE3 LYS 108 HE1 LYS 108 5.728 6.195 -12.504 837 HZ1 LYS 108 HZ1 LYS 108 4.858 7.243 -14.493 838 HZ2 LYS 108 HZ2 LYS 108 6.037 8.448 -14.417 839 HZ3 LYS 108 HZ3 LYS 108 4.854 8.349 -13.213 840 H THR 109 HN THR 109 6.351 8.741 -9.240 841 HA THR 109 HA THR 109 6.879 11.606 -9.625 842 HB THR 109 HB THR 109 4.798 11.699 -11.042 843 HG1 THR 109 HG1 THR 109 3.918 9.827 -11.779 844 HG21 THR 109 HG21 THR 109 6.945 11.843 -12.108 845 HG22 THR 109 HG22 THR 109 5.916 10.783 -13.074 846 HG23 THR 109 HG23 THR 109 7.152 10.093 -12.019 847 H ARG 110 HN ARG 110 5.318 13.016 -8.695 848 HA ARG 110 HA ARG 110 4.068 12.129 -6.328 849 HB2 ARG 110 HB2 ARG 110 4.603 14.464 -6.494 850 HB3 ARG 110 HB1 ARG 110 3.660 14.636 -7.973 851 HG2 ARG 110 HG2 ARG 110 1.714 13.803 -6.375 852 HG3 ARG 110 HG1 ARG 110 2.770 14.504 -5.150 853 HD2 ARG 110 HD2 ARG 110 2.725 16.641 -6.277 854 HD3 ARG 110 HD1 ARG 110 1.790 15.952 -7.606 855 HE ARG 110 HE ARG 110 0.798 16.327 -4.852 856 HH11 ARG 110 HH11 ARG 110 0.215 16.088 -8.308 857 HH12 ARG 110 HH12 ARG 110 -1.503 16.285 -8.151 858 HH21 ARG 110 HH21 ARG 110 -1.472 16.565 -4.661 859 HH22 ARG 110 HH22 ARG 110 -2.455 16.536 -6.089 860 H GLU 111 HN GLU 111 2.916 12.644 -9.608 861 HA GLU 111 HA GLU 111 0.176 12.508 -9.176 862 HB2 GLU 111 HB2 GLU 111 1.741 11.562 -11.580 863 HB3 GLU 111 HB1 GLU 111 0.013 11.870 -11.554 864 HG2 GLU 111 HG2 GLU 111 0.471 14.226 -10.998 865 HG3 GLU 111 HG1 GLU 111 2.196 13.894 -11.134 866 H GLU 112 HN GLU 112 2.490 9.885 -9.736 867 HA GLU 112 HA GLU 112 0.609 7.805 -9.929 868 HB2 GLU 112 HB2 GLU 112 3.536 7.932 -9.320 869 HB3 GLU 112 HB1 GLU 112 2.672 6.413 -9.089 870 HG2 GLU 112 HG2 GLU 112 2.976 7.978 -11.632 871 HG3 GLU 112 HG1 GLU 112 3.688 6.415 -11.243 872 H ARG 113 HN ARG 113 2.480 8.982 -7.139 873 HA ARG 113 HA ARG 113 1.292 7.108 -5.348 874 HB2 ARG 113 HB2 ARG 113 2.495 8.246 -3.593 875 HB3 ARG 113 HB1 ARG 113 3.549 8.111 -4.990 876 HG2 ARG 113 HG2 ARG 113 3.964 10.256 -4.331 877 HG3 ARG 113 HG1 ARG 113 2.670 10.527 -5.499 878 HD2 ARG 113 HD2 ARG 113 1.052 10.467 -3.608 879 HD3 ARG 113 HD1 ARG 113 2.418 10.389 -2.499 880 HE ARG 113 HE ARG 113 3.080 12.583 -3.661 881 HH11 ARG 113 HH11 ARG 113 -0.191 11.521 -3.047 882 HH12 ARG 113 HH12 ARG 113 -0.827 13.119 -2.845 883 HH21 ARG 113 HH21 ARG 113 2.255 14.707 -3.369 884 HH22 ARG 113 HH22 ARG 113 0.576 14.939 -3.014 885 H GLU 114 HN GLU 114 0.524 10.284 -6.446 886 HA GLU 114 HA GLU 114 -1.200 11.197 -4.456 887 HB2 GLU 114 HB2 GLU 114 -0.268 12.316 -6.626 888 HB3 GLU 114 HB1 GLU 114 -1.714 11.670 -7.378 889 HG2 GLU 114 HG2 GLU 114 -1.743 13.477 -4.980 890 HG3 GLU 114 HG1 GLU 114 -1.856 14.045 -6.643 891 H SER 115 HN SER 115 -1.988 9.442 -7.451 892 HA SER 115 HA SER 115 -4.722 9.143 -6.929 893 HB2 SER 115 HB2 SER 115 -3.645 8.783 -9.154 894 HB3 SER 115 HB1 SER 115 -2.956 7.282 -8.540 895 HG SER 115 HG SER 115 -4.865 6.844 -9.650 896 H TRP 116 HN TRP 116 -1.954 7.064 -6.174 897 HA TRP 116 HA TRP 116 -3.326 4.835 -5.248 898 HB2 TRP 116 HB2 TRP 116 -0.844 5.099 -5.689 899 HB3 TRP 116 HB1 TRP 116 -0.729 5.872 -4.112 900 HD1 TRP 116 HD1 TRP 116 -1.149 2.490 -5.770 901 HE1 TRP 116 HE1 TRP 116 -0.855 0.646 -4.006 902 HE3 TRP 116 HE3 TRP 116 -1.106 5.401 -1.555 903 HZ2 TRP 116 HZ2 TRP 116 -0.638 0.453 -1.201 904 HZ3 TRP 116 HZ3 TRP 116 -0.854 4.298 0.623 905 HH2 TRP 116 HH2 TRP 116 -0.624 1.876 0.800 906 H GLN 117 HN GLN 117 -1.992 7.530 -3.298 907 HA GLN 117 HA GLN 117 -3.025 6.747 -0.848 908 HB2 GLN 117 HB2 GLN 117 -1.381 8.471 -0.922 909 HB3 GLN 117 HB1 GLN 117 -2.396 9.496 -1.924 910 HG2 GLN 117 HG2 GLN 117 -3.963 9.755 -0.061 911 HG3 GLN 117 HG1 GLN 117 -2.935 8.729 0.938 912 HE21 GLN 117 HE21 GLN 117 -1.759 11.100 -1.347 913 HE22 GLN 117 HE22 GLN 117 -1.068 12.165 -0.178 914 H ASN 118 HN ASN 118 -4.549 8.757 -3.365 915 HA ASN 118 HA ASN 118 -6.852 9.493 -1.946 916 HB2 ASN 118 HB2 ASN 118 -6.376 9.014 -4.885 917 HB3 ASN 118 HB1 ASN 118 -7.961 9.469 -4.280 918 HD21 ASN 118 HD21 ASN 118 -4.939 10.676 -2.956 919 HD22 ASN 118 HD22 ASN 118 -5.120 12.298 -3.536 920 H ASN 119 HN ASN 119 -6.203 6.668 -3.952 921 HA ASN 119 HA ASN 119 -8.759 5.476 -3.675 922 HB2 ASN 119 HB2 ASN 119 -6.090 4.216 -4.345 923 HB3 ASN 119 HB1 ASN 119 -7.657 3.443 -4.557 924 HD21 ASN 119 HD21 ASN 119 -5.511 4.180 -6.449 925 HD22 ASN 119 HD22 ASN 119 -6.273 5.140 -7.662 926 H LEU 120 HN LEU 120 -5.629 4.758 -2.133 927 HA LEU 120 HA LEU 120 -6.608 2.573 -0.658 928 HB2 LEU 120 HB2 LEU 120 -4.205 3.059 -1.238 929 HB3 LEU 120 HB1 LEU 120 -4.210 4.260 0.036 930 HG LEU 120 HG LEU 120 -3.227 1.922 0.535 931 HD11 LEU 120 HD11 LEU 120 -5.275 3.098 2.401 932 HD12 LEU 120 HD12 LEU 120 -3.606 3.637 2.231 933 HD13 LEU 120 HD13 LEU 120 -3.949 2.023 2.847 934 HD21 LEU 120 HD21 LEU 120 -5.116 0.653 -0.396 935 HD22 LEU 120 HD22 LEU 120 -6.155 1.302 0.872 936 HD23 LEU 120 HD23 LEU 120 -4.802 0.254 1.292 937 H GLU 121 HN GLU 121 -6.241 6.002 0.192 938 HA GLU 121 HA GLU 121 -6.836 5.702 2.923 939 HB2 GLU 121 HB2 GLU 121 -5.894 7.771 2.025 940 HB3 GLU 121 HB1 GLU 121 -7.374 8.069 1.122 941 HG2 GLU 121 HG2 GLU 121 -8.620 8.318 3.174 942 HG3 GLU 121 HG1 GLU 121 -7.191 7.908 4.120 943 H SER 122 HN SER 122 -8.942 6.306 0.136 944 HA SER 122 HA SER 122 -11.347 6.459 1.634 945 HB2 SER 122 HB2 SER 122 -10.994 5.670 -1.273 946 HB3 SER 122 HB1 SER 122 -12.462 6.295 -0.520 947 HG SER 122 HG SER 122 -10.144 7.626 -1.305 948 H PHE 123 HN PHE 123 -9.611 3.797 0.100 949 HA PHE 123 HA PHE 123 -11.579 1.809 0.572 950 HB2 PHE 123 HB2 PHE 123 -9.703 1.542 -1.026 951 HB3 PHE 123 HB1 PHE 123 -8.573 1.516 0.320 952 HD1 PHE 123 HD1 PHE 123 -11.865 -0.184 0.052 953 HD2 PHE 123 HD2 PHE 123 -7.633 -0.602 0.176 954 HE1 PHE 123 HE1 PHE 123 -12.114 -2.625 0.198 955 HE2 PHE 123 HE2 PHE 123 -7.876 -3.041 0.325 956 HZ PHE 123 HZ PHE 123 -10.118 -4.054 0.335 957 H ARG 124 HN ARG 124 -8.750 2.906 2.372 958 HA ARG 124 HA ARG 124 -9.006 1.230 4.601 959 HB2 ARG 124 HB2 ARG 124 -6.977 2.326 4.526 960 HB3 ARG 124 HB1 ARG 124 -7.700 3.854 4.049 961 HG2 ARG 124 HG2 ARG 124 -8.518 4.183 6.321 962 HG3 ARG 124 HG1 ARG 124 -7.812 2.637 6.797 963 HD2 ARG 124 HD2 ARG 124 -5.638 3.413 6.561 964 HD3 ARG 124 HD1 ARG 124 -6.126 4.763 5.541 965 HE ARG 124 HE ARG 124 -6.486 6.008 7.415 966 HH11 ARG 124 HH11 ARG 124 -6.429 2.632 8.369 967 HH12 ARG 124 HH12 ARG 124 -6.384 2.990 10.068 968 HH21 ARG 124 HH21 ARG 124 -6.428 6.469 9.635 969 HH22 ARG 124 HH22 ARG 124 -6.383 5.170 10.785 970 H LYS 125 HN LYS 125 -10.513 4.329 3.826 971 HA LYS 125 HA LYS 125 -11.726 4.753 6.325 972 HB2 LYS 125 HB2 LYS 125 -12.462 5.708 3.566 973 HB3 LYS 125 HB1 LYS 125 -13.377 6.162 4.999 974 HG2 LYS 125 HG2 LYS 125 -11.301 7.100 5.971 975 HG3 LYS 125 HG1 LYS 125 -10.475 6.746 4.452 976 HD2 LYS 125 HD2 LYS 125 -11.898 8.259 3.255 977 HD3 LYS 125 HD1 LYS 125 -12.928 8.487 4.669 978 HE2 LYS 125 HE2 LYS 125 -11.024 9.495 5.862 979 HE3 LYS 125 HE1 LYS 125 -10.038 9.313 4.414 980 HZ1 LYS 125 HZ1 LYS 125 -11.013 11.559 4.723 981 HZ2 LYS 125 HZ2 LYS 125 -12.547 10.888 4.506 982 HZ3 LYS 125 HZ3 LYS 125 -11.419 10.836 3.249 983 H ILE 126 HN ILE 126 -12.698 2.761 3.594 984 HA ILE 126 HA ILE 126 -15.335 2.257 4.473 985 HB ILE 126 HB ILE 126 -13.524 0.430 2.889 986 HG12 ILE 126 HG12 ILE 126 -15.573 2.411 1.885 987 HG13 ILE 126 HG11 ILE 126 -13.837 2.704 1.898 988 HG21 ILE 126 HG21 ILE 126 -16.521 0.491 3.192 989 HG22 ILE 126 HG22 ILE 126 -15.424 -0.752 3.798 990 HG23 ILE 126 HG23 ILE 126 -15.636 -0.531 2.062 991 HD11 ILE 126 HD11 ILE 126 -14.665 1.997 -0.294 992 HD12 ILE 126 HD12 ILE 126 -15.203 0.474 0.415 993 HD13 ILE 126 HD13 ILE 126 -13.486 0.873 0.376 994 H MET 127 HN MET 127 -12.255 1.088 5.527 995 HA MET 127 HA MET 127 -13.497 -1.168 6.924 996 HB2 MET 127 HB2 MET 127 -10.601 -0.545 6.339 997 HB3 MET 127 HB1 MET 127 -11.150 -1.946 7.249 998 HG2 MET 127 HG2 MET 127 -12.334 -2.786 5.325 999 HG3 MET 127 HG1 MET 127 -11.933 -1.336 4.410 1000 HE1 MET 127 HE1 MET 127 -8.150 -1.677 3.731 1001 HE2 MET 127 HE2 MET 127 -8.904 -0.761 5.035 1002 HE3 MET 127 HE3 MET 127 -9.632 -0.769 3.427 1003 H SER 128 HN SER 128 -11.459 1.666 7.522 1004 HA SER 128 HA SER 128 -11.512 1.131 10.393 1005 HB2 SER 128 HB2 SER 128 -9.399 1.844 9.229 1006 HB3 SER 128 HB1 SER 128 -10.160 3.404 8.925 1007 HG SER 128 HG SER 128 -10.490 3.002 11.473 1008 H MET 129 HN MET 129 -12.748 3.418 8.033 1009 HA MET 129 HA MET 129 -14.131 4.862 10.184 1010 HB2 MET 129 HB2 MET 129 -13.487 5.728 7.345 1011 HB3 MET 129 HB1 MET 129 -14.452 6.668 8.484 1012 HG2 MET 129 HG2 MET 129 -12.528 6.776 10.004 1013 HG3 MET 129 HG1 MET 129 -11.568 5.881 8.829 1014 HE1 MET 129 HE1 MET 129 -13.213 10.145 8.161 1015 HE2 MET 129 HE2 MET 129 -13.366 9.259 9.677 1016 HE3 MET 129 HE3 MET 129 -14.250 8.722 8.250 1017 H LYS 130 HN LYS 130 -14.961 2.331 9.253 1018 HA LYS 130 HA LYS 130 -16.864 2.410 7.187 1019 HB2 LYS 130 HB2 LYS 130 -15.752 0.357 8.079 1020 HB3 LYS 130 HB1 LYS 130 -16.753 0.488 9.517 1021 HG2 LYS 130 HG2 LYS 130 -18.762 0.268 8.100 1022 HG3 LYS 130 HG1 LYS 130 -17.713 0.036 6.701 1023 HD2 LYS 130 HD2 LYS 130 -17.765 -1.721 9.154 1024 HD3 LYS 130 HD1 LYS 130 -18.542 -2.096 7.617 1025 HE2 LYS 130 HE2 LYS 130 -16.345 -2.037 6.515 1026 HE3 LYS 130 HE1 LYS 130 -15.585 -1.702 8.068 1027 HZ1 LYS 130 HZ1 LYS 130 -16.325 -3.822 8.884 1028 HZ2 LYS 130 HZ2 LYS 130 -15.476 -4.056 7.439 1029 HZ3 LYS 130 HZ3 LYS 130 -17.162 -4.137 7.449 Start of MODEL 6 1 H1 SER 12 HT1 SER 12 -21.357 -5.271 -3.930 2 H2 SER 12 HT2 SER 12 -21.865 -6.675 -4.732 3 H3 SER 12 HT3 SER 12 -21.045 -6.799 -3.260 4 HA SER 12 HA SER 12 -23.368 -7.199 -2.912 5 HB2 SER 12 HB2 SER 12 -22.842 -4.420 -1.908 6 HB3 SER 12 HB1 SER 12 -23.658 -5.749 -1.087 7 HG SER 12 HG SER 12 -21.768 -6.658 -0.605 8 H ALA 13 HN ALA 13 -22.737 -4.057 -4.428 9 HA ALA 13 HA ALA 13 -25.289 -4.156 -5.757 10 HB1 ALA 13 HB1 ALA 13 -25.912 -3.176 -3.604 11 HB2 ALA 13 HB2 ALA 13 -26.101 -2.021 -4.921 12 HB3 ALA 13 HB3 ALA 13 -24.715 -1.905 -3.839 13 H LYS 14 HN LYS 14 -22.664 -1.912 -4.886 14 HA LYS 14 HA LYS 14 -21.980 -1.740 -7.695 15 HB2 LYS 14 HB2 LYS 14 -21.876 0.707 -7.712 16 HB3 LYS 14 HB1 LYS 14 -23.508 0.124 -7.439 17 HG2 LYS 14 HG2 LYS 14 -21.816 0.845 -5.099 18 HG3 LYS 14 HG1 LYS 14 -22.557 2.122 -6.065 19 HD2 LYS 14 HD2 LYS 14 -24.754 1.069 -5.724 20 HD3 LYS 14 HD1 LYS 14 -23.994 -0.154 -4.707 21 HE2 LYS 14 HE2 LYS 14 -25.034 1.620 -3.371 22 HE3 LYS 14 HE1 LYS 14 -23.288 1.558 -3.134 23 HZ1 LYS 14 HZ1 LYS 14 -24.122 3.828 -3.380 24 HZ2 LYS 14 HZ2 LYS 14 -24.693 3.460 -4.927 25 HZ3 LYS 14 HZ3 LYS 14 -23.033 3.429 -4.608 26 H ASP 15 HN ASP 15 -21.037 -1.421 -4.349 27 HA ASP 15 HA ASP 15 -18.257 -1.476 -5.013 28 HB2 ASP 15 HB2 ASP 15 -19.341 0.988 -3.650 29 HB3 ASP 15 HB1 ASP 15 -17.653 0.554 -3.818 30 H ILE 16 HN ILE 16 -20.601 -2.490 -2.925 31 HA ILE 16 HA ILE 16 -19.678 -1.213 -0.537 32 HB ILE 16 HB ILE 16 -21.761 -3.367 -0.871 33 HG12 ILE 16 HG12 ILE 16 -23.252 -1.416 -0.144 34 HG13 ILE 16 HG11 ILE 16 -21.871 -0.378 -0.466 35 HG21 ILE 16 HG21 ILE 16 -20.758 -3.530 1.354 36 HG22 ILE 16 HG22 ILE 16 -22.408 -2.915 1.444 37 HG23 ILE 16 HG23 ILE 16 -21.045 -1.809 1.613 38 HD11 ILE 16 HD11 ILE 16 -23.166 -2.177 -2.495 39 HD12 ILE 16 HD12 ILE 16 -21.890 -0.994 -2.781 40 HD13 ILE 16 HD13 ILE 16 -23.500 -0.457 -2.305 41 H LYS 17 HN LYS 17 -20.198 -4.773 -0.650 42 HA LYS 17 HA LYS 17 -18.053 -5.029 1.255 43 HB2 LYS 17 HB2 LYS 17 -19.722 -7.143 -0.101 44 HB3 LYS 17 HB1 LYS 17 -18.573 -7.447 1.192 45 HG2 LYS 17 HG2 LYS 17 -21.055 -5.754 1.384 46 HG3 LYS 17 HG1 LYS 17 -20.838 -7.374 2.047 47 HD2 LYS 17 HD2 LYS 17 -19.047 -6.528 3.499 48 HD3 LYS 17 HD1 LYS 17 -19.292 -4.907 2.845 49 HE2 LYS 17 HE2 LYS 17 -21.600 -4.936 3.678 50 HE3 LYS 17 HE1 LYS 17 -21.324 -6.537 4.361 51 HZ1 LYS 17 HZ1 LYS 17 -19.903 -4.050 5.129 52 HZ2 LYS 17 HZ2 LYS 17 -19.601 -5.582 5.771 53 HZ3 LYS 17 HZ3 LYS 17 -21.092 -4.835 6.036 54 H ASP 18 HN ASP 18 -18.589 -6.716 -1.811 55 HA ASP 18 HA ASP 18 -15.812 -7.506 -1.897 56 HB2 ASP 18 HB2 ASP 18 -16.527 -8.820 -3.878 57 HB3 ASP 18 HB1 ASP 18 -17.502 -9.147 -2.450 58 H GLU 19 HN GLU 19 -17.901 -5.276 -3.511 59 HA GLU 19 HA GLU 19 -16.490 -5.103 -5.940 60 HB2 GLU 19 HB2 GLU 19 -18.508 -3.247 -4.664 61 HB3 GLU 19 HB1 GLU 19 -17.974 -3.158 -6.345 62 HG2 GLU 19 HG2 GLU 19 -19.041 -5.095 -6.925 63 HG3 GLU 19 HG1 GLU 19 -19.042 -5.722 -5.279 64 H LYS 20 HN LYS 20 -16.251 -3.264 -2.951 65 HA LYS 20 HA LYS 20 -14.603 -1.200 -3.931 66 HB2 LYS 20 HB2 LYS 20 -13.928 -0.894 -1.563 67 HB3 LYS 20 HB1 LYS 20 -15.673 -1.003 -1.762 68 HG2 LYS 20 HG2 LYS 20 -15.668 -3.280 -0.995 69 HG3 LYS 20 HG1 LYS 20 -13.908 -3.289 -0.931 70 HD2 LYS 20 HD2 LYS 20 -14.005 -1.516 0.793 71 HD3 LYS 20 HD1 LYS 20 -15.768 -1.641 0.769 72 HE2 LYS 20 HE2 LYS 20 -15.666 -3.933 1.472 73 HE3 LYS 20 HE1 LYS 20 -13.909 -3.931 1.354 74 HZ1 LYS 20 HZ1 LYS 20 -13.837 -2.308 3.140 75 HZ2 LYS 20 HZ2 LYS 20 -14.621 -3.717 3.632 76 HZ3 LYS 20 HZ3 LYS 20 -15.523 -2.336 3.263 77 H ILE 21 HN ILE 21 -13.866 -4.353 -2.518 78 HA ILE 21 HA ILE 21 -11.086 -4.044 -2.321 79 HB ILE 21 HB ILE 21 -12.655 -6.602 -2.697 80 HG12 ILE 21 HG12 ILE 21 -11.776 -5.261 -0.129 81 HG13 ILE 21 HG11 ILE 21 -13.410 -5.187 -0.781 82 HG21 ILE 21 HG21 ILE 21 -9.910 -6.133 -1.538 83 HG22 ILE 21 HG22 ILE 21 -10.268 -6.898 -3.087 84 HG23 ILE 21 HG23 ILE 21 -10.758 -7.679 -1.583 85 HD11 ILE 21 HD11 ILE 21 -13.604 -7.607 -0.562 86 HD12 ILE 21 HD12 ILE 21 -13.238 -6.837 0.982 87 HD13 ILE 21 HD13 ILE 21 -11.968 -7.677 0.091 88 H GLN 22 HN GLN 22 -13.120 -5.455 -4.844 89 HA GLN 22 HA GLN 22 -11.019 -6.416 -6.456 90 HB2 GLN 22 HB2 GLN 22 -13.822 -5.628 -7.267 91 HB3 GLN 22 HB1 GLN 22 -12.730 -6.651 -8.193 92 HG2 GLN 22 HG2 GLN 22 -12.775 -8.330 -6.450 93 HG3 GLN 22 HG1 GLN 22 -13.795 -7.294 -5.454 94 HE21 GLN 22 HE21 GLN 22 -15.368 -6.376 -7.738 95 HE22 GLN 22 HE22 GLN 22 -16.408 -7.693 -8.154 96 H GLN 23 HN GLN 23 -12.956 -3.436 -6.690 97 HA GLN 23 HA GLN 23 -11.692 -2.489 -9.038 98 HB2 GLN 23 HB2 GLN 23 -13.911 -1.724 -8.127 99 HB3 GLN 23 HB1 GLN 23 -13.028 -0.818 -6.913 100 HG2 GLN 23 HG2 GLN 23 -11.901 0.443 -8.688 101 HG3 GLN 23 HG1 GLN 23 -12.846 -0.429 -9.891 102 HE21 GLN 23 HE21 GLN 23 -12.874 2.003 -7.435 103 HE22 GLN 23 HE22 GLN 23 -14.434 2.646 -7.799 104 H TYR 24 HN TYR 24 -11.282 -1.648 -5.619 105 HA TYR 24 HA TYR 24 -9.227 0.217 -6.064 106 HB2 TYR 24 HB2 TYR 24 -10.135 -1.269 -3.624 107 HB3 TYR 24 HB1 TYR 24 -8.679 -0.276 -3.578 108 HD1 TYR 24 HD1 TYR 24 -12.079 -0.264 -2.938 109 HD2 TYR 24 HD2 TYR 24 -9.069 2.166 -4.703 110 HE1 TYR 24 HE1 TYR 24 -13.478 1.722 -2.570 111 HE2 TYR 24 HE2 TYR 24 -10.460 4.162 -4.336 112 HH TYR 24 HH TYR 24 -13.318 4.079 -2.388 113 H ARG 25 HN ARG 25 -9.042 -3.259 -5.229 114 HA ARG 25 HA ARG 25 -6.279 -3.422 -4.913 115 HB2 ARG 25 HB2 ARG 25 -7.851 -5.269 -4.430 116 HB3 ARG 25 HB1 ARG 25 -8.074 -5.499 -6.157 117 HG2 ARG 25 HG2 ARG 25 -5.682 -6.021 -6.377 118 HG3 ARG 25 HG1 ARG 25 -5.511 -5.858 -4.628 119 HD2 ARG 25 HD2 ARG 25 -5.736 -8.202 -5.311 120 HD3 ARG 25 HD1 ARG 25 -7.069 -7.684 -4.280 121 HE ARG 25 HE ARG 25 -7.574 -7.487 -7.122 122 HH11 ARG 25 HH11 ARG 25 -7.733 -9.532 -4.289 123 HH12 ARG 25 HH12 ARG 25 -9.050 -10.488 -4.891 124 HH21 ARG 25 HH21 ARG 25 -9.301 -8.764 -7.928 125 HH22 ARG 25 HH22 ARG 25 -9.924 -10.062 -6.960 126 H LYS 26 HN LYS 26 -8.224 -3.489 -7.823 127 HA LYS 26 HA LYS 26 -6.322 -4.157 -9.728 128 HB2 LYS 26 HB2 LYS 26 -8.721 -4.014 -10.164 129 HB3 LYS 26 HB1 LYS 26 -8.677 -2.279 -9.906 130 HG2 LYS 26 HG2 LYS 26 -6.937 -3.377 -12.033 131 HG3 LYS 26 HG1 LYS 26 -8.676 -3.371 -12.321 132 HD2 LYS 26 HD2 LYS 26 -7.033 -0.966 -11.532 133 HD3 LYS 26 HD1 LYS 26 -7.562 -1.340 -13.171 134 HE2 LYS 26 HE2 LYS 26 -9.369 -0.811 -10.809 135 HE3 LYS 26 HE1 LYS 26 -9.009 0.323 -12.105 136 HZ1 LYS 26 HZ1 LYS 26 -10.419 -2.270 -12.385 137 HZ2 LYS 26 HZ2 LYS 26 -10.004 -1.257 -13.671 138 HZ3 LYS 26 HZ3 LYS 26 -11.110 -0.731 -12.509 139 H THR 27 HN THR 27 -7.203 -0.939 -8.494 140 HA THR 27 HA THR 27 -5.154 0.291 -10.127 141 HB THR 27 HB THR 27 -7.309 1.426 -9.897 142 HG1 THR 27 HG1 THR 27 -4.883 2.559 -9.247 143 HG21 THR 27 HG21 THR 27 -7.926 2.514 -7.783 144 HG22 THR 27 HG22 THR 27 -6.562 1.726 -6.989 145 HG23 THR 27 HG23 THR 27 -7.890 0.756 -7.630 146 H LEU 28 HN LEU 28 -5.468 -0.939 -6.986 147 HA LEU 28 HA LEU 28 -3.612 0.751 -5.634 148 HB2 LEU 28 HB2 LEU 28 -5.258 -1.583 -5.055 149 HB3 LEU 28 HB1 LEU 28 -3.707 -1.644 -4.243 150 HG LEU 28 HG LEU 28 -5.574 -0.665 -2.888 151 HD11 LEU 28 HD11 LEU 28 -4.258 1.220 -2.047 152 HD12 LEU 28 HD12 LEU 28 -3.216 1.107 -3.464 153 HD13 LEU 28 HD13 LEU 28 -3.280 -0.222 -2.308 154 HD21 LEU 28 HD21 LEU 28 -6.706 0.558 -4.679 155 HD22 LEU 28 HD22 LEU 28 -5.316 1.635 -4.821 156 HD23 LEU 28 HD23 LEU 28 -6.273 1.620 -3.339 157 H THR 29 HN THR 29 -3.324 -2.026 -7.669 158 HA THR 29 HA THR 29 -0.795 -2.912 -6.704 159 HB THR 29 HB THR 29 -1.900 -3.399 -9.468 160 HG1 THR 29 HG1 THR 29 -3.517 -4.118 -8.168 161 HG21 THR 29 HG21 THR 29 -0.628 -5.505 -9.268 162 HG22 THR 29 HG22 THR 29 -0.038 -4.992 -7.686 163 HG23 THR 29 HG23 THR 29 0.420 -4.094 -9.133 164 H LYS 30 HN LYS 30 0.932 -1.665 -6.767 165 HA LYS 30 HA LYS 30 1.628 -0.283 -9.262 166 HB2 LYS 30 HB2 LYS 30 1.603 0.938 -6.501 167 HB3 LYS 30 HB1 LYS 30 2.409 1.665 -7.880 168 HG2 LYS 30 HG2 LYS 30 -0.529 1.049 -7.861 169 HG3 LYS 30 HG1 LYS 30 0.139 2.578 -7.288 170 HD2 LYS 30 HD2 LYS 30 1.249 2.811 -9.535 171 HD3 LYS 30 HD1 LYS 30 0.298 1.421 -10.065 172 HE2 LYS 30 HE2 LYS 30 -1.754 2.601 -9.623 173 HE3 LYS 30 HE1 LYS 30 -0.867 3.953 -8.920 174 HZ1 LYS 30 HZ1 LYS 30 -0.662 3.084 -11.750 175 HZ2 LYS 30 HZ2 LYS 30 0.093 4.437 -11.064 176 HZ3 LYS 30 HZ3 LYS 30 -1.594 4.383 -11.206 177 H ILE 31 HN ILE 31 3.839 -0.152 -9.672 178 HA ILE 31 HA ILE 31 5.599 -1.720 -7.964 179 HB ILE 31 HB ILE 31 6.202 -0.221 -10.527 180 HG12 ILE 31 HG12 ILE 31 4.651 -2.171 -10.772 181 HG13 ILE 31 HG11 ILE 31 6.171 -2.363 -11.636 182 HG21 ILE 31 HG21 ILE 31 8.300 -1.509 -10.548 183 HG22 ILE 31 HG22 ILE 31 7.899 -2.166 -8.962 184 HG23 ILE 31 HG23 ILE 31 8.190 -0.438 -9.153 185 HD11 ILE 31 HD11 ILE 31 5.463 -3.615 -8.993 186 HD12 ILE 31 HD12 ILE 31 7.001 -3.796 -9.838 187 HD13 ILE 31 HD13 ILE 31 5.519 -4.426 -10.558 188 H VAL 32 HN VAL 32 6.442 -0.750 -6.228 189 HA VAL 32 HA VAL 32 7.264 2.066 -6.456 190 HB VAL 32 HB VAL 32 6.335 2.608 -4.298 191 HG11 VAL 32 HG11 VAL 32 4.894 2.879 -6.242 192 HG12 VAL 32 HG12 VAL 32 3.955 2.463 -4.808 193 HG13 VAL 32 HG13 VAL 32 4.288 1.234 -6.030 194 HG21 VAL 32 HG21 VAL 32 5.340 -0.243 -4.214 195 HG22 VAL 32 HG22 VAL 32 4.919 1.020 -3.056 196 HG23 VAL 32 HG23 VAL 32 6.588 0.460 -3.184 197 H LYS 33 HN LYS 33 8.575 2.714 -4.486 198 HA LYS 33 HA LYS 33 10.422 0.527 -3.843 199 HB2 LYS 33 HB2 LYS 33 10.832 3.519 -3.578 200 HB3 LYS 33 HB1 LYS 33 12.045 2.272 -3.307 201 HG2 LYS 33 HG2 LYS 33 12.042 1.654 -5.616 202 HG3 LYS 33 HG1 LYS 33 10.669 2.711 -5.945 203 HD2 LYS 33 HD2 LYS 33 12.004 4.660 -5.439 204 HD3 LYS 33 HD1 LYS 33 13.375 3.641 -4.997 205 HE2 LYS 33 HE2 LYS 33 13.485 2.795 -7.285 206 HE3 LYS 33 HE1 LYS 33 12.096 3.788 -7.725 207 HZ1 LYS 33 HZ1 LYS 33 14.718 4.817 -6.785 208 HZ2 LYS 33 HZ2 LYS 33 13.390 5.760 -7.234 209 HZ3 LYS 33 HZ3 LYS 33 14.179 4.813 -8.388 210 H ILE 34 HN ILE 34 10.126 -0.402 -1.957 211 HA ILE 34 HA ILE 34 8.747 1.038 0.160 212 HB ILE 34 HB ILE 34 9.071 -1.774 -0.554 213 HG12 ILE 34 HG12 ILE 34 7.125 -0.201 1.122 214 HG13 ILE 34 HG11 ILE 34 6.944 -0.636 -0.572 215 HG21 ILE 34 HG21 ILE 34 9.155 -1.089 2.380 216 HG22 ILE 34 HG22 ILE 34 10.497 -1.773 1.461 217 HG23 ILE 34 HG23 ILE 34 9.012 -2.702 1.681 218 HD11 ILE 34 HD11 ILE 34 6.891 -2.466 1.809 219 HD12 ILE 34 HD12 ILE 34 6.933 -3.030 0.141 220 HD13 ILE 34 HD13 ILE 34 5.563 -2.080 0.715 221 H LYS 35 HN LYS 35 9.587 1.458 2.125 222 HA LYS 35 HA LYS 35 12.454 0.937 2.510 223 HB2 LYS 35 HB2 LYS 35 10.955 3.532 2.756 224 HB3 LYS 35 HB1 LYS 35 12.463 3.289 3.581 225 HG2 LYS 35 HG2 LYS 35 13.450 4.036 1.745 226 HG3 LYS 35 HG1 LYS 35 13.015 2.491 1.006 227 HD2 LYS 35 HD2 LYS 35 11.853 3.723 -0.460 228 HD3 LYS 35 HD1 LYS 35 10.704 3.886 0.869 229 HE2 LYS 35 HE2 LYS 35 11.222 6.054 -0.100 230 HE3 LYS 35 HE1 LYS 35 11.763 5.941 1.578 231 HZ1 LYS 35 HZ1 LYS 35 13.466 5.698 -0.842 232 HZ2 LYS 35 HZ2 LYS 35 14.011 5.477 0.743 233 HZ3 LYS 35 HZ3 LYS 35 13.443 6.991 0.250 234 H THR 36 HN THR 36 12.535 -0.409 4.185 235 HA THR 36 HA THR 36 10.956 0.228 6.584 236 HB THR 36 HB THR 36 10.582 -2.141 7.008 237 HG1 THR 36 HG1 THR 36 11.715 -2.703 4.452 238 HG21 THR 36 HG21 THR 36 9.058 -2.679 5.178 239 HG22 THR 36 HG22 THR 36 9.817 -1.442 4.176 240 HG23 THR 36 HG23 THR 36 8.920 -0.976 5.623 241 H ALA 37 HN ALA 37 11.901 -1.355 8.442 242 HA ALA 37 HA ALA 37 14.722 -0.796 8.643 243 HB1 ALA 37 HB1 ALA 37 12.875 -2.300 10.497 244 HB2 ALA 37 HB2 ALA 37 13.343 -0.605 10.633 245 HB3 ALA 37 HB3 ALA 37 14.547 -1.872 10.853 246 H ILE 38 HN ILE 38 12.705 -3.378 7.643 247 HA ILE 38 HA ILE 38 14.533 -5.533 8.025 248 HB ILE 38 HB ILE 38 12.313 -5.414 5.978 249 HG12 ILE 38 HG12 ILE 38 12.093 -6.266 8.872 250 HG13 ILE 38 HG11 ILE 38 11.461 -4.760 8.219 251 HG21 ILE 38 HG21 ILE 38 13.613 -7.700 7.452 252 HG22 ILE 38 HG22 ILE 38 13.807 -7.302 5.746 253 HG23 ILE 38 HG23 ILE 38 12.244 -7.849 6.353 254 HD11 ILE 38 HD11 ILE 38 10.596 -7.532 7.432 255 HD12 ILE 38 HD12 ILE 38 9.965 -6.029 6.761 256 HD13 ILE 38 HD13 ILE 38 9.705 -6.412 8.463 257 H PHE 39 HN PHE 39 13.420 -3.772 5.162 258 HA PHE 39 HA PHE 39 15.996 -3.485 4.049 259 HB2 PHE 39 HB2 PHE 39 15.429 -4.893 1.945 260 HB3 PHE 39 HB1 PHE 39 16.069 -5.706 3.362 261 HD1 PHE 39 HD1 PHE 39 15.211 -7.806 3.502 262 HD2 PHE 39 HD2 PHE 39 12.611 -4.626 2.395 263 HE1 PHE 39 HE1 PHE 39 13.316 -9.370 3.478 264 HE2 PHE 39 HE2 PHE 39 10.714 -6.180 2.378 265 HZ PHE 39 HZ PHE 39 11.062 -8.560 2.918 266 H HIS 40 HN HIS 40 16.008 -2.115 2.287 267 HA HIS 40 HA HIS 40 13.419 -0.878 1.649 268 HB2 HIS 40 HB2 HIS 40 16.097 0.164 0.746 269 HB3 HIS 40 HB1 HIS 40 14.607 1.055 1.008 270 HD1 HIS 40 HD1 HIS 40 17.705 -0.044 2.680 271 HD2 HIS 40 HD2 HIS 40 14.035 1.571 3.772 272 HE1 HIS 40 HE1 HIS 40 18.000 0.769 5.039 273 HE2 HIS 40 HE2 HIS 40 15.712 1.553 5.738 274 H GLU 41 HN GLU 41 12.473 -1.742 -0.129 275 HA GLU 41 HA GLU 41 14.172 -2.723 -2.313 276 HB2 GLU 41 HB2 GLU 41 12.068 -4.363 -0.887 277 HB3 GLU 41 HB1 GLU 41 12.926 -4.861 -2.335 278 HG2 GLU 41 HG2 GLU 41 14.330 -4.205 0.235 279 HG3 GLU 41 HG1 GLU 41 13.730 -5.818 -0.140 280 H THR 42 HN THR 42 13.220 -2.654 -4.318 281 HA THR 42 HA THR 42 10.781 -1.230 -4.677 282 HB THR 42 HB THR 42 12.121 -2.971 -6.749 283 HG1 THR 42 HG1 THR 42 13.014 -0.655 -5.511 284 HG21 THR 42 HG21 THR 42 9.931 -2.044 -7.337 285 HG22 THR 42 HG22 THR 42 11.213 -1.308 -8.299 286 HG23 THR 42 HG23 THR 42 10.511 -0.422 -6.945 287 H VAL 43 HN VAL 43 8.728 -2.020 -4.926 288 HA VAL 43 HA VAL 43 8.351 -4.920 -4.982 289 HB VAL 43 HB VAL 43 8.558 -3.976 -2.587 290 HG11 VAL 43 HG11 VAL 43 6.419 -3.115 -1.672 291 HG12 VAL 43 HG12 VAL 43 5.820 -2.969 -3.322 292 HG13 VAL 43 HG13 VAL 43 7.211 -2.016 -2.800 293 HG21 VAL 43 HG21 VAL 43 7.785 -6.210 -3.024 294 HG22 VAL 43 HG22 VAL 43 6.166 -5.613 -3.397 295 HG23 VAL 43 HG23 VAL 43 6.798 -5.479 -1.755 296 H LYS 44 HN LYS 44 6.164 -5.546 -5.521 297 HA LYS 44 HA LYS 44 4.581 -3.391 -6.729 298 HB2 LYS 44 HB2 LYS 44 5.095 -5.587 -7.978 299 HB3 LYS 44 HB1 LYS 44 3.977 -6.344 -6.853 300 HG2 LYS 44 HG2 LYS 44 2.175 -4.958 -7.618 301 HG3 LYS 44 HG1 LYS 44 3.268 -4.074 -8.685 302 HD2 LYS 44 HD2 LYS 44 1.991 -5.735 -9.931 303 HD3 LYS 44 HD1 LYS 44 3.708 -6.132 -9.934 304 HE2 LYS 44 HE2 LYS 44 3.328 -7.757 -8.137 305 HE3 LYS 44 HE1 LYS 44 1.610 -7.361 -8.147 306 HZ1 LYS 44 HZ1 LYS 44 3.135 -8.544 -10.403 307 HZ2 LYS 44 HZ2 LYS 44 1.492 -8.143 -10.438 308 HZ3 LYS 44 HZ3 LYS 44 2.045 -9.365 -9.404 309 H VAL 45 HN VAL 45 3.204 -2.477 -5.381 310 HA VAL 45 HA VAL 45 2.277 -3.981 -3.056 311 HB VAL 45 HB VAL 45 3.217 -1.795 -2.588 312 HG11 VAL 45 HG11 VAL 45 2.786 -0.735 -4.756 313 HG12 VAL 45 HG12 VAL 45 2.222 0.265 -3.417 314 HG13 VAL 45 HG13 VAL 45 1.065 -0.659 -4.374 315 HG21 VAL 45 HG21 VAL 45 1.382 -0.803 -1.327 316 HG22 VAL 45 HG22 VAL 45 1.376 -2.560 -1.176 317 HG23 VAL 45 HG23 VAL 45 0.221 -1.763 -2.244 318 H THR 46 HN THR 46 0.266 -4.731 -2.875 319 HA THR 46 HA THR 46 -1.842 -3.549 -4.512 320 HB THR 46 HB THR 46 -0.904 -5.587 -5.697 321 HG1 THR 46 HG1 THR 46 -2.899 -5.182 -6.382 322 HG21 THR 46 HG21 THR 46 -2.165 -7.018 -3.356 323 HG22 THR 46 HG22 THR 46 -0.451 -7.002 -3.775 324 HG23 THR 46 HG23 THR 46 -1.614 -7.789 -4.842 325 H CYS 47 HN CYS 47 -4.013 -4.674 -3.785 326 HA CYS 47 HA CYS 47 -3.965 -4.736 -0.858 327 HB2 CYS 47 HB2 CYS 47 -5.580 -3.205 -1.358 328 HB3 CYS 47 HB1 CYS 47 -6.004 -3.963 -2.883 329 HG CYS 47 HG CYS 47 -7.378 -6.103 -1.495 330 H SER 48 HN SER 48 -5.208 -6.337 0.237 331 HA SER 48 HA SER 48 -4.594 -8.922 -0.800 332 HB2 SER 48 HB2 SER 48 -4.442 -8.288 1.605 333 HB3 SER 48 HB1 SER 48 -6.200 -8.182 1.655 334 HG SER 48 HG SER 48 -4.551 -10.449 1.307 335 H LYS 49 HN LYS 49 -6.099 -10.660 -1.048 336 HA LYS 49 HA LYS 49 -8.417 -10.104 -2.525 337 HB2 LYS 49 HB2 LYS 49 -8.969 -12.516 -2.110 338 HB3 LYS 49 HB1 LYS 49 -7.393 -12.226 -2.833 339 HG2 LYS 49 HG2 LYS 49 -6.438 -12.421 -0.504 340 HG3 LYS 49 HG1 LYS 49 -8.030 -12.978 -0.001 341 HD2 LYS 49 HD2 LYS 49 -6.963 -14.975 -0.407 342 HD3 LYS 49 HD1 LYS 49 -7.734 -14.677 -1.964 343 HE2 LYS 49 HE2 LYS 49 -4.866 -14.042 -1.265 344 HE3 LYS 49 HE1 LYS 49 -5.408 -15.426 -2.209 345 HZ1 LYS 49 HZ1 LYS 49 -5.670 -12.568 -2.968 346 HZ2 LYS 49 HZ2 LYS 49 -6.293 -13.860 -3.863 347 HZ3 LYS 49 HZ3 LYS 49 -4.624 -13.701 -3.659 348 H ASP 50 HN ASP 50 -7.873 -10.691 0.869 349 HA ASP 50 HA ASP 50 -10.644 -10.801 1.547 350 HB2 ASP 50 HB2 ASP 50 -8.938 -11.874 2.956 351 HB3 ASP 50 HB1 ASP 50 -8.232 -10.300 3.309 352 H GLY 51 HN GLY 51 -8.251 -8.317 1.193 353 HA2 GLY 51 HA2 GLY 51 -8.719 -6.088 0.694 354 HA3 GLY 51 HA1 GLY 51 -10.360 -6.328 1.267 355 H LYS 52 HN LYS 52 -8.610 -7.568 3.689 356 HA LYS 52 HA LYS 52 -8.956 -5.114 5.213 357 HB2 LYS 52 HB2 LYS 52 -9.870 -7.287 6.019 358 HB3 LYS 52 HB1 LYS 52 -8.222 -7.874 6.195 359 HG2 LYS 52 HG2 LYS 52 -7.782 -6.091 7.831 360 HG3 LYS 52 HG1 LYS 52 -9.461 -5.564 7.680 361 HD2 LYS 52 HD2 LYS 52 -10.237 -7.700 8.508 362 HD3 LYS 52 HD1 LYS 52 -8.584 -8.308 8.561 363 HE2 LYS 52 HE2 LYS 52 -8.017 -6.602 10.225 364 HE3 LYS 52 HE1 LYS 52 -9.679 -6.017 10.184 365 HZ1 LYS 52 HZ1 LYS 52 -10.428 -8.143 11.016 366 HZ2 LYS 52 HZ2 LYS 52 -9.263 -7.502 12.058 367 HZ3 LYS 52 HZ3 LYS 52 -8.850 -8.749 10.997 368 H MET 53 HN MET 53 -6.437 -6.593 3.585 369 HA MET 53 HA MET 53 -4.516 -5.085 5.168 370 HB2 MET 53 HB2 MET 53 -2.908 -6.889 5.277 371 HB3 MET 53 HB1 MET 53 -4.415 -7.401 6.023 372 HG2 MET 53 HG2 MET 53 -4.988 -8.613 3.959 373 HG3 MET 53 HG1 MET 53 -3.437 -8.136 3.280 374 HE1 MET 53 HE1 MET 53 -4.200 -9.191 7.015 375 HE2 MET 53 HE2 MET 53 -3.911 -10.929 6.924 376 HE3 MET 53 HE3 MET 53 -5.263 -10.212 6.046 377 H LEU 54 HN LEU 54 -2.509 -4.699 4.100 378 HA LEU 54 HA LEU 54 -2.889 -4.492 1.195 379 HB2 LEU 54 HB2 LEU 54 -2.504 -2.445 2.647 380 HB3 LEU 54 HB1 LEU 54 -0.890 -3.055 2.938 381 HG LEU 54 HG LEU 54 -0.511 -2.969 0.449 382 HD11 LEU 54 HD11 LEU 54 -2.003 -1.503 -0.846 383 HD12 LEU 54 HD12 LEU 54 -3.099 -1.420 0.533 384 HD13 LEU 54 HD13 LEU 54 -2.827 -2.959 -0.287 385 HD21 LEU 54 HD21 LEU 54 0.335 -1.274 2.011 386 HD22 LEU 54 HD22 LEU 54 -1.166 -0.365 1.822 387 HD23 LEU 54 HD23 LEU 54 -0.086 -0.580 0.445 388 H GLU 55 HN GLU 55 -1.970 -6.207 0.222 389 HA GLU 55 HA GLU 55 0.477 -7.296 1.401 390 HB2 GLU 55 HB2 GLU 55 -1.596 -8.544 -0.393 391 HB3 GLU 55 HB1 GLU 55 -0.034 -9.296 -0.085 392 HG2 GLU 55 HG2 GLU 55 -0.537 -9.254 2.334 393 HG3 GLU 55 HG1 GLU 55 -2.140 -8.627 1.964 394 H TRP 56 HN TRP 56 2.334 -7.343 0.347 395 HA TRP 56 HA TRP 56 2.331 -6.274 -2.387 396 HB2 TRP 56 HB2 TRP 56 4.626 -5.274 -1.643 397 HB3 TRP 56 HB1 TRP 56 3.133 -4.442 -1.229 398 HD1 TRP 56 HD1 TRP 56 5.094 -7.277 0.592 399 HE1 TRP 56 HE1 TRP 56 5.407 -6.551 3.043 400 HE3 TRP 56 HE3 TRP 56 2.803 -2.725 0.385 401 HZ2 TRP 56 HZ2 TRP 56 4.764 -4.346 4.670 402 HZ3 TRP 56 HZ3 TRP 56 2.696 -1.374 2.429 403 HH2 TRP 56 HH2 TRP 56 3.652 -2.163 4.528 404 H TYR 57 HN TYR 57 3.690 -7.145 -3.825 405 HA TYR 57 HA TYR 57 5.219 -9.492 -2.904 406 HB2 TYR 57 HB2 TYR 57 3.897 -9.117 -5.605 407 HB3 TYR 57 HB1 TYR 57 4.749 -10.556 -5.049 408 HD1 TYR 57 HD1 TYR 57 1.643 -8.640 -4.881 409 HD2 TYR 57 HD2 TYR 57 3.717 -12.057 -3.421 410 HE1 TYR 57 HE1 TYR 57 -0.470 -9.548 -4.007 411 HE2 TYR 57 HE2 TYR 57 1.609 -12.973 -2.548 412 HH TYR 57 HH TYR 57 -1.405 -11.805 -3.433 413 H LYS 58 HN LYS 58 7.266 -9.605 -3.467 414 HA LYS 58 HA LYS 58 9.007 -7.759 -4.143 415 HB2 LYS 58 HB2 LYS 58 10.373 -9.507 -5.308 416 HB3 LYS 58 HB1 LYS 58 9.742 -9.999 -3.745 417 HG2 LYS 58 HG2 LYS 58 8.200 -10.682 -6.205 418 HG3 LYS 58 HG1 LYS 58 9.644 -11.611 -5.810 419 HD2 LYS 58 HD2 LYS 58 8.731 -12.347 -3.760 420 HD3 LYS 58 HD1 LYS 58 7.437 -11.153 -3.817 421 HE2 LYS 58 HE2 LYS 58 6.692 -13.456 -4.350 422 HE3 LYS 58 HE1 LYS 58 6.376 -12.293 -5.637 423 HZ1 LYS 58 HZ1 LYS 58 7.296 -14.464 -6.387 424 HZ2 LYS 58 HZ2 LYS 58 8.747 -14.090 -5.590 425 HZ3 LYS 58 HZ3 LYS 58 8.206 -13.127 -6.875 426 H GLY 59 HN GLY 59 9.168 -6.230 -5.647 427 HA2 GLY 59 HA2 GLY 59 7.982 -6.770 -8.302 428 HA3 GLY 59 HA1 GLY 59 7.830 -5.224 -7.480 429 H LYS 60 HN LYS 60 10.850 -6.627 -7.009 430 HA LYS 60 HA LYS 60 12.187 -4.631 -8.533 431 HB2 LYS 60 HB2 LYS 60 13.171 -7.104 -7.106 432 HB3 LYS 60 HB1 LYS 60 14.245 -5.986 -7.931 433 HG2 LYS 60 HG2 LYS 60 13.816 -4.267 -6.416 434 HG3 LYS 60 HG1 LYS 60 12.351 -5.041 -5.812 435 HD2 LYS 60 HD2 LYS 60 15.061 -6.298 -5.470 436 HD3 LYS 60 HD1 LYS 60 14.441 -5.105 -4.326 437 HE2 LYS 60 HE2 LYS 60 12.525 -6.499 -3.844 438 HE3 LYS 60 HE1 LYS 60 13.015 -7.652 -5.085 439 HZ1 LYS 60 HZ1 LYS 60 14.968 -8.199 -3.815 440 HZ2 LYS 60 HZ2 LYS 60 13.604 -8.371 -2.829 441 HZ3 LYS 60 HZ3 LYS 60 14.609 -7.017 -2.653 442 H ASN 61 HN ASN 61 12.634 -8.150 -8.789 443 HA ASN 61 HA ASN 61 11.694 -8.487 -11.387 444 HB2 ASN 61 HB2 ASN 61 13.592 -7.009 -12.036 445 HB3 ASN 61 HB1 ASN 61 14.709 -8.161 -11.314 446 HD21 ASN 61 HD21 ASN 61 15.231 -10.006 -12.412 447 HD22 ASN 61 HD22 ASN 61 14.709 -10.338 -14.022 448 H ASP 62 HN ASP 62 14.755 -9.512 -9.909 449 HA ASP 62 HA ASP 62 13.548 -12.085 -9.237 450 HB2 ASP 62 HB2 ASP 62 15.877 -11.680 -11.061 451 HB3 ASP 62 HB1 ASP 62 15.892 -13.066 -9.974 452 H SER 63 HN SER 63 13.546 -11.063 -7.207 453 HA SER 63 HA SER 63 15.872 -11.625 -5.641 454 HB2 SER 63 HB2 SER 63 16.525 -9.424 -6.453 455 HB3 SER 63 HB1 SER 63 14.957 -8.757 -6.008 456 HG SER 63 HG SER 63 17.131 -9.466 -4.387 457 H ASP 64 HN ASP 64 14.325 -13.024 -4.696 458 HA ASP 64 HA ASP 64 12.929 -11.777 -2.524 459 HB2 ASP 64 HB2 ASP 64 10.833 -13.058 -2.970 460 HB3 ASP 64 HB1 ASP 64 11.144 -11.762 -4.109 461 H GLY 65 HN GLY 65 14.119 -12.762 -1.038 462 HA2 GLY 65 HA2 GLY 65 15.166 -15.382 -1.287 463 HA3 GLY 65 HA1 GLY 65 15.129 -14.423 0.184 464 H LYS 66 HN LYS 66 12.238 -14.111 0.116 465 HA LYS 66 HA LYS 66 11.562 -16.647 1.334 466 HB2 LYS 66 HB2 LYS 66 10.959 -14.421 2.347 467 HB3 LYS 66 HB1 LYS 66 9.828 -14.191 1.023 468 HG2 LYS 66 HG2 LYS 66 8.647 -14.958 2.968 469 HG3 LYS 66 HG1 LYS 66 8.619 -16.210 1.728 470 HD2 LYS 66 HD2 LYS 66 9.034 -17.185 3.912 471 HD3 LYS 66 HD1 LYS 66 10.443 -17.377 2.872 472 HE2 LYS 66 HE2 LYS 66 11.137 -16.740 5.099 473 HE3 LYS 66 HE1 LYS 66 11.491 -15.441 3.965 474 HZ1 LYS 66 HZ1 LYS 66 9.515 -14.285 4.719 475 HZ2 LYS 66 HZ2 LYS 66 10.543 -14.606 6.021 476 HZ3 LYS 66 HZ3 LYS 66 9.154 -15.542 5.791 477 H LYS 67 HN LYS 67 11.258 -15.151 -1.696 478 HA LYS 67 HA LYS 67 10.080 -15.538 -3.589 479 HB2 LYS 67 HB2 LYS 67 9.571 -18.232 -2.328 480 HB3 LYS 67 HB1 LYS 67 9.265 -17.831 -4.011 481 HG2 LYS 67 HG2 LYS 67 11.938 -17.871 -2.632 482 HG3 LYS 67 HG1 LYS 67 11.341 -19.045 -3.804 483 HD2 LYS 67 HD2 LYS 67 11.881 -16.121 -4.332 484 HD3 LYS 67 HD1 LYS 67 12.910 -17.467 -4.825 485 HE2 LYS 67 HE2 LYS 67 11.140 -18.322 -6.254 486 HE3 LYS 67 HE1 LYS 67 10.062 -17.037 -5.715 487 HZ1 LYS 67 HZ1 LYS 67 12.565 -16.711 -7.274 488 HZ2 LYS 67 HZ2 LYS 67 11.658 -15.425 -6.647 489 HZ3 LYS 67 HZ3 LYS 67 10.987 -16.443 -7.821 490 H LYS 68 HN LYS 68 8.764 -14.533 -1.116 491 HA LYS 68 HA LYS 68 5.969 -14.883 -1.888 492 HB2 LYS 68 HB2 LYS 68 7.146 -15.383 0.856 493 HB3 LYS 68 HB1 LYS 68 5.437 -15.110 0.594 494 HG2 LYS 68 HG2 LYS 68 6.931 -17.306 -0.787 495 HG3 LYS 68 HG1 LYS 68 6.181 -17.511 0.797 496 HD2 LYS 68 HD2 LYS 68 4.659 -16.496 -1.584 497 HD3 LYS 68 HD1 LYS 68 4.811 -18.219 -1.233 498 HE2 LYS 68 HE2 LYS 68 3.820 -17.813 0.991 499 HE3 LYS 68 HE1 LYS 68 3.621 -16.113 0.572 500 HZ1 LYS 68 HZ1 LYS 68 1.576 -17.357 0.248 501 HZ2 LYS 68 HZ2 LYS 68 2.352 -18.394 -0.840 502 HZ3 LYS 68 HZ3 LYS 68 2.152 -16.761 -1.228 503 HA PRO 69 HA PRO 69 5.407 -10.533 -0.691 504 HB2 PRO 69 HB2 PRO 69 4.067 -11.435 1.824 505 HB3 PRO 69 HB1 PRO 69 3.584 -10.177 0.681 506 HG2 PRO 69 HG2 PRO 69 2.392 -12.555 0.673 507 HG3 PRO 69 HG1 PRO 69 2.727 -11.691 -0.837 508 HD2 PRO 69 HD2 PRO 69 4.048 -14.082 0.305 509 HD3 PRO 69 HD1 PRO 69 3.863 -13.595 -1.387 510 H ILE 70 HN ILE 70 6.584 -9.083 0.387 511 HA ILE 70 HA ILE 70 8.751 -10.050 1.956 512 HB ILE 70 HB ILE 70 9.512 -7.675 2.017 513 HG12 ILE 70 HG12 ILE 70 7.187 -7.215 0.147 514 HG13 ILE 70 HG11 ILE 70 7.250 -6.644 1.814 515 HG21 ILE 70 HG21 ILE 70 10.269 -9.243 0.317 516 HG22 ILE 70 HG22 ILE 70 10.098 -7.625 -0.363 517 HG23 ILE 70 HG23 ILE 70 8.872 -8.852 -0.688 518 HD11 ILE 70 HD11 ILE 70 9.227 -5.303 1.253 519 HD12 ILE 70 HD12 ILE 70 7.815 -4.863 0.292 520 HD13 ILE 70 HD13 ILE 70 9.098 -5.840 -0.422 521 H GLY 71 HN GLY 71 5.792 -9.741 3.005 522 HA2 GLY 71 HA2 GLY 71 5.323 -9.902 5.360 523 HA3 GLY 71 HA1 GLY 71 6.649 -8.791 5.659 524 H SER 72 HN SER 72 3.521 -8.997 4.070 525 HA SER 72 HA SER 72 3.019 -6.229 3.883 526 HB2 SER 72 HB2 SER 72 0.970 -8.445 3.974 527 HB3 SER 72 HB1 SER 72 0.843 -6.884 3.163 528 HG SER 72 HG SER 72 1.964 -9.205 2.291 529 H PHE 73 HN PHE 73 0.929 -5.291 4.888 530 HA PHE 73 HA PHE 73 0.647 -6.070 7.705 531 HB2 PHE 73 HB2 PHE 73 1.071 -3.932 8.536 532 HB3 PHE 73 HB1 PHE 73 2.237 -4.027 7.222 533 HD1 PHE 73 HD1 PHE 73 1.809 -2.806 5.107 534 HD2 PHE 73 HD2 PHE 73 -0.719 -2.410 8.495 535 HE1 PHE 73 HE1 PHE 73 0.831 -0.767 4.135 536 HE2 PHE 73 HE2 PHE 73 -1.721 -0.391 7.538 537 HZ PHE 73 HZ PHE 73 -0.936 0.446 5.349 538 HA PRO 74 HA PRO 74 -3.636 -5.422 6.758 539 HB2 PRO 74 HB2 PRO 74 -4.536 -5.026 9.372 540 HB3 PRO 74 HB1 PRO 74 -4.368 -6.568 8.542 541 HG2 PRO 74 HG2 PRO 74 -2.843 -5.615 10.743 542 HG3 PRO 74 HG1 PRO 74 -2.623 -7.122 9.847 543 HD2 PRO 74 HD2 PRO 74 -1.119 -4.599 9.674 544 HD3 PRO 74 HD1 PRO 74 -0.645 -6.235 9.175 545 H LEU 75 HN LEU 75 -4.924 -3.787 6.167 546 HA LEU 75 HA LEU 75 -3.935 -1.148 6.305 547 HB2 LEU 75 HB2 LEU 75 -6.555 -2.281 5.350 548 HB3 LEU 75 HB1 LEU 75 -6.133 -0.588 5.194 549 HG LEU 75 HG LEU 75 -4.498 -2.820 3.994 550 HD11 LEU 75 HD11 LEU 75 -5.529 -2.233 1.863 551 HD12 LEU 75 HD12 LEU 75 -6.584 -1.081 2.683 552 HD13 LEU 75 HD13 LEU 75 -6.738 -2.806 3.014 553 HD21 LEU 75 HD21 LEU 75 -3.661 -0.915 2.590 554 HD22 LEU 75 HD22 LEU 75 -3.198 -0.852 4.289 555 HD23 LEU 75 HD23 LEU 75 -4.502 0.175 3.692 556 H ASN 76 HN ASN 76 -6.096 -2.881 8.328 557 HA ASN 76 HA ASN 76 -7.539 -0.686 9.397 558 HB2 ASN 76 HB2 ASN 76 -8.053 -2.283 11.265 559 HB3 ASN 76 HB1 ASN 76 -8.429 -2.900 9.659 560 HD21 ASN 76 HD21 ASN 76 -6.147 -3.040 12.307 561 HD22 ASN 76 HD22 ASN 76 -5.478 -4.580 11.895 562 H LYS 77 HN LYS 77 -4.322 -1.775 9.861 563 HA LYS 77 HA LYS 77 -4.102 -0.811 12.585 564 HB2 LYS 77 HB2 LYS 77 -1.994 -1.858 10.684 565 HB3 LYS 77 HB1 LYS 77 -1.723 -1.481 12.380 566 HG2 LYS 77 HG2 LYS 77 -3.695 -3.541 11.416 567 HG3 LYS 77 HG1 LYS 77 -2.028 -3.904 11.860 568 HD2 LYS 77 HD2 LYS 77 -3.976 -2.565 13.728 569 HD3 LYS 77 HD1 LYS 77 -3.765 -4.313 13.647 570 HE2 LYS 77 HE2 LYS 77 -1.587 -2.319 14.266 571 HE3 LYS 77 HE1 LYS 77 -2.449 -3.287 15.458 572 HZ1 LYS 77 HZ1 LYS 77 -0.768 -4.364 13.259 573 HZ2 LYS 77 HZ2 LYS 77 -1.575 -5.283 14.428 574 HZ3 LYS 77 HZ3 LYS 77 -0.313 -4.256 14.883 575 H ILE 78 HN ILE 78 -3.948 0.593 9.528 576 HA ILE 78 HA ILE 78 -1.766 2.344 9.731 577 HB ILE 78 HB ILE 78 -4.370 2.896 8.298 578 HG12 ILE 78 HG12 ILE 78 -1.861 1.569 7.259 579 HG13 ILE 78 HG11 ILE 78 -3.352 0.725 7.669 580 HG21 ILE 78 HG21 ILE 78 -2.962 4.867 8.527 581 HG22 ILE 78 HG22 ILE 78 -2.993 4.321 6.850 582 HG23 ILE 78 HG23 ILE 78 -1.587 3.980 7.862 583 HD11 ILE 78 HD11 ILE 78 -3.169 1.051 5.288 584 HD12 ILE 78 HD12 ILE 78 -3.025 2.794 5.514 585 HD13 ILE 78 HD13 ILE 78 -4.530 1.971 5.933 586 H THR 79 HN THR 79 -1.454 4.263 10.716 587 HA THR 79 HA THR 79 -3.642 5.277 12.381 588 HB THR 79 HB THR 79 -1.909 6.490 13.631 589 HG1 THR 79 HG1 THR 79 0.221 6.371 13.045 590 HG21 THR 79 HG21 THR 79 -1.223 3.576 13.212 591 HG22 THR 79 HG22 THR 79 -2.453 4.200 14.311 592 HG23 THR 79 HG23 THR 79 -0.750 4.557 14.601 593 H SER 80 HN SER 80 -1.429 6.125 9.796 594 HA SER 80 HA SER 80 -3.189 8.158 8.854 595 HB2 SER 80 HB2 SER 80 -1.956 9.314 10.745 596 HB3 SER 80 HB1 SER 80 -0.489 9.140 9.787 597 HG SER 80 HG SER 80 -1.131 10.996 9.012 598 H ILE 81 HN ILE 81 -3.049 8.117 6.714 599 HA ILE 81 HA ILE 81 -0.563 7.227 5.443 600 HB ILE 81 HB ILE 81 -2.368 5.984 4.574 601 HG12 ILE 81 HG12 ILE 81 -1.935 8.254 2.614 602 HG13 ILE 81 HG11 ILE 81 -0.874 6.864 2.800 603 HG21 ILE 81 HG21 ILE 81 -3.899 8.560 4.265 604 HG22 ILE 81 HG22 ILE 81 -4.199 7.289 5.450 605 HG23 ILE 81 HG23 ILE 81 -4.455 6.972 3.735 606 HD11 ILE 81 HD11 ILE 81 -2.270 6.567 0.880 607 HD12 ILE 81 HD12 ILE 81 -3.722 6.829 1.845 608 HD13 ILE 81 HD13 ILE 81 -2.726 5.400 2.119 609 H ARG 82 HN ARG 82 0.820 8.822 4.963 610 HA ARG 82 HA ARG 82 -0.308 11.374 4.027 611 HB2 ARG 82 HB2 ARG 82 1.918 10.946 6.006 612 HB3 ARG 82 HB1 ARG 82 1.690 12.482 5.167 613 HG2 ARG 82 HG2 ARG 82 -0.182 11.124 7.094 614 HG3 ARG 82 HG1 ARG 82 0.662 12.663 7.292 615 HD2 ARG 82 HD2 ARG 82 -0.616 13.533 5.329 616 HD3 ARG 82 HD1 ARG 82 -1.539 12.026 5.341 617 HE ARG 82 HE ARG 82 -1.483 13.731 7.735 618 HH11 ARG 82 HH11 ARG 82 -3.264 12.184 5.147 619 HH12 ARG 82 HH12 ARG 82 -4.812 12.477 5.866 620 HH21 ARG 82 HH21 ARG 82 -3.535 14.112 8.688 621 HH22 ARG 82 HH22 ARG 82 -4.968 13.580 7.867 622 H THR 83 HN THR 83 0.922 12.577 2.640 623 HA THR 83 HA THR 83 2.827 11.203 0.990 624 HB THR 83 HB THR 83 2.149 14.147 1.037 625 HG1 THR 83 HG1 THR 83 0.248 13.570 0.336 626 HG21 THR 83 HG21 THR 83 3.149 12.340 -1.160 627 HG22 THR 83 HG22 THR 83 4.120 13.509 -0.263 628 HG23 THR 83 HG23 THR 83 2.810 14.066 -1.303 629 H LYS 84 HN LYS 84 5.082 11.564 0.980 630 HA LYS 84 HA LYS 84 6.224 12.366 3.427 631 HB2 LYS 84 HB2 LYS 84 7.370 10.852 1.837 632 HB3 LYS 84 HB1 LYS 84 7.632 12.230 0.770 633 HG2 LYS 84 HG2 LYS 84 9.314 13.026 2.005 634 HG3 LYS 84 HG1 LYS 84 8.483 12.695 3.526 635 HD2 LYS 84 HD2 LYS 84 10.296 11.259 3.621 636 HD3 LYS 84 HD1 LYS 84 9.019 10.223 2.981 637 HE2 LYS 84 HE2 LYS 84 10.771 9.736 1.562 638 HE3 LYS 84 HE1 LYS 84 9.929 11.007 0.672 639 HZ1 LYS 84 HZ1 LYS 84 11.516 12.619 1.623 640 HZ2 LYS 84 HZ2 LYS 84 12.276 11.441 0.673 641 HZ3 LYS 84 HZ3 LYS 84 12.349 11.341 2.356 642 H VAL 85 HN VAL 85 6.348 14.275 4.203 643 HA VAL 85 HA VAL 85 5.424 16.544 2.975 644 HB VAL 85 HB VAL 85 5.931 17.584 4.997 645 HG11 VAL 85 HG11 VAL 85 4.258 15.832 5.158 646 HG12 VAL 85 HG12 VAL 85 5.107 16.091 6.682 647 HG13 VAL 85 HG13 VAL 85 5.517 14.708 5.668 648 HG21 VAL 85 HG21 VAL 85 7.958 15.432 5.509 649 HG22 VAL 85 HG22 VAL 85 7.535 16.713 6.650 650 HG23 VAL 85 HG23 VAL 85 8.315 17.116 5.116 651 H ASP 86 HN ASP 86 8.592 15.169 2.973 652 HA ASP 86 HA ASP 86 9.772 17.705 2.088 653 HB2 ASP 86 HB2 ASP 86 11.935 16.718 2.593 654 HB3 ASP 86 HB1 ASP 86 10.876 16.571 3.986 655 H ASN 87 HN ASN 87 8.413 14.994 0.811 656 HA ASN 87 HA ASN 87 9.588 15.443 -1.782 657 HB2 ASN 87 HB2 ASN 87 11.175 13.811 -0.694 658 HB3 ASN 87 HB1 ASN 87 9.835 12.683 -0.565 659 HD21 ASN 87 HD21 ASN 87 12.041 14.273 -2.725 660 HD22 ASN 87 HD22 ASN 87 11.717 13.277 -4.101 661 H LEU 88 HN LEU 88 7.673 15.746 -2.757 662 HA LEU 88 HA LEU 88 5.304 14.476 -1.839 663 HB2 LEU 88 HB2 LEU 88 5.919 16.236 -4.203 664 HB3 LEU 88 HB1 LEU 88 4.318 15.571 -3.947 665 HG LEU 88 HG LEU 88 5.768 17.366 -1.996 666 HD11 LEU 88 HD11 LEU 88 4.183 19.085 -2.710 667 HD12 LEU 88 HD12 LEU 88 3.550 17.989 -3.940 668 HD13 LEU 88 HD13 LEU 88 5.215 18.561 -4.040 669 HD21 LEU 88 HD21 LEU 88 3.544 17.546 -0.947 670 HD22 LEU 88 HD22 LEU 88 4.188 15.906 -0.893 671 HD23 LEU 88 HD23 LEU 88 2.940 16.325 -2.068 672 H LYS 89 HN LYS 89 7.716 13.435 -3.956 673 HA LYS 89 HA LYS 89 6.007 11.839 -5.634 674 HB2 LYS 89 HB2 LYS 89 8.949 11.429 -5.261 675 HB3 LYS 89 HB1 LYS 89 7.976 10.983 -6.641 676 HG2 LYS 89 HG2 LYS 89 8.884 13.701 -5.794 677 HG3 LYS 89 HG1 LYS 89 9.279 12.830 -7.276 678 HD2 LYS 89 HD2 LYS 89 6.864 12.946 -7.858 679 HD3 LYS 89 HD1 LYS 89 6.649 14.021 -6.482 680 HE2 LYS 89 HE2 LYS 89 8.334 15.548 -7.450 681 HE3 LYS 89 HE1 LYS 89 8.452 14.490 -8.854 682 HZ1 LYS 89 HZ1 LYS 89 6.208 14.975 -9.432 683 HZ2 LYS 89 HZ2 LYS 89 7.000 16.445 -9.180 684 HZ3 LYS 89 HZ3 LYS 89 5.951 15.839 -8.002 685 H SER 90 HN SER 90 7.262 11.648 -2.522 686 HA SER 90 HA SER 90 6.961 8.730 -2.425 687 HB2 SER 90 HB2 SER 90 9.215 9.648 -1.812 688 HB3 SER 90 HB1 SER 90 8.455 10.506 -0.475 689 HG SER 90 HG SER 90 8.903 7.756 -0.817 690 H LEU 91 HN LEU 91 6.200 7.969 -0.219 691 HA LEU 91 HA LEU 91 4.141 9.712 0.912 692 HB2 LEU 91 HB2 LEU 91 3.221 8.436 -1.042 693 HB3 LEU 91 HB1 LEU 91 3.606 6.955 -0.196 694 HG LEU 91 HG LEU 91 2.068 8.199 1.656 695 HD11 LEU 91 HD11 LEU 91 0.175 9.205 0.577 696 HD12 LEU 91 HD12 LEU 91 0.867 8.902 -1.016 697 HD13 LEU 91 HD13 LEU 91 1.633 10.058 0.073 698 HD21 LEU 91 HD21 LEU 91 1.143 6.447 -0.615 699 HD22 LEU 91 HD22 LEU 91 0.291 6.697 0.910 700 HD23 LEU 91 HD23 LEU 91 1.864 5.898 0.900 701 H GLU 92 HN GLU 92 4.472 9.593 3.068 702 HA GLU 92 HA GLU 92 5.618 7.140 4.182 703 HB2 GLU 92 HB2 GLU 92 6.739 9.250 4.777 704 HB3 GLU 92 HB1 GLU 92 5.241 9.848 5.482 705 HG2 GLU 92 HG2 GLU 92 5.302 8.015 7.116 706 HG3 GLU 92 HG1 GLU 92 6.824 7.463 6.422 707 H ILE 93 HN ILE 93 4.295 5.696 5.013 708 HA ILE 93 HA ILE 93 1.700 6.633 6.038 709 HB ILE 93 HB ILE 93 2.478 4.001 4.803 710 HG12 ILE 93 HG12 ILE 93 0.405 6.095 4.133 711 HG13 ILE 93 HG11 ILE 93 1.897 5.781 3.252 712 HG21 ILE 93 HG21 ILE 93 -0.068 4.678 6.277 713 HG22 ILE 93 HG22 ILE 93 1.135 3.475 6.749 714 HG23 ILE 93 HG23 ILE 93 0.174 3.240 5.287 715 HD11 ILE 93 HD11 ILE 93 -0.302 3.765 3.570 716 HD12 ILE 93 HD12 ILE 93 1.106 3.678 2.509 717 HD13 ILE 93 HD13 ILE 93 -0.158 4.870 2.206 718 H SER 94 HN SER 94 1.606 6.713 8.113 719 HA SER 94 HA SER 94 3.311 5.023 9.748 720 HB2 SER 94 HB2 SER 94 1.368 7.190 10.592 721 HB3 SER 94 HB1 SER 94 2.639 6.462 11.581 722 HG SER 94 HG SER 94 3.679 7.383 9.285 723 H VAL 95 HN VAL 95 2.626 3.222 10.624 724 HA VAL 95 HA VAL 95 -0.260 2.808 10.981 725 HB VAL 95 HB VAL 95 -0.012 1.566 9.042 726 HG11 VAL 95 HG11 VAL 95 2.298 1.898 8.605 727 HG12 VAL 95 HG12 VAL 95 1.974 0.161 8.520 728 HG13 VAL 95 HG13 VAL 95 2.764 0.843 9.946 729 HG21 VAL 95 HG21 VAL 95 -0.854 0.067 10.757 730 HG22 VAL 95 HG22 VAL 95 0.792 -0.418 11.163 731 HG23 VAL 95 HG23 VAL 95 0.120 -0.816 9.581 732 H SER 96 HN SER 96 -0.807 1.317 12.676 733 HA SER 96 HA SER 96 1.018 1.274 14.850 734 HB2 SER 96 HB2 SER 96 -1.445 1.242 15.169 735 HB3 SER 96 HB1 SER 96 -1.508 -0.358 14.437 736 HG SER 96 HG SER 96 0.008 0.273 16.754 737 H SER 97 HN SER 97 2.795 0.107 14.780 738 HA SER 97 HA SER 97 2.802 -2.269 13.069 739 HB2 SER 97 HB2 SER 97 5.175 -1.506 12.503 740 HB3 SER 97 HB1 SER 97 3.851 -0.551 11.841 741 HG SER 97 HG SER 97 5.699 0.089 13.829 742 H VAL 98 HN VAL 98 4.337 -3.843 13.459 743 HA VAL 98 HA VAL 98 5.269 -4.042 16.235 744 HB VAL 98 HB VAL 98 5.556 -6.450 15.772 745 HG11 VAL 98 HG11 VAL 98 3.186 -7.050 15.542 746 HG12 VAL 98 HG12 VAL 98 2.830 -5.409 15.004 747 HG13 VAL 98 HG13 VAL 98 3.415 -5.693 16.643 748 HG21 VAL 98 HG21 VAL 98 6.079 -6.288 13.384 749 HG22 VAL 98 HG22 VAL 98 4.412 -5.820 13.051 750 HG23 VAL 98 HG23 VAL 98 4.766 -7.428 13.678 751 H HIS 99 HN HIS 99 7.429 -5.743 15.932 752 HA HIS 99 HA HIS 99 9.581 -4.183 15.488 753 HB2 HIS 99 HB2 HIS 99 9.735 -6.460 16.367 754 HB3 HIS 99 HB1 HIS 99 9.387 -7.116 14.773 755 HD1 HIS 99 HD1 HIS 99 11.391 -7.843 13.545 756 HD2 HIS 99 HD2 HIS 99 12.270 -4.820 16.254 757 HE1 HIS 99 HE1 HIS 99 13.876 -7.508 13.398 758 HE2 HIS 99 HE2 HIS 99 14.403 -5.778 15.150 759 H ILE 100 HN ILE 100 9.640 -2.772 13.843 760 HA ILE 100 HA ILE 100 10.584 -3.304 11.315 761 HB ILE 100 HB ILE 100 8.245 -4.434 11.125 762 HG12 ILE 100 HG12 ILE 100 9.035 -2.341 9.085 763 HG13 ILE 100 HG11 ILE 100 9.705 -3.962 9.192 764 HG21 ILE 100 HG21 ILE 100 7.438 -1.535 10.956 765 HG22 ILE 100 HG22 ILE 100 6.895 -2.724 12.142 766 HG23 ILE 100 HG23 ILE 100 6.429 -2.889 10.448 767 HD11 ILE 100 HD11 ILE 100 7.492 -4.888 8.703 768 HD12 ILE 100 HD12 ILE 100 8.061 -3.811 7.426 769 HD13 ILE 100 HD13 ILE 100 6.847 -3.250 8.577 770 H SER 101 HN SER 101 9.931 -1.282 9.812 771 HA SER 101 HA SER 101 9.901 1.075 11.555 772 HB2 SER 101 HB2 SER 101 11.973 0.717 10.200 773 HB3 SER 101 HB1 SER 101 10.998 0.857 8.741 774 HG SER 101 HG SER 101 12.054 2.800 10.257 775 H THR 102 HN THR 102 9.086 3.073 10.264 776 HA THR 102 HA THR 102 6.361 2.745 9.630 777 HB THR 102 HB THR 102 8.217 5.012 8.829 778 HG1 THR 102 HG1 THR 102 7.232 5.907 10.871 779 HG21 THR 102 HG21 THR 102 5.233 4.978 9.281 780 HG22 THR 102 HG22 THR 102 6.038 5.098 7.717 781 HG23 THR 102 HG23 THR 102 6.203 6.400 8.894 782 H TYR 103 HN TYR 103 5.311 2.758 7.587 783 HA TYR 103 HA TYR 103 6.932 1.499 5.532 784 HB2 TYR 103 HB2 TYR 103 4.999 0.266 5.871 785 HB3 TYR 103 HB1 TYR 103 4.003 1.691 6.125 786 HD1 TYR 103 HD1 TYR 103 2.340 1.865 4.573 787 HD2 TYR 103 HD2 TYR 103 6.143 0.444 3.286 788 HE1 TYR 103 HE1 TYR 103 1.498 1.712 2.272 789 HE2 TYR 103 HE2 TYR 103 5.300 0.299 0.979 790 HH TYR 103 HH TYR 103 2.333 1.674 0.005 791 H LEU 104 HN LEU 104 7.759 2.592 3.940 792 HA LEU 104 HA LEU 104 6.530 5.136 3.164 793 HB2 LEU 104 HB2 LEU 104 9.279 4.249 3.503 794 HB3 LEU 104 HB1 LEU 104 9.020 5.035 1.953 795 HG LEU 104 HG LEU 104 8.124 6.310 4.530 796 HD11 LEU 104 HD11 LEU 104 10.519 5.829 4.740 797 HD12 LEU 104 HD12 LEU 104 10.216 7.557 4.564 798 HD13 LEU 104 HD13 LEU 104 10.812 6.625 3.193 799 HD21 LEU 104 HD21 LEU 104 8.851 7.433 1.823 800 HD22 LEU 104 HD22 LEU 104 8.293 8.356 3.218 801 HD23 LEU 104 HD23 LEU 104 7.216 7.197 2.442 802 H PHE 105 HN PHE 105 5.323 5.031 1.489 803 HA PHE 105 HA PHE 105 5.809 3.114 -0.664 804 HB2 PHE 105 HB2 PHE 105 3.530 3.219 0.058 805 HB3 PHE 105 HB1 PHE 105 3.542 4.971 0.080 806 HD1 PHE 105 HD1 PHE 105 3.524 6.217 -2.080 807 HD2 PHE 105 HD2 PHE 105 2.923 2.014 -1.874 808 HE1 PHE 105 HE1 PHE 105 2.493 6.263 -4.299 809 HE2 PHE 105 HE2 PHE 105 1.891 2.057 -4.108 810 HZ PHE 105 HZ PHE 105 1.666 4.190 -5.321 811 H THR 106 HN THR 106 7.214 3.815 -2.203 812 HA THR 106 HA THR 106 7.290 6.717 -2.682 813 HB THR 106 HB THR 106 9.646 4.843 -2.852 814 HG1 THR 106 HG1 THR 106 8.943 5.078 -0.696 815 HG21 THR 106 HG21 THR 106 10.948 6.935 -2.882 816 HG22 THR 106 HG22 THR 106 9.444 7.860 -2.896 817 HG23 THR 106 HG23 THR 106 9.855 6.821 -4.261 818 H PHE 107 HN PHE 107 6.881 7.357 -4.649 819 HA PHE 107 HA PHE 107 7.304 5.483 -6.881 820 HB2 PHE 107 HB2 PHE 107 5.025 7.054 -6.157 821 HB3 PHE 107 HB1 PHE 107 5.660 7.667 -7.679 822 HD1 PHE 107 HD1 PHE 107 3.361 5.507 -6.341 823 HD2 PHE 107 HD2 PHE 107 6.391 5.628 -9.314 824 HE1 PHE 107 HE1 PHE 107 2.250 3.675 -7.545 825 HE2 PHE 107 HE2 PHE 107 5.291 3.797 -10.526 826 HZ PHE 107 HZ PHE 107 3.217 2.816 -9.643 827 H LYS 108 HN LYS 108 7.510 6.939 -9.013 828 HA LYS 108 HA LYS 108 9.811 8.626 -8.583 829 HB2 LYS 108 HB2 LYS 108 9.812 8.854 -11.066 830 HB3 LYS 108 HB1 LYS 108 9.882 7.185 -10.509 831 HG2 LYS 108 HG2 LYS 108 7.186 8.245 -11.039 832 HG3 LYS 108 HG1 LYS 108 8.234 8.068 -12.448 833 HD2 LYS 108 HD2 LYS 108 7.855 5.858 -10.451 834 HD3 LYS 108 HD1 LYS 108 6.759 6.083 -11.817 835 HE2 LYS 108 HE2 LYS 108 8.522 5.750 -13.381 836 HE3 LYS 108 HE1 LYS 108 9.748 5.838 -12.120 837 HZ1 LYS 108 HZ1 LYS 108 8.979 3.768 -11.224 838 HZ2 LYS 108 HZ2 LYS 108 9.295 3.559 -12.870 839 HZ3 LYS 108 HZ3 LYS 108 7.701 3.697 -12.329 840 H THR 109 HN THR 109 6.409 8.990 -9.180 841 HA THR 109 HA THR 109 6.783 11.900 -9.377 842 HB THR 109 HB THR 109 4.822 11.972 -10.891 843 HG1 THR 109 HG1 THR 109 4.731 9.463 -11.735 844 HG21 THR 109 HG21 THR 109 5.923 11.095 -12.876 845 HG22 THR 109 HG22 THR 109 6.988 10.108 -11.872 846 HG23 THR 109 HG23 THR 109 7.108 11.869 -11.822 847 H ARG 110 HN ARG 110 4.955 13.166 -8.632 848 HA ARG 110 HA ARG 110 3.791 12.170 -6.224 849 HB2 ARG 110 HB2 ARG 110 4.303 14.532 -6.371 850 HB3 ARG 110 HB1 ARG 110 3.287 14.704 -7.798 851 HG2 ARG 110 HG2 ARG 110 1.441 13.793 -6.125 852 HG3 ARG 110 HG1 ARG 110 2.536 14.510 -4.942 853 HD2 ARG 110 HD2 ARG 110 2.430 16.642 -6.138 854 HD3 ARG 110 HD1 ARG 110 1.342 15.918 -7.326 855 HE ARG 110 HE ARG 110 0.679 16.343 -4.479 856 HH11 ARG 110 HH11 ARG 110 -0.272 16.125 -7.844 857 HH12 ARG 110 HH12 ARG 110 -1.947 16.424 -7.519 858 HH21 ARG 110 HH21 ARG 110 -1.533 16.728 -4.050 859 HH22 ARG 110 HH22 ARG 110 -2.668 16.754 -5.362 860 H GLU 111 HN GLU 111 2.732 12.640 -9.529 861 HA GLU 111 HA GLU 111 -0.027 12.462 -9.139 862 HB2 GLU 111 HB2 GLU 111 1.573 11.554 -11.540 863 HB3 GLU 111 HB1 GLU 111 -0.154 11.883 -11.520 864 HG2 GLU 111 HG2 GLU 111 0.302 14.222 -10.976 865 HG3 GLU 111 HG1 GLU 111 2.032 13.887 -11.015 866 H GLU 112 HN GLU 112 2.360 9.925 -9.826 867 HA GLU 112 HA GLU 112 0.600 7.762 -9.980 868 HB2 GLU 112 HB2 GLU 112 3.506 7.999 -9.252 869 HB3 GLU 112 HB1 GLU 112 2.685 6.446 -9.159 870 HG2 GLU 112 HG2 GLU 112 3.119 8.160 -11.587 871 HG3 GLU 112 HG1 GLU 112 3.794 6.568 -11.246 872 H ARG 113 HN ARG 113 2.354 9.057 -7.166 873 HA ARG 113 HA ARG 113 1.253 7.097 -5.404 874 HB2 ARG 113 HB2 ARG 113 2.448 8.199 -3.650 875 HB3 ARG 113 HB1 ARG 113 3.479 8.216 -5.070 876 HG2 ARG 113 HG2 ARG 113 3.772 10.345 -4.290 877 HG3 ARG 113 HG1 ARG 113 2.437 10.597 -5.417 878 HD2 ARG 113 HD2 ARG 113 0.879 10.287 -3.479 879 HD3 ARG 113 HD1 ARG 113 2.289 10.307 -2.424 880 HE ARG 113 HE ARG 113 2.670 12.596 -3.568 881 HH11 ARG 113 HH11 ARG 113 -0.408 11.182 -2.690 882 HH12 ARG 113 HH12 ARG 113 -1.179 12.702 -2.386 883 HH21 ARG 113 HH21 ARG 113 1.648 14.621 -3.153 884 HH22 ARG 113 HH22 ARG 113 -0.009 14.658 -2.649 885 H GLU 114 HN GLU 114 0.351 10.290 -6.415 886 HA GLU 114 HA GLU 114 -1.416 11.023 -4.380 887 HB2 GLU 114 HB2 GLU 114 -0.608 12.062 -6.827 888 HB3 GLU 114 HB1 GLU 114 -2.328 11.782 -7.045 889 HG2 GLU 114 HG2 GLU 114 -1.195 13.309 -4.722 890 HG3 GLU 114 HG1 GLU 114 -1.665 14.067 -6.241 891 H SER 115 HN SER 115 -2.102 9.396 -7.471 892 HA SER 115 HA SER 115 -4.817 8.936 -7.054 893 HB2 SER 115 HB2 SER 115 -3.665 8.603 -9.229 894 HB3 SER 115 HB1 SER 115 -2.863 7.179 -8.570 895 HG SER 115 HG SER 115 -5.333 7.412 -9.623 896 H TRP 116 HN TRP 116 -2.012 6.901 -6.280 897 HA TRP 116 HA TRP 116 -3.375 4.686 -5.301 898 HB2 TRP 116 HB2 TRP 116 -0.909 4.913 -5.812 899 HB3 TRP 116 HB1 TRP 116 -0.737 5.726 -4.262 900 HD1 TRP 116 HD1 TRP 116 -1.206 2.309 -5.818 901 HE1 TRP 116 HE1 TRP 116 -0.877 0.506 -4.019 902 HE3 TRP 116 HE3 TRP 116 -1.065 5.315 -1.680 903 HZ2 TRP 116 HZ2 TRP 116 -0.601 0.375 -1.219 904 HZ3 TRP 116 HZ3 TRP 116 -0.767 4.263 0.519 905 HH2 TRP 116 HH2 TRP 116 -0.541 1.845 0.747 906 H GLN 117 HN GLN 117 -1.959 7.388 -3.421 907 HA GLN 117 HA GLN 117 -2.928 6.702 -0.927 908 HB2 GLN 117 HB2 GLN 117 -1.368 8.444 -0.970 909 HB3 GLN 117 HB1 GLN 117 -2.258 9.346 -2.188 910 HG2 GLN 117 HG2 GLN 117 -4.035 9.744 -0.473 911 HG3 GLN 117 HG1 GLN 117 -2.962 9.009 0.718 912 HE21 GLN 117 HE21 GLN 117 -1.190 10.139 1.439 913 HE22 GLN 117 HE22 GLN 117 -0.922 11.808 1.074 914 H ASN 118 HN ASN 118 -4.529 8.700 -3.414 915 HA ASN 118 HA ASN 118 -6.790 9.354 -1.873 916 HB2 ASN 118 HB2 ASN 118 -6.379 9.154 -4.853 917 HB3 ASN 118 HB1 ASN 118 -7.928 9.610 -4.160 918 HD21 ASN 118 HD21 ASN 118 -4.829 10.550 -2.798 919 HD22 ASN 118 HD22 ASN 118 -4.946 12.231 -3.198 920 H ASN 119 HN ASN 119 -6.197 6.693 -4.123 921 HA ASN 119 HA ASN 119 -8.706 5.443 -3.913 922 HB2 ASN 119 HB2 ASN 119 -5.979 4.274 -4.504 923 HB3 ASN 119 HB1 ASN 119 -7.488 3.391 -4.684 924 HD21 ASN 119 HD21 ASN 119 -5.393 4.199 -6.601 925 HD22 ASN 119 HD22 ASN 119 -6.212 5.057 -7.851 926 H LEU 120 HN LEU 120 -5.643 4.729 -2.245 927 HA LEU 120 HA LEU 120 -6.692 2.591 -0.738 928 HB2 LEU 120 HB2 LEU 120 -4.261 3.049 -1.264 929 HB3 LEU 120 HB1 LEU 120 -4.297 4.275 -0.016 930 HG LEU 120 HG LEU 120 -3.351 1.935 0.560 931 HD11 LEU 120 HD11 LEU 120 -3.744 3.686 2.210 932 HD12 LEU 120 HD12 LEU 120 -4.147 2.094 2.850 933 HD13 LEU 120 HD13 LEU 120 -5.430 3.188 2.338 934 HD21 LEU 120 HD21 LEU 120 -5.231 0.664 -0.389 935 HD22 LEU 120 HD22 LEU 120 -6.294 1.358 0.837 936 HD23 LEU 120 HD23 LEU 120 -4.963 0.305 1.317 937 H GLU 121 HN GLU 121 -6.263 6.038 0.012 938 HA GLU 121 HA GLU 121 -6.957 5.854 2.729 939 HB2 GLU 121 HB2 GLU 121 -5.946 7.874 1.628 940 HB3 GLU 121 HB1 GLU 121 -7.520 8.210 0.920 941 HG2 GLU 121 HG2 GLU 121 -8.467 8.342 3.206 942 HG3 GLU 121 HG1 GLU 121 -6.840 8.141 3.851 943 H SER 122 HN SER 122 -8.934 6.279 -0.178 944 HA SER 122 HA SER 122 -11.400 6.594 1.193 945 HB2 SER 122 HB2 SER 122 -10.869 5.603 -1.623 946 HB3 SER 122 HB1 SER 122 -12.429 6.146 -1.002 947 HG SER 122 HG SER 122 -10.133 7.629 -1.632 948 H PHE 123 HN PHE 123 -9.764 3.776 -0.208 949 HA PHE 123 HA PHE 123 -11.713 1.858 0.460 950 HB2 PHE 123 HB2 PHE 123 -9.791 1.466 -1.071 951 HB3 PHE 123 HB1 PHE 123 -8.704 1.526 0.307 952 HD1 PHE 123 HD1 PHE 123 -12.004 -0.152 0.237 953 HD2 PHE 123 HD2 PHE 123 -7.774 -0.624 0.155 954 HE1 PHE 123 HE1 PHE 123 -12.269 -2.578 0.536 955 HE2 PHE 123 HE2 PHE 123 -8.038 -3.046 0.461 956 HZ PHE 123 HZ PHE 123 -10.285 -4.025 0.651 957 H ARG 124 HN ARG 124 -9.042 3.264 2.240 958 HA ARG 124 HA ARG 124 -9.331 1.748 4.610 959 HB2 ARG 124 HB2 ARG 124 -7.275 2.888 4.232 960 HB3 ARG 124 HB1 ARG 124 -8.091 4.428 4.008 961 HG2 ARG 124 HG2 ARG 124 -8.663 4.497 6.362 962 HG3 ARG 124 HG1 ARG 124 -7.925 2.909 6.601 963 HD2 ARG 124 HD2 ARG 124 -5.774 3.717 6.263 964 HD3 ARG 124 HD1 ARG 124 -6.343 5.164 5.434 965 HE ARG 124 HE ARG 124 -6.533 6.209 7.450 966 HH11 ARG 124 HH11 ARG 124 -6.413 2.755 8.054 967 HH12 ARG 124 HH12 ARG 124 -6.167 2.942 9.758 968 HH21 ARG 124 HH21 ARG 124 -6.210 6.442 9.679 969 HH22 ARG 124 HH22 ARG 124 -6.044 5.037 10.684 970 H LYS 125 HN LYS 125 -10.848 4.720 3.450 971 HA LYS 125 HA LYS 125 -12.068 5.493 5.859 972 HB2 LYS 125 HB2 LYS 125 -13.128 5.885 3.054 973 HB3 LYS 125 HB1 LYS 125 -13.689 6.728 4.490 974 HG2 LYS 125 HG2 LYS 125 -11.567 7.834 4.731 975 HG3 LYS 125 HG1 LYS 125 -10.889 6.896 3.398 976 HD2 LYS 125 HD2 LYS 125 -12.759 7.897 1.974 977 HD3 LYS 125 HD1 LYS 125 -13.001 9.031 3.302 978 HE2 LYS 125 HE2 LYS 125 -10.377 8.612 1.880 979 HE3 LYS 125 HE1 LYS 125 -11.529 9.880 1.476 980 HZ1 LYS 125 HZ1 LYS 125 -9.693 10.595 2.954 981 HZ2 LYS 125 HZ2 LYS 125 -10.296 9.564 4.154 982 HZ3 LYS 125 HZ3 LYS 125 -11.235 10.860 3.608 983 H ILE 126 HN ILE 126 -12.954 3.091 3.480 984 HA ILE 126 HA ILE 126 -15.583 2.629 4.399 985 HB ILE 126 HB ILE 126 -13.725 0.692 3.021 986 HG12 ILE 126 HG12 ILE 126 -15.776 2.548 1.798 987 HG13 ILE 126 HG11 ILE 126 -14.044 2.857 1.808 988 HG21 ILE 126 HG21 ILE 126 -16.733 0.749 3.198 989 HG22 ILE 126 HG22 ILE 126 -15.668 -0.369 4.052 990 HG23 ILE 126 HG23 ILE 126 -15.768 -0.415 2.292 991 HD11 ILE 126 HD11 ILE 126 -14.836 1.940 -0.320 992 HD12 ILE 126 HD12 ILE 126 -15.362 0.479 0.522 993 HD13 ILE 126 HD13 ILE 126 -13.651 0.900 0.468 994 H MET 127 HN MET 127 -12.453 1.573 5.500 995 HA MET 127 HA MET 127 -13.671 -0.510 7.171 996 HB2 MET 127 HB2 MET 127 -10.780 0.022 6.455 997 HB3 MET 127 HB1 MET 127 -11.328 -1.286 7.494 998 HG2 MET 127 HG2 MET 127 -12.535 -2.290 5.668 999 HG3 MET 127 HG1 MET 127 -12.143 -0.931 4.619 1000 HE1 MET 127 HE1 MET 127 -9.854 -0.478 3.546 1001 HE2 MET 127 HE2 MET 127 -8.372 -1.362 3.914 1002 HE3 MET 127 HE3 MET 127 -9.099 -0.315 5.133 1003 H SER 128 HN SER 128 -11.517 2.297 7.380 1004 HA SER 128 HA SER 128 -11.404 2.065 10.280 1005 HB2 SER 128 HB2 SER 128 -10.072 4.070 8.444 1006 HB3 SER 128 HB1 SER 128 -9.692 3.788 10.145 1007 HG SER 128 HG SER 128 -9.241 1.545 9.426 1008 H MET 129 HN MET 129 -12.637 4.231 7.786 1009 HA MET 129 HA MET 129 -13.948 5.854 9.848 1010 HB2 MET 129 HB2 MET 129 -13.631 6.301 6.859 1011 HB3 MET 129 HB1 MET 129 -14.543 7.360 7.932 1012 HG2 MET 129 HG2 MET 129 -12.526 7.855 9.194 1013 HG3 MET 129 HG1 MET 129 -11.604 6.761 8.165 1014 HE1 MET 129 HE1 MET 129 -13.532 10.680 6.660 1015 HE2 MET 129 HE2 MET 129 -13.695 10.069 8.306 1016 HE3 MET 129 HE3 MET 129 -14.469 9.218 6.969 1017 H LYS 130 HN LYS 130 -14.706 3.174 9.361 1018 HA LYS 130 HA LYS 130 -16.812 2.858 7.537 1019 HB2 LYS 130 HB2 LYS 130 -15.497 1.015 8.583 1020 HB3 LYS 130 HB1 LYS 130 -16.336 1.319 10.096 1021 HG2 LYS 130 HG2 LYS 130 -18.485 0.860 8.872 1022 HG3 LYS 130 HG1 LYS 130 -17.497 0.310 7.516 1023 HD2 LYS 130 HD2 LYS 130 -17.466 -0.821 10.313 1024 HD3 LYS 130 HD1 LYS 130 -18.212 -1.568 8.900 1025 HE2 LYS 130 HE2 LYS 130 -16.018 -1.722 7.827 1026 HE3 LYS 130 HE1 LYS 130 -15.274 -0.973 9.239 1027 HZ1 LYS 130 HZ1 LYS 130 -16.730 -3.556 9.235 1028 HZ2 LYS 130 HZ2 LYS 130 -15.989 -2.843 10.575 1029 HZ3 LYS 130 HZ3 LYS 130 -15.049 -3.380 9.278 Start of MODEL 7 1 H1 SER 12 HT1 SER 12 -21.504 -9.826 -3.558 2 H2 SER 12 HT2 SER 12 -20.207 -9.497 -2.519 3 H3 SER 12 HT3 SER 12 -21.046 -8.232 -3.251 4 HA SER 12 HA SER 12 -22.229 -10.125 -1.330 5 HB2 SER 12 HB2 SER 12 -22.175 -8.237 0.262 6 HB3 SER 12 HB1 SER 12 -20.556 -8.703 -0.248 7 HG SER 12 HG SER 12 -21.728 -6.320 -0.423 8 H ALA 13 HN ALA 13 -22.648 -6.754 -2.347 9 HA ALA 13 HA ALA 13 -25.418 -7.406 -3.105 10 HB1 ALA 13 HB1 ALA 13 -25.939 -5.026 -2.722 11 HB2 ALA 13 HB2 ALA 13 -24.283 -4.768 -2.179 12 HB3 ALA 13 HB3 ALA 13 -25.355 -5.824 -1.260 13 H LYS 14 HN LYS 14 -23.019 -4.872 -3.821 14 HA LYS 14 HA LYS 14 -22.770 -5.665 -6.549 15 HB2 LYS 14 HB2 LYS 14 -23.764 -3.677 -7.562 16 HB3 LYS 14 HB1 LYS 14 -24.965 -4.568 -6.637 17 HG2 LYS 14 HG2 LYS 14 -24.026 -2.807 -4.777 18 HG3 LYS 14 HG1 LYS 14 -23.938 -1.860 -6.264 19 HD2 LYS 14 HD2 LYS 14 -26.314 -2.562 -6.718 20 HD3 LYS 14 HD1 LYS 14 -26.348 -3.225 -5.081 21 HE2 LYS 14 HE2 LYS 14 -27.297 -1.045 -4.986 22 HE3 LYS 14 HE1 LYS 14 -25.700 -0.955 -4.248 23 HZ1 LYS 14 HZ1 LYS 14 -26.064 0.912 -5.707 24 HZ2 LYS 14 HZ2 LYS 14 -26.397 -0.111 -7.008 25 HZ3 LYS 14 HZ3 LYS 14 -24.844 -0.068 -6.346 26 H ASP 15 HN ASP 15 -21.197 -4.805 -4.068 27 HA ASP 15 HA ASP 15 -19.204 -3.156 -5.143 28 HB2 ASP 15 HB2 ASP 15 -21.480 -1.746 -3.837 29 HB3 ASP 15 HB1 ASP 15 -19.861 -1.176 -3.466 30 H ILE 16 HN ILE 16 -20.995 -3.830 -2.155 31 HA ILE 16 HA ILE 16 -19.261 -2.500 -0.484 32 HB ILE 16 HB ILE 16 -21.170 -4.726 0.199 33 HG12 ILE 16 HG12 ILE 16 -22.431 -2.718 1.189 34 HG13 ILE 16 HG11 ILE 16 -21.336 -1.714 0.252 35 HG21 ILE 16 HG21 ILE 16 -19.467 -4.595 1.926 36 HG22 ILE 16 HG22 ILE 16 -20.999 -3.957 2.524 37 HG23 ILE 16 HG23 ILE 16 -19.707 -2.852 2.054 38 HD11 ILE 16 HD11 ILE 16 -23.572 -2.138 -0.774 39 HD12 ILE 16 HD12 ILE 16 -23.087 -3.821 -0.973 40 HD13 ILE 16 HD13 ILE 16 -22.194 -2.541 -1.792 41 H LYS 17 HN LYS 17 -19.501 -6.092 -0.223 42 HA LYS 17 HA LYS 17 -17.120 -6.026 1.350 43 HB2 LYS 17 HB2 LYS 17 -18.748 -8.325 0.289 44 HB3 LYS 17 HB1 LYS 17 -17.357 -8.528 1.340 45 HG2 LYS 17 HG2 LYS 17 -19.841 -6.975 2.040 46 HG3 LYS 17 HG1 LYS 17 -19.498 -8.631 2.542 47 HD2 LYS 17 HD2 LYS 17 -17.864 -6.187 3.241 48 HD3 LYS 17 HD1 LYS 17 -18.962 -7.045 4.322 49 HE2 LYS 17 HE2 LYS 17 -17.572 -9.064 4.098 50 HE3 LYS 17 HE1 LYS 17 -16.463 -8.171 3.060 51 HZ1 LYS 17 HZ1 LYS 17 -15.639 -8.261 5.311 52 HZ2 LYS 17 HZ2 LYS 17 -17.061 -7.560 5.901 53 HZ3 LYS 17 HZ3 LYS 17 -16.026 -6.665 4.910 54 H ASP 18 HN ASP 18 -17.753 -7.940 -1.595 55 HA ASP 18 HA ASP 18 -14.913 -8.418 -1.804 56 HB2 ASP 18 HB2 ASP 18 -15.550 -9.983 -3.626 57 HB3 ASP 18 HB1 ASP 18 -16.345 -10.319 -2.095 58 H GLU 19 HN GLU 19 -17.352 -6.644 -3.577 59 HA GLU 19 HA GLU 19 -15.864 -6.431 -5.969 60 HB2 GLU 19 HB2 GLU 19 -18.324 -5.107 -4.899 61 HB3 GLU 19 HB1 GLU 19 -17.565 -4.488 -6.368 62 HG2 GLU 19 HG2 GLU 19 -18.498 -7.312 -5.929 63 HG3 GLU 19 HG1 GLU 19 -19.356 -6.077 -6.849 64 H LYS 20 HN LYS 20 -16.328 -4.119 -3.291 65 HA LYS 20 HA LYS 20 -14.800 -2.057 -4.440 66 HB2 LYS 20 HB2 LYS 20 -16.074 -2.569 -1.910 67 HB3 LYS 20 HB1 LYS 20 -14.482 -1.862 -1.655 68 HG2 LYS 20 HG2 LYS 20 -16.298 -0.191 -1.800 69 HG3 LYS 20 HG1 LYS 20 -15.039 0.032 -3.015 70 HD2 LYS 20 HD2 LYS 20 -16.470 -1.157 -4.651 71 HD3 LYS 20 HD1 LYS 20 -17.737 -1.248 -3.430 72 HE2 LYS 20 HE2 LYS 20 -16.529 1.301 -4.491 73 HE3 LYS 20 HE1 LYS 20 -18.058 0.607 -5.027 74 HZ1 LYS 20 HZ1 LYS 20 -18.873 0.817 -2.739 75 HZ2 LYS 20 HZ2 LYS 20 -18.457 2.311 -3.408 76 HZ3 LYS 20 HZ3 LYS 20 -17.427 1.570 -2.293 77 H ILE 21 HN ILE 21 -13.882 -4.792 -2.416 78 HA ILE 21 HA ILE 21 -11.194 -4.111 -2.031 79 HB ILE 21 HB ILE 21 -12.451 -6.845 -2.311 80 HG12 ILE 21 HG12 ILE 21 -11.613 -5.284 0.148 81 HG13 ILE 21 HG11 ILE 21 -13.272 -5.463 -0.423 82 HG21 ILE 21 HG21 ILE 21 -9.705 -6.107 -1.297 83 HG22 ILE 21 HG22 ILE 21 -10.067 -6.970 -2.792 84 HG23 ILE 21 HG23 ILE 21 -10.427 -7.716 -1.235 85 HD11 ILE 21 HD11 ILE 21 -11.460 -7.668 0.526 86 HD12 ILE 21 HD12 ILE 21 -13.103 -7.884 -0.081 87 HD13 ILE 21 HD13 ILE 21 -12.824 -6.974 1.404 88 H GLN 22 HN GLN 22 -12.746 -5.993 -4.620 89 HA GLN 22 HA GLN 22 -10.334 -6.500 -6.032 90 HB2 GLN 22 HB2 GLN 22 -13.188 -6.539 -7.023 91 HB3 GLN 22 HB1 GLN 22 -11.805 -7.229 -7.862 92 HG2 GLN 22 HG2 GLN 22 -11.458 -8.776 -5.997 93 HG3 GLN 22 HG1 GLN 22 -12.870 -8.096 -5.186 94 HE21 GLN 22 HE21 GLN 22 -14.914 -8.527 -5.990 95 HE22 GLN 22 HE22 GLN 22 -15.209 -9.811 -7.108 96 H GLN 23 HN GLN 23 -12.854 -4.054 -6.332 97 HA GLN 23 HA GLN 23 -12.027 -2.823 -8.698 98 HB2 GLN 23 HB2 GLN 23 -14.153 -2.363 -7.455 99 HB3 GLN 23 HB1 GLN 23 -13.216 -1.456 -6.277 100 HG2 GLN 23 HG2 GLN 23 -12.428 -0.022 -8.199 101 HG3 GLN 23 HG1 GLN 23 -13.667 -0.812 -9.170 102 HE21 GLN 23 HE21 GLN 23 -13.415 1.982 -8.438 103 HE22 GLN 23 HE22 GLN 23 -14.868 2.396 -7.596 104 H TYR 24 HN TYR 24 -11.310 -1.875 -5.348 105 HA TYR 24 HA TYR 24 -9.447 0.108 -6.103 106 HB2 TYR 24 HB2 TYR 24 -10.122 -1.223 -3.503 107 HB3 TYR 24 HB1 TYR 24 -8.732 -0.144 -3.618 108 HD1 TYR 24 HD1 TYR 24 -12.372 -0.378 -3.691 109 HD2 TYR 24 HD2 TYR 24 -9.046 2.248 -4.025 110 HE1 TYR 24 HE1 TYR 24 -13.872 1.545 -3.397 111 HE2 TYR 24 HE2 TYR 24 -10.540 4.181 -3.732 112 HH TYR 24 HH TYR 24 -13.716 3.895 -2.626 113 H ARG 25 HN ARG 25 -9.068 -3.283 -5.151 114 HA ARG 25 HA ARG 25 -6.326 -3.468 -4.922 115 HB2 ARG 25 HB2 ARG 25 -7.881 -5.331 -4.530 116 HB3 ARG 25 HB1 ARG 25 -8.167 -5.445 -6.259 117 HG2 ARG 25 HG2 ARG 25 -5.831 -6.031 -6.616 118 HG3 ARG 25 HG1 ARG 25 -5.538 -5.906 -4.879 119 HD2 ARG 25 HD2 ARG 25 -5.841 -8.229 -5.565 120 HD3 ARG 25 HD1 ARG 25 -7.118 -7.710 -4.466 121 HE ARG 25 HE ARG 25 -7.926 -7.361 -7.161 122 HH11 ARG 25 HH11 ARG 25 -7.365 -9.856 -4.774 123 HH12 ARG 25 HH12 ARG 25 -8.547 -10.939 -5.436 124 HH21 ARG 25 HH21 ARG 25 -9.485 -8.785 -8.045 125 HH22 ARG 25 HH22 ARG 25 -9.742 -10.336 -7.309 126 H LYS 26 HN LYS 26 -8.290 -3.298 -7.816 127 HA LYS 26 HA LYS 26 -6.430 -3.931 -9.790 128 HB2 LYS 26 HB2 LYS 26 -8.807 -3.702 -10.231 129 HB3 LYS 26 HB1 LYS 26 -8.747 -1.996 -9.816 130 HG2 LYS 26 HG2 LYS 26 -7.290 -1.597 -11.756 131 HG3 LYS 26 HG1 LYS 26 -7.439 -3.302 -12.190 132 HD2 LYS 26 HD2 LYS 26 -9.001 -2.005 -13.497 133 HD3 LYS 26 HD1 LYS 26 -9.889 -3.010 -12.352 134 HE2 LYS 26 HE2 LYS 26 -10.875 -0.815 -12.392 135 HE3 LYS 26 HE1 LYS 26 -10.074 -1.052 -10.841 136 HZ1 LYS 26 HZ1 LYS 26 -9.598 1.131 -11.698 137 HZ2 LYS 26 HZ2 LYS 26 -9.013 0.489 -13.149 138 HZ3 LYS 26 HZ3 LYS 26 -8.176 0.215 -11.706 139 H THR 27 HN THR 27 -7.287 -0.739 -8.478 140 HA THR 27 HA THR 27 -5.254 0.546 -10.075 141 HB THR 27 HB THR 27 -7.403 1.661 -9.740 142 HG1 THR 27 HG1 THR 27 -4.981 2.782 -9.147 143 HG21 THR 27 HG21 THR 27 -7.984 0.884 -7.535 144 HG22 THR 27 HG22 THR 27 -7.954 2.650 -7.538 145 HG23 THR 27 HG23 THR 27 -6.613 1.745 -6.833 146 H LEU 28 HN LEU 28 -5.518 -0.815 -6.979 147 HA LEU 28 HA LEU 28 -3.597 0.797 -5.615 148 HB2 LEU 28 HB2 LEU 28 -5.259 -1.548 -5.065 149 HB3 LEU 28 HB1 LEU 28 -3.711 -1.584 -4.246 150 HG LEU 28 HG LEU 28 -5.534 -0.653 -2.855 151 HD11 LEU 28 HD11 LEU 28 -3.257 -0.026 -2.382 152 HD12 LEU 28 HD12 LEU 28 -4.322 1.354 -2.120 153 HD13 LEU 28 HD13 LEU 28 -3.330 1.270 -3.575 154 HD21 LEU 28 HD21 LEU 28 -6.827 0.444 -4.624 155 HD22 LEU 28 HD22 LEU 28 -5.526 1.611 -4.855 156 HD23 LEU 28 HD23 LEU 28 -6.414 1.571 -3.331 157 H THR 29 HN THR 29 -3.410 -1.998 -7.686 158 HA THR 29 HA THR 29 -0.903 -2.948 -6.716 159 HB THR 29 HB THR 29 -2.053 -3.462 -9.462 160 HG1 THR 29 HG1 THR 29 -3.595 -4.023 -7.855 161 HG21 THR 29 HG21 THR 29 -0.787 -5.578 -9.256 162 HG22 THR 29 HG22 THR 29 -0.139 -5.028 -7.709 163 HG23 THR 29 HG23 THR 29 0.266 -4.167 -9.193 164 H LYS 30 HN LYS 30 0.857 -1.761 -6.804 165 HA LYS 30 HA LYS 30 1.573 -0.411 -9.309 166 HB2 LYS 30 HB2 LYS 30 1.518 0.844 -6.564 167 HB3 LYS 30 HB1 LYS 30 2.356 1.551 -7.935 168 HG2 LYS 30 HG2 LYS 30 -0.595 0.971 -7.904 169 HG3 LYS 30 HG1 LYS 30 0.112 2.523 -7.453 170 HD2 LYS 30 HD2 LYS 30 1.224 2.507 -9.737 171 HD3 LYS 30 HD1 LYS 30 0.156 1.162 -10.135 172 HE2 LYS 30 HE2 LYS 30 -1.784 2.526 -9.762 173 HE3 LYS 30 HE1 LYS 30 -0.786 3.849 -9.160 174 HZ1 LYS 30 HZ1 LYS 30 -1.469 4.231 -11.441 175 HZ2 LYS 30 HZ2 LYS 30 -0.750 2.782 -11.929 176 HZ3 LYS 30 HZ3 LYS 30 0.216 4.051 -11.356 177 H ILE 31 HN ILE 31 3.785 -0.339 -9.732 178 HA ILE 31 HA ILE 31 5.534 -1.858 -7.971 179 HB ILE 31 HB ILE 31 6.136 -0.442 -10.580 180 HG12 ILE 31 HG12 ILE 31 4.604 -2.410 -10.757 181 HG13 ILE 31 HG11 ILE 31 6.129 -2.625 -11.609 182 HG21 ILE 31 HG21 ILE 31 7.864 -2.335 -8.982 183 HG22 ILE 31 HG22 ILE 31 8.120 -0.600 -9.167 184 HG23 ILE 31 HG23 ILE 31 8.255 -1.665 -10.566 185 HD11 ILE 31 HD11 ILE 31 5.435 -3.770 -8.917 186 HD12 ILE 31 HD12 ILE 31 6.964 -3.985 -9.767 187 HD13 ILE 31 HD13 ILE 31 5.477 -4.647 -10.446 188 H VAL 32 HN VAL 32 6.358 -0.845 -6.256 189 HA VAL 32 HA VAL 32 7.178 1.967 -6.543 190 HB VAL 32 HB VAL 32 6.245 2.543 -4.396 191 HG11 VAL 32 HG11 VAL 32 3.872 2.398 -4.909 192 HG12 VAL 32 HG12 VAL 32 4.193 1.125 -6.086 193 HG13 VAL 32 HG13 VAL 32 4.807 2.755 -6.361 194 HG21 VAL 32 HG21 VAL 32 6.499 0.446 -3.218 195 HG22 VAL 32 HG22 VAL 32 5.299 -0.321 -4.261 196 HG23 VAL 32 HG23 VAL 32 4.811 0.957 -3.146 197 H LYS 33 HN LYS 33 8.391 2.626 -4.455 198 HA LYS 33 HA LYS 33 10.356 0.509 -3.904 199 HB2 LYS 33 HB2 LYS 33 10.709 3.488 -3.568 200 HB3 LYS 33 HB1 LYS 33 11.963 2.253 -3.556 201 HG2 LYS 33 HG2 LYS 33 11.823 1.911 -5.866 202 HG3 LYS 33 HG1 LYS 33 10.255 2.717 -5.976 203 HD2 LYS 33 HD2 LYS 33 11.321 4.831 -5.355 204 HD3 LYS 33 HD1 LYS 33 12.889 4.033 -5.330 205 HE2 LYS 33 HE2 LYS 33 11.076 4.283 -7.729 206 HE3 LYS 33 HE1 LYS 33 12.492 5.281 -7.412 207 HZ1 LYS 33 HZ1 LYS 33 12.490 2.349 -7.868 208 HZ2 LYS 33 HZ2 LYS 33 13.855 3.270 -7.489 209 HZ3 LYS 33 HZ3 LYS 33 13.039 3.532 -8.943 210 H ILE 34 HN ILE 34 10.114 -0.400 -1.990 211 HA ILE 34 HA ILE 34 8.702 1.038 0.104 212 HB ILE 34 HB ILE 34 9.080 -1.780 -0.582 213 HG12 ILE 34 HG12 ILE 34 7.043 -0.186 0.953 214 HG13 ILE 34 HG11 ILE 34 6.950 -0.673 -0.733 215 HG21 ILE 34 HG21 ILE 34 10.400 -1.736 1.502 216 HG22 ILE 34 HG22 ILE 34 8.909 -2.666 1.665 217 HG23 ILE 34 HG23 ILE 34 9.010 -1.039 2.339 218 HD11 ILE 34 HD11 ILE 34 6.945 -3.048 0.067 219 HD12 ILE 34 HD12 ILE 34 5.525 -2.101 0.504 220 HD13 ILE 34 HD13 ILE 34 6.778 -2.417 1.704 221 H LYS 35 HN LYS 35 9.476 1.376 2.123 222 HA LYS 35 HA LYS 35 12.312 0.821 2.616 223 HB2 LYS 35 HB2 LYS 35 10.910 3.464 2.648 224 HB3 LYS 35 HB1 LYS 35 12.241 3.193 3.759 225 HG2 LYS 35 HG2 LYS 35 13.763 2.817 1.978 226 HG3 LYS 35 HG1 LYS 35 12.457 2.754 0.795 227 HD2 LYS 35 HD2 LYS 35 12.986 5.202 2.449 228 HD3 LYS 35 HD1 LYS 35 13.832 4.907 0.926 229 HE2 LYS 35 HE2 LYS 35 11.586 4.669 -0.156 230 HE3 LYS 35 HE1 LYS 35 10.871 5.203 1.362 231 HZ1 LYS 35 HZ1 LYS 35 12.068 7.281 1.166 232 HZ2 LYS 35 HZ2 LYS 35 11.129 7.025 -0.217 233 HZ3 LYS 35 HZ3 LYS 35 12.795 6.763 -0.269 234 H THR 36 HN THR 36 12.248 -0.549 4.291 235 HA THR 36 HA THR 36 10.514 0.115 6.582 236 HB THR 36 HB THR 36 10.122 -2.253 6.983 237 HG1 THR 36 HG1 THR 36 11.317 -2.929 4.513 238 HG21 THR 36 HG21 THR 36 9.576 -1.634 4.086 239 HG22 THR 36 HG22 THR 36 8.599 -1.048 5.435 240 HG23 THR 36 HG23 THR 36 8.705 -2.781 5.103 241 H ALA 37 HN ALA 37 11.303 -1.649 8.426 242 HA ALA 37 HA ALA 37 14.056 -0.963 8.984 243 HB1 ALA 37 HB1 ALA 37 12.148 -2.684 10.567 244 HB2 ALA 37 HB2 ALA 37 12.375 -0.950 10.785 245 HB3 ALA 37 HB3 ALA 37 13.700 -2.061 11.125 246 H ILE 38 HN ILE 38 12.310 -3.526 7.572 247 HA ILE 38 HA ILE 38 14.230 -5.590 8.159 248 HB ILE 38 HB ILE 38 12.066 -5.692 6.057 249 HG12 ILE 38 HG12 ILE 38 11.841 -6.433 8.985 250 HG13 ILE 38 HG11 ILE 38 11.108 -5.015 8.245 251 HG21 ILE 38 HG21 ILE 38 13.444 -7.841 7.666 252 HG22 ILE 38 HG22 ILE 38 13.736 -7.468 5.968 253 HG23 ILE 38 HG23 ILE 38 12.170 -8.104 6.475 254 HD11 ILE 38 HD11 ILE 38 9.739 -6.465 6.835 255 HD12 ILE 38 HD12 ILE 38 9.482 -6.787 8.550 256 HD13 ILE 38 HD13 ILE 38 10.472 -7.882 7.586 257 H PHE 39 HN PHE 39 13.125 -3.909 5.232 258 HA PHE 39 HA PHE 39 15.751 -3.581 4.221 259 HB2 PHE 39 HB2 PHE 39 15.251 -4.959 2.079 260 HB3 PHE 39 HB1 PHE 39 15.843 -5.792 3.507 261 HD1 PHE 39 HD1 PHE 39 14.942 -7.876 3.691 262 HD2 PHE 39 HD2 PHE 39 12.457 -4.693 2.356 263 HE1 PHE 39 HE1 PHE 39 13.026 -9.411 3.614 264 HE2 PHE 39 HE2 PHE 39 10.539 -6.218 2.278 265 HZ PHE 39 HZ PHE 39 10.820 -8.585 2.909 266 H HIS 40 HN HIS 40 15.834 -2.198 2.478 267 HA HIS 40 HA HIS 40 13.272 -0.956 1.739 268 HB2 HIS 40 HB2 HIS 40 16.018 0.092 1.038 269 HB3 HIS 40 HB1 HIS 40 14.509 0.984 1.152 270 HD1 HIS 40 HD1 HIS 40 17.417 -0.126 3.135 271 HD2 HIS 40 HD2 HIS 40 13.691 1.557 3.843 272 HE1 HIS 40 HE1 HIS 40 17.487 0.696 5.507 273 HE2 HIS 40 HE2 HIS 40 15.172 1.569 5.958 274 H GLU 41 HN GLU 41 12.424 -1.813 -0.097 275 HA GLU 41 HA GLU 41 14.199 -2.571 -2.295 276 HB2 GLU 41 HB2 GLU 41 12.256 -4.479 -0.973 277 HB3 GLU 41 HB1 GLU 41 13.113 -4.797 -2.473 278 HG2 GLU 41 HG2 GLU 41 14.581 -4.194 0.065 279 HG3 GLU 41 HG1 GLU 41 14.018 -5.818 -0.310 280 H THR 42 HN THR 42 13.156 -2.749 -4.307 281 HA THR 42 HA THR 42 10.720 -1.262 -4.627 282 HB THR 42 HB THR 42 12.115 -2.922 -6.725 283 HG1 THR 42 HG1 THR 42 13.525 -1.376 -5.584 284 HG21 THR 42 HG21 THR 42 10.436 -0.419 -6.916 285 HG22 THR 42 HG22 THR 42 9.902 -2.047 -7.334 286 HG23 THR 42 HG23 THR 42 11.180 -1.271 -8.268 287 H VAL 43 HN VAL 43 8.657 -2.087 -5.091 288 HA VAL 43 HA VAL 43 8.314 -4.977 -5.214 289 HB VAL 43 HB VAL 43 8.550 -4.271 -2.774 290 HG11 VAL 43 HG11 VAL 43 7.300 -2.227 -2.812 291 HG12 VAL 43 HG12 VAL 43 6.488 -3.370 -1.741 292 HG13 VAL 43 HG13 VAL 43 5.850 -3.073 -3.357 293 HG21 VAL 43 HG21 VAL 43 6.033 -5.686 -3.636 294 HG22 VAL 43 HG22 VAL 43 6.748 -5.754 -2.025 295 HG23 VAL 43 HG23 VAL 43 7.622 -6.417 -3.407 296 H LYS 44 HN LYS 44 6.126 -5.632 -5.696 297 HA LYS 44 HA LYS 44 4.477 -3.503 -6.852 298 HB2 LYS 44 HB2 LYS 44 4.997 -5.736 -8.049 299 HB3 LYS 44 HB1 LYS 44 3.883 -6.454 -6.896 300 HG2 LYS 44 HG2 LYS 44 2.085 -5.062 -7.694 301 HG3 LYS 44 HG1 LYS 44 3.181 -4.265 -8.825 302 HD2 LYS 44 HD2 LYS 44 1.844 -5.999 -9.932 303 HD3 LYS 44 HD1 LYS 44 3.567 -6.377 -9.971 304 HE2 LYS 44 HE2 LYS 44 3.267 -7.896 -8.067 305 HE3 LYS 44 HE1 LYS 44 1.545 -7.524 -8.045 306 HZ1 LYS 44 HZ1 LYS 44 3.018 -8.830 -10.268 307 HZ2 LYS 44 HZ2 LYS 44 1.369 -8.454 -10.276 308 HZ3 LYS 44 HZ3 LYS 44 1.970 -9.595 -9.185 309 H VAL 45 HN VAL 45 3.132 -2.578 -5.461 310 HA VAL 45 HA VAL 45 2.248 -4.080 -3.119 311 HB VAL 45 HB VAL 45 3.188 -1.901 -2.654 312 HG11 VAL 45 HG11 VAL 45 2.174 0.166 -3.483 313 HG12 VAL 45 HG12 VAL 45 1.056 -0.777 -4.469 314 HG13 VAL 45 HG13 VAL 45 2.785 -0.829 -4.806 315 HG21 VAL 45 HG21 VAL 45 0.193 -1.831 -2.313 316 HG22 VAL 45 HG22 VAL 45 1.369 -0.894 -1.390 317 HG23 VAL 45 HG23 VAL 45 1.331 -2.651 -1.247 318 H THR 46 HN THR 46 0.246 -4.869 -2.933 319 HA THR 46 HA THR 46 -1.901 -3.629 -4.477 320 HB THR 46 HB THR 46 -1.041 -5.634 -5.747 321 HG1 THR 46 HG1 THR 46 -3.041 -5.401 -6.392 322 HG21 THR 46 HG21 THR 46 -1.661 -7.862 -4.921 323 HG22 THR 46 HG22 THR 46 -2.191 -7.147 -3.398 324 HG23 THR 46 HG23 THR 46 -0.490 -7.082 -3.859 325 H CYS 47 HN CYS 47 -4.055 -4.729 -3.737 326 HA CYS 47 HA CYS 47 -3.982 -4.797 -0.807 327 HB2 CYS 47 HB2 CYS 47 -6.157 -4.171 -2.790 328 HB3 CYS 47 HB1 CYS 47 -6.496 -4.429 -1.091 329 HG CYS 47 HG CYS 47 -4.436 -2.325 -0.552 330 H SER 48 HN SER 48 -5.050 -6.471 0.336 331 HA SER 48 HA SER 48 -4.551 -8.979 -0.922 332 HB2 SER 48 HB2 SER 48 -4.074 -8.493 1.478 333 HB3 SER 48 HB1 SER 48 -5.810 -8.448 1.775 334 HG SER 48 HG SER 48 -4.164 -10.633 1.067 335 H LYS 49 HN LYS 49 -6.142 -10.815 -0.762 336 HA LYS 49 HA LYS 49 -8.483 -10.305 -2.196 337 HB2 LYS 49 HB2 LYS 49 -7.904 -12.635 -0.348 338 HB3 LYS 49 HB1 LYS 49 -9.155 -12.595 -1.582 339 HG2 LYS 49 HG2 LYS 49 -7.488 -12.459 -3.324 340 HG3 LYS 49 HG1 LYS 49 -6.204 -12.371 -2.120 341 HD2 LYS 49 HD2 LYS 49 -6.774 -14.603 -1.325 342 HD3 LYS 49 HD1 LYS 49 -8.094 -14.692 -2.493 343 HE2 LYS 49 HE2 LYS 49 -5.192 -14.339 -3.228 344 HE3 LYS 49 HE1 LYS 49 -6.022 -15.894 -3.190 345 HZ1 LYS 49 HZ1 LYS 49 -7.544 -15.084 -4.877 346 HZ2 LYS 49 HZ2 LYS 49 -5.950 -14.972 -5.423 347 HZ3 LYS 49 HZ3 LYS 49 -6.765 -13.584 -4.905 348 H ASP 50 HN ASP 50 -7.876 -10.525 1.250 349 HA ASP 50 HA ASP 50 -10.631 -10.240 2.014 350 HB2 ASP 50 HB2 ASP 50 -8.022 -10.212 3.510 351 HB3 ASP 50 HB1 ASP 50 -9.533 -9.790 4.308 352 H GLY 51 HN GLY 51 -8.215 -8.119 0.973 353 HA2 GLY 51 HA2 GLY 51 -8.238 -5.835 0.693 354 HA3 GLY 51 HA1 GLY 51 -9.849 -5.816 1.386 355 H LYS 52 HN LYS 52 -8.672 -7.273 3.765 356 HA LYS 52 HA LYS 52 -8.615 -4.937 5.371 357 HB2 LYS 52 HB2 LYS 52 -9.637 -7.095 6.043 358 HB3 LYS 52 HB1 LYS 52 -8.030 -7.801 6.140 359 HG2 LYS 52 HG2 LYS 52 -7.443 -6.268 7.932 360 HG3 LYS 52 HG1 LYS 52 -9.032 -5.506 7.815 361 HD2 LYS 52 HD2 LYS 52 -10.092 -7.631 8.404 362 HD3 LYS 52 HD1 LYS 52 -8.505 -8.394 8.518 363 HE2 LYS 52 HE2 LYS 52 -7.905 -6.894 10.341 364 HE3 LYS 52 HE1 LYS 52 -9.469 -6.091 10.210 365 HZ1 LYS 52 HZ1 LYS 52 -9.059 -8.947 10.905 366 HZ2 LYS 52 HZ2 LYS 52 -10.550 -8.154 10.808 367 HZ3 LYS 52 HZ3 LYS 52 -9.434 -7.715 11.998 368 H MET 53 HN MET 53 -6.175 -6.763 3.836 369 HA MET 53 HA MET 53 -4.186 -5.154 5.244 370 HB2 MET 53 HB2 MET 53 -2.624 -6.973 5.382 371 HB3 MET 53 HB1 MET 53 -4.132 -7.484 6.128 372 HG2 MET 53 HG2 MET 53 -4.700 -8.634 3.985 373 HG3 MET 53 HG1 MET 53 -3.077 -8.252 3.426 374 HE1 MET 53 HE1 MET 53 -0.872 -10.216 6.024 375 HE2 MET 53 HE2 MET 53 -1.431 -8.551 6.183 376 HE3 MET 53 HE3 MET 53 -0.857 -9.144 4.624 377 H LEU 54 HN LEU 54 -2.265 -4.760 4.076 378 HA LEU 54 HA LEU 54 -2.765 -4.630 1.185 379 HB2 LEU 54 HB2 LEU 54 -2.309 -2.568 2.595 380 HB3 LEU 54 HB1 LEU 54 -0.686 -3.180 2.820 381 HG LEU 54 HG LEU 54 -0.400 -3.109 0.327 382 HD11 LEU 54 HD11 LEU 54 -2.750 -3.135 -0.324 383 HD12 LEU 54 HD12 LEU 54 -1.951 -1.687 -0.942 384 HD13 LEU 54 HD13 LEU 54 -2.998 -1.578 0.471 385 HD21 LEU 54 HD21 LEU 54 0.054 -0.751 0.292 386 HD22 LEU 54 HD22 LEU 54 0.433 -1.378 1.893 387 HD23 LEU 54 HD23 LEU 54 -1.058 -0.473 1.631 388 H GLU 55 HN GLU 55 -1.884 -6.376 0.208 389 HA GLU 55 HA GLU 55 0.614 -7.447 1.290 390 HB2 GLU 55 HB2 GLU 55 -1.523 -8.677 -0.428 391 HB3 GLU 55 HB1 GLU 55 0.062 -9.417 -0.245 392 HG2 GLU 55 HG2 GLU 55 -0.290 -9.459 2.202 393 HG3 GLU 55 HG1 GLU 55 -1.923 -8.854 1.950 394 H TRP 56 HN TRP 56 2.441 -7.481 0.173 395 HA TRP 56 HA TRP 56 2.327 -6.471 -2.577 396 HB2 TRP 56 HB2 TRP 56 4.657 -5.468 -1.961 397 HB3 TRP 56 HB1 TRP 56 3.187 -4.620 -1.505 398 HD1 TRP 56 HD1 TRP 56 5.271 -7.385 0.277 399 HE1 TRP 56 HE1 TRP 56 5.688 -6.598 2.694 400 HE3 TRP 56 HE3 TRP 56 2.849 -2.901 0.094 401 HZ2 TRP 56 HZ2 TRP 56 5.064 -4.374 4.304 402 HZ3 TRP 56 HZ3 TRP 56 2.807 -1.508 2.111 403 HH2 TRP 56 HH2 TRP 56 3.888 -2.226 4.173 404 H TYR 57 HN TYR 57 3.681 -7.334 -4.048 405 HA TYR 57 HA TYR 57 5.279 -9.637 -3.141 406 HB2 TYR 57 HB2 TYR 57 3.805 -9.393 -5.780 407 HB3 TYR 57 HB1 TYR 57 4.766 -10.775 -5.247 408 HD1 TYR 57 HD1 TYR 57 1.612 -8.933 -4.778 409 HD2 TYR 57 HD2 TYR 57 3.870 -12.367 -3.672 410 HE1 TYR 57 HE1 TYR 57 -0.398 -9.921 -3.765 411 HE2 TYR 57 HE2 TYR 57 1.862 -13.363 -2.659 412 HH TYR 57 HH TYR 57 -0.293 -12.601 -1.708 413 H LYS 58 HN LYS 58 7.272 -9.747 -3.835 414 HA LYS 58 HA LYS 58 8.945 -7.842 -4.482 415 HB2 LYS 58 HB2 LYS 58 10.295 -9.538 -5.786 416 HB3 LYS 58 HB1 LYS 58 9.789 -10.022 -4.174 417 HG2 LYS 58 HG2 LYS 58 8.024 -10.763 -6.440 418 HG3 LYS 58 HG1 LYS 58 9.557 -11.621 -6.278 419 HD2 LYS 58 HD2 LYS 58 8.990 -12.393 -4.098 420 HD3 LYS 58 HD1 LYS 58 7.589 -11.325 -4.012 421 HE2 LYS 58 HE2 LYS 58 6.990 -13.673 -4.460 422 HE3 LYS 58 HE1 LYS 58 6.471 -12.571 -5.741 423 HZ1 LYS 58 HZ1 LYS 58 8.368 -13.256 -7.055 424 HZ2 LYS 58 HZ2 LYS 58 7.472 -14.617 -6.614 425 HZ3 LYS 58 HZ3 LYS 58 8.927 -14.262 -5.815 426 H GLY 59 HN GLY 59 9.058 -6.278 -5.899 427 HA2 GLY 59 HA2 GLY 59 8.332 -6.806 -8.706 428 HA3 GLY 59 HA1 GLY 59 7.750 -5.361 -7.884 429 H LYS 60 HN LYS 60 10.854 -6.773 -7.344 430 HA LYS 60 HA LYS 60 12.214 -4.319 -7.893 431 HB2 LYS 60 HB2 LYS 60 13.625 -6.936 -7.529 432 HB3 LYS 60 HB1 LYS 60 14.103 -5.339 -6.982 433 HG2 LYS 60 HG2 LYS 60 12.417 -5.398 -5.245 434 HG3 LYS 60 HG1 LYS 60 11.859 -6.970 -5.817 435 HD2 LYS 60 HD2 LYS 60 14.192 -7.823 -5.401 436 HD3 LYS 60 HD1 LYS 60 14.519 -6.293 -4.585 437 HE2 LYS 60 HE2 LYS 60 12.667 -6.748 -3.027 438 HE3 LYS 60 HE1 LYS 60 12.385 -8.290 -3.834 439 HZ1 LYS 60 HZ1 LYS 60 13.705 -8.602 -1.858 440 HZ2 LYS 60 HZ2 LYS 60 14.865 -7.495 -2.402 441 HZ3 LYS 60 HZ3 LYS 60 14.639 -8.961 -3.219 442 H ASN 61 HN ASN 61 14.210 -4.328 -9.280 443 HA ASN 61 HA ASN 61 13.818 -5.688 -11.806 444 HB2 ASN 61 HB2 ASN 61 15.888 -4.537 -12.500 445 HB3 ASN 61 HB1 ASN 61 14.731 -3.405 -11.810 446 HD21 ASN 61 HD21 ASN 61 17.783 -4.990 -11.401 447 HD22 ASN 61 HD22 ASN 61 18.324 -4.040 -10.062 448 H ASP 62 HN ASP 62 15.185 -6.292 -8.824 449 HA ASP 62 HA ASP 62 16.973 -8.390 -9.807 450 HB2 ASP 62 HB2 ASP 62 16.516 -7.290 -7.021 451 HB3 ASP 62 HB1 ASP 62 17.614 -8.612 -7.395 452 H SER 63 HN SER 63 16.815 -10.249 -7.855 453 HA SER 63 HA SER 63 14.129 -11.333 -8.267 454 HB2 SER 63 HB2 SER 63 16.130 -12.665 -8.963 455 HB3 SER 63 HB1 SER 63 16.622 -12.735 -7.273 456 HG SER 63 HG SER 63 15.494 -14.579 -7.630 457 H ASP 64 HN ASP 64 13.207 -12.615 -6.472 458 HA ASP 64 HA ASP 64 13.369 -11.152 -3.977 459 HB2 ASP 64 HB2 ASP 64 11.465 -12.908 -3.456 460 HB3 ASP 64 HB1 ASP 64 11.138 -11.488 -4.443 461 H GLY 65 HN GLY 65 14.555 -11.821 -2.339 462 HA2 GLY 65 HA2 GLY 65 15.661 -14.506 -2.312 463 HA3 GLY 65 HA1 GLY 65 15.994 -13.222 -1.155 464 H LYS 66 HN LYS 66 12.762 -13.247 -1.517 465 HA LYS 66 HA LYS 66 12.384 -14.938 0.848 466 HB2 LYS 66 HB2 LYS 66 11.693 -12.482 0.833 467 HB3 LYS 66 HB1 LYS 66 10.432 -12.944 -0.303 468 HG2 LYS 66 HG2 LYS 66 9.446 -12.896 1.843 469 HG3 LYS 66 HG1 LYS 66 9.637 -14.596 1.405 470 HD2 LYS 66 HD2 LYS 66 11.895 -14.412 2.662 471 HD3 LYS 66 HD1 LYS 66 11.184 -12.968 3.383 472 HE2 LYS 66 HE2 LYS 66 9.265 -14.329 4.121 473 HE3 LYS 66 HE1 LYS 66 10.062 -15.757 3.459 474 HZ1 LYS 66 HZ1 LYS 66 10.450 -15.589 5.823 475 HZ2 LYS 66 HZ2 LYS 66 11.096 -14.039 5.649 476 HZ3 LYS 66 HZ3 LYS 66 11.906 -15.369 4.990 477 H LYS 67 HN LYS 67 11.512 -14.524 -2.508 478 HA LYS 67 HA LYS 67 10.233 -15.681 -3.964 479 HB2 LYS 67 HB2 LYS 67 10.848 -17.772 -1.930 480 HB3 LYS 67 HB1 LYS 67 9.605 -18.123 -3.120 481 HG2 LYS 67 HG2 LYS 67 11.754 -18.978 -3.838 482 HG3 LYS 67 HG1 LYS 67 11.198 -17.703 -4.920 483 HD2 LYS 67 HD2 LYS 67 12.663 -16.102 -3.747 484 HD3 LYS 67 HD1 LYS 67 13.249 -17.419 -2.722 485 HE2 LYS 67 HE2 LYS 67 14.064 -18.592 -4.724 486 HE3 LYS 67 HE1 LYS 67 13.509 -17.253 -5.725 487 HZ1 LYS 67 HZ1 LYS 67 15.832 -16.998 -5.330 488 HZ2 LYS 67 HZ2 LYS 67 15.639 -17.172 -3.662 489 HZ3 LYS 67 HZ3 LYS 67 15.029 -15.801 -4.442 490 H LYS 68 HN LYS 68 9.115 -14.378 -1.359 491 HA LYS 68 HA LYS 68 6.318 -15.076 -1.841 492 HB2 LYS 68 HB2 LYS 68 7.673 -15.196 0.873 493 HB3 LYS 68 HB1 LYS 68 5.938 -15.262 0.634 494 HG2 LYS 68 HG2 LYS 68 7.888 -17.273 -0.454 495 HG3 LYS 68 HG1 LYS 68 6.954 -17.468 1.031 496 HD2 LYS 68 HD2 LYS 68 4.881 -17.317 -0.251 497 HD3 LYS 68 HD1 LYS 68 5.805 -17.098 -1.738 498 HE2 LYS 68 HE2 LYS 68 6.824 -19.304 -1.420 499 HE3 LYS 68 HE1 LYS 68 5.884 -19.523 0.054 500 HZ1 LYS 68 HZ1 LYS 68 3.860 -19.395 -1.266 501 HZ2 LYS 68 HZ2 LYS 68 4.856 -20.646 -1.810 502 HZ3 LYS 68 HZ3 LYS 68 4.769 -19.199 -2.678 503 HA PRO 69 HA PRO 69 5.461 -10.716 -0.811 504 HB2 PRO 69 HB2 PRO 69 4.250 -11.641 1.756 505 HB3 PRO 69 HB1 PRO 69 3.634 -10.479 0.577 506 HG2 PRO 69 HG2 PRO 69 2.648 -12.947 0.695 507 HG3 PRO 69 HG1 PRO 69 2.881 -12.126 -0.858 508 HD2 PRO 69 HD2 PRO 69 4.443 -14.325 0.371 509 HD3 PRO 69 HD1 PRO 69 4.155 -13.963 -1.338 510 H ILE 70 HN ILE 70 6.595 -9.162 0.212 511 HA ILE 70 HA ILE 70 8.859 -10.096 1.700 512 HB ILE 70 HB ILE 70 9.703 -7.764 1.535 513 HG12 ILE 70 HG12 ILE 70 7.312 -7.335 -0.255 514 HG13 ILE 70 HG11 ILE 70 7.473 -6.654 1.364 515 HG21 ILE 70 HG21 ILE 70 10.332 -9.466 -0.071 516 HG22 ILE 70 HG22 ILE 70 10.150 -7.911 -0.880 517 HG23 ILE 70 HG23 ILE 70 8.887 -9.132 -1.024 518 HD11 ILE 70 HD11 ILE 70 8.046 -5.040 -0.379 519 HD12 ILE 70 HD12 ILE 70 9.330 -6.113 -0.947 520 HD13 ILE 70 HD13 ILE 70 9.423 -5.399 0.664 521 H GLY 71 HN GLY 71 5.976 -9.664 2.844 522 HA2 GLY 71 HA2 GLY 71 5.661 -9.672 5.243 523 HA3 GLY 71 HA1 GLY 71 6.964 -8.505 5.372 524 H SER 72 HN SER 72 3.767 -8.940 4.011 525 HA SER 72 HA SER 72 3.135 -6.205 3.670 526 HB2 SER 72 HB2 SER 72 1.170 -8.475 4.003 527 HB3 SER 72 HB1 SER 72 0.982 -6.999 3.061 528 HG SER 72 HG SER 72 2.036 -9.359 2.317 529 H PHE 73 HN PHE 73 1.155 -5.209 4.757 530 HA PHE 73 HA PHE 73 0.952 -5.937 7.600 531 HB2 PHE 73 HB2 PHE 73 1.239 -3.710 8.348 532 HB3 PHE 73 HB1 PHE 73 2.512 -3.936 7.152 533 HD1 PHE 73 HD1 PHE 73 2.138 -3.013 4.823 534 HD2 PHE 73 HD2 PHE 73 -0.339 -2.022 8.130 535 HE1 PHE 73 HE1 PHE 73 1.340 -1.021 3.623 536 HE2 PHE 73 HE2 PHE 73 -1.145 -0.036 6.936 537 HZ PHE 73 HZ PHE 73 -0.308 0.473 4.679 538 HA PRO 74 HA PRO 74 -3.371 -5.364 6.814 539 HB2 PRO 74 HB2 PRO 74 -4.118 -4.781 9.466 540 HB3 PRO 74 HB1 PRO 74 -4.085 -6.356 8.685 541 HG2 PRO 74 HG2 PRO 74 -2.409 -5.492 10.768 542 HG3 PRO 74 HG1 PRO 74 -2.234 -6.965 9.805 543 HD2 PRO 74 HD2 PRO 74 -0.791 -4.394 9.604 544 HD3 PRO 74 HD1 PRO 74 -0.275 -6.025 9.135 545 H LEU 75 HN LEU 75 -4.661 -3.773 6.140 546 HA LEU 75 HA LEU 75 -3.727 -1.094 6.222 547 HB2 LEU 75 HB2 LEU 75 -6.279 -2.313 5.189 548 HB3 LEU 75 HB1 LEU 75 -5.881 -0.618 5.007 549 HG LEU 75 HG LEU 75 -4.226 -2.886 3.898 550 HD11 LEU 75 HD11 LEU 75 -5.118 -2.185 1.719 551 HD12 LEU 75 HD12 LEU 75 -6.205 -1.063 2.537 552 HD13 LEU 75 HD13 LEU 75 -6.378 -2.800 2.788 553 HD21 LEU 75 HD21 LEU 75 -2.831 -1.010 4.246 554 HD22 LEU 75 HD22 LEU 75 -4.075 0.110 3.696 555 HD23 LEU 75 HD23 LEU 75 -3.281 -0.957 2.540 556 H ASN 76 HN ASN 76 -6.164 -2.834 8.022 557 HA ASN 76 HA ASN 76 -7.517 -0.523 8.990 558 HB2 ASN 76 HB2 ASN 76 -8.741 -1.975 10.430 559 HB3 ASN 76 HB1 ASN 76 -8.512 -2.827 8.909 560 HD21 ASN 76 HD21 ASN 76 -5.727 -3.530 9.504 561 HD22 ASN 76 HD22 ASN 76 -5.801 -4.780 10.695 562 H LYS 77 HN LYS 77 -4.440 -1.375 9.565 563 HA LYS 77 HA LYS 77 -4.476 -0.578 12.386 564 HB2 LYS 77 HB2 LYS 77 -2.228 -1.738 10.728 565 HB3 LYS 77 HB1 LYS 77 -2.135 -1.359 12.440 566 HG2 LYS 77 HG2 LYS 77 -3.926 -3.422 11.173 567 HG3 LYS 77 HG1 LYS 77 -2.450 -3.738 12.086 568 HD2 LYS 77 HD2 LYS 77 -4.837 -2.309 13.243 569 HD3 LYS 77 HD1 LYS 77 -4.610 -4.054 13.349 570 HE2 LYS 77 HE2 LYS 77 -2.547 -3.745 14.571 571 HE3 LYS 77 HE1 LYS 77 -2.662 -1.999 14.380 572 HZ1 LYS 77 HZ1 LYS 77 -3.399 -2.772 16.572 573 HZ2 LYS 77 HZ2 LYS 77 -4.634 -3.666 15.840 574 HZ3 LYS 77 HZ3 LYS 77 -4.632 -1.978 15.727 575 H ILE 78 HN ILE 78 -4.079 0.745 9.336 576 HA ILE 78 HA ILE 78 -1.858 2.445 9.674 577 HB ILE 78 HB ILE 78 -4.319 2.936 7.986 578 HG12 ILE 78 HG12 ILE 78 -1.644 1.785 7.180 579 HG13 ILE 78 HG11 ILE 78 -3.072 0.808 7.507 580 HG21 ILE 78 HG21 ILE 78 -3.011 4.965 8.391 581 HG22 ILE 78 HG22 ILE 78 -2.887 4.449 6.707 582 HG23 ILE 78 HG23 ILE 78 -1.556 4.141 7.826 583 HD11 ILE 78 HD11 ILE 78 -4.241 1.863 5.667 584 HD12 ILE 78 HD12 ILE 78 -2.716 1.167 5.117 585 HD13 ILE 78 HD13 ILE 78 -2.853 2.909 5.363 586 H THR 79 HN THR 79 -1.579 4.249 10.828 587 HA THR 79 HA THR 79 -3.877 5.264 12.295 588 HB THR 79 HB THR 79 -2.218 6.469 13.673 589 HG1 THR 79 HG1 THR 79 -0.010 6.093 13.304 590 HG21 THR 79 HG21 THR 79 -2.903 4.197 14.285 591 HG22 THR 79 HG22 THR 79 -1.222 4.497 14.727 592 HG23 THR 79 HG23 THR 79 -1.601 3.539 13.293 593 H SER 80 HN SER 80 -1.416 6.297 9.994 594 HA SER 80 HA SER 80 -3.226 8.312 9.030 595 HB2 SER 80 HB2 SER 80 -1.515 10.161 9.258 596 HB3 SER 80 HB1 SER 80 -2.269 9.635 10.761 597 HG SER 80 HG SER 80 0.249 9.833 10.368 598 H ILE 81 HN ILE 81 -3.081 8.461 6.910 599 HA ILE 81 HA ILE 81 -0.591 7.617 5.583 600 HB ILE 81 HB ILE 81 -2.213 6.084 4.866 601 HG12 ILE 81 HG12 ILE 81 -2.233 8.285 2.778 602 HG13 ILE 81 HG11 ILE 81 -0.976 7.068 2.963 603 HG21 ILE 81 HG21 ILE 81 -4.148 8.372 4.552 604 HG22 ILE 81 HG22 ILE 81 -4.177 7.126 5.803 605 HG23 ILE 81 HG23 ILE 81 -4.478 6.694 4.117 606 HD11 ILE 81 HD11 ILE 81 -3.829 6.608 2.140 607 HD12 ILE 81 HD12 ILE 81 -2.663 5.329 2.470 608 HD13 ILE 81 HD13 ILE 81 -2.382 6.451 1.142 609 H ARG 82 HN ARG 82 0.537 9.270 4.829 610 HA ARG 82 HA ARG 82 -0.778 11.426 3.423 611 HB2 ARG 82 HB2 ARG 82 0.736 13.041 4.925 612 HB3 ARG 82 HB1 ARG 82 -0.929 12.649 5.334 613 HG2 ARG 82 HG2 ARG 82 0.340 12.457 7.317 614 HG3 ARG 82 HG1 ARG 82 -0.044 10.817 6.798 615 HD2 ARG 82 HD2 ARG 82 2.216 10.776 7.453 616 HD3 ARG 82 HD1 ARG 82 2.225 10.785 5.690 617 HE ARG 82 HE ARG 82 2.423 13.413 6.356 618 HH11 ARG 82 HH11 ARG 82 4.186 10.542 7.207 619 HH12 ARG 82 HH12 ARG 82 5.700 11.358 7.442 620 HH21 ARG 82 HH21 ARG 82 4.407 14.534 6.662 621 HH22 ARG 82 HH22 ARG 82 5.824 13.643 7.120 622 H THR 83 HN THR 83 0.834 12.987 2.550 623 HA THR 83 HA THR 83 2.840 11.423 1.190 624 HB THR 83 HB THR 83 2.305 14.360 0.835 625 HG1 THR 83 HG1 THR 83 0.599 12.277 0.427 626 HG21 THR 83 HG21 THR 83 3.206 12.205 -1.082 627 HG22 THR 83 HG22 THR 83 4.258 13.392 -0.309 628 HG23 THR 83 HG23 THR 83 3.024 13.921 -1.453 629 H LYS 84 HN LYS 84 5.046 11.695 1.273 630 HA LYS 84 HA LYS 84 6.222 12.948 3.527 631 HB2 LYS 84 HB2 LYS 84 7.243 11.066 2.222 632 HB3 LYS 84 HB1 LYS 84 7.618 12.238 0.963 633 HG2 LYS 84 HG2 LYS 84 9.294 13.170 2.132 634 HG3 LYS 84 HG1 LYS 84 8.458 12.985 3.675 635 HD2 LYS 84 HD2 LYS 84 10.241 11.515 3.875 636 HD3 LYS 84 HD1 LYS 84 8.914 10.475 3.348 637 HE2 LYS 84 HE2 LYS 84 10.706 9.828 1.990 638 HE3 LYS 84 HE1 LYS 84 9.774 10.926 0.974 639 HZ1 LYS 84 HZ1 LYS 84 12.020 11.541 0.737 640 HZ2 LYS 84 HZ2 LYS 84 12.304 11.486 2.396 641 HZ3 LYS 84 HZ3 LYS 84 11.341 12.721 1.753 642 H VAL 85 HN VAL 85 6.576 15.038 3.833 643 HA VAL 85 HA VAL 85 5.626 16.942 2.075 644 HB VAL 85 HB VAL 85 6.561 18.498 3.732 645 HG11 VAL 85 HG11 VAL 85 5.060 16.168 4.867 646 HG12 VAL 85 HG12 VAL 85 4.354 17.565 4.054 647 HG13 VAL 85 HG13 VAL 85 5.169 17.767 5.605 648 HG21 VAL 85 HG21 VAL 85 7.643 16.004 4.992 649 HG22 VAL 85 HG22 VAL 85 7.588 17.585 5.778 650 HG23 VAL 85 HG23 VAL 85 8.587 17.349 4.340 651 H ASP 86 HN ASP 86 8.906 15.762 2.630 652 HA ASP 86 HA ASP 86 10.039 17.980 1.139 653 HB2 ASP 86 HB2 ASP 86 12.111 17.337 1.923 654 HB3 ASP 86 HB1 ASP 86 11.064 16.782 3.218 655 H ASN 87 HN ASN 87 8.797 14.919 0.497 656 HA ASN 87 HA ASN 87 9.878 14.991 -2.210 657 HB2 ASN 87 HB2 ASN 87 11.339 13.454 -0.879 658 HB3 ASN 87 HB1 ASN 87 9.920 12.478 -0.524 659 HD21 ASN 87 HD21 ASN 87 10.587 14.045 -3.610 660 HD22 ASN 87 HD22 ASN 87 10.808 12.577 -4.500 661 H LEU 88 HN LEU 88 7.910 15.460 -3.064 662 HA LEU 88 HA LEU 88 5.495 14.337 -2.097 663 HB2 LEU 88 HB2 LEU 88 6.175 15.929 -4.548 664 HB3 LEU 88 HB1 LEU 88 4.547 15.361 -4.241 665 HG LEU 88 HG LEU 88 6.119 17.192 -2.416 666 HD11 LEU 88 HD11 LEU 88 3.854 17.798 -4.312 667 HD12 LEU 88 HD12 LEU 88 5.536 18.284 -4.517 668 HD13 LEU 88 HD13 LEU 88 4.590 18.931 -3.179 669 HD21 LEU 88 HD21 LEU 88 3.962 17.505 -1.288 670 HD22 LEU 88 HD22 LEU 88 4.507 15.830 -1.207 671 HD23 LEU 88 HD23 LEU 88 3.240 16.291 -2.345 672 H LYS 89 HN LYS 89 7.853 13.090 -4.158 673 HA LYS 89 HA LYS 89 6.067 11.329 -5.596 674 HB2 LYS 89 HB2 LYS 89 9.082 11.387 -5.376 675 HB3 LYS 89 HB1 LYS 89 8.197 10.206 -6.330 676 HG2 LYS 89 HG2 LYS 89 8.821 11.773 -7.898 677 HG3 LYS 89 HG1 LYS 89 7.170 12.252 -7.504 678 HD2 LYS 89 HD2 LYS 89 8.003 13.982 -6.018 679 HD3 LYS 89 HD1 LYS 89 9.665 13.476 -6.333 680 HE2 LYS 89 HE2 LYS 89 9.312 13.987 -8.731 681 HE3 LYS 89 HE1 LYS 89 7.711 14.604 -8.333 682 HZ1 LYS 89 HZ1 LYS 89 10.309 15.682 -7.390 683 HZ2 LYS 89 HZ2 LYS 89 8.803 16.231 -6.861 684 HZ3 LYS 89 HZ3 LYS 89 9.247 16.417 -8.481 685 H SER 90 HN SER 90 7.226 11.492 -2.501 686 HA SER 90 HA SER 90 7.047 8.581 -2.150 687 HB2 SER 90 HB2 SER 90 9.257 9.736 -1.576 688 HB3 SER 90 HB1 SER 90 8.390 10.482 -0.234 689 HG SER 90 HG SER 90 8.856 7.721 -0.692 690 H LEU 91 HN LEU 91 6.123 7.897 -0.121 691 HA LEU 91 HA LEU 91 4.147 9.736 1.020 692 HB2 LEU 91 HB2 LEU 91 3.151 8.451 -0.870 693 HB3 LEU 91 HB1 LEU 91 3.566 6.968 -0.041 694 HG LEU 91 HG LEU 91 2.102 8.141 1.877 695 HD11 LEU 91 HD11 LEU 91 0.191 9.249 0.915 696 HD12 LEU 91 HD12 LEU 91 0.856 9.060 -0.707 697 HD13 LEU 91 HD13 LEU 91 1.661 10.109 0.460 698 HD21 LEU 91 HD21 LEU 91 0.218 6.771 1.022 699 HD22 LEU 91 HD22 LEU 91 1.759 5.910 1.078 700 HD23 LEU 91 HD23 LEU 91 1.136 6.509 -0.462 701 H GLU 92 HN GLU 92 4.495 9.662 3.168 702 HA GLU 92 HA GLU 92 5.670 7.225 4.287 703 HB2 GLU 92 HB2 GLU 92 6.884 9.332 4.700 704 HB3 GLU 92 HB1 GLU 92 5.464 9.986 5.505 705 HG2 GLU 92 HG2 GLU 92 5.634 8.361 7.257 706 HG3 GLU 92 HG1 GLU 92 6.932 7.524 6.411 707 H ILE 93 HN ILE 93 4.370 5.860 5.256 708 HA ILE 93 HA ILE 93 1.794 6.874 6.258 709 HB ILE 93 HB ILE 93 2.527 4.219 5.043 710 HG12 ILE 93 HG12 ILE 93 0.458 6.318 4.370 711 HG13 ILE 93 HG11 ILE 93 1.938 5.988 3.474 712 HG21 ILE 93 HG21 ILE 93 0.236 3.468 5.553 713 HG22 ILE 93 HG22 ILE 93 -0.007 4.922 6.521 714 HG23 ILE 93 HG23 ILE 93 1.198 3.728 7.010 715 HD11 ILE 93 HD11 ILE 93 1.125 3.872 2.774 716 HD12 ILE 93 HD12 ILE 93 -0.129 5.076 2.457 717 HD13 ILE 93 HD13 ILE 93 -0.272 3.994 3.843 718 H SER 94 HN SER 94 1.622 6.916 8.350 719 HA SER 94 HA SER 94 3.297 5.211 10.007 720 HB2 SER 94 HB2 SER 94 1.295 7.342 10.818 721 HB3 SER 94 HB1 SER 94 2.497 6.580 11.861 722 HG SER 94 HG SER 94 3.703 7.575 9.688 723 H VAL 95 HN VAL 95 2.587 3.362 10.798 724 HA VAL 95 HA VAL 95 -0.320 2.938 10.969 725 HB VAL 95 HB VAL 95 0.079 1.783 9.008 726 HG11 VAL 95 HG11 VAL 95 2.766 1.000 10.110 727 HG12 VAL 95 HG12 VAL 95 2.420 2.119 8.786 728 HG13 VAL 95 HG13 VAL 95 2.103 0.393 8.592 729 HG21 VAL 95 HG21 VAL 95 -0.928 0.229 10.564 730 HG22 VAL 95 HG22 VAL 95 0.666 -0.272 11.131 731 HG23 VAL 95 HG23 VAL 95 0.166 -0.629 9.477 732 H SER 96 HN SER 96 -1.008 1.446 12.557 733 HA SER 96 HA SER 96 0.620 1.305 14.881 734 HB2 SER 96 HB2 SER 96 -1.889 1.376 14.904 735 HB3 SER 96 HB1 SER 96 -1.896 -0.262 14.259 736 HG SER 96 HG SER 96 -1.755 0.478 16.779 737 H SER 97 HN SER 97 2.338 0.057 14.968 738 HA SER 97 HA SER 97 2.404 -2.342 13.288 739 HB2 SER 97 HB2 SER 97 4.797 -1.527 12.738 740 HB3 SER 97 HB1 SER 97 3.434 -0.742 11.938 741 HG SER 97 HG SER 97 3.586 0.957 13.400 742 H VAL 98 HN VAL 98 3.940 -3.867 13.771 743 HA VAL 98 HA VAL 98 5.014 -3.836 16.498 744 HB VAL 98 HB VAL 98 5.410 -6.275 16.121 745 HG11 VAL 98 HG11 VAL 98 3.054 -6.966 16.235 746 HG12 VAL 98 HG12 VAL 98 2.569 -5.359 15.695 747 HG13 VAL 98 HG13 VAL 98 3.383 -5.559 17.246 748 HG21 VAL 98 HG21 VAL 98 3.871 -5.835 13.562 749 HG22 VAL 98 HG22 VAL 98 4.411 -7.388 14.201 750 HG23 VAL 98 HG23 VAL 98 5.594 -6.191 13.672 751 H HIS 99 HN HIS 99 7.198 -5.524 16.153 752 HA HIS 99 HA HIS 99 9.261 -3.868 15.650 753 HB2 HIS 99 HB2 HIS 99 9.445 -6.182 16.537 754 HB3 HIS 99 HB1 HIS 99 9.271 -6.798 14.898 755 HD1 HIS 99 HD1 HIS 99 11.310 -6.545 13.313 756 HD2 HIS 99 HD2 HIS 99 11.944 -5.116 17.163 757 HE1 HIS 99 HE1 HIS 99 13.793 -6.197 13.504 758 HE2 HIS 99 HE2 HIS 99 14.131 -5.190 15.787 759 H ILE 100 HN ILE 100 9.061 -2.471 13.948 760 HA ILE 100 HA ILE 100 10.238 -3.050 11.506 761 HB ILE 100 HB ILE 100 8.031 -4.317 11.162 762 HG12 ILE 100 HG12 ILE 100 8.708 -2.087 9.226 763 HG13 ILE 100 HG11 ILE 100 9.513 -3.650 9.309 764 HG21 ILE 100 HG21 ILE 100 6.103 -2.914 10.459 765 HG22 ILE 100 HG22 ILE 100 6.968 -1.497 11.058 766 HG23 ILE 100 HG23 ILE 100 6.489 -2.777 12.175 767 HD11 ILE 100 HD11 ILE 100 6.627 -3.184 8.601 768 HD12 ILE 100 HD12 ILE 100 7.427 -4.754 8.686 769 HD13 ILE 100 HD13 ILE 100 7.929 -3.571 7.477 770 H SER 101 HN SER 101 10.193 -1.152 10.088 771 HA SER 101 HA SER 101 9.924 1.270 11.636 772 HB2 SER 101 HB2 SER 101 11.956 0.819 10.255 773 HB3 SER 101 HB1 SER 101 10.954 0.908 8.810 774 HG SER 101 HG SER 101 11.989 2.906 10.361 775 H THR 102 HN THR 102 9.121 3.241 10.339 776 HA THR 102 HA THR 102 6.368 2.941 9.766 777 HB THR 102 HB THR 102 8.241 5.199 8.978 778 HG1 THR 102 HG1 THR 102 7.757 4.335 11.365 779 HG21 THR 102 HG21 THR 102 5.257 5.176 9.436 780 HG22 THR 102 HG22 THR 102 6.064 5.340 7.878 781 HG23 THR 102 HG23 THR 102 6.233 6.604 9.097 782 H TYR 103 HN TYR 103 5.292 2.996 7.728 783 HA TYR 103 HA TYR 103 6.874 1.638 5.700 784 HB2 TYR 103 HB2 TYR 103 4.896 0.482 6.103 785 HB3 TYR 103 HB1 TYR 103 3.944 1.949 6.263 786 HD1 TYR 103 HD1 TYR 103 2.354 2.192 4.647 787 HD2 TYR 103 HD2 TYR 103 6.057 0.390 3.559 788 HE1 TYR 103 HE1 TYR 103 1.551 1.950 2.338 789 HE2 TYR 103 HE2 TYR 103 5.251 0.152 1.248 790 HH TYR 103 HH TYR 103 2.424 1.688 0.104 791 H LEU 104 HN LEU 104 7.709 2.646 4.064 792 HA LEU 104 HA LEU 104 6.559 5.209 3.235 793 HB2 LEU 104 HB2 LEU 104 9.320 4.243 3.510 794 HB3 LEU 104 HB1 LEU 104 9.002 5.140 2.033 795 HG LEU 104 HG LEU 104 8.192 6.243 4.711 796 HD11 LEU 104 HD11 LEU 104 10.870 6.564 3.356 797 HD12 LEU 104 HD12 LEU 104 10.570 5.719 4.875 798 HD13 LEU 104 HD13 LEU 104 10.315 7.461 4.769 799 HD21 LEU 104 HD21 LEU 104 7.276 7.272 2.687 800 HD22 LEU 104 HD22 LEU 104 8.909 7.526 2.074 801 HD23 LEU 104 HD23 LEU 104 8.373 8.366 3.528 802 H PHE 105 HN PHE 105 5.361 5.098 1.571 803 HA PHE 105 HA PHE 105 5.834 3.149 -0.556 804 HB2 PHE 105 HB2 PHE 105 3.556 3.286 0.167 805 HB3 PHE 105 HB1 PHE 105 3.581 5.039 0.145 806 HD1 PHE 105 HD1 PHE 105 3.567 6.231 -2.042 807 HD2 PHE 105 HD2 PHE 105 2.965 2.032 -1.741 808 HE1 PHE 105 HE1 PHE 105 2.550 6.223 -4.270 809 HE2 PHE 105 HE2 PHE 105 1.947 2.024 -3.980 810 HZ PHE 105 HZ PHE 105 1.731 4.126 -5.247 811 H THR 106 HN THR 106 7.275 3.821 -2.078 812 HA THR 106 HA THR 106 7.303 6.702 -2.686 813 HB THR 106 HB THR 106 9.690 4.859 -2.774 814 HG1 THR 106 HG1 THR 106 8.893 5.271 -0.629 815 HG21 THR 106 HG21 THR 106 10.962 6.962 -2.935 816 HG22 THR 106 HG22 THR 106 9.447 7.862 -2.995 817 HG23 THR 106 HG23 THR 106 9.867 6.752 -4.299 818 H PHE 107 HN PHE 107 7.001 7.279 -4.710 819 HA PHE 107 HA PHE 107 7.150 5.191 -6.778 820 HB2 PHE 107 HB2 PHE 107 4.930 6.695 -5.983 821 HB3 PHE 107 HB1 PHE 107 5.459 7.435 -7.488 822 HD1 PHE 107 HD1 PHE 107 3.011 5.531 -6.530 823 HD2 PHE 107 HD2 PHE 107 6.462 5.096 -8.973 824 HE1 PHE 107 HE1 PHE 107 1.897 3.740 -7.793 825 HE2 PHE 107 HE2 PHE 107 5.355 3.315 -10.239 826 HZ PHE 107 HZ PHE 107 3.073 2.632 -9.653 827 H LYS 108 HN LYS 108 7.070 6.502 -9.034 828 HA LYS 108 HA LYS 108 9.599 7.877 -9.095 829 HB2 LYS 108 HB2 LYS 108 9.370 7.750 -11.515 830 HB3 LYS 108 HB1 LYS 108 8.994 6.185 -10.800 831 HG2 LYS 108 HG2 LYS 108 6.595 7.716 -11.012 832 HG3 LYS 108 HG1 LYS 108 7.430 7.740 -12.563 833 HD2 LYS 108 HD2 LYS 108 6.845 5.227 -11.011 834 HD3 LYS 108 HD1 LYS 108 5.793 5.878 -12.267 835 HE2 LYS 108 HE2 LYS 108 7.700 5.745 -13.851 836 HE3 LYS 108 HE1 LYS 108 8.648 4.967 -12.586 837 HZ1 LYS 108 HZ1 LYS 108 7.718 3.313 -14.028 838 HZ2 LYS 108 HZ2 LYS 108 6.159 3.925 -13.817 839 HZ3 LYS 108 HZ3 LYS 108 6.960 3.198 -12.520 840 H THR 109 HN THR 109 6.214 8.644 -9.275 841 HA THR 109 HA THR 109 6.860 11.482 -9.681 842 HB THR 109 HB THR 109 4.859 11.725 -11.096 843 HG1 THR 109 HG1 THR 109 3.918 9.686 -11.875 844 HG21 THR 109 HG21 THR 109 5.669 10.533 -13.092 845 HG22 THR 109 HG22 THR 109 6.738 9.567 -12.071 846 HG23 THR 109 HG23 THR 109 6.989 11.310 -12.215 847 H ARG 110 HN ARG 110 5.088 12.938 -8.922 848 HA ARG 110 HA ARG 110 3.985 12.082 -6.429 849 HB2 ARG 110 HB2 ARG 110 4.510 14.424 -6.704 850 HB3 ARG 110 HB1 ARG 110 3.448 14.544 -8.100 851 HG2 ARG 110 HG2 ARG 110 1.639 13.747 -6.357 852 HG3 ARG 110 HG1 ARG 110 2.783 14.441 -5.210 853 HD2 ARG 110 HD2 ARG 110 2.710 16.563 -6.416 854 HD3 ARG 110 HD1 ARG 110 1.586 15.862 -7.584 855 HE ARG 110 HE ARG 110 0.972 16.340 -4.734 856 HH11 ARG 110 HH11 ARG 110 -0.022 16.087 -8.077 857 HH12 ARG 110 HH12 ARG 110 -1.698 16.360 -7.733 858 HH21 ARG 110 HH21 ARG 110 -1.235 16.724 -4.274 859 HH22 ARG 110 HH22 ARG 110 -2.392 16.720 -5.569 860 H GLU 111 HN GLU 111 2.766 12.478 -9.702 861 HA GLU 111 HA GLU 111 0.034 12.378 -9.239 862 HB2 GLU 111 HB2 GLU 111 1.575 11.270 -11.592 863 HB3 GLU 111 HB1 GLU 111 -0.158 11.566 -11.569 864 HG2 GLU 111 HG2 GLU 111 0.260 13.951 -11.236 865 HG3 GLU 111 HG1 GLU 111 1.996 13.647 -11.273 866 H GLU 112 HN GLU 112 2.284 9.705 -9.851 867 HA GLU 112 HA GLU 112 0.421 7.624 -9.878 868 HB2 GLU 112 HB2 GLU 112 3.352 7.718 -9.206 869 HB3 GLU 112 HB1 GLU 112 2.445 6.212 -9.198 870 HG2 GLU 112 HG2 GLU 112 2.799 8.052 -11.552 871 HG3 GLU 112 HG1 GLU 112 3.652 6.533 -11.279 872 H ARG 113 HN ARG 113 2.357 8.911 -7.187 873 HA ARG 113 HA ARG 113 1.243 7.067 -5.313 874 HB2 ARG 113 HB2 ARG 113 2.559 8.179 -3.646 875 HB3 ARG 113 HB1 ARG 113 3.531 8.067 -5.103 876 HG2 ARG 113 HG2 ARG 113 3.980 10.204 -4.432 877 HG3 ARG 113 HG1 ARG 113 2.626 10.490 -5.528 878 HD2 ARG 113 HD2 ARG 113 1.121 10.341 -3.522 879 HD3 ARG 113 HD1 ARG 113 2.570 10.349 -2.522 880 HE ARG 113 HE ARG 113 3.014 12.558 -3.776 881 HH11 ARG 113 HH11 ARG 113 -0.112 11.320 -2.813 882 HH12 ARG 113 HH12 ARG 113 -0.812 12.886 -2.574 883 HH21 ARG 113 HH21 ARG 113 2.085 14.645 -3.436 884 HH22 ARG 113 HH22 ARG 113 0.433 14.775 -2.924 885 H GLU 114 HN GLU 114 0.470 10.255 -6.412 886 HA GLU 114 HA GLU 114 -1.220 11.158 -4.378 887 HB2 GLU 114 HB2 GLU 114 -0.361 12.161 -6.735 888 HB3 GLU 114 HB1 GLU 114 -1.992 11.707 -7.192 889 HG2 GLU 114 HG2 GLU 114 -1.264 13.531 -4.918 890 HG3 GLU 114 HG1 GLU 114 -1.803 14.047 -6.512 891 H SER 115 HN SER 115 -2.015 9.443 -7.375 892 HA SER 115 HA SER 115 -4.709 8.986 -6.909 893 HB2 SER 115 HB2 SER 115 -3.589 8.583 -9.073 894 HB3 SER 115 HB1 SER 115 -2.733 7.212 -8.373 895 HG SER 115 HG SER 115 -4.478 6.367 -9.397 896 H TRP 116 HN TRP 116 -1.932 6.871 -6.172 897 HA TRP 116 HA TRP 116 -3.290 4.719 -5.106 898 HB2 TRP 116 HB2 TRP 116 -0.820 4.938 -5.621 899 HB3 TRP 116 HB1 TRP 116 -0.651 5.748 -4.068 900 HD1 TRP 116 HD1 TRP 116 -1.099 2.340 -5.638 901 HE1 TRP 116 HE1 TRP 116 -0.821 0.531 -3.838 902 HE3 TRP 116 HE3 TRP 116 -1.058 5.332 -1.469 903 HZ2 TRP 116 HZ2 TRP 116 -0.616 0.389 -1.034 904 HZ3 TRP 116 HZ3 TRP 116 -0.812 4.264 0.729 905 HH2 TRP 116 HH2 TRP 116 -0.596 1.844 0.944 906 H GLN 117 HN GLN 117 -1.880 7.446 -3.282 907 HA GLN 117 HA GLN 117 -2.743 6.790 -0.753 908 HB2 GLN 117 HB2 GLN 117 -1.255 8.572 -0.852 909 HB3 GLN 117 HB1 GLN 117 -2.140 9.382 -2.134 910 HG2 GLN 117 HG2 GLN 117 -3.915 9.929 -0.495 911 HG3 GLN 117 HG1 GLN 117 -2.907 9.225 0.772 912 HE21 GLN 117 HE21 GLN 117 -3.304 11.860 -1.450 913 HE22 GLN 117 HE22 GLN 117 -2.143 12.915 -0.725 914 H ASN 118 HN ASN 118 -4.513 8.687 -3.203 915 HA ASN 118 HA ASN 118 -6.723 9.242 -1.513 916 HB2 ASN 118 HB2 ASN 118 -6.269 9.394 -4.473 917 HB3 ASN 118 HB1 ASN 118 -7.887 9.629 -3.813 918 HD21 ASN 118 HD21 ASN 118 -4.615 10.827 -3.861 919 HD22 ASN 118 HD22 ASN 118 -4.985 12.440 -3.347 920 H ASN 119 HN ASN 119 -6.094 6.723 -3.900 921 HA ASN 119 HA ASN 119 -8.623 5.477 -3.768 922 HB2 ASN 119 HB2 ASN 119 -5.923 4.252 -4.385 923 HB3 ASN 119 HB1 ASN 119 -7.480 3.500 -4.713 924 HD21 ASN 119 HD21 ASN 119 -5.309 4.238 -6.517 925 HD22 ASN 119 HD22 ASN 119 -5.999 5.304 -7.687 926 H LEU 120 HN LEU 120 -5.564 4.781 -2.110 927 HA LEU 120 HA LEU 120 -6.572 2.578 -0.661 928 HB2 LEU 120 HB2 LEU 120 -4.142 3.122 -1.168 929 HB3 LEU 120 HB1 LEU 120 -4.225 4.291 0.128 930 HG LEU 120 HG LEU 120 -3.238 1.933 0.603 931 HD11 LEU 120 HD11 LEU 120 -3.986 2.035 2.899 932 HD12 LEU 120 HD12 LEU 120 -5.316 3.097 2.441 933 HD13 LEU 120 HD13 LEU 120 -3.650 3.656 2.291 934 HD21 LEU 120 HD21 LEU 120 -5.129 0.692 -0.373 935 HD22 LEU 120 HD22 LEU 120 -6.174 1.332 0.897 936 HD23 LEU 120 HD23 LEU 120 -4.829 0.270 1.313 937 H GLU 121 HN GLU 121 -6.295 6.025 0.105 938 HA GLU 121 HA GLU 121 -6.952 5.846 2.828 939 HB2 GLU 121 HB2 GLU 121 -6.076 7.880 1.692 940 HB3 GLU 121 HB1 GLU 121 -7.644 8.095 0.935 941 HG2 GLU 121 HG2 GLU 121 -8.692 8.455 3.056 942 HG3 GLU 121 HG1 GLU 121 -7.203 8.053 3.910 943 H SER 122 HN SER 122 -9.015 6.303 -0.013 944 HA SER 122 HA SER 122 -11.458 6.347 1.425 945 HB2 SER 122 HB2 SER 122 -11.016 5.525 -1.459 946 HB3 SER 122 HB1 SER 122 -12.522 6.104 -0.744 947 HG SER 122 HG SER 122 -10.282 7.509 -1.568 948 H PHE 123 HN PHE 123 -9.697 3.734 -0.238 949 HA PHE 123 HA PHE 123 -11.525 1.671 0.298 950 HB2 PHE 123 HB2 PHE 123 -9.590 1.516 -1.272 951 HB3 PHE 123 HB1 PHE 123 -8.509 1.467 0.113 952 HD1 PHE 123 HD1 PHE 123 -11.752 -0.272 -0.461 953 HD2 PHE 123 HD2 PHE 123 -7.546 -0.636 0.081 954 HE1 PHE 123 HE1 PHE 123 -11.975 -2.719 -0.394 955 HE2 PHE 123 HE2 PHE 123 -7.765 -3.082 0.151 956 HZ PHE 123 HZ PHE 123 -9.978 -4.125 -0.086 957 H ARG 124 HN ARG 124 -8.816 2.941 2.135 958 HA ARG 124 HA ARG 124 -8.923 1.324 4.398 959 HB2 ARG 124 HB2 ARG 124 -7.105 2.867 4.023 960 HB3 ARG 124 HB1 ARG 124 -8.199 4.239 4.052 961 HG2 ARG 124 HG2 ARG 124 -8.648 3.768 6.442 962 HG3 ARG 124 HG1 ARG 124 -7.426 2.492 6.377 963 HD2 ARG 124 HD2 ARG 124 -5.738 4.119 5.731 964 HD3 ARG 124 HD1 ARG 124 -6.950 5.397 5.721 965 HE ARG 124 HE ARG 124 -6.366 3.926 8.199 966 HH11 ARG 124 HH11 ARG 124 -6.481 6.931 6.400 967 HH12 ARG 124 HH12 ARG 124 -6.155 7.920 7.784 968 HH21 ARG 124 HH21 ARG 124 -5.902 5.225 10.013 969 HH22 ARG 124 HH22 ARG 124 -5.812 6.950 9.833 970 H LYS 125 HN LYS 125 -10.709 4.285 3.604 971 HA LYS 125 HA LYS 125 -12.098 4.426 6.063 972 HB2 LYS 125 HB2 LYS 125 -12.749 5.606 3.367 973 HB3 LYS 125 HB1 LYS 125 -13.667 5.939 4.830 974 HG2 LYS 125 HG2 LYS 125 -11.601 6.831 5.861 975 HG3 LYS 125 HG1 LYS 125 -10.782 6.609 4.311 976 HD2 LYS 125 HD2 LYS 125 -12.342 8.120 3.238 977 HD3 LYS 125 HD1 LYS 125 -13.249 8.288 4.740 978 HE2 LYS 125 HE2 LYS 125 -11.289 9.292 5.806 979 HE3 LYS 125 HE1 LYS 125 -10.388 9.128 4.300 980 HZ1 LYS 125 HZ1 LYS 125 -11.941 10.615 3.232 981 HZ2 LYS 125 HZ2 LYS 125 -11.276 11.361 4.592 982 HZ3 LYS 125 HZ3 LYS 125 -12.851 10.749 4.653 983 H ILE 126 HN ILE 126 -12.752 2.719 3.059 984 HA ILE 126 HA ILE 126 -15.451 2.105 3.602 985 HB ILE 126 HB ILE 126 -13.445 0.532 1.980 986 HG12 ILE 126 HG12 ILE 126 -15.561 2.484 1.063 987 HG13 ILE 126 HG11 ILE 126 -13.867 2.908 1.279 988 HG21 ILE 126 HG21 ILE 126 -16.461 0.387 1.993 989 HG22 ILE 126 HG22 ILE 126 -15.365 -0.843 2.621 990 HG23 ILE 126 HG23 ILE 126 -15.391 -0.483 0.893 991 HD11 ILE 126 HD11 ILE 126 -13.255 1.270 -0.422 992 HD12 ILE 126 HD12 ILE 126 -14.367 2.485 -1.045 993 HD13 ILE 126 HD13 ILE 126 -14.955 0.870 -0.646 994 H MET 127 HN MET 127 -12.460 0.730 4.760 995 HA MET 127 HA MET 127 -13.934 -1.539 5.912 996 HB2 MET 127 HB2 MET 127 -10.959 -1.139 5.578 997 HB3 MET 127 HB1 MET 127 -11.733 -2.586 6.209 998 HG2 MET 127 HG2 MET 127 -12.769 -3.019 4.087 999 HG3 MET 127 HG1 MET 127 -12.163 -1.494 3.441 1000 HE1 MET 127 HE1 MET 127 -8.332 -2.105 3.195 1001 HE2 MET 127 HE2 MET 127 -9.171 -1.377 4.563 1002 HE3 MET 127 HE3 MET 127 -9.664 -0.984 2.917 1003 H SER 128 HN SER 128 -11.652 1.033 6.789 1004 HA SER 128 HA SER 128 -11.750 0.187 9.575 1005 HB2 SER 128 HB2 SER 128 -9.575 0.763 8.509 1006 HB3 SER 128 HB1 SER 128 -10.146 2.419 8.309 1007 HG SER 128 HG SER 128 -10.191 1.221 10.854 1008 H MET 129 HN MET 129 -12.706 2.900 7.548 1009 HA MET 129 HA MET 129 -14.023 4.131 9.872 1010 HB2 MET 129 HB2 MET 129 -13.397 5.320 7.143 1011 HB3 MET 129 HB1 MET 129 -14.203 6.162 8.467 1012 HG2 MET 129 HG2 MET 129 -12.197 5.897 9.852 1013 HG3 MET 129 HG1 MET 129 -11.390 5.089 8.511 1014 HE1 MET 129 HE1 MET 129 -12.854 8.437 9.886 1015 HE2 MET 129 HE2 MET 129 -13.812 8.216 8.421 1016 HE3 MET 129 HE3 MET 129 -12.640 9.530 8.518 1017 H LYS 130 HN LYS 130 -14.997 1.787 8.656 1018 HA LYS 130 HA LYS 130 -16.862 2.167 6.608 1019 HB2 LYS 130 HB2 LYS 130 -15.915 -0.026 7.351 1020 HB3 LYS 130 HB1 LYS 130 -16.946 0.060 8.772 1021 HG2 LYS 130 HG2 LYS 130 -18.922 0.121 7.281 1022 HG3 LYS 130 HG1 LYS 130 -17.840 -0.091 5.903 1023 HD2 LYS 130 HD2 LYS 130 -17.912 -2.025 8.203 1024 HD3 LYS 130 HD1 LYS 130 -18.975 -2.180 6.805 1025 HE2 LYS 130 HE2 LYS 130 -15.962 -2.090 6.688 1026 HE3 LYS 130 HE1 LYS 130 -16.929 -3.561 6.631 1027 HZ1 LYS 130 HZ1 LYS 130 -16.361 -2.944 4.414 1028 HZ2 LYS 130 HZ2 LYS 130 -16.906 -1.360 4.641 1029 HZ3 LYS 130 HZ3 LYS 130 -18.014 -2.638 4.615 Start of MODEL 8 1 H1 SER 12 HT1 SER 12 -20.988 -5.653 -3.027 2 H2 SER 12 HT2 SER 12 -21.478 -7.053 -3.836 3 H3 SER 12 HT3 SER 12 -20.614 -7.181 -2.385 4 HA SER 12 HA SER 12 -22.916 -7.644 -2.015 5 HB2 SER 12 HB2 SER 12 -23.329 -5.870 -0.277 6 HB3 SER 12 HB1 SER 12 -21.749 -6.642 -0.189 7 HG SER 12 HG SER 12 -22.266 -4.073 -0.375 8 H ALA 13 HN ALA 13 -23.058 -4.120 -2.233 9 HA ALA 13 HA ALA 13 -25.043 -4.399 -4.376 10 HB1 ALA 13 HB1 ALA 13 -25.201 -2.558 -2.000 11 HB2 ALA 13 HB2 ALA 13 -26.309 -3.867 -2.417 12 HB3 ALA 13 HB3 ALA 13 -26.224 -2.421 -3.430 13 H LYS 14 HN LYS 14 -23.965 -1.409 -2.878 14 HA LYS 14 HA LYS 14 -22.710 -0.710 -5.441 15 HB2 LYS 14 HB2 LYS 14 -23.651 1.183 -3.283 16 HB3 LYS 14 HB1 LYS 14 -23.100 1.610 -4.895 17 HG2 LYS 14 HG2 LYS 14 -25.662 0.288 -4.088 18 HG3 LYS 14 HG1 LYS 14 -25.428 1.788 -4.981 19 HD2 LYS 14 HD2 LYS 14 -24.323 0.303 -6.766 20 HD3 LYS 14 HD1 LYS 14 -25.089 -1.041 -5.910 21 HE2 LYS 14 HE2 LYS 14 -26.562 -0.421 -7.661 22 HE3 LYS 14 HE1 LYS 14 -27.270 0.178 -6.163 23 HZ1 LYS 14 HZ1 LYS 14 -26.359 2.376 -6.681 24 HZ2 LYS 14 HZ2 LYS 14 -27.420 1.835 -7.881 25 HZ3 LYS 14 HZ3 LYS 14 -25.753 1.782 -8.146 26 H ASP 15 HN ASP 15 -20.877 -1.976 -4.649 27 HA ASP 15 HA ASP 15 -18.646 -1.891 -4.250 28 HB2 ASP 15 HB2 ASP 15 -19.230 0.916 -3.401 29 HB3 ASP 15 HB1 ASP 15 -17.639 0.188 -3.214 30 H ILE 16 HN ILE 16 -20.897 -1.278 -1.711 31 HA ILE 16 HA ILE 16 -19.424 -0.660 0.444 32 HB ILE 16 HB ILE 16 -21.796 -2.516 0.380 33 HG12 ILE 16 HG12 ILE 16 -22.711 -0.362 1.615 34 HG13 ILE 16 HG11 ILE 16 -21.366 0.418 0.794 35 HG21 ILE 16 HG21 ILE 16 -22.003 -2.182 2.803 36 HG22 ILE 16 HG22 ILE 16 -20.464 -1.318 2.812 37 HG23 ILE 16 HG23 ILE 16 -20.512 -3.030 2.387 38 HD11 ILE 16 HD11 ILE 16 -22.251 -0.178 -1.343 39 HD12 ILE 16 HD12 ILE 16 -23.526 0.581 -0.396 40 HD13 ILE 16 HD13 ILE 16 -23.503 -1.169 -0.598 41 H LYS 17 HN LYS 17 -20.302 -4.159 0.271 42 HA LYS 17 HA LYS 17 -18.047 -4.689 1.961 43 HB2 LYS 17 HB2 LYS 17 -20.026 -6.536 0.647 44 HB3 LYS 17 HB1 LYS 17 -18.746 -7.085 1.719 45 HG2 LYS 17 HG2 LYS 17 -20.924 -5.147 2.471 46 HG3 LYS 17 HG1 LYS 17 -20.908 -6.867 2.859 47 HD2 LYS 17 HD2 LYS 17 -18.824 -6.548 4.126 48 HD3 LYS 17 HD1 LYS 17 -18.876 -4.824 3.760 49 HE2 LYS 17 HE2 LYS 17 -19.725 -5.275 5.998 50 HE3 LYS 17 HE1 LYS 17 -20.986 -4.620 4.956 51 HZ1 LYS 17 HZ1 LYS 17 -21.872 -6.828 4.663 52 HZ2 LYS 17 HZ2 LYS 17 -21.758 -6.485 6.312 53 HZ3 LYS 17 HZ3 LYS 17 -20.621 -7.500 5.582 54 H ASP 18 HN ASP 18 -18.860 -6.096 -1.219 55 HA ASP 18 HA ASP 18 -16.211 -7.249 -1.343 56 HB2 ASP 18 HB2 ASP 18 -18.367 -7.419 -3.440 57 HB3 ASP 18 HB1 ASP 18 -17.002 -8.506 -3.210 58 H GLU 19 HN GLU 19 -18.086 -4.974 -3.298 59 HA GLU 19 HA GLU 19 -16.317 -5.078 -5.479 60 HB2 GLU 19 HB2 GLU 19 -18.721 -3.547 -4.756 61 HB3 GLU 19 HB1 GLU 19 -17.678 -2.808 -5.970 62 HG2 GLU 19 HG2 GLU 19 -18.952 -5.532 -6.077 63 HG3 GLU 19 HG1 GLU 19 -19.409 -4.115 -7.018 64 H LYS 20 HN LYS 20 -16.456 -2.897 -2.711 65 HA LYS 20 HA LYS 20 -14.693 -0.942 -3.642 66 HB2 LYS 20 HB2 LYS 20 -14.203 -0.432 -1.319 67 HB3 LYS 20 HB1 LYS 20 -15.918 -0.763 -1.493 68 HG2 LYS 20 HG2 LYS 20 -15.697 -2.885 -0.463 69 HG3 LYS 20 HG1 LYS 20 -13.935 -2.808 -0.541 70 HD2 LYS 20 HD2 LYS 20 -14.035 -0.807 0.944 71 HD3 LYS 20 HD1 LYS 20 -15.768 -1.089 1.113 72 HE2 LYS 20 HE2 LYS 20 -13.646 -3.094 1.826 73 HE3 LYS 20 HE1 LYS 20 -14.392 -1.993 2.979 74 HZ1 LYS 20 HZ1 LYS 20 -15.500 -4.077 3.102 75 HZ2 LYS 20 HZ2 LYS 20 -15.730 -4.136 1.427 76 HZ3 LYS 20 HZ3 LYS 20 -16.558 -2.986 2.357 77 H ILE 21 HN ILE 21 -14.096 -4.104 -2.233 78 HA ILE 21 HA ILE 21 -11.285 -3.869 -2.010 79 HB ILE 21 HB ILE 21 -12.991 -6.350 -2.303 80 HG12 ILE 21 HG12 ILE 21 -11.850 -5.104 0.211 81 HG13 ILE 21 HG11 ILE 21 -13.509 -4.871 -0.337 82 HG21 ILE 21 HG21 ILE 21 -10.675 -6.810 -2.857 83 HG22 ILE 21 HG22 ILE 21 -11.085 -7.534 -1.302 84 HG23 ILE 21 HG23 ILE 21 -10.142 -6.045 -1.359 85 HD11 ILE 21 HD11 ILE 21 -13.418 -6.556 1.377 86 HD12 ILE 21 HD12 ILE 21 -12.230 -7.474 0.451 87 HD13 ILE 21 HD13 ILE 21 -13.876 -7.292 -0.160 88 H GLN 22 HN GLN 22 -13.404 -5.340 -4.432 89 HA GLN 22 HA GLN 22 -11.391 -6.267 -6.146 90 HB2 GLN 22 HB2 GLN 22 -14.222 -5.451 -6.822 91 HB3 GLN 22 HB1 GLN 22 -13.174 -6.439 -7.831 92 HG2 GLN 22 HG2 GLN 22 -14.094 -7.199 -5.063 93 HG3 GLN 22 HG1 GLN 22 -14.851 -7.737 -6.560 94 HE21 GLN 22 HE21 GLN 22 -14.438 -9.889 -6.075 95 HE22 GLN 22 HE22 GLN 22 -12.856 -10.571 -6.201 96 H GLN 23 HN GLN 23 -13.265 -3.257 -6.208 97 HA GLN 23 HA GLN 23 -12.179 -2.172 -8.560 98 HB2 GLN 23 HB2 GLN 23 -14.205 -1.333 -7.384 99 HB3 GLN 23 HB1 GLN 23 -13.175 -0.691 -6.119 100 HG2 GLN 23 HG2 GLN 23 -12.042 0.693 -7.875 101 HG3 GLN 23 HG1 GLN 23 -13.305 0.177 -8.990 102 HE21 GLN 23 HE21 GLN 23 -15.353 0.177 -6.880 103 HE22 GLN 23 HE22 GLN 23 -15.716 1.842 -6.585 104 H TYR 24 HN TYR 24 -11.378 -1.451 -5.177 105 HA TYR 24 HA TYR 24 -9.271 0.292 -5.860 106 HB2 TYR 24 HB2 TYR 24 -10.105 -0.998 -3.284 107 HB3 TYR 24 HB1 TYR 24 -8.639 -0.024 -3.382 108 HD1 TYR 24 HD1 TYR 24 -11.962 0.136 -2.473 109 HD2 TYR 24 HD2 TYR 24 -9.104 2.273 -4.782 110 HE1 TYR 24 HE1 TYR 24 -13.296 2.187 -2.216 111 HE2 TYR 24 HE2 TYR 24 -10.420 4.331 -4.523 112 HH TYR 24 HH TYR 24 -12.931 4.649 -2.289 113 H ARG 25 HN ARG 25 -9.291 -3.152 -5.013 114 HA ARG 25 HA ARG 25 -6.541 -3.480 -4.659 115 HB2 ARG 25 HB2 ARG 25 -8.230 -5.196 -4.128 116 HB3 ARG 25 HB1 ARG 25 -8.486 -5.453 -5.845 117 HG2 ARG 25 HG2 ARG 25 -6.264 -6.302 -6.113 118 HG3 ARG 25 HG1 ARG 25 -5.860 -5.881 -4.447 119 HD2 ARG 25 HD2 ARG 25 -6.341 -8.275 -4.705 120 HD3 ARG 25 HD1 ARG 25 -7.473 -7.484 -3.614 121 HE ARG 25 HE ARG 25 -9.044 -7.467 -5.554 122 HH11 ARG 25 HH11 ARG 25 -6.443 -9.809 -5.417 123 HH12 ARG 25 HH12 ARG 25 -7.301 -11.004 -6.333 124 HH21 ARG 25 HH21 ARG 25 -10.191 -9.049 -6.743 125 HH22 ARG 25 HH22 ARG 25 -9.422 -10.567 -7.103 126 H LYS 26 HN LYS 26 -8.446 -3.273 -7.579 127 HA LYS 26 HA LYS 26 -6.505 -4.154 -9.422 128 HB2 LYS 26 HB2 LYS 26 -8.843 -4.000 -10.036 129 HB3 LYS 26 HB1 LYS 26 -8.849 -2.274 -9.723 130 HG2 LYS 26 HG2 LYS 26 -6.976 -3.307 -11.785 131 HG3 LYS 26 HG1 LYS 26 -8.695 -3.248 -12.170 132 HD2 LYS 26 HD2 LYS 26 -7.129 -0.894 -11.119 133 HD3 LYS 26 HD1 LYS 26 -7.389 -1.209 -12.834 134 HE2 LYS 26 HE2 LYS 26 -9.630 -0.903 -10.840 135 HE3 LYS 26 HE1 LYS 26 -8.977 0.435 -11.781 136 HZ1 LYS 26 HZ1 LYS 26 -10.926 -0.473 -12.839 137 HZ2 LYS 26 HZ2 LYS 26 -10.238 -2.017 -12.880 138 HZ3 LYS 26 HZ3 LYS 26 -9.569 -0.767 -13.803 139 H THR 27 HN THR 27 -7.385 -0.899 -8.318 140 HA THR 27 HA THR 27 -5.370 0.331 -9.957 141 HB THR 27 HB THR 27 -7.527 1.455 -9.513 142 HG1 THR 27 HG1 THR 27 -6.296 3.100 -9.984 143 HG21 THR 27 HG21 THR 27 -7.850 0.772 -7.193 144 HG22 THR 27 HG22 THR 27 -7.934 2.526 -7.355 145 HG23 THR 27 HG23 THR 27 -6.481 1.770 -6.702 146 H LEU 28 HN LEU 28 -5.494 -1.045 -6.870 147 HA LEU 28 HA LEU 28 -3.587 0.614 -5.552 148 HB2 LEU 28 HB2 LEU 28 -5.191 -1.744 -4.957 149 HB3 LEU 28 HB1 LEU 28 -3.602 -1.815 -4.226 150 HG LEU 28 HG LEU 28 -5.457 -0.863 -2.788 151 HD11 LEU 28 HD11 LEU 28 -3.011 0.801 -3.325 152 HD12 LEU 28 HD12 LEU 28 -3.150 -0.554 -2.204 153 HD13 LEU 28 HD13 LEU 28 -4.035 0.939 -1.898 154 HD21 LEU 28 HD21 LEU 28 -6.060 1.469 -3.119 155 HD22 LEU 28 HD22 LEU 28 -6.551 0.500 -4.509 156 HD23 LEU 28 HD23 LEU 28 -5.117 1.521 -4.607 157 H THR 29 HN THR 29 -3.346 -2.180 -7.638 158 HA THR 29 HA THR 29 -0.788 -3.046 -6.762 159 HB THR 29 HB THR 29 -1.895 -3.482 -9.533 160 HG1 THR 29 HG1 THR 29 -3.238 -4.964 -8.724 161 HG21 THR 29 HG21 THR 29 0.407 -4.209 -9.222 162 HG22 THR 29 HG22 THR 29 -0.643 -5.620 -9.319 163 HG23 THR 29 HG23 THR 29 -0.033 -5.082 -7.754 164 H LYS 30 HN LYS 30 0.947 -1.804 -6.822 165 HA LYS 30 HA LYS 30 1.636 -0.399 -9.301 166 HB2 LYS 30 HB2 LYS 30 1.520 0.837 -6.551 167 HB3 LYS 30 HB1 LYS 30 2.391 1.562 -7.893 168 HG2 LYS 30 HG2 LYS 30 -0.559 0.964 -7.926 169 HG3 LYS 30 HG1 LYS 30 0.141 2.526 -7.494 170 HD2 LYS 30 HD2 LYS 30 1.290 2.485 -9.745 171 HD3 LYS 30 HD1 LYS 30 0.272 1.103 -10.144 172 HE2 LYS 30 HE2 LYS 30 -0.786 3.777 -9.257 173 HE3 LYS 30 HE1 LYS 30 -0.578 3.314 -10.943 174 HZ1 LYS 30 HZ1 LYS 30 -2.328 1.951 -8.970 175 HZ2 LYS 30 HZ2 LYS 30 -2.111 1.478 -10.578 176 HZ3 LYS 30 HZ3 LYS 30 -2.839 2.961 -10.227 177 H ILE 31 HN ILE 31 3.845 -0.221 -9.706 178 HA ILE 31 HA ILE 31 5.642 -1.739 -7.987 179 HB ILE 31 HB ILE 31 6.129 -0.300 -10.607 180 HG12 ILE 31 HG12 ILE 31 4.788 -2.419 -10.683 181 HG13 ILE 31 HG11 ILE 31 6.290 -2.485 -11.597 182 HG21 ILE 31 HG21 ILE 31 8.355 -1.383 -10.598 183 HG22 ILE 31 HG22 ILE 31 8.057 -1.927 -8.944 184 HG23 ILE 31 HG23 ILE 31 8.157 -0.203 -9.303 185 HD11 ILE 31 HD11 ILE 31 5.827 -3.662 -8.866 186 HD12 ILE 31 HD12 ILE 31 7.341 -3.720 -9.769 187 HD13 ILE 31 HD13 ILE 31 5.911 -4.548 -10.388 188 H VAL 32 HN VAL 32 6.451 -0.745 -6.260 189 HA VAL 32 HA VAL 32 7.296 2.060 -6.505 190 HB VAL 32 HB VAL 32 6.291 2.666 -4.406 191 HG11 VAL 32 HG11 VAL 32 4.897 2.828 -6.420 192 HG12 VAL 32 HG12 VAL 32 3.939 2.542 -4.968 193 HG13 VAL 32 HG13 VAL 32 4.256 1.215 -6.090 194 HG21 VAL 32 HG21 VAL 32 4.851 1.119 -3.141 195 HG22 VAL 32 HG22 VAL 32 6.524 0.562 -3.209 196 HG23 VAL 32 HG23 VAL 32 5.302 -0.182 -4.243 197 H LYS 33 HN LYS 33 8.614 2.711 -4.549 198 HA LYS 33 HA LYS 33 10.370 0.480 -3.827 199 HB2 LYS 33 HB2 LYS 33 10.813 3.462 -3.539 200 HB3 LYS 33 HB1 LYS 33 11.985 2.210 -3.153 201 HG2 LYS 33 HG2 LYS 33 12.084 1.537 -5.475 202 HG3 LYS 33 HG1 LYS 33 10.845 2.724 -5.892 203 HD2 LYS 33 HD2 LYS 33 12.307 4.533 -5.231 204 HD3 LYS 33 HD1 LYS 33 13.534 3.383 -4.692 205 HE2 LYS 33 HE2 LYS 33 13.674 2.536 -7.024 206 HE3 LYS 33 HE1 LYS 33 12.549 3.803 -7.510 207 HZ1 LYS 33 HZ1 LYS 33 14.792 4.490 -7.942 208 HZ2 LYS 33 HZ2 LYS 33 15.244 4.203 -6.340 209 HZ3 LYS 33 HZ3 LYS 33 14.156 5.445 -6.701 210 H ILE 34 HN ILE 34 10.086 -0.440 -1.932 211 HA ILE 34 HA ILE 34 8.664 0.983 0.170 212 HB ILE 34 HB ILE 34 9.057 -1.825 -0.520 213 HG12 ILE 34 HG12 ILE 34 7.112 -0.314 1.207 214 HG13 ILE 34 HG11 ILE 34 6.905 -0.711 -0.493 215 HG21 ILE 34 HG21 ILE 34 9.151 -1.134 2.416 216 HG22 ILE 34 HG22 ILE 34 10.515 -1.763 1.487 217 HG23 ILE 34 HG23 ILE 34 9.069 -2.753 1.711 218 HD11 ILE 34 HD11 ILE 34 6.972 -3.125 0.173 219 HD12 ILE 34 HD12 ILE 34 5.584 -2.219 0.774 220 HD13 ILE 34 HD13 ILE 34 6.931 -2.587 1.851 221 H LYS 35 HN LYS 35 9.535 1.570 2.070 222 HA LYS 35 HA LYS 35 12.403 1.051 2.454 223 HB2 LYS 35 HB2 LYS 35 10.942 3.677 2.531 224 HB3 LYS 35 HB1 LYS 35 12.449 3.465 3.373 225 HG2 LYS 35 HG2 LYS 35 13.503 3.993 1.499 226 HG3 LYS 35 HG1 LYS 35 12.902 2.483 0.802 227 HD2 LYS 35 HD2 LYS 35 11.912 3.862 -0.682 228 HD3 LYS 35 HD1 LYS 35 10.726 4.011 0.617 229 HE2 LYS 35 HE2 LYS 35 11.342 6.193 -0.275 230 HE3 LYS 35 HE1 LYS 35 11.799 6.025 1.419 231 HZ1 LYS 35 HZ1 LYS 35 14.072 5.554 0.698 232 HZ2 LYS 35 HZ2 LYS 35 13.554 7.069 0.164 233 HZ3 LYS 35 HZ3 LYS 35 13.616 5.771 -0.916 234 H THR 36 HN THR 36 12.416 -0.246 4.180 235 HA THR 36 HA THR 36 10.986 0.660 6.593 236 HB THR 36 HB THR 36 10.507 -1.620 7.223 237 HG1 THR 36 HG1 THR 36 11.709 -2.449 4.768 238 HG21 THR 36 HG21 THR 36 8.872 -0.601 5.724 239 HG22 THR 36 HG22 THR 36 9.002 -2.334 5.417 240 HG23 THR 36 HG23 THR 36 9.780 -1.184 4.328 241 H ALA 37 HN ALA 37 11.965 -0.569 8.591 242 HA ALA 37 HA ALA 37 14.769 -0.092 8.667 243 HB1 ALA 37 HB1 ALA 37 12.948 -1.498 10.619 244 HB2 ALA 37 HB2 ALA 37 13.485 0.182 10.684 245 HB3 ALA 37 HB3 ALA 37 14.643 -1.123 10.927 246 H ILE 38 HN ILE 38 12.766 -2.814 7.954 247 HA ILE 38 HA ILE 38 14.758 -4.812 8.426 248 HB ILE 38 HB ILE 38 12.244 -5.112 6.783 249 HG12 ILE 38 HG12 ILE 38 12.604 -5.540 9.760 250 HG13 ILE 38 HG11 ILE 38 11.740 -4.190 9.035 251 HG21 ILE 38 HG21 ILE 38 13.836 -6.931 6.541 252 HG22 ILE 38 HG22 ILE 38 12.428 -7.472 7.456 253 HG23 ILE 38 HG23 ILE 38 13.936 -7.102 8.293 254 HD11 ILE 38 HD11 ILE 38 10.984 -7.091 8.781 255 HD12 ILE 38 HD12 ILE 38 10.104 -5.725 8.097 256 HD13 ILE 38 HD13 ILE 38 10.222 -5.914 9.848 257 H PHE 39 HN PHE 39 13.367 -3.242 5.572 258 HA PHE 39 HA PHE 39 15.794 -3.479 4.098 259 HB2 PHE 39 HB2 PHE 39 14.699 -4.841 2.215 260 HB3 PHE 39 HB1 PHE 39 15.245 -5.721 3.635 261 HD1 PHE 39 HD1 PHE 39 13.854 -7.367 4.380 262 HD2 PHE 39 HD2 PHE 39 12.138 -3.956 2.505 263 HE1 PHE 39 HE1 PHE 39 11.614 -8.338 4.665 264 HE2 PHE 39 HE2 PHE 39 9.900 -4.920 2.793 265 HZ PHE 39 HZ PHE 39 9.633 -7.112 3.875 266 H HIS 40 HN HIS 40 15.830 -2.141 2.311 267 HA HIS 40 HA HIS 40 13.306 -0.762 1.650 268 HB2 HIS 40 HB2 HIS 40 16.044 0.125 0.742 269 HB3 HIS 40 HB1 HIS 40 14.572 1.073 0.836 270 HD1 HIS 40 HD1 HIS 40 17.636 0.344 2.625 271 HD2 HIS 40 HD2 HIS 40 13.833 1.683 3.621 272 HE1 HIS 40 HE1 HIS 40 17.864 1.407 4.893 273 HE2 HIS 40 HE2 HIS 40 15.511 2.027 5.551 274 H GLU 41 HN GLU 41 12.355 -1.673 -0.105 275 HA GLU 41 HA GLU 41 14.045 -2.811 -2.212 276 HB2 GLU 41 HB2 GLU 41 11.944 -4.309 -0.646 277 HB3 GLU 41 HB1 GLU 41 12.607 -4.879 -2.171 278 HG2 GLU 41 HG2 GLU 41 14.305 -4.281 0.230 279 HG3 GLU 41 HG1 GLU 41 13.605 -5.868 -0.088 280 H THR 42 HN THR 42 13.207 -2.633 -4.232 281 HA THR 42 HA THR 42 10.773 -1.252 -4.709 282 HB THR 42 HB THR 42 12.159 -3.017 -6.719 283 HG1 THR 42 HG1 THR 42 13.757 -1.607 -6.856 284 HG21 THR 42 HG21 THR 42 10.017 -2.059 -7.385 285 HG22 THR 42 HG22 THR 42 11.335 -1.318 -8.294 286 HG23 THR 42 HG23 THR 42 10.591 -0.447 -6.954 287 H VAL 43 HN VAL 43 8.737 -2.027 -4.926 288 HA VAL 43 HA VAL 43 8.349 -4.919 -5.043 289 HB VAL 43 HB VAL 43 8.608 -4.002 -2.629 290 HG11 VAL 43 HG11 VAL 43 7.172 -2.106 -2.749 291 HG12 VAL 43 HG12 VAL 43 6.443 -3.275 -1.646 292 HG13 VAL 43 HG13 VAL 43 5.815 -3.099 -3.282 293 HG21 VAL 43 HG21 VAL 43 6.297 -5.751 -3.442 294 HG22 VAL 43 HG22 VAL 43 6.932 -5.613 -1.801 295 HG23 VAL 43 HG23 VAL 43 7.951 -6.260 -3.089 296 H LYS 44 HN LYS 44 6.192 -5.553 -5.559 297 HA LYS 44 HA LYS 44 4.577 -3.426 -6.772 298 HB2 LYS 44 HB2 LYS 44 5.195 -5.666 -7.957 299 HB3 LYS 44 HB1 LYS 44 3.982 -6.371 -6.900 300 HG2 LYS 44 HG2 LYS 44 2.258 -5.031 -7.841 301 HG3 LYS 44 HG1 LYS 44 3.426 -4.105 -8.786 302 HD2 LYS 44 HD2 LYS 44 2.269 -5.800 -10.146 303 HD3 LYS 44 HD1 LYS 44 4.008 -6.087 -10.062 304 HE2 LYS 44 HE2 LYS 44 3.580 -7.734 -8.243 305 HE3 LYS 44 HE1 LYS 44 1.852 -7.513 -8.508 306 HZ1 LYS 44 HZ1 LYS 44 2.135 -8.297 -10.769 307 HZ2 LYS 44 HZ2 LYS 44 2.693 -9.451 -9.671 308 HZ3 LYS 44 HZ3 LYS 44 3.795 -8.497 -10.523 309 H VAL 45 HN VAL 45 3.167 -2.543 -5.428 310 HA VAL 45 HA VAL 45 2.248 -4.085 -3.123 311 HB VAL 45 HB VAL 45 3.171 -1.900 -2.633 312 HG11 VAL 45 HG11 VAL 45 2.119 0.162 -3.429 313 HG12 VAL 45 HG12 VAL 45 1.021 -0.784 -4.433 314 HG13 VAL 45 HG13 VAL 45 2.753 -0.798 -4.765 315 HG21 VAL 45 HG21 VAL 45 0.176 -1.896 -2.285 316 HG22 VAL 45 HG22 VAL 45 1.330 -0.934 -1.360 317 HG23 VAL 45 HG23 VAL 45 1.341 -2.693 -1.227 318 H THR 46 HN THR 46 0.269 -4.930 -3.020 319 HA THR 46 HA THR 46 -1.905 -3.614 -4.464 320 HB THR 46 HB THR 46 -1.081 -5.557 -5.853 321 HG1 THR 46 HG1 THR 46 -3.120 -5.096 -6.352 322 HG21 THR 46 HG21 THR 46 -0.493 -7.094 -4.042 323 HG22 THR 46 HG22 THR 46 -1.673 -7.823 -5.131 324 HG23 THR 46 HG23 THR 46 -2.188 -7.191 -3.566 325 H CYS 47 HN CYS 47 -4.061 -4.774 -3.683 326 HA CYS 47 HA CYS 47 -3.789 -5.081 -0.780 327 HB2 CYS 47 HB2 CYS 47 -5.315 -3.349 -1.294 328 HB3 CYS 47 HB1 CYS 47 -6.148 -4.316 -2.500 329 HG CYS 47 HG CYS 47 -6.710 -4.004 0.747 330 H SER 48 HN SER 48 -5.268 -6.639 0.229 331 HA SER 48 HA SER 48 -4.896 -9.210 -1.044 332 HB2 SER 48 HB2 SER 48 -4.523 -8.718 1.425 333 HB3 SER 48 HB1 SER 48 -6.276 -8.628 1.585 334 HG SER 48 HG SER 48 -4.630 -10.838 0.996 335 H LYS 49 HN LYS 49 -6.704 -10.778 -1.187 336 HA LYS 49 HA LYS 49 -8.893 -9.689 -2.621 337 HB2 LYS 49 HB2 LYS 49 -7.899 -11.997 -2.896 338 HB3 LYS 49 HB1 LYS 49 -8.715 -12.444 -1.404 339 HG2 LYS 49 HG2 LYS 49 -10.865 -11.939 -2.427 340 HG3 LYS 49 HG1 LYS 49 -10.052 -11.498 -3.930 341 HD2 LYS 49 HD2 LYS 49 -9.139 -13.784 -4.070 342 HD3 LYS 49 HD1 LYS 49 -10.024 -14.210 -2.606 343 HE2 LYS 49 HE2 LYS 49 -11.258 -13.260 -5.186 344 HE3 LYS 49 HE1 LYS 49 -11.185 -14.935 -4.648 345 HZ1 LYS 49 HZ1 LYS 49 -13.329 -13.969 -4.161 346 HZ2 LYS 49 HZ2 LYS 49 -12.611 -12.726 -3.267 347 HZ3 LYS 49 HZ3 LYS 49 -12.520 -14.322 -2.721 348 H ASP 50 HN ASP 50 -8.312 -10.340 0.693 349 HA ASP 50 HA ASP 50 -11.096 -10.338 1.456 350 HB2 ASP 50 HB2 ASP 50 -8.557 -10.297 3.097 351 HB3 ASP 50 HB1 ASP 50 -10.174 -10.340 3.789 352 H GLY 51 HN GLY 51 -8.717 -8.021 0.794 353 HA2 GLY 51 HA2 GLY 51 -8.937 -5.722 0.725 354 HA3 GLY 51 HA1 GLY 51 -10.493 -5.880 1.514 355 H LYS 52 HN LYS 52 -8.850 -7.567 3.568 356 HA LYS 52 HA LYS 52 -8.901 -5.481 5.490 357 HB2 LYS 52 HB2 LYS 52 -9.548 -7.717 6.104 358 HB3 LYS 52 HB1 LYS 52 -7.974 -8.348 5.645 359 HG2 LYS 52 HG2 LYS 52 -6.944 -7.041 7.459 360 HG3 LYS 52 HG1 LYS 52 -8.548 -6.486 7.943 361 HD2 LYS 52 HD2 LYS 52 -9.224 -8.717 8.490 362 HD3 LYS 52 HD1 LYS 52 -7.748 -9.387 7.798 363 HE2 LYS 52 HE2 LYS 52 -6.444 -8.160 9.518 364 HE3 LYS 52 HE1 LYS 52 -7.963 -7.641 10.248 365 HZ1 LYS 52 HZ1 LYS 52 -7.086 -10.458 9.912 366 HZ2 LYS 52 HZ2 LYS 52 -8.528 -9.954 10.631 367 HZ3 LYS 52 HZ3 LYS 52 -7.050 -9.584 11.358 368 H MET 53 HN MET 53 -6.344 -6.832 3.553 369 HA MET 53 HA MET 53 -4.425 -5.232 5.068 370 HB2 MET 53 HB2 MET 53 -2.798 -7.018 5.158 371 HB3 MET 53 HB1 MET 53 -4.288 -7.542 5.930 372 HG2 MET 53 HG2 MET 53 -4.881 -8.708 3.804 373 HG3 MET 53 HG1 MET 53 -3.274 -8.308 3.210 374 HE1 MET 53 HE1 MET 53 -0.997 -10.245 5.771 375 HE2 MET 53 HE2 MET 53 -1.566 -8.585 5.936 376 HE3 MET 53 HE3 MET 53 -1.019 -9.179 4.368 377 H LEU 54 HN LEU 54 -2.379 -4.941 3.971 378 HA LEU 54 HA LEU 54 -2.809 -4.662 1.076 379 HB2 LEU 54 HB2 LEU 54 -2.401 -2.647 2.569 380 HB3 LEU 54 HB1 LEU 54 -0.783 -3.265 2.818 381 HG LEU 54 HG LEU 54 -0.426 -3.110 0.339 382 HD11 LEU 54 HD11 LEU 54 -3.025 -1.579 0.445 383 HD12 LEU 54 HD12 LEU 54 -2.771 -3.133 -0.352 384 HD13 LEU 54 HD13 LEU 54 -1.945 -1.690 -0.943 385 HD21 LEU 54 HD21 LEU 54 -1.125 -0.549 1.768 386 HD22 LEU 54 HD22 LEU 54 -0.058 -0.710 0.373 387 HD23 LEU 54 HD23 LEU 54 0.397 -1.427 1.915 388 H GLU 55 HN GLU 55 -1.893 -6.365 0.053 389 HA GLU 55 HA GLU 55 0.545 -7.505 1.204 390 HB2 GLU 55 HB2 GLU 55 -1.549 -8.686 -0.602 391 HB3 GLU 55 HB1 GLU 55 0.001 -9.468 -0.311 392 HG2 GLU 55 HG2 GLU 55 -0.503 -9.435 2.116 393 HG3 GLU 55 HG1 GLU 55 -2.103 -8.812 1.738 394 H TRP 56 HN TRP 56 2.394 -7.619 0.131 395 HA TRP 56 HA TRP 56 2.417 -6.528 -2.590 396 HB2 TRP 56 HB2 TRP 56 4.678 -5.470 -1.823 397 HB3 TRP 56 HB1 TRP 56 3.160 -4.672 -1.436 398 HD1 TRP 56 HD1 TRP 56 5.043 -7.502 0.458 399 HE1 TRP 56 HE1 TRP 56 5.362 -6.731 2.893 400 HE3 TRP 56 HE3 TRP 56 2.933 -2.869 0.123 401 HZ2 TRP 56 HZ2 TRP 56 4.798 -4.461 4.459 402 HZ3 TRP 56 HZ3 TRP 56 2.862 -1.461 2.132 403 HH2 TRP 56 HH2 TRP 56 3.774 -2.240 4.257 404 H TYR 57 HN TYR 57 3.876 -7.314 -3.986 405 HA TYR 57 HA TYR 57 5.535 -9.565 -3.051 406 HB2 TYR 57 HB2 TYR 57 4.176 -9.320 -5.753 407 HB3 TYR 57 HB1 TYR 57 5.147 -10.682 -5.190 408 HD1 TYR 57 HD1 TYR 57 1.893 -9.017 -5.013 409 HD2 TYR 57 HD2 TYR 57 4.242 -12.244 -3.541 410 HE1 TYR 57 HE1 TYR 57 -0.140 -10.088 -4.138 411 HE2 TYR 57 HE2 TYR 57 2.214 -13.323 -2.661 412 HH TYR 57 HH TYR 57 -0.068 -12.669 -1.948 413 H LYS 58 HN LYS 58 7.600 -9.519 -3.669 414 HA LYS 58 HA LYS 58 9.073 -7.415 -4.353 415 HB2 LYS 58 HB2 LYS 58 10.747 -8.937 -5.344 416 HB3 LYS 58 HB1 LYS 58 10.076 -9.561 -3.843 417 HG2 LYS 58 HG2 LYS 58 8.900 -10.412 -6.453 418 HG3 LYS 58 HG1 LYS 58 10.408 -11.134 -5.891 419 HD2 LYS 58 HD2 LYS 58 9.389 -12.139 -4.061 420 HD3 LYS 58 HD1 LYS 58 8.029 -11.014 -4.072 421 HE2 LYS 58 HE2 LYS 58 7.079 -12.033 -5.979 422 HE3 LYS 58 HE1 LYS 58 8.542 -12.972 -6.289 423 HZ1 LYS 58 HZ1 LYS 58 8.115 -14.306 -4.387 424 HZ2 LYS 58 HZ2 LYS 58 6.679 -14.241 -5.279 425 HZ3 LYS 58 HZ3 LYS 58 6.846 -13.311 -3.881 426 H GLY 59 HN GLY 59 9.120 -5.974 -5.928 427 HA2 GLY 59 HA2 GLY 59 7.854 -6.680 -8.494 428 HA3 GLY 59 HA1 GLY 59 7.964 -5.052 -7.833 429 H LYS 60 HN LYS 60 10.785 -6.617 -7.248 430 HA LYS 60 HA LYS 60 12.271 -5.072 -9.101 431 HB2 LYS 60 HB2 LYS 60 13.125 -7.419 -7.390 432 HB3 LYS 60 HB1 LYS 60 14.213 -6.310 -8.214 433 HG2 LYS 60 HG2 LYS 60 13.581 -4.507 -6.824 434 HG3 LYS 60 HG1 LYS 60 12.217 -5.404 -6.161 435 HD2 LYS 60 HD2 LYS 60 15.067 -6.300 -5.820 436 HD3 LYS 60 HD1 LYS 60 14.279 -5.198 -4.691 437 HE2 LYS 60 HE2 LYS 60 12.581 -6.854 -4.201 438 HE3 LYS 60 HE1 LYS 60 13.263 -7.944 -5.410 439 HZ1 LYS 60 HZ1 LYS 60 14.708 -7.007 -2.981 440 HZ2 LYS 60 HZ2 LYS 60 15.262 -8.146 -4.104 441 HZ3 LYS 60 HZ3 LYS 60 13.932 -8.504 -3.121 442 H ASN 61 HN ASN 61 12.544 -8.586 -8.730 443 HA ASN 61 HA ASN 61 11.408 -9.320 -11.174 444 HB2 ASN 61 HB2 ASN 61 13.419 -8.168 -12.118 445 HB3 ASN 61 HB1 ASN 61 14.435 -9.319 -11.258 446 HD21 ASN 61 HD21 ASN 61 15.324 -10.134 -13.135 447 HD22 ASN 61 HD22 ASN 61 14.433 -11.135 -14.226 448 H ASP 62 HN ASP 62 14.455 -10.398 -9.669 449 HA ASP 62 HA ASP 62 13.059 -12.757 -8.628 450 HB2 ASP 62 HB2 ASP 62 14.582 -14.312 -9.611 451 HB3 ASP 62 HB1 ASP 62 14.012 -13.272 -10.909 452 H SER 63 HN SER 63 15.097 -10.249 -8.052 453 HA SER 63 HA SER 63 17.039 -11.618 -6.410 454 HB2 SER 63 HB2 SER 63 16.567 -8.641 -6.625 455 HB3 SER 63 HB1 SER 63 18.037 -9.461 -6.095 456 HG SER 63 HG SER 63 18.570 -9.854 -8.115 457 H ASP 64 HN ASP 64 14.309 -11.967 -5.633 458 HA ASP 64 HA ASP 64 14.017 -10.427 -3.171 459 HB2 ASP 64 HB2 ASP 64 11.895 -11.683 -2.929 460 HB3 ASP 64 HB1 ASP 64 11.988 -10.820 -4.461 461 H GLY 65 HN GLY 65 14.077 -11.356 -1.119 462 HA2 GLY 65 HA2 GLY 65 15.555 -13.902 -1.035 463 HA3 GLY 65 HA1 GLY 65 15.613 -12.655 0.203 464 H LYS 66 HN LYS 66 12.552 -13.433 -1.154 465 HA LYS 66 HA LYS 66 11.871 -14.948 1.278 466 HB2 LYS 66 HB2 LYS 66 11.063 -12.564 1.272 467 HB3 LYS 66 HB1 LYS 66 10.077 -12.967 -0.129 468 HG2 LYS 66 HG2 LYS 66 8.654 -13.115 1.728 469 HG3 LYS 66 HG1 LYS 66 9.050 -14.780 1.294 470 HD2 LYS 66 HD2 LYS 66 10.915 -14.616 3.015 471 HD3 LYS 66 HD1 LYS 66 10.121 -13.141 3.567 472 HE2 LYS 66 HE2 LYS 66 8.031 -14.464 3.853 473 HE3 LYS 66 HE1 LYS 66 8.964 -15.910 3.466 474 HZ1 LYS 66 HZ1 LYS 66 9.529 -14.085 5.739 475 HZ2 LYS 66 HZ2 LYS 66 10.341 -15.525 5.387 476 HZ3 LYS 66 HZ3 LYS 66 8.719 -15.566 5.861 477 H LYS 67 HN LYS 67 11.213 -14.308 -2.120 478 HA LYS 67 HA LYS 67 10.111 -15.392 -3.746 479 HB2 LYS 67 HB2 LYS 67 11.034 -17.661 -2.034 480 HB3 LYS 67 HB1 LYS 67 9.957 -17.987 -3.385 481 HG2 LYS 67 HG2 LYS 67 12.320 -18.274 -3.986 482 HG3 LYS 67 HG1 LYS 67 11.539 -17.013 -4.936 483 HD2 LYS 67 HD2 LYS 67 12.528 -15.304 -3.446 484 HD3 LYS 67 HD1 LYS 67 13.345 -16.592 -2.551 485 HE2 LYS 67 HE2 LYS 67 14.907 -15.634 -4.096 486 HE3 LYS 67 HE1 LYS 67 14.492 -17.252 -4.659 487 HZ1 LYS 67 HZ1 LYS 67 13.343 -14.712 -5.704 488 HZ2 LYS 67 HZ2 LYS 67 12.971 -16.271 -6.255 489 HZ3 LYS 67 HZ3 LYS 67 14.526 -15.653 -6.471 490 H LYS 68 HN LYS 68 8.846 -14.377 -1.363 491 HA LYS 68 HA LYS 68 6.130 -15.178 -1.937 492 HB2 LYS 68 HB2 LYS 68 7.433 -15.627 0.758 493 HB3 LYS 68 HB1 LYS 68 5.709 -15.366 0.620 494 HG2 LYS 68 HG2 LYS 68 7.213 -17.579 -0.745 495 HG3 LYS 68 HG1 LYS 68 6.330 -17.741 0.775 496 HD2 LYS 68 HD2 LYS 68 4.263 -17.082 -0.368 497 HD3 LYS 68 HD1 LYS 68 5.151 -16.945 -1.886 498 HE2 LYS 68 HE2 LYS 68 5.710 -19.319 -1.779 499 HE3 LYS 68 HE1 LYS 68 4.836 -19.460 -0.255 500 HZ1 LYS 68 HZ1 LYS 68 3.627 -18.683 -2.852 501 HZ2 LYS 68 HZ2 LYS 68 2.801 -18.884 -1.393 502 HZ3 LYS 68 HZ3 LYS 68 3.519 -20.215 -2.146 503 HA PRO 69 HA PRO 69 5.412 -10.846 -0.722 504 HB2 PRO 69 HB2 PRO 69 4.048 -11.596 1.813 505 HB3 PRO 69 HB1 PRO 69 3.519 -10.508 0.528 506 HG2 PRO 69 HG2 PRO 69 2.438 -12.924 0.788 507 HG3 PRO 69 HG1 PRO 69 2.765 -12.234 -0.814 508 HD2 PRO 69 HD2 PRO 69 4.255 -14.332 0.689 509 HD3 PRO 69 HD1 PRO 69 3.945 -14.197 -1.050 510 H ILE 70 HN ILE 70 6.524 -9.308 0.421 511 HA ILE 70 HA ILE 70 8.720 -10.303 1.968 512 HB ILE 70 HB ILE 70 9.473 -7.907 2.048 513 HG12 ILE 70 HG12 ILE 70 7.167 -7.498 0.134 514 HG13 ILE 70 HG11 ILE 70 7.262 -6.832 1.767 515 HG21 ILE 70 HG21 ILE 70 8.949 -9.150 -0.648 516 HG22 ILE 70 HG22 ILE 70 10.317 -9.484 0.414 517 HG23 ILE 70 HG23 ILE 70 10.135 -7.888 -0.315 518 HD11 ILE 70 HD11 ILE 70 7.842 -5.135 0.196 519 HD12 ILE 70 HD12 ILE 70 9.045 -6.177 -0.563 520 HD13 ILE 70 HD13 ILE 70 9.293 -5.600 1.084 521 H GLY 71 HN GLY 71 5.764 -9.973 2.988 522 HA2 GLY 71 HA2 GLY 71 5.243 -10.091 5.329 523 HA3 GLY 71 HA1 GLY 71 6.585 -9.004 5.644 524 H SER 72 HN SER 72 3.542 -9.154 3.922 525 HA SER 72 HA SER 72 3.046 -6.409 3.718 526 HB2 SER 72 HB2 SER 72 0.941 -8.568 3.882 527 HB3 SER 72 HB1 SER 72 0.891 -7.059 2.973 528 HG SER 72 HG SER 72 1.817 -9.447 2.203 529 H PHE 73 HN PHE 73 1.093 -5.317 4.740 530 HA PHE 73 HA PHE 73 0.788 -6.058 7.571 531 HB2 PHE 73 HB2 PHE 73 1.184 -3.866 8.330 532 HB3 PHE 73 HB1 PHE 73 2.402 -4.079 7.079 533 HD1 PHE 73 HD1 PHE 73 2.001 -3.054 4.818 534 HD2 PHE 73 HD2 PHE 73 -0.431 -2.205 8.193 535 HE1 PHE 73 HE1 PHE 73 1.174 -1.021 3.707 536 HE2 PHE 73 HE2 PHE 73 -1.270 -0.185 7.094 537 HZ PHE 73 HZ PHE 73 -0.467 0.419 4.844 538 HA PRO 74 HA PRO 74 -3.508 -5.436 6.725 539 HB2 PRO 74 HB2 PRO 74 -4.290 -4.881 9.368 540 HB3 PRO 74 HB1 PRO 74 -4.216 -6.457 8.588 541 HG2 PRO 74 HG2 PRO 74 -2.582 -5.535 10.691 542 HG3 PRO 74 HG1 PRO 74 -2.385 -7.027 9.764 543 HD2 PRO 74 HD2 PRO 74 -0.945 -4.457 9.535 544 HD3 PRO 74 HD1 PRO 74 -0.426 -6.095 9.088 545 H LEU 75 HN LEU 75 -4.827 -3.846 6.098 546 HA LEU 75 HA LEU 75 -3.941 -1.154 6.233 547 HB2 LEU 75 HB2 LEU 75 -6.536 -2.343 5.262 548 HB3 LEU 75 HB1 LEU 75 -6.079 -0.666 5.046 549 HG LEU 75 HG LEU 75 -4.525 -2.999 3.926 550 HD11 LEU 75 HD11 LEU 75 -6.723 -2.875 2.891 551 HD12 LEU 75 HD12 LEU 75 -5.472 -2.350 1.765 552 HD13 LEU 75 HD13 LEU 75 -6.490 -1.156 2.571 553 HD21 LEU 75 HD21 LEU 75 -3.093 -1.132 4.206 554 HD22 LEU 75 HD22 LEU 75 -4.323 -0.015 3.618 555 HD23 LEU 75 HD23 LEU 75 -3.563 -1.149 2.505 556 H ASN 76 HN ASN 76 -6.034 -3.030 8.208 557 HA ASN 76 HA ASN 76 -7.551 -0.841 9.254 558 HB2 ASN 76 HB2 ASN 76 -8.301 -2.518 10.972 559 HB3 ASN 76 HB1 ASN 76 -8.606 -2.972 9.304 560 HD21 ASN 76 HD21 ASN 76 -5.502 -3.237 10.997 561 HD22 ASN 76 HD22 ASN 76 -5.442 -4.966 10.960 562 H LYS 77 HN LYS 77 -4.392 -1.468 9.581 563 HA LYS 77 HA LYS 77 -4.276 -0.655 12.397 564 HB2 LYS 77 HB2 LYS 77 -2.152 -1.791 10.573 565 HB3 LYS 77 HB1 LYS 77 -1.842 -1.233 12.208 566 HG2 LYS 77 HG2 LYS 77 -3.653 -3.506 11.418 567 HG3 LYS 77 HG1 LYS 77 -2.047 -3.645 12.135 568 HD2 LYS 77 HD2 LYS 77 -2.919 -2.372 14.111 569 HD3 LYS 77 HD1 LYS 77 -4.530 -2.501 13.402 570 HE2 LYS 77 HE2 LYS 77 -4.288 -4.965 13.417 571 HE3 LYS 77 HE1 LYS 77 -2.739 -4.778 14.238 572 HZ1 LYS 77 HZ1 LYS 77 -4.452 -5.234 15.834 573 HZ2 LYS 77 HZ2 LYS 77 -5.395 -3.946 15.270 574 HZ3 LYS 77 HZ3 LYS 77 -3.924 -3.639 16.047 575 H ILE 78 HN ILE 78 -4.092 0.652 9.289 576 HA ILE 78 HA ILE 78 -1.909 2.421 9.505 577 HB ILE 78 HB ILE 78 -4.427 2.852 7.892 578 HG12 ILE 78 HG12 ILE 78 -1.803 1.602 7.060 579 HG13 ILE 78 HG11 ILE 78 -3.279 0.700 7.396 580 HG21 ILE 78 HG21 ILE 78 -3.073 4.870 8.197 581 HG22 ILE 78 HG22 ILE 78 -3.025 4.312 6.522 582 HG23 ILE 78 HG23 ILE 78 -1.654 4.010 7.592 583 HD11 ILE 78 HD11 ILE 78 -2.954 2.762 5.229 584 HD12 ILE 78 HD12 ILE 78 -4.392 1.786 5.543 585 HD13 ILE 78 HD13 ILE 78 -2.901 1.013 5.004 586 H THR 79 HN THR 79 -1.628 4.196 10.663 587 HA THR 79 HA THR 79 -3.903 5.258 12.130 588 HB THR 79 HB THR 79 -2.244 6.437 13.502 589 HG1 THR 79 HG1 THR 79 -0.393 6.834 12.562 590 HG21 THR 79 HG21 THR 79 -1.129 4.475 14.480 591 HG22 THR 79 HG22 THR 79 -1.559 3.528 13.055 592 HG23 THR 79 HG23 THR 79 -2.822 4.149 14.118 593 H SER 80 HN SER 80 -1.491 6.210 9.758 594 HA SER 80 HA SER 80 -3.185 8.348 8.846 595 HB2 SER 80 HB2 SER 80 -1.979 9.408 10.751 596 HB3 SER 80 HB1 SER 80 -0.452 9.043 9.949 597 HG SER 80 HG SER 80 -2.486 10.839 9.161 598 H ILE 81 HN ILE 81 -3.059 8.272 6.699 599 HA ILE 81 HA ILE 81 -0.540 7.378 5.468 600 HB ILE 81 HB ILE 81 -2.208 5.942 4.676 601 HG12 ILE 81 HG12 ILE 81 -2.097 8.158 2.614 602 HG13 ILE 81 HG11 ILE 81 -0.878 6.905 2.822 603 HG21 ILE 81 HG21 ILE 81 -4.021 8.325 4.344 604 HG22 ILE 81 HG22 ILE 81 -4.145 7.063 5.573 605 HG23 ILE 81 HG23 ILE 81 -4.419 6.672 3.874 606 HD11 ILE 81 HD11 ILE 81 -2.580 5.214 2.267 607 HD12 ILE 81 HD12 ILE 81 -2.277 6.358 0.962 608 HD13 ILE 81 HD13 ILE 81 -3.729 6.515 1.953 609 H ARG 82 HN ARG 82 0.712 9.068 4.960 610 HA ARG 82 HA ARG 82 -0.542 11.355 3.644 611 HB2 ARG 82 HB2 ARG 82 1.192 11.470 6.097 612 HB3 ARG 82 HB1 ARG 82 1.024 12.851 5.019 613 HG2 ARG 82 HG2 ARG 82 -1.145 11.498 6.609 614 HG3 ARG 82 HG1 ARG 82 -0.511 13.133 6.818 615 HD2 ARG 82 HD2 ARG 82 -1.345 13.728 4.585 616 HD3 ARG 82 HD1 ARG 82 -1.991 12.100 4.404 617 HE ARG 82 HE ARG 82 -2.953 13.992 6.449 618 HH11 ARG 82 HH11 ARG 82 -3.469 11.391 4.172 619 HH12 ARG 82 HH12 ARG 82 -5.205 11.427 4.300 620 HH21 ARG 82 HH21 ARG 82 -5.243 14.049 6.643 621 HH22 ARG 82 HH22 ARG 82 -6.206 12.944 5.719 622 H THR 83 HN THR 83 0.989 12.849 2.718 623 HA THR 83 HA THR 83 2.975 11.388 1.195 624 HB THR 83 HB THR 83 2.124 14.275 0.938 625 HG1 THR 83 HG1 THR 83 0.282 13.474 0.290 626 HG21 THR 83 HG21 THR 83 2.878 14.011 -1.373 627 HG22 THR 83 HG22 THR 83 3.347 12.345 -1.034 628 HG23 THR 83 HG23 THR 83 4.184 13.678 -0.235 629 H LYS 84 HN LYS 84 5.178 11.852 1.209 630 HA LYS 84 HA LYS 84 6.219 13.037 3.564 631 HB2 LYS 84 HB2 LYS 84 7.373 11.269 2.200 632 HB3 LYS 84 HB1 LYS 84 7.775 12.543 1.051 633 HG2 LYS 84 HG2 LYS 84 9.333 13.449 2.384 634 HG3 LYS 84 HG1 LYS 84 8.396 13.155 3.852 635 HD2 LYS 84 HD2 LYS 84 10.217 11.736 4.101 636 HD3 LYS 84 HD1 LYS 84 8.967 10.682 3.432 637 HE2 LYS 84 HE2 LYS 84 10.888 10.182 2.178 638 HE3 LYS 84 HE1 LYS 84 9.949 11.267 1.149 639 HZ1 LYS 84 HZ1 LYS 84 11.347 13.117 1.962 640 HZ2 LYS 84 HZ2 LYS 84 12.241 11.936 1.133 641 HZ3 LYS 84 HZ3 LYS 84 12.290 12.002 2.819 642 H VAL 85 HN VAL 85 6.485 15.055 4.000 643 HA VAL 85 HA VAL 85 5.457 17.068 2.398 644 HB VAL 85 HB VAL 85 5.558 17.109 4.851 645 HG11 VAL 85 HG11 VAL 85 7.823 16.239 5.135 646 HG12 VAL 85 HG12 VAL 85 7.603 17.761 6.003 647 HG13 VAL 85 HG13 VAL 85 8.483 17.738 4.476 648 HG21 VAL 85 HG21 VAL 85 6.073 19.493 5.101 649 HG22 VAL 85 HG22 VAL 85 5.114 19.170 3.658 650 HG23 VAL 85 HG23 VAL 85 6.842 19.484 3.516 651 H ASP 86 HN ASP 86 8.786 15.954 2.677 652 HA ASP 86 HA ASP 86 9.745 18.305 1.237 653 HB2 ASP 86 HB2 ASP 86 11.905 17.733 1.895 654 HB3 ASP 86 HB1 ASP 86 10.926 17.226 3.263 655 H ASN 87 HN ASN 87 8.774 15.109 0.629 656 HA ASN 87 HA ASN 87 9.734 15.313 -2.126 657 HB2 ASN 87 HB2 ASN 87 11.310 13.846 -0.779 658 HB3 ASN 87 HB1 ASN 87 9.962 12.743 -0.548 659 HD21 ASN 87 HD21 ASN 87 12.538 12.396 -1.931 660 HD22 ASN 87 HD22 ASN 87 12.137 11.889 -3.535 661 H LEU 88 HN LEU 88 7.781 15.577 -3.024 662 HA LEU 88 HA LEU 88 5.434 14.389 -1.942 663 HB2 LEU 88 HB2 LEU 88 5.909 15.916 -4.498 664 HB3 LEU 88 HB1 LEU 88 4.326 15.405 -3.949 665 HG LEU 88 HG LEU 88 6.146 17.277 -2.433 666 HD11 LEU 88 HD11 LEU 88 3.691 17.848 -4.093 667 HD12 LEU 88 HD12 LEU 88 5.349 18.292 -4.500 668 HD13 LEU 88 HD13 LEU 88 4.560 19.019 -3.101 669 HD21 LEU 88 HD21 LEU 88 4.151 17.691 -1.070 670 HD22 LEU 88 HD22 LEU 88 4.659 16.006 -0.984 671 HD23 LEU 88 HD23 LEU 88 3.277 16.460 -1.982 672 H LYS 89 HN LYS 89 7.783 13.222 -4.041 673 HA LYS 89 HA LYS 89 6.031 11.433 -5.487 674 HB2 LYS 89 HB2 LYS 89 9.045 11.573 -5.282 675 HB3 LYS 89 HB1 LYS 89 8.185 10.391 -6.257 676 HG2 LYS 89 HG2 LYS 89 8.769 12.025 -7.782 677 HG3 LYS 89 HG1 LYS 89 7.094 12.409 -7.390 678 HD2 LYS 89 HD2 LYS 89 7.889 14.110 -5.791 679 HD3 LYS 89 HD1 LYS 89 9.551 13.758 -6.275 680 HE2 LYS 89 HE2 LYS 89 8.965 14.354 -8.594 681 HE3 LYS 89 HE1 LYS 89 7.344 14.780 -8.052 682 HZ1 LYS 89 HZ1 LYS 89 8.759 16.726 -8.255 683 HZ2 LYS 89 HZ2 LYS 89 9.857 16.078 -7.147 684 HZ3 LYS 89 HZ3 LYS 89 8.295 16.491 -6.645 685 H SER 90 HN SER 90 7.437 11.604 -2.452 686 HA SER 90 HA SER 90 7.286 8.711 -2.052 687 HB2 SER 90 HB2 SER 90 8.442 10.754 -0.159 688 HB3 SER 90 HB1 SER 90 8.672 9.011 -0.144 689 HG SER 90 HG SER 90 9.403 10.290 -2.482 690 H LEU 91 HN LEU 91 6.244 7.959 -0.158 691 HA LEU 91 HA LEU 91 4.195 9.735 0.959 692 HB2 LEU 91 HB2 LEU 91 3.321 8.409 -0.991 693 HB3 LEU 91 HB1 LEU 91 3.677 6.953 -0.086 694 HG LEU 91 HG LEU 91 2.131 8.181 1.713 695 HD11 LEU 91 HD11 LEU 91 1.079 9.119 -0.948 696 HD12 LEU 91 HD12 LEU 91 1.794 10.144 0.295 697 HD13 LEU 91 HD13 LEU 91 0.282 9.297 0.615 698 HD21 LEU 91 HD21 LEU 91 1.764 5.950 0.934 699 HD22 LEU 91 HD22 LEU 91 1.248 6.536 -0.650 700 HD23 LEU 91 HD23 LEU 91 0.253 6.849 0.773 701 H GLU 92 HN GLU 92 4.436 9.641 3.109 702 HA GLU 92 HA GLU 92 5.632 7.223 4.250 703 HB2 GLU 92 HB2 GLU 92 6.808 9.339 4.699 704 HB3 GLU 92 HB1 GLU 92 5.360 9.978 5.463 705 HG2 GLU 92 HG2 GLU 92 5.502 8.296 7.195 706 HG3 GLU 92 HG1 GLU 92 6.900 7.571 6.404 707 H ILE 93 HN ILE 93 4.308 5.837 5.134 708 HA ILE 93 HA ILE 93 1.705 6.816 6.090 709 HB ILE 93 HB ILE 93 2.503 4.169 4.901 710 HG12 ILE 93 HG12 ILE 93 0.458 6.255 4.121 711 HG13 ILE 93 HG11 ILE 93 2.000 5.965 3.318 712 HG21 ILE 93 HG21 ILE 93 -0.104 4.882 6.244 713 HG22 ILE 93 HG22 ILE 93 1.075 3.691 6.804 714 HG23 ILE 93 HG23 ILE 93 0.190 3.421 5.300 715 HD11 ILE 93 HD11 ILE 93 1.284 3.829 2.567 716 HD12 ILE 93 HD12 ILE 93 0.043 5.013 2.153 717 HD13 ILE 93 HD13 ILE 93 -0.195 3.928 3.523 718 H SER 94 HN SER 94 1.493 6.856 8.161 719 HA SER 94 HA SER 94 3.163 5.210 9.871 720 HB2 SER 94 HB2 SER 94 1.057 7.249 10.645 721 HB3 SER 94 HB1 SER 94 2.331 6.593 11.674 722 HG SER 94 HG SER 94 3.695 7.969 10.854 723 H VAL 95 HN VAL 95 2.482 3.356 10.671 724 HA VAL 95 HA VAL 95 -0.407 2.857 10.870 725 HB VAL 95 HB VAL 95 -0.023 1.645 8.937 726 HG11 VAL 95 HG11 VAL 95 2.045 0.287 8.533 727 HG12 VAL 95 HG12 VAL 95 2.734 1.049 9.971 728 HG13 VAL 95 HG13 VAL 95 2.269 2.039 8.580 729 HG21 VAL 95 HG21 VAL 95 0.710 -0.330 11.090 730 HG22 VAL 95 HG22 VAL 95 0.194 -0.750 9.458 731 HG23 VAL 95 HG23 VAL 95 -0.916 0.082 10.548 732 H SER 96 HN SER 96 -0.970 1.240 12.486 733 HA SER 96 HA SER 96 0.685 1.315 14.795 734 HB2 SER 96 HB2 SER 96 -1.855 1.047 14.730 735 HB3 SER 96 HB1 SER 96 -1.578 -0.625 14.253 736 HG SER 96 HG SER 96 -0.105 0.009 16.432 737 H SER 97 HN SER 97 2.571 0.263 14.851 738 HA SER 97 HA SER 97 2.890 -1.966 12.970 739 HB2 SER 97 HB2 SER 97 4.952 0.081 13.811 740 HB3 SER 97 HB1 SER 97 5.167 -1.182 12.602 741 HG SER 97 HG SER 97 3.172 0.825 12.426 742 H VAL 98 HN VAL 98 4.243 -3.613 13.414 743 HA VAL 98 HA VAL 98 5.147 -3.972 16.182 744 HB VAL 98 HB VAL 98 5.490 -6.359 15.525 745 HG11 VAL 98 HG11 VAL 98 3.111 -6.973 15.434 746 HG12 VAL 98 HG12 VAL 98 2.704 -5.296 15.072 747 HG13 VAL 98 HG13 VAL 98 3.426 -5.712 16.627 748 HG21 VAL 98 HG21 VAL 98 4.135 -5.537 12.956 749 HG22 VAL 98 HG22 VAL 98 4.519 -7.189 13.435 750 HG23 VAL 98 HG23 VAL 98 5.818 -6.037 13.125 751 H HIS 99 HN HIS 99 7.343 -5.641 15.755 752 HA HIS 99 HA HIS 99 9.428 -3.945 15.338 753 HB2 HIS 99 HB2 HIS 99 9.180 -6.896 15.027 754 HB3 HIS 99 HB1 HIS 99 10.670 -6.122 14.496 755 HD1 HIS 99 HD1 HIS 99 12.366 -6.408 16.262 756 HD2 HIS 99 HD2 HIS 99 8.606 -5.628 17.856 757 HE1 HIS 99 HE1 HIS 99 12.698 -6.289 18.752 758 HE2 HIS 99 HE2 HIS 99 10.429 -5.723 19.687 759 H ILE 100 HN ILE 100 9.460 -2.545 13.736 760 HA ILE 100 HA ILE 100 10.478 -2.961 11.242 761 HB ILE 100 HB ILE 100 8.271 -4.236 10.879 762 HG12 ILE 100 HG12 ILE 100 8.812 -1.900 9.031 763 HG13 ILE 100 HG11 ILE 100 9.727 -3.403 9.039 764 HG21 ILE 100 HG21 ILE 100 6.296 -2.887 10.357 765 HG22 ILE 100 HG22 ILE 100 7.158 -1.433 10.863 766 HG23 ILE 100 HG23 ILE 100 6.788 -2.694 12.039 767 HD11 ILE 100 HD11 ILE 100 6.797 -3.125 8.413 768 HD12 ILE 100 HD12 ILE 100 7.720 -4.628 8.404 769 HD13 ILE 100 HD13 ILE 100 8.096 -3.356 7.242 770 H SER 101 HN SER 101 9.957 -0.946 9.807 771 HA SER 101 HA SER 101 9.748 1.359 11.605 772 HB2 SER 101 HB2 SER 101 11.861 1.142 10.331 773 HB3 SER 101 HB1 SER 101 10.950 1.186 8.826 774 HG SER 101 HG SER 101 11.709 3.234 10.490 775 H THR 102 HN THR 102 8.899 3.375 10.389 776 HA THR 102 HA THR 102 6.209 2.990 9.662 777 HB THR 102 HB THR 102 8.078 5.326 9.139 778 HG1 THR 102 HG1 THR 102 6.407 4.566 11.294 779 HG21 THR 102 HG21 THR 102 6.043 6.695 8.966 780 HG22 THR 102 HG22 THR 102 5.059 5.234 9.074 781 HG23 THR 102 HG23 THR 102 6.124 5.480 7.691 782 H TYR 103 HN TYR 103 5.213 3.036 7.600 783 HA TYR 103 HA TYR 103 6.931 1.745 5.645 784 HB2 TYR 103 HB2 TYR 103 5.023 0.472 5.961 785 HB3 TYR 103 HB1 TYR 103 3.986 1.876 6.147 786 HD1 TYR 103 HD1 TYR 103 2.429 2.167 4.512 787 HD2 TYR 103 HD2 TYR 103 6.150 0.387 3.437 788 HE1 TYR 103 HE1 TYR 103 1.638 1.921 2.200 789 HE2 TYR 103 HE2 TYR 103 5.351 0.149 1.121 790 HH TYR 103 HH TYR 103 3.185 -0.013 -0.075 791 H LEU 104 HN LEU 104 7.785 2.775 4.040 792 HA LEU 104 HA LEU 104 6.579 5.291 3.163 793 HB2 LEU 104 HB2 LEU 104 9.302 4.411 3.598 794 HB3 LEU 104 HB1 LEU 104 9.095 5.073 1.985 795 HG LEU 104 HG LEU 104 8.138 6.566 4.417 796 HD11 LEU 104 HD11 LEU 104 10.256 7.783 4.410 797 HD12 LEU 104 HD12 LEU 104 10.877 6.717 3.152 798 HD13 LEU 104 HD13 LEU 104 10.515 6.073 4.752 799 HD21 LEU 104 HD21 LEU 104 8.413 8.493 2.933 800 HD22 LEU 104 HD22 LEU 104 7.314 7.300 2.244 801 HD23 LEU 104 HD23 LEU 104 8.968 7.424 1.645 802 H PHE 105 HN PHE 105 5.364 5.125 1.510 803 HA PHE 105 HA PHE 105 5.844 3.158 -0.599 804 HB2 PHE 105 HB2 PHE 105 3.570 3.266 0.128 805 HB3 PHE 105 HB1 PHE 105 3.568 5.020 0.111 806 HD1 PHE 105 HD1 PHE 105 3.490 6.226 -2.045 807 HD2 PHE 105 HD2 PHE 105 3.036 2.006 -1.802 808 HE1 PHE 105 HE1 PHE 105 2.483 6.213 -4.275 809 HE2 PHE 105 HE2 PHE 105 2.025 1.991 -4.045 810 HZ PHE 105 HZ PHE 105 1.744 4.100 -5.285 811 H THR 106 HN THR 106 7.201 3.817 -2.197 812 HA THR 106 HA THR 106 7.309 6.713 -2.716 813 HB THR 106 HB THR 106 9.618 4.798 -2.976 814 HG1 THR 106 HG1 THR 106 8.974 5.014 -0.793 815 HG21 THR 106 HG21 THR 106 9.791 6.812 -4.358 816 HG22 THR 106 HG22 THR 106 10.963 6.846 -3.042 817 HG23 THR 106 HG23 THR 106 9.493 7.817 -2.939 818 H PHE 107 HN PHE 107 6.767 7.321 -4.659 819 HA PHE 107 HA PHE 107 7.137 5.461 -6.914 820 HB2 PHE 107 HB2 PHE 107 4.873 6.975 -6.123 821 HB3 PHE 107 HB1 PHE 107 5.493 7.715 -7.594 822 HD1 PHE 107 HD1 PHE 107 3.209 5.427 -6.446 823 HD2 PHE 107 HD2 PHE 107 6.258 5.809 -9.385 824 HE1 PHE 107 HE1 PHE 107 2.127 3.678 -7.781 825 HE2 PHE 107 HE2 PHE 107 5.179 4.054 -10.729 826 HZ PHE 107 HZ PHE 107 3.100 2.995 -9.925 827 H LYS 108 HN LYS 108 7.269 6.970 -9.028 828 HA LYS 108 HA LYS 108 9.616 8.597 -8.551 829 HB2 LYS 108 HB2 LYS 108 9.681 8.573 -11.145 830 HB3 LYS 108 HB1 LYS 108 10.125 7.131 -10.243 831 HG2 LYS 108 HG2 LYS 108 8.834 6.357 -12.003 832 HG3 LYS 108 HG1 LYS 108 7.712 6.384 -10.651 833 HD2 LYS 108 HD2 LYS 108 6.598 8.268 -11.458 834 HD3 LYS 108 HD1 LYS 108 7.940 8.711 -12.519 835 HE2 LYS 108 HE2 LYS 108 7.512 6.659 -13.825 836 HE3 LYS 108 HE1 LYS 108 6.091 6.358 -12.828 837 HZ1 LYS 108 HZ1 LYS 108 5.503 7.439 -14.905 838 HZ2 LYS 108 HZ2 LYS 108 6.523 8.740 -14.553 839 HZ3 LYS 108 HZ3 LYS 108 5.157 8.453 -13.601 840 H THR 109 HN THR 109 6.292 9.049 -9.162 841 HA THR 109 HA THR 109 6.812 11.926 -9.418 842 HB THR 109 HB THR 109 4.896 12.164 -10.964 843 HG1 THR 109 HG1 THR 109 3.918 10.374 -11.824 844 HG21 THR 109 HG21 THR 109 6.000 11.205 -12.966 845 HG22 THR 109 HG22 THR 109 7.097 10.327 -11.897 846 HG23 THR 109 HG23 THR 109 7.109 12.092 -11.922 847 H ARG 110 HN ARG 110 5.108 13.284 -8.565 848 HA ARG 110 HA ARG 110 3.880 12.279 -6.236 849 HB2 ARG 110 HB2 ARG 110 4.339 14.656 -6.437 850 HB3 ARG 110 HB1 ARG 110 3.253 14.778 -7.815 851 HG2 ARG 110 HG2 ARG 110 1.493 13.843 -6.102 852 HG3 ARG 110 HG1 ARG 110 2.622 14.510 -4.922 853 HD2 ARG 110 HD2 ARG 110 2.456 16.697 -5.970 854 HD3 ARG 110 HD1 ARG 110 1.391 16.036 -7.214 855 HE ARG 110 HE ARG 110 0.657 16.141 -4.352 856 HH11 ARG 110 HH11 ARG 110 -0.135 16.580 -7.737 857 HH12 ARG 110 HH12 ARG 110 -1.784 17.010 -7.423 858 HH21 ARG 110 HH21 ARG 110 -1.533 16.684 -3.943 859 HH22 ARG 110 HH22 ARG 110 -2.583 17.045 -5.277 860 H GLU 111 HN GLU 111 2.658 12.896 -9.485 861 HA GLU 111 HA GLU 111 -0.058 12.636 -9.049 862 HB2 GLU 111 HB2 GLU 111 1.493 11.739 -11.481 863 HB3 GLU 111 HB1 GLU 111 -0.233 12.063 -11.426 864 HG2 GLU 111 HG2 GLU 111 0.170 14.392 -10.994 865 HG3 GLU 111 HG1 GLU 111 1.906 14.106 -10.879 866 H GLU 112 HN GLU 112 2.332 10.118 -9.734 867 HA GLU 112 HA GLU 112 0.462 8.014 -9.974 868 HB2 GLU 112 HB2 GLU 112 3.436 8.042 -9.463 869 HB3 GLU 112 HB1 GLU 112 2.511 6.551 -9.648 870 HG2 GLU 112 HG2 GLU 112 2.995 8.712 -11.669 871 HG3 GLU 112 HG1 GLU 112 3.473 7.016 -11.741 872 H ARG 113 HN ARG 113 2.438 9.160 -7.252 873 HA ARG 113 HA ARG 113 1.453 7.122 -5.503 874 HB2 ARG 113 HB2 ARG 113 2.699 8.191 -3.760 875 HB3 ARG 113 HB1 ARG 113 3.674 8.276 -5.215 876 HG2 ARG 113 HG2 ARG 113 3.956 10.381 -4.364 877 HG3 ARG 113 HG1 ARG 113 2.587 10.646 -5.445 878 HD2 ARG 113 HD2 ARG 113 1.096 10.212 -3.464 879 HD3 ARG 113 HD1 ARG 113 2.540 10.277 -2.461 880 HE ARG 113 HE ARG 113 2.796 12.599 -3.511 881 HH11 ARG 113 HH11 ARG 113 -0.252 11.038 -2.795 882 HH12 ARG 113 HH12 ARG 113 -1.106 12.516 -2.509 883 HH21 ARG 113 HH21 ARG 113 1.675 14.570 -3.097 884 HH22 ARG 113 HH22 ARG 113 0.000 14.526 -2.652 885 H GLU 114 HN GLU 114 0.484 10.313 -6.410 886 HA GLU 114 HA GLU 114 -1.263 11.001 -4.347 887 HB2 GLU 114 HB2 GLU 114 -0.537 12.031 -6.842 888 HB3 GLU 114 HB1 GLU 114 -2.266 11.753 -6.968 889 HG2 GLU 114 HG2 GLU 114 -0.923 13.361 -4.814 890 HG3 GLU 114 HG1 GLU 114 -1.703 14.026 -6.246 891 H SER 115 HN SER 115 -1.962 9.377 -7.427 892 HA SER 115 HA SER 115 -4.660 8.889 -7.037 893 HB2 SER 115 HB2 SER 115 -3.424 8.498 -9.172 894 HB3 SER 115 HB1 SER 115 -2.691 7.067 -8.452 895 HG SER 115 HG SER 115 -5.450 7.526 -8.951 896 H TRP 116 HN TRP 116 -1.894 6.812 -6.252 897 HA TRP 116 HA TRP 116 -3.286 4.646 -5.232 898 HB2 TRP 116 HB2 TRP 116 -0.818 4.836 -5.766 899 HB3 TRP 116 HB1 TRP 116 -0.622 5.646 -4.217 900 HD1 TRP 116 HD1 TRP 116 -1.122 2.243 -5.775 901 HE1 TRP 116 HE1 TRP 116 -0.816 0.434 -3.982 902 HE3 TRP 116 HE3 TRP 116 -0.983 5.237 -1.625 903 HZ2 TRP 116 HZ2 TRP 116 -0.556 0.294 -1.178 904 HZ3 TRP 116 HZ3 TRP 116 -0.705 4.176 0.572 905 HH2 TRP 116 HH2 TRP 116 -0.496 1.755 0.793 906 H GLN 117 HN GLN 117 -1.826 7.357 -3.389 907 HA GLN 117 HA GLN 117 -2.764 6.673 -0.878 908 HB2 GLN 117 HB2 GLN 117 -1.210 8.430 -0.916 909 HB3 GLN 117 HB1 GLN 117 -2.104 9.325 -2.138 910 HG2 GLN 117 HG2 GLN 117 -3.878 9.752 -0.458 911 HG3 GLN 117 HG1 GLN 117 -2.874 8.961 0.752 912 HE21 GLN 117 HE21 GLN 117 -1.148 10.049 1.613 913 HE22 GLN 117 HE22 GLN 117 -0.818 11.716 1.290 914 H ASN 118 HN ASN 118 -4.379 8.702 -3.336 915 HA ASN 118 HA ASN 118 -6.578 9.396 -1.721 916 HB2 ASN 118 HB2 ASN 118 -6.258 9.245 -4.715 917 HB3 ASN 118 HB1 ASN 118 -7.761 9.754 -3.962 918 HD21 ASN 118 HD21 ASN 118 -4.566 10.507 -2.714 919 HD22 ASN 118 HD22 ASN 118 -4.610 12.203 -3.063 920 H ASN 119 HN ASN 119 -6.076 6.726 -3.969 921 HA ASN 119 HA ASN 119 -8.650 5.585 -3.742 922 HB2 ASN 119 HB2 ASN 119 -6.008 4.268 -4.416 923 HB3 ASN 119 HB1 ASN 119 -7.591 3.542 -4.659 924 HD21 ASN 119 HD21 ASN 119 -5.451 4.211 -6.540 925 HD22 ASN 119 HD22 ASN 119 -6.167 5.235 -7.727 926 H LEU 120 HN LEU 120 -5.565 4.724 -2.185 927 HA LEU 120 HA LEU 120 -6.641 2.596 -0.681 928 HB2 LEU 120 HB2 LEU 120 -4.206 3.001 -1.264 929 HB3 LEU 120 HB1 LEU 120 -4.183 4.193 0.013 930 HG LEU 120 HG LEU 120 -3.303 1.795 0.496 931 HD11 LEU 120 HD11 LEU 120 -3.538 3.537 2.181 932 HD12 LEU 120 HD12 LEU 120 -4.001 1.960 2.820 933 HD13 LEU 120 HD13 LEU 120 -5.243 3.129 2.372 934 HD21 LEU 120 HD21 LEU 120 -4.962 0.235 1.309 935 HD22 LEU 120 HD22 LEU 120 -5.278 0.625 -0.382 936 HD23 LEU 120 HD23 LEU 120 -6.256 1.357 0.889 937 H GLU 121 HN GLU 121 -6.126 6.013 0.061 938 HA GLU 121 HA GLU 121 -6.686 5.931 2.794 939 HB2 GLU 121 HB2 GLU 121 -5.815 7.929 1.655 940 HB3 GLU 121 HB1 GLU 121 -7.352 8.131 0.831 941 HG2 GLU 121 HG2 GLU 121 -8.449 8.421 3.025 942 HG3 GLU 121 HG1 GLU 121 -6.865 8.327 3.794 943 H SER 122 HN SER 122 -8.898 6.555 0.076 944 HA SER 122 HA SER 122 -11.258 6.728 1.574 945 HB2 SER 122 HB2 SER 122 -11.022 7.363 -0.841 946 HB3 SER 122 HB1 SER 122 -10.981 5.646 -1.243 947 HG SER 122 HG SER 122 -13.111 7.134 -0.115 948 H PHE 123 HN PHE 123 -9.724 3.938 0.023 949 HA PHE 123 HA PHE 123 -11.658 2.033 0.690 950 HB2 PHE 123 HB2 PHE 123 -9.845 1.676 -0.948 951 HB3 PHE 123 HB1 PHE 123 -8.671 1.669 0.358 952 HD1 PHE 123 HD1 PHE 123 -11.992 0.051 0.364 953 HD2 PHE 123 HD2 PHE 123 -7.775 -0.503 0.131 954 HE1 PHE 123 HE1 PHE 123 -12.298 -2.373 0.604 955 HE2 PHE 123 HE2 PHE 123 -8.085 -2.929 0.376 956 HZ PHE 123 HZ PHE 123 -10.278 -3.876 0.577 957 H ARG 124 HN ARG 124 -8.756 3.098 2.398 958 HA ARG 124 HA ARG 124 -9.038 1.493 4.691 959 HB2 ARG 124 HB2 ARG 124 -6.950 2.534 4.383 960 HB3 ARG 124 HB1 ARG 124 -7.675 4.114 4.132 961 HG2 ARG 124 HG2 ARG 124 -8.348 4.111 6.527 962 HG3 ARG 124 HG1 ARG 124 -7.430 2.614 6.726 963 HD2 ARG 124 HD2 ARG 124 -5.395 3.707 6.102 964 HD3 ARG 124 HD1 ARG 124 -6.262 5.175 5.659 965 HE ARG 124 HE ARG 124 -5.961 4.169 8.417 966 HH11 ARG 124 HH11 ARG 124 -6.420 6.789 6.142 967 HH12 ARG 124 HH12 ARG 124 -6.273 8.029 7.340 968 HH21 ARG 124 HH21 ARG 124 -5.769 5.797 10.002 969 HH22 ARG 124 HH22 ARG 124 -5.894 7.463 9.537 970 H LYS 125 HN LYS 125 -10.361 4.660 3.843 971 HA LYS 125 HA LYS 125 -11.464 5.268 6.361 972 HB2 LYS 125 HB2 LYS 125 -12.341 6.162 3.613 973 HB3 LYS 125 HB1 LYS 125 -12.950 6.828 5.124 974 HG2 LYS 125 HG2 LYS 125 -10.796 7.693 5.691 975 HG3 LYS 125 HG1 LYS 125 -10.052 6.869 4.321 976 HD2 LYS 125 HD2 LYS 125 -10.355 9.223 3.818 977 HD3 LYS 125 HD1 LYS 125 -11.395 8.244 2.786 978 HE2 LYS 125 HE2 LYS 125 -13.288 8.708 4.278 979 HE3 LYS 125 HE1 LYS 125 -12.242 9.716 5.277 980 HZ1 LYS 125 HZ1 LYS 125 -11.870 11.136 3.327 981 HZ2 LYS 125 HZ2 LYS 125 -13.498 11.080 3.777 982 HZ3 LYS 125 HZ3 LYS 125 -12.962 10.197 2.439 983 H ILE 126 HN ILE 126 -12.643 3.303 3.715 984 HA ILE 126 HA ILE 126 -15.298 3.048 4.675 985 HB ILE 126 HB ILE 126 -13.744 1.096 2.978 986 HG12 ILE 126 HG12 ILE 126 -15.578 3.314 2.060 987 HG13 ILE 126 HG11 ILE 126 -13.823 3.452 2.090 988 HG21 ILE 126 HG21 ILE 126 -16.700 1.505 3.382 989 HG22 ILE 126 HG22 ILE 126 -15.742 0.110 3.881 990 HG23 ILE 126 HG23 ILE 126 -15.985 0.448 2.166 991 HD11 ILE 126 HD11 ILE 126 -13.675 1.560 0.535 992 HD12 ILE 126 HD12 ILE 126 -14.582 2.918 -0.130 993 HD13 ILE 126 HD13 ILE 126 -15.436 1.496 0.471 994 H MET 127 HN MET 127 -12.289 1.547 5.528 995 HA MET 127 HA MET 127 -13.690 -0.614 6.927 996 HB2 MET 127 HB2 MET 127 -10.760 -0.294 6.259 997 HB3 MET 127 HB1 MET 127 -11.465 -1.684 7.071 998 HG2 MET 127 HG2 MET 127 -12.787 -2.196 5.109 999 HG3 MET 127 HG1 MET 127 -12.170 -0.760 4.294 1000 HE1 MET 127 HE1 MET 127 -8.428 -1.651 3.680 1001 HE2 MET 127 HE2 MET 127 -9.073 -0.754 5.053 1002 HE3 MET 127 HE3 MET 127 -9.716 -0.471 3.436 1003 H SER 128 HN SER 128 -11.269 1.924 7.505 1004 HA SER 128 HA SER 128 -11.246 1.264 10.352 1005 HB2 SER 128 HB2 SER 128 -9.105 1.681 9.095 1006 HB3 SER 128 HB1 SER 128 -9.615 3.355 8.889 1007 HG SER 128 HG SER 128 -9.532 3.638 11.111 1008 H MET 129 HN MET 129 -12.120 3.862 8.152 1009 HA MET 129 HA MET 129 -13.234 5.406 10.376 1010 HB2 MET 129 HB2 MET 129 -12.827 6.135 7.449 1011 HB3 MET 129 HB1 MET 129 -13.561 7.190 8.654 1012 HG2 MET 129 HG2 MET 129 -11.511 7.244 9.927 1013 HG3 MET 129 HG1 MET 129 -10.762 6.102 8.814 1014 HE1 MET 129 HE1 MET 129 -13.140 9.106 7.799 1015 HE2 MET 129 HE2 MET 129 -11.961 10.410 7.668 1016 HE3 MET 129 HE3 MET 129 -12.288 9.668 9.235 1017 H LYS 130 HN LYS 130 -14.348 2.928 9.602 1018 HA LYS 130 HA LYS 130 -16.429 3.091 7.732 1019 HB2 LYS 130 HB2 LYS 130 -15.410 0.978 8.582 1020 HB3 LYS 130 HB1 LYS 130 -16.233 1.233 10.113 1021 HG2 LYS 130 HG2 LYS 130 -18.394 1.195 8.869 1022 HG3 LYS 130 HG1 LYS 130 -17.488 0.742 7.427 1023 HD2 LYS 130 HD2 LYS 130 -17.487 -0.830 10.002 1024 HD3 LYS 130 HD1 LYS 130 -18.534 -1.178 8.629 1025 HE2 LYS 130 HE2 LYS 130 -16.811 -2.638 8.229 1026 HE3 LYS 130 HE1 LYS 130 -16.267 -1.237 7.312 1027 HZ1 LYS 130 HZ1 LYS 130 -15.396 -1.918 10.067 1028 HZ2 LYS 130 HZ2 LYS 130 -14.835 -0.620 9.145 1029 HZ3 LYS 130 HZ3 LYS 130 -14.501 -2.205 8.664 Start of MODEL 9 1 H1 SER 12 HT1 SER 12 -22.359 -9.567 -2.997 2 H2 SER 12 HT2 SER 12 -21.059 -9.319 -1.935 3 H3 SER 12 HT3 SER 12 -21.877 -7.994 -2.607 4 HA SER 12 HA SER 12 -23.157 -9.975 -0.834 5 HB2 SER 12 HB2 SER 12 -21.429 -8.826 0.427 6 HB3 SER 12 HB1 SER 12 -21.948 -7.268 -0.210 7 HG SER 12 HG SER 12 -23.466 -8.992 1.474 8 H ALA 13 HN ALA 13 -23.179 -6.609 -1.907 9 HA ALA 13 HA ALA 13 -26.052 -6.844 -2.421 10 HB1 ALA 13 HB1 ALA 13 -24.477 -4.326 -1.906 11 HB2 ALA 13 HB2 ALA 13 -25.472 -5.159 -0.714 12 HB3 ALA 13 HB3 ALA 13 -26.221 -4.445 -2.142 13 H LYS 14 HN LYS 14 -23.338 -4.804 -3.545 14 HA LYS 14 HA LYS 14 -23.294 -5.866 -6.155 15 HB2 LYS 14 HB2 LYS 14 -24.301 -4.070 -7.435 16 HB3 LYS 14 HB1 LYS 14 -25.486 -4.736 -6.322 17 HG2 LYS 14 HG2 LYS 14 -23.913 -2.347 -5.482 18 HG3 LYS 14 HG1 LYS 14 -25.228 -2.143 -6.641 19 HD2 LYS 14 HD2 LYS 14 -25.529 -3.495 -3.963 20 HD3 LYS 14 HD1 LYS 14 -25.871 -1.788 -4.249 21 HE2 LYS 14 HE2 LYS 14 -27.539 -2.436 -5.941 22 HE3 LYS 14 HE1 LYS 14 -27.221 -4.132 -5.588 23 HZ1 LYS 14 HZ1 LYS 14 -29.185 -3.324 -4.436 24 HZ2 LYS 14 HZ2 LYS 14 -28.266 -2.141 -3.651 25 HZ3 LYS 14 HZ3 LYS 14 -27.986 -3.777 -3.334 26 H ASP 15 HN ASP 15 -21.577 -4.514 -3.877 27 HA ASP 15 HA ASP 15 -19.704 -3.069 -5.339 28 HB2 ASP 15 HB2 ASP 15 -21.489 -1.534 -5.871 29 HB3 ASP 15 HB1 ASP 15 -21.907 -1.394 -4.166 30 H ILE 16 HN ILE 16 -21.508 -3.047 -2.305 31 HA ILE 16 HA ILE 16 -19.715 -1.413 -0.906 32 HB ILE 16 HB ILE 16 -21.839 -3.281 0.141 33 HG12 ILE 16 HG12 ILE 16 -22.940 -0.970 0.589 34 HG13 ILE 16 HG11 ILE 16 -21.783 -0.362 -0.585 35 HG21 ILE 16 HG21 ILE 16 -20.327 -1.123 1.612 36 HG22 ILE 16 HG22 ILE 16 -20.185 -2.860 1.879 37 HG23 ILE 16 HG23 ILE 16 -21.699 -2.034 2.243 38 HD11 ILE 16 HD11 ILE 16 -23.736 -2.577 -1.155 39 HD12 ILE 16 HD12 ILE 16 -22.722 -1.714 -2.312 40 HD13 ILE 16 HD13 ILE 16 -24.039 -0.875 -1.498 41 H LYS 17 HN LYS 17 -20.338 -4.854 -0.063 42 HA LYS 17 HA LYS 17 -18.097 -4.829 1.679 43 HB2 LYS 17 HB2 LYS 17 -19.780 -7.139 0.717 44 HB3 LYS 17 HB1 LYS 17 -18.610 -7.223 2.027 45 HG2 LYS 17 HG2 LYS 17 -21.042 -5.449 1.988 46 HG3 LYS 17 HG1 LYS 17 -20.920 -6.994 2.829 47 HD2 LYS 17 HD2 LYS 17 -19.100 -4.647 3.354 48 HD3 LYS 17 HD1 LYS 17 -20.572 -4.967 4.267 49 HE2 LYS 17 HE2 LYS 17 -18.261 -6.887 4.005 50 HE3 LYS 17 HE1 LYS 17 -18.516 -5.806 5.374 51 HZ1 LYS 17 HZ1 LYS 17 -20.629 -6.907 5.796 52 HZ2 LYS 17 HZ2 LYS 17 -19.354 -8.012 5.843 53 HZ3 LYS 17 HZ3 LYS 17 -20.368 -7.952 4.493 54 H ASP 18 HN ASP 18 -18.651 -6.910 -1.168 55 HA ASP 18 HA ASP 18 -15.905 -7.798 -1.100 56 HB2 ASP 18 HB2 ASP 18 -17.762 -8.358 -3.389 57 HB3 ASP 18 HB1 ASP 18 -16.510 -9.384 -2.705 58 H GLU 19 HN GLU 19 -17.929 -5.865 -3.200 59 HA GLU 19 HA GLU 19 -16.164 -5.902 -5.383 60 HB2 GLU 19 HB2 GLU 19 -18.645 -4.374 -4.709 61 HB3 GLU 19 HB1 GLU 19 -17.753 -4.045 -6.200 62 HG2 GLU 19 HG2 GLU 19 -18.966 -6.666 -5.349 63 HG3 GLU 19 HG1 GLU 19 -19.552 -5.597 -6.621 64 H LYS 20 HN LYS 20 -16.643 -3.476 -2.817 65 HA LYS 20 HA LYS 20 -15.030 -1.457 -3.869 66 HB2 LYS 20 HB2 LYS 20 -15.354 -2.333 -0.994 67 HB3 LYS 20 HB1 LYS 20 -14.487 -0.884 -1.475 68 HG2 LYS 20 HG2 LYS 20 -17.397 -1.418 -2.019 69 HG3 LYS 20 HG1 LYS 20 -16.769 -0.437 -0.696 70 HD2 LYS 20 HD2 LYS 20 -15.641 0.984 -2.464 71 HD3 LYS 20 HD1 LYS 20 -16.617 0.111 -3.650 72 HE2 LYS 20 HE2 LYS 20 -18.649 0.794 -2.447 73 HE3 LYS 20 HE1 LYS 20 -17.658 1.703 -1.311 74 HZ1 LYS 20 HZ1 LYS 20 -18.568 3.160 -2.970 75 HZ2 LYS 20 HZ2 LYS 20 -17.924 2.225 -4.218 76 HZ3 LYS 20 HZ3 LYS 20 -16.894 3.068 -3.180 77 H ILE 21 HN ILE 21 -14.154 -4.298 -1.965 78 HA ILE 21 HA ILE 21 -11.406 -3.839 -1.745 79 HB ILE 21 HB ILE 21 -12.880 -6.475 -1.901 80 HG12 ILE 21 HG12 ILE 21 -11.942 -4.917 0.520 81 HG13 ILE 21 HG11 ILE 21 -13.602 -4.949 -0.067 82 HG21 ILE 21 HG21 ILE 21 -10.537 -6.817 -2.361 83 HG22 ILE 21 HG22 ILE 21 -10.912 -7.411 -0.742 84 HG23 ILE 21 HG23 ILE 21 -10.086 -5.865 -0.945 85 HD11 ILE 21 HD11 ILE 21 -13.684 -7.359 0.341 86 HD12 ILE 21 HD12 ILE 21 -13.313 -6.449 1.805 87 HD13 ILE 21 HD13 ILE 21 -12.029 -7.304 0.949 88 H GLN 22 HN GLN 22 -13.239 -5.680 -4.164 89 HA GLN 22 HA GLN 22 -10.969 -6.549 -5.616 90 HB2 GLN 22 HB2 GLN 22 -13.828 -6.278 -6.561 91 HB3 GLN 22 HB1 GLN 22 -12.571 -7.234 -7.333 92 HG2 GLN 22 HG2 GLN 22 -13.855 -7.714 -4.653 93 HG3 GLN 22 HG1 GLN 22 -13.978 -8.706 -6.104 94 HE21 GLN 22 HE21 GLN 22 -12.049 -7.852 -3.380 95 HE22 GLN 22 HE22 GLN 22 -10.847 -9.073 -3.577 96 H GLN 23 HN GLN 23 -13.179 -3.837 -6.005 97 HA GLN 23 HA GLN 23 -12.269 -2.886 -8.481 98 HB2 GLN 23 HB2 GLN 23 -14.354 -2.173 -7.322 99 HB3 GLN 23 HB1 GLN 23 -13.373 -1.283 -6.174 100 HG2 GLN 23 HG2 GLN 23 -12.488 0.072 -8.042 101 HG3 GLN 23 HG1 GLN 23 -13.595 -0.764 -9.128 102 HE21 GLN 23 HE21 GLN 23 -14.449 0.050 -5.851 103 HE22 GLN 23 HE22 GLN 23 -15.606 1.272 -6.247 104 H TYR 24 HN TYR 24 -11.446 -1.821 -5.198 105 HA TYR 24 HA TYR 24 -9.523 0.054 -6.083 106 HB2 TYR 24 HB2 TYR 24 -10.198 -1.102 -3.407 107 HB3 TYR 24 HB1 TYR 24 -8.749 -0.117 -3.603 108 HD1 TYR 24 HD1 TYR 24 -12.348 -0.089 -3.277 109 HD2 TYR 24 HD2 TYR 24 -8.974 2.224 -4.433 110 HE1 TYR 24 HE1 TYR 24 -13.690 1.962 -3.082 111 HE2 TYR 24 HE2 TYR 24 -10.303 4.282 -4.237 112 HH TYR 24 HH TYR 24 -12.607 4.986 -4.271 113 H ARG 25 HN ARG 25 -9.234 -3.322 -5.043 114 HA ARG 25 HA ARG 25 -6.477 -3.478 -4.766 115 HB2 ARG 25 HB2 ARG 25 -8.068 -5.317 -4.257 116 HB3 ARG 25 HB1 ARG 25 -8.253 -5.591 -5.983 117 HG2 ARG 25 HG2 ARG 25 -5.876 -6.129 -6.156 118 HG3 ARG 25 HG1 ARG 25 -5.694 -5.859 -4.423 119 HD2 ARG 25 HD2 ARG 25 -5.875 -8.217 -4.828 120 HD3 ARG 25 HD1 ARG 25 -7.334 -7.668 -4.012 121 HE ARG 25 HE ARG 25 -8.124 -7.571 -6.546 122 HH11 ARG 25 HH11 ARG 25 -6.261 -10.045 -4.906 123 HH12 ARG 25 HH12 ARG 25 -6.937 -11.350 -5.832 124 HH21 ARG 25 HH21 ARG 25 -8.994 -9.277 -7.784 125 HH22 ARG 25 HH22 ARG 25 -8.493 -10.910 -7.470 126 H LYS 26 HN LYS 26 -8.425 -3.412 -7.652 127 HA LYS 26 HA LYS 26 -6.559 -4.200 -9.573 128 HB2 LYS 26 HB2 LYS 26 -8.959 -3.938 -9.995 129 HB3 LYS 26 HB1 LYS 26 -8.811 -2.202 -9.780 130 HG2 LYS 26 HG2 LYS 26 -7.325 -2.116 -11.744 131 HG3 LYS 26 HG1 LYS 26 -7.583 -3.845 -11.980 132 HD2 LYS 26 HD2 LYS 26 -9.072 -2.668 -13.436 133 HD3 LYS 26 HD1 LYS 26 -10.028 -3.389 -12.141 134 HE2 LYS 26 HE2 LYS 26 -10.835 -1.170 -12.484 135 HE3 LYS 26 HE1 LYS 26 -9.943 -1.180 -10.964 136 HZ1 LYS 26 HZ1 LYS 26 -8.896 -0.222 -13.573 137 HZ2 LYS 26 HZ2 LYS 26 -8.045 -0.224 -12.114 138 HZ3 LYS 26 HZ3 LYS 26 -9.408 0.759 -12.295 139 H THR 27 HN THR 27 -7.366 -0.927 -8.426 140 HA THR 27 HA THR 27 -5.289 0.243 -10.061 141 HB THR 27 HB THR 27 -7.428 1.407 -9.798 142 HG1 THR 27 HG1 THR 27 -5.919 2.872 -10.257 143 HG21 THR 27 HG21 THR 27 -8.018 0.792 -7.542 144 HG22 THR 27 HG22 THR 27 -7.952 2.552 -7.670 145 HG23 THR 27 HG23 THR 27 -6.628 1.674 -6.904 146 H LEU 28 HN LEU 28 -5.599 -0.988 -6.921 147 HA LEU 28 HA LEU 28 -3.717 0.680 -5.581 148 HB2 LEU 28 HB2 LEU 28 -5.388 -1.627 -4.989 149 HB3 LEU 28 HB1 LEU 28 -3.821 -1.735 -4.210 150 HG LEU 28 HG LEU 28 -5.612 -0.728 -2.795 151 HD11 LEU 28 HD11 LEU 28 -3.275 -0.309 -2.325 152 HD12 LEU 28 HD12 LEU 28 -4.242 1.124 -1.984 153 HD13 LEU 28 HD13 LEU 28 -3.272 1.045 -3.453 154 HD21 LEU 28 HD21 LEU 28 -6.308 1.565 -3.222 155 HD22 LEU 28 HD22 LEU 28 -6.803 0.504 -4.541 156 HD23 LEU 28 HD23 LEU 28 -5.410 1.568 -4.741 157 H THR 29 HN THR 29 -3.410 -1.962 -7.739 158 HA THR 29 HA THR 29 -0.926 -2.951 -6.679 159 HB THR 29 HB THR 29 -2.077 -3.512 -9.415 160 HG1 THR 29 HG1 THR 29 -3.479 -3.934 -7.457 161 HG21 THR 29 HG21 THR 29 -0.193 -5.063 -7.619 162 HG22 THR 29 HG22 THR 29 0.236 -4.235 -9.117 163 HG23 THR 29 HG23 THR 29 -0.835 -5.636 -9.159 164 H LYS 30 HN LYS 30 0.852 -1.767 -6.801 165 HA LYS 30 HA LYS 30 1.543 -0.424 -9.315 166 HB2 LYS 30 HB2 LYS 30 1.403 0.872 -6.597 167 HB3 LYS 30 HB1 LYS 30 2.289 1.571 -7.941 168 HG2 LYS 30 HG2 LYS 30 -0.658 0.964 -7.984 169 HG3 LYS 30 HG1 LYS 30 0.042 2.540 -7.604 170 HD2 LYS 30 HD2 LYS 30 1.190 2.444 -9.842 171 HD3 LYS 30 HD1 LYS 30 0.223 1.018 -10.194 172 HE2 LYS 30 HE2 LYS 30 -0.993 3.634 -9.383 173 HE3 LYS 30 HE1 LYS 30 -0.629 3.245 -11.061 174 HZ1 LYS 30 HZ1 LYS 30 -2.903 2.703 -10.588 175 HZ2 LYS 30 HZ2 LYS 30 -2.465 1.747 -9.263 176 HZ3 LYS 30 HZ3 LYS 30 -2.048 1.264 -10.832 177 H ILE 31 HN ILE 31 3.775 -0.163 -9.682 178 HA ILE 31 HA ILE 31 5.540 -1.726 -7.962 179 HB ILE 31 HB ILE 31 6.091 -0.299 -10.575 180 HG12 ILE 31 HG12 ILE 31 4.626 -2.342 -10.674 181 HG13 ILE 31 HG11 ILE 31 6.116 -2.467 -11.599 182 HG21 ILE 31 HG21 ILE 31 8.104 -0.352 -9.226 183 HG22 ILE 31 HG22 ILE 31 8.249 -1.493 -10.562 184 HG23 ILE 31 HG23 ILE 31 7.898 -2.080 -8.937 185 HD11 ILE 31 HD11 ILE 31 5.627 -4.528 -10.420 186 HD12 ILE 31 HD12 ILE 31 5.618 -3.661 -8.885 187 HD13 ILE 31 HD13 ILE 31 7.111 -3.793 -9.813 188 H VAL 32 HN VAL 32 6.369 -0.736 -6.249 189 HA VAL 32 HA VAL 32 7.204 2.073 -6.502 190 HB VAL 32 HB VAL 32 6.265 2.627 -4.348 191 HG11 VAL 32 HG11 VAL 32 4.838 2.851 -6.334 192 HG12 VAL 32 HG12 VAL 32 3.902 2.521 -4.877 193 HG13 VAL 32 HG13 VAL 32 4.200 1.232 -6.044 194 HG21 VAL 32 HG21 VAL 32 5.280 -0.226 -4.258 195 HG22 VAL 32 HG22 VAL 32 4.841 1.039 -3.111 196 HG23 VAL 32 HG23 VAL 32 6.514 0.488 -3.220 197 H LYS 33 HN LYS 33 8.482 2.704 -4.457 198 HA LYS 33 HA LYS 33 10.361 0.516 -3.894 199 HB2 LYS 33 HB2 LYS 33 10.838 3.483 -3.466 200 HB3 LYS 33 HB1 LYS 33 12.023 2.177 -3.463 201 HG2 LYS 33 HG2 LYS 33 11.894 1.851 -5.773 202 HG3 LYS 33 HG1 LYS 33 10.395 2.768 -5.910 203 HD2 LYS 33 HD2 LYS 33 11.646 4.791 -5.241 204 HD3 LYS 33 HD1 LYS 33 13.136 3.850 -5.270 205 HE2 LYS 33 HE2 LYS 33 12.654 3.317 -7.660 206 HE3 LYS 33 HE1 LYS 33 11.290 4.432 -7.582 207 HZ1 LYS 33 HZ1 LYS 33 13.240 5.489 -8.518 208 HZ2 LYS 33 HZ2 LYS 33 14.132 5.151 -7.124 209 HZ3 LYS 33 HZ3 LYS 33 12.823 6.217 -7.050 210 H ILE 34 HN ILE 34 10.049 -0.449 -2.034 211 HA ILE 34 HA ILE 34 8.705 0.968 0.116 212 HB ILE 34 HB ILE 34 8.989 -1.832 -0.649 213 HG12 ILE 34 HG12 ILE 34 7.100 -0.246 1.072 214 HG13 ILE 34 HG11 ILE 34 6.875 -0.692 -0.613 215 HG21 ILE 34 HG21 ILE 34 10.452 -1.888 1.337 216 HG22 ILE 34 HG22 ILE 34 8.957 -2.793 1.576 217 HG23 ILE 34 HG23 ILE 34 9.142 -1.193 2.294 218 HD11 ILE 34 HD11 ILE 34 6.849 -2.491 1.790 219 HD12 ILE 34 HD12 ILE 34 6.878 -3.084 0.132 220 HD13 ILE 34 HD13 ILE 34 5.514 -2.121 0.698 221 H LYS 35 HN LYS 35 9.562 1.384 2.052 222 HA LYS 35 HA LYS 35 12.374 0.706 2.494 223 HB2 LYS 35 HB2 LYS 35 11.137 3.445 2.471 224 HB3 LYS 35 HB1 LYS 35 12.595 3.130 3.365 225 HG2 LYS 35 HG2 LYS 35 13.715 3.566 1.506 226 HG3 LYS 35 HG1 LYS 35 13.097 2.032 0.886 227 HD2 LYS 35 HD2 LYS 35 12.116 3.242 -0.717 228 HD3 LYS 35 HD1 LYS 35 10.999 3.738 0.561 229 HE2 LYS 35 HE2 LYS 35 12.201 5.697 1.005 230 HE3 LYS 35 HE1 LYS 35 13.570 5.164 0.032 231 HZ1 LYS 35 HZ1 LYS 35 12.219 5.383 -1.937 232 HZ2 LYS 35 HZ2 LYS 35 12.273 6.846 -1.094 233 HZ3 LYS 35 HZ3 LYS 35 10.890 5.875 -1.010 234 H THR 36 HN THR 36 12.236 -0.550 4.223 235 HA THR 36 HA THR 36 10.605 0.348 6.508 236 HB THR 36 HB THR 36 10.130 -1.981 7.045 237 HG1 THR 36 HG1 THR 36 11.254 -2.845 4.603 238 HG21 THR 36 HG21 THR 36 8.722 -2.596 5.138 239 HG22 THR 36 HG22 THR 36 9.569 -1.419 4.135 240 HG23 THR 36 HG23 THR 36 8.587 -0.873 5.495 241 H ALA 37 HN ALA 37 11.383 -1.176 8.507 242 HA ALA 37 HA ALA 37 14.167 -0.657 8.906 243 HB1 ALA 37 HB1 ALA 37 12.272 -2.341 10.543 244 HB2 ALA 37 HB2 ALA 37 12.579 -0.619 10.772 245 HB3 ALA 37 HB3 ALA 37 13.870 -1.790 11.049 246 H ILE 38 HN ILE 38 12.192 -3.390 8.007 247 HA ILE 38 HA ILE 38 14.087 -5.438 8.334 248 HB ILE 38 HB ILE 38 11.850 -5.382 6.303 249 HG12 ILE 38 HG12 ILE 38 11.763 -6.299 9.187 250 HG13 ILE 38 HG11 ILE 38 11.044 -4.810 8.583 251 HG21 ILE 38 HG21 ILE 38 13.456 -7.201 6.017 252 HG22 ILE 38 HG22 ILE 38 11.891 -7.812 6.556 253 HG23 ILE 38 HG23 ILE 38 13.225 -7.674 7.701 254 HD11 ILE 38 HD11 ILE 38 9.370 -6.540 8.864 255 HD12 ILE 38 HD12 ILE 38 10.265 -7.603 7.777 256 HD13 ILE 38 HD13 ILE 38 9.547 -6.115 7.162 257 H PHE 39 HN PHE 39 13.015 -3.820 5.340 258 HA PHE 39 HA PHE 39 15.649 -3.553 4.338 259 HB2 PHE 39 HB2 PHE 39 15.223 -5.046 2.277 260 HB3 PHE 39 HB1 PHE 39 15.750 -5.807 3.769 261 HD1 PHE 39 HD1 PHE 39 14.896 -7.912 3.845 262 HD2 PHE 39 HD2 PHE 39 12.367 -4.734 2.579 263 HE1 PHE 39 HE1 PHE 39 13.000 -9.472 3.735 264 HE2 PHE 39 HE2 PHE 39 10.466 -6.285 2.473 265 HZ PHE 39 HZ PHE 39 10.780 -8.660 3.049 266 H HIS 40 HN HIS 40 15.779 -2.319 2.486 267 HA HIS 40 HA HIS 40 13.269 -1.019 1.678 268 HB2 HIS 40 HB2 HIS 40 16.018 -0.171 0.779 269 HB3 HIS 40 HB1 HIS 40 14.568 0.802 0.916 270 HD1 HIS 40 HD1 HIS 40 17.691 0.561 2.412 271 HD2 HIS 40 HD2 HIS 40 13.838 0.795 3.958 272 HE1 HIS 40 HE1 HIS 40 17.958 1.373 4.776 273 HE2 HIS 40 HE2 HIS 40 15.629 1.375 5.733 274 H GLU 41 HN GLU 41 12.325 -1.908 -0.087 275 HA GLU 41 HA GLU 41 14.013 -3.010 -2.219 276 HB2 GLU 41 HB2 GLU 41 11.860 -4.508 -0.719 277 HB3 GLU 41 HB1 GLU 41 12.527 -5.048 -2.249 278 HG2 GLU 41 HG2 GLU 41 14.303 -4.525 0.100 279 HG3 GLU 41 HG1 GLU 41 13.439 -6.053 -0.068 280 H THR 42 HN THR 42 13.135 -2.844 -4.256 281 HA THR 42 HA THR 42 10.779 -1.291 -4.695 282 HB THR 42 HB THR 42 12.078 -3.101 -6.730 283 HG1 THR 42 HG1 THR 42 13.439 -1.265 -7.183 284 HG21 THR 42 HG21 THR 42 11.325 -1.388 -8.308 285 HG22 THR 42 HG22 THR 42 10.647 -0.450 -6.975 286 HG23 THR 42 HG23 THR 42 9.970 -2.030 -7.378 287 H VAL 43 HN VAL 43 8.681 -2.006 -4.926 288 HA VAL 43 HA VAL 43 8.236 -4.890 -5.083 289 HB VAL 43 HB VAL 43 8.465 -4.107 -2.659 290 HG11 VAL 43 HG11 VAL 43 5.791 -2.897 -3.325 291 HG12 VAL 43 HG12 VAL 43 7.237 -2.056 -2.761 292 HG13 VAL 43 HG13 VAL 43 6.383 -3.166 -1.689 293 HG21 VAL 43 HG21 VAL 43 5.934 -5.505 -3.498 294 HG22 VAL 43 HG22 VAL 43 6.677 -5.574 -1.900 295 HG23 VAL 43 HG23 VAL 43 7.515 -6.257 -3.293 296 H LYS 44 HN LYS 44 6.096 -5.499 -5.650 297 HA LYS 44 HA LYS 44 4.473 -3.340 -6.779 298 HB2 LYS 44 HB2 LYS 44 5.031 -5.528 -8.054 299 HB3 LYS 44 HB1 LYS 44 3.871 -6.285 -6.971 300 HG2 LYS 44 HG2 LYS 44 2.095 -4.930 -7.781 301 HG3 LYS 44 HG1 LYS 44 3.211 -3.941 -8.726 302 HD2 LYS 44 HD2 LYS 44 2.045 -5.536 -10.152 303 HD3 LYS 44 HD1 LYS 44 3.772 -5.889 -10.099 304 HE2 LYS 44 HE2 LYS 44 3.349 -7.644 -8.437 305 HE3 LYS 44 HE1 LYS 44 1.621 -7.303 -8.526 306 HZ1 LYS 44 HZ1 LYS 44 3.327 -8.277 -10.749 307 HZ2 LYS 44 HZ2 LYS 44 1.685 -7.903 -10.878 308 HZ3 LYS 44 HZ3 LYS 44 2.185 -9.185 -9.897 309 H VAL 45 HN VAL 45 3.071 -2.481 -5.432 310 HA VAL 45 HA VAL 45 2.220 -4.012 -3.099 311 HB VAL 45 HB VAL 45 3.108 -1.803 -2.654 312 HG11 VAL 45 HG11 VAL 45 2.650 -0.739 -4.791 313 HG12 VAL 45 HG12 VAL 45 1.991 0.224 -3.470 314 HG13 VAL 45 HG13 VAL 45 0.919 -0.767 -4.456 315 HG21 VAL 45 HG21 VAL 45 1.313 -2.603 -1.206 316 HG22 VAL 45 HG22 VAL 45 0.117 -1.852 -2.263 317 HG23 VAL 45 HG23 VAL 45 1.263 -0.848 -1.372 318 H THR 46 HN THR 46 0.263 -4.864 -2.923 319 HA THR 46 HA THR 46 -1.958 -3.689 -4.410 320 HB THR 46 HB THR 46 -1.058 -5.634 -5.737 321 HG1 THR 46 HG1 THR 46 -3.065 -5.582 -6.347 322 HG21 THR 46 HG21 THR 46 -2.057 -7.242 -3.386 323 HG22 THR 46 HG22 THR 46 -0.377 -7.084 -3.898 324 HG23 THR 46 HG23 THR 46 -1.543 -7.903 -4.938 325 H CYS 47 HN CYS 47 -4.057 -4.919 -3.599 326 HA CYS 47 HA CYS 47 -3.771 -5.203 -0.693 327 HB2 CYS 47 HB2 CYS 47 -5.332 -3.497 -1.204 328 HB3 CYS 47 HB1 CYS 47 -6.156 -4.484 -2.397 329 HG CYS 47 HG CYS 47 -6.790 -4.092 0.792 330 H SER 48 HN SER 48 -5.214 -6.827 0.302 331 HA SER 48 HA SER 48 -4.769 -9.343 -1.091 332 HB2 SER 48 HB2 SER 48 -4.178 -9.049 1.331 333 HB3 SER 48 HB1 SER 48 -5.895 -8.882 1.685 334 HG SER 48 HG SER 48 -5.756 -10.990 1.913 335 H LYS 49 HN LYS 49 -6.544 -11.023 -1.046 336 HA LYS 49 HA LYS 49 -8.935 -10.088 -2.196 337 HB2 LYS 49 HB2 LYS 49 -8.049 -12.396 -2.458 338 HB3 LYS 49 HB1 LYS 49 -8.443 -12.715 -0.776 339 HG2 LYS 49 HG2 LYS 49 -10.126 -13.670 -2.199 340 HG3 LYS 49 HG1 LYS 49 -10.816 -12.332 -1.281 341 HD2 LYS 49 HD2 LYS 49 -10.548 -10.869 -3.234 342 HD3 LYS 49 HD1 LYS 49 -9.886 -12.224 -4.148 343 HE2 LYS 49 HE2 LYS 49 -12.648 -12.120 -2.943 344 HE3 LYS 49 HE1 LYS 49 -12.269 -11.810 -4.635 345 HZ1 LYS 49 HZ1 LYS 49 -11.820 -14.368 -3.195 346 HZ2 LYS 49 HZ2 LYS 49 -11.428 -14.076 -4.814 347 HZ3 LYS 49 HZ3 LYS 49 -13.043 -14.064 -4.320 348 H ASP 50 HN ASP 50 -7.907 -10.565 1.058 349 HA ASP 50 HA ASP 50 -10.445 -10.549 2.332 350 HB2 ASP 50 HB2 ASP 50 -7.805 -9.677 3.523 351 HB3 ASP 50 HB1 ASP 50 -9.222 -10.256 4.390 352 H GLY 51 HN GLY 51 -8.319 -8.099 1.119 353 HA2 GLY 51 HA2 GLY 51 -8.668 -5.833 0.855 354 HA3 GLY 51 HA1 GLY 51 -10.220 -6.013 1.657 355 H LYS 52 HN LYS 52 -8.655 -7.411 3.878 356 HA LYS 52 HA LYS 52 -8.631 -5.048 5.512 357 HB2 LYS 52 HB2 LYS 52 -9.668 -7.178 6.215 358 HB3 LYS 52 HB1 LYS 52 -8.080 -7.929 6.225 359 HG2 LYS 52 HG2 LYS 52 -7.375 -6.371 7.992 360 HG3 LYS 52 HG1 LYS 52 -9.000 -5.680 8.003 361 HD2 LYS 52 HD2 LYS 52 -9.944 -7.793 8.677 362 HD3 LYS 52 HD1 LYS 52 -8.375 -8.582 8.526 363 HE2 LYS 52 HE2 LYS 52 -7.510 -7.091 10.307 364 HE3 LYS 52 HE1 LYS 52 -9.135 -6.435 10.500 365 HZ1 LYS 52 HZ1 LYS 52 -8.716 -8.141 12.133 366 HZ2 LYS 52 HZ2 LYS 52 -8.330 -9.260 10.927 367 HZ3 LYS 52 HZ3 LYS 52 -9.908 -8.673 11.057 368 H MET 53 HN MET 53 -6.260 -6.759 3.779 369 HA MET 53 HA MET 53 -4.197 -5.304 5.249 370 HB2 MET 53 HB2 MET 53 -2.700 -7.137 5.368 371 HB3 MET 53 HB1 MET 53 -4.240 -7.726 5.978 372 HG2 MET 53 HG2 MET 53 -4.659 -8.690 3.704 373 HG3 MET 53 HG1 MET 53 -3.008 -8.250 3.291 374 HE1 MET 53 HE1 MET 53 -0.863 -9.236 4.523 375 HE2 MET 53 HE2 MET 53 -0.941 -10.433 5.815 376 HE3 MET 53 HE3 MET 53 -1.520 -8.792 6.099 377 H LEU 54 HN LEU 54 -2.323 -4.828 4.083 378 HA LEU 54 HA LEU 54 -2.808 -4.638 1.198 379 HB2 LEU 54 HB2 LEU 54 -2.353 -2.612 2.677 380 HB3 LEU 54 HB1 LEU 54 -0.723 -3.223 2.851 381 HG LEU 54 HG LEU 54 -0.470 -3.063 0.365 382 HD11 LEU 54 HD11 LEU 54 -2.062 -1.626 -0.844 383 HD12 LEU 54 HD12 LEU 54 -3.108 -1.612 0.576 384 HD13 LEU 54 HD13 LEU 54 -2.810 -3.122 -0.283 385 HD21 LEU 54 HD21 LEU 54 -0.071 -0.696 0.382 386 HD22 LEU 54 HD22 LEU 54 0.340 -1.351 1.966 387 HD23 LEU 54 HD23 LEU 54 -1.174 -0.475 1.737 388 H GLU 55 HN GLU 55 -1.940 -6.350 0.178 389 HA GLU 55 HA GLU 55 0.480 -7.590 1.256 390 HB2 GLU 55 HB2 GLU 55 -1.605 -8.508 -0.720 391 HB3 GLU 55 HB1 GLU 55 -0.097 -9.377 -0.478 392 HG2 GLU 55 HG2 GLU 55 -1.607 -8.787 1.977 393 HG3 GLU 55 HG1 GLU 55 -2.389 -9.889 0.844 394 H TRP 56 HN TRP 56 2.396 -7.524 0.204 395 HA TRP 56 HA TRP 56 2.355 -6.407 -2.505 396 HB2 TRP 56 HB2 TRP 56 4.610 -5.324 -1.827 397 HB3 TRP 56 HB1 TRP 56 3.105 -4.558 -1.345 398 HD1 TRP 56 HD1 TRP 56 5.243 -7.323 0.375 399 HE1 TRP 56 HE1 TRP 56 5.676 -6.567 2.796 400 HE3 TRP 56 HE3 TRP 56 2.804 -2.838 0.277 401 HZ2 TRP 56 HZ2 TRP 56 5.063 -4.372 4.445 402 HZ3 TRP 56 HZ3 TRP 56 2.778 -1.472 2.318 403 HH2 TRP 56 HH2 TRP 56 3.881 -2.223 4.359 404 H TYR 57 HN TYR 57 3.728 -7.192 -3.962 405 HA TYR 57 HA TYR 57 5.347 -9.510 -3.128 406 HB2 TYR 57 HB2 TYR 57 3.833 -9.147 -5.735 407 HB3 TYR 57 HB1 TYR 57 4.849 -10.527 -5.323 408 HD1 TYR 57 HD1 TYR 57 1.655 -8.835 -4.646 409 HD2 TYR 57 HD2 TYR 57 4.052 -12.258 -3.847 410 HE1 TYR 57 HE1 TYR 57 -0.293 -9.962 -3.657 411 HE2 TYR 57 HE2 TYR 57 2.108 -13.396 -2.859 412 HH TYR 57 HH TYR 57 -1.059 -12.299 -3.240 413 H LYS 58 HN LYS 58 7.366 -9.593 -3.863 414 HA LYS 58 HA LYS 58 9.017 -7.652 -4.482 415 HB2 LYS 58 HB2 LYS 58 10.381 -9.259 -5.835 416 HB3 LYS 58 HB1 LYS 58 9.837 -9.885 -4.283 417 HG2 LYS 58 HG2 LYS 58 8.215 -10.440 -6.727 418 HG3 LYS 58 HG1 LYS 58 9.696 -11.353 -6.445 419 HD2 LYS 58 HD2 LYS 58 8.871 -12.247 -4.416 420 HD3 LYS 58 HD1 LYS 58 7.541 -11.093 -4.360 421 HE2 LYS 58 HE2 LYS 58 6.855 -13.383 -5.023 422 HE3 LYS 58 HE1 LYS 58 6.461 -12.148 -6.219 423 HZ1 LYS 58 HZ1 LYS 58 8.316 -12.825 -7.541 424 HZ2 LYS 58 HZ2 LYS 58 7.418 -14.207 -7.169 425 HZ3 LYS 58 HZ3 LYS 58 8.867 -13.889 -6.346 426 H GLY 59 HN GLY 59 9.083 -6.025 -5.862 427 HA2 GLY 59 HA2 GLY 59 7.758 -6.360 -8.483 428 HA3 GLY 59 HA1 GLY 59 7.738 -4.863 -7.561 429 H LYS 60 HN LYS 60 10.627 -6.650 -7.538 430 HA LYS 60 HA LYS 60 12.098 -4.614 -8.882 431 HB2 LYS 60 HB2 LYS 60 13.022 -7.424 -8.253 432 HB3 LYS 60 HB1 LYS 60 14.036 -6.034 -8.591 433 HG2 LYS 60 HG2 LYS 60 14.221 -6.181 -6.319 434 HG3 LYS 60 HG1 LYS 60 12.888 -5.037 -6.473 435 HD2 LYS 60 HD2 LYS 60 11.284 -6.663 -5.909 436 HD3 LYS 60 HD1 LYS 60 12.412 -7.994 -6.182 437 HE2 LYS 60 HE2 LYS 60 12.614 -5.935 -3.986 438 HE3 LYS 60 HE1 LYS 60 12.013 -7.582 -3.786 439 HZ1 LYS 60 HZ1 LYS 60 14.757 -6.818 -4.638 440 HZ2 LYS 60 HZ2 LYS 60 14.196 -8.406 -4.485 441 HZ3 LYS 60 HZ3 LYS 60 14.329 -7.414 -3.114 442 H ASN 61 HN ASN 61 11.966 -8.067 -9.633 443 HA ASN 61 HA ASN 61 10.901 -7.910 -12.207 444 HB2 ASN 61 HB2 ASN 61 13.036 -6.729 -12.738 445 HB3 ASN 61 HB1 ASN 61 13.926 -8.144 -12.190 446 HD21 ASN 61 HD21 ASN 61 14.875 -8.585 -14.124 447 HD22 ASN 61 HD22 ASN 61 14.000 -9.138 -15.510 448 H ASP 62 HN ASP 62 13.562 -9.540 -10.511 449 HA ASP 62 HA ASP 62 12.011 -12.021 -10.513 450 HB2 ASP 62 HB2 ASP 62 13.417 -12.280 -12.462 451 HB3 ASP 62 HB1 ASP 62 14.840 -11.780 -11.555 452 H SER 63 HN SER 63 14.675 -10.120 -9.281 453 HA SER 63 HA SER 63 15.627 -11.997 -7.413 454 HB2 SER 63 HB2 SER 63 15.924 -8.990 -7.427 455 HB3 SER 63 HB1 SER 63 16.899 -10.116 -6.483 456 HG SER 63 HG SER 63 17.178 -11.074 -8.801 457 H ASP 64 HN ASP 64 13.989 -12.811 -6.150 458 HA ASP 64 HA ASP 64 13.149 -10.983 -4.016 459 HB2 ASP 64 HB2 ASP 64 11.311 -12.696 -3.574 460 HB3 ASP 64 HB1 ASP 64 11.115 -11.679 -4.991 461 H GLY 65 HN GLY 65 13.872 -11.438 -2.051 462 HA2 GLY 65 HA2 GLY 65 15.639 -13.704 -1.716 463 HA3 GLY 65 HA1 GLY 65 15.338 -12.428 -0.545 464 H LYS 66 HN LYS 66 12.367 -12.972 -1.067 465 HA LYS 66 HA LYS 66 12.193 -15.172 0.862 466 HB2 LYS 66 HB2 LYS 66 11.302 -13.024 1.632 467 HB3 LYS 66 HB1 LYS 66 10.227 -12.961 0.244 468 HG2 LYS 66 HG2 LYS 66 8.781 -13.702 1.835 469 HG3 LYS 66 HG1 LYS 66 9.368 -15.246 1.221 470 HD2 LYS 66 HD2 LYS 66 10.568 -13.855 3.603 471 HD3 LYS 66 HD1 LYS 66 9.253 -15.018 3.735 472 HE2 LYS 66 HE2 LYS 66 12.033 -15.516 2.687 473 HE3 LYS 66 HE1 LYS 66 11.336 -16.123 4.181 474 HZ1 LYS 66 HZ1 LYS 66 10.417 -16.837 1.446 475 HZ2 LYS 66 HZ2 LYS 66 9.772 -17.427 2.896 476 HZ3 LYS 66 HZ3 LYS 66 11.361 -17.811 2.459 477 H LYS 67 HN LYS 67 11.482 -14.339 -2.371 478 HA LYS 67 HA LYS 67 10.346 -15.330 -4.067 479 HB2 LYS 67 HB2 LYS 67 10.768 -17.608 -2.193 480 HB3 LYS 67 HB1 LYS 67 9.641 -17.836 -3.521 481 HG2 LYS 67 HG2 LYS 67 11.844 -18.646 -4.108 482 HG3 LYS 67 HG1 LYS 67 11.397 -17.273 -5.117 483 HD2 LYS 67 HD2 LYS 67 12.759 -15.801 -3.690 484 HD3 LYS 67 HD1 LYS 67 13.233 -17.205 -2.725 485 HE2 LYS 67 HE2 LYS 67 14.262 -18.224 -4.679 486 HE3 LYS 67 HE1 LYS 67 13.748 -16.867 -5.678 487 HZ1 LYS 67 HZ1 LYS 67 16.014 -16.549 -5.110 488 HZ2 LYS 67 HZ2 LYS 67 15.723 -16.822 -3.468 489 HZ3 LYS 67 HZ3 LYS 67 15.120 -15.425 -4.210 490 H LYS 68 HN LYS 68 8.968 -14.238 -1.515 491 HA LYS 68 HA LYS 68 6.229 -14.901 -2.256 492 HB2 LYS 68 HB2 LYS 68 7.403 -15.281 0.519 493 HB3 LYS 68 HB1 LYS 68 5.690 -15.306 0.173 494 HG2 LYS 68 HG2 LYS 68 7.689 -17.223 -0.980 495 HG3 LYS 68 HG1 LYS 68 6.652 -17.546 0.410 496 HD2 LYS 68 HD2 LYS 68 4.675 -17.248 -0.977 497 HD3 LYS 68 HD1 LYS 68 5.692 -16.875 -2.370 498 HE2 LYS 68 HE2 LYS 68 6.692 -19.111 -2.220 499 HE3 LYS 68 HE1 LYS 68 5.638 -19.483 -0.859 500 HZ1 LYS 68 HZ1 LYS 68 4.786 -20.371 -2.940 501 HZ2 LYS 68 HZ2 LYS 68 4.729 -18.816 -3.601 502 HZ3 LYS 68 HZ3 LYS 68 3.730 -19.214 -2.297 503 HA PRO 69 HA PRO 69 5.320 -10.641 -0.862 504 HB2 PRO 69 HB2 PRO 69 4.198 -11.689 1.703 505 HB3 PRO 69 HB1 PRO 69 3.554 -10.455 0.614 506 HG2 PRO 69 HG2 PRO 69 2.535 -12.908 0.623 507 HG3 PRO 69 HG1 PRO 69 2.744 -12.015 -0.895 508 HD2 PRO 69 HD2 PRO 69 4.308 -14.285 0.197 509 HD3 PRO 69 HD1 PRO 69 3.969 -13.860 -1.487 510 H ILE 70 HN ILE 70 6.495 -9.135 0.203 511 HA ILE 70 HA ILE 70 8.768 -10.143 1.643 512 HB ILE 70 HB ILE 70 9.636 -7.812 1.559 513 HG12 ILE 70 HG12 ILE 70 7.250 -7.310 -0.222 514 HG13 ILE 70 HG11 ILE 70 7.438 -6.657 1.406 515 HG21 ILE 70 HG21 ILE 70 8.824 -9.079 -1.055 516 HG22 ILE 70 HG22 ILE 70 10.248 -9.476 -0.094 517 HG23 ILE 70 HG23 ILE 70 10.109 -7.889 -0.848 518 HD11 ILE 70 HD11 ILE 70 8.027 -5.024 -0.306 519 HD12 ILE 70 HD12 ILE 70 9.275 -6.115 -0.922 520 HD13 ILE 70 HD13 ILE 70 9.414 -5.438 0.703 521 H GLY 71 HN GLY 71 5.885 -9.710 2.776 522 HA2 GLY 71 HA2 GLY 71 5.530 -9.851 5.152 523 HA3 GLY 71 HA1 GLY 71 6.871 -8.742 5.376 524 H SER 72 HN SER 72 3.693 -8.953 3.903 525 HA SER 72 HA SER 72 3.153 -6.193 3.747 526 HB2 SER 72 HB2 SER 72 1.136 -8.424 3.951 527 HB3 SER 72 HB1 SER 72 0.965 -6.885 3.110 528 HG SER 72 HG SER 72 1.663 -9.074 2.013 529 H PHE 73 HN PHE 73 1.136 -5.252 4.832 530 HA PHE 73 HA PHE 73 0.933 -6.034 7.658 531 HB2 PHE 73 HB2 PHE 73 1.212 -3.814 8.437 532 HB3 PHE 73 HB1 PHE 73 2.482 -4.014 7.234 533 HD1 PHE 73 HD1 PHE 73 2.098 -3.059 4.922 534 HD2 PHE 73 HD2 PHE 73 -0.386 -2.143 8.244 535 HE1 PHE 73 HE1 PHE 73 1.273 -1.060 3.750 536 HE2 PHE 73 HE2 PHE 73 -1.217 -0.150 7.080 537 HZ PHE 73 HZ PHE 73 -0.389 0.399 4.829 538 HA PRO 74 HA PRO 74 -3.395 -5.473 6.883 539 HB2 PRO 74 HB2 PRO 74 -4.116 -4.881 9.547 540 HB3 PRO 74 HB1 PRO 74 -4.106 -6.453 8.764 541 HG2 PRO 74 HG2 PRO 74 -2.412 -5.622 10.833 542 HG3 PRO 74 HG1 PRO 74 -2.238 -7.080 9.848 543 HD2 PRO 74 HD2 PRO 74 -0.811 -4.496 9.670 544 HD3 PRO 74 HD1 PRO 74 -0.284 -6.121 9.192 545 H LEU 75 HN LEU 75 -4.670 -3.877 6.195 546 HA LEU 75 HA LEU 75 -3.756 -1.195 6.292 547 HB2 LEU 75 HB2 LEU 75 -6.307 -2.423 5.272 548 HB3 LEU 75 HB1 LEU 75 -5.939 -0.719 5.112 549 HG LEU 75 HG LEU 75 -4.224 -2.918 3.957 550 HD11 LEU 75 HD11 LEU 75 -6.435 -2.924 2.918 551 HD12 LEU 75 HD12 LEU 75 -5.207 -2.322 1.805 552 HD13 LEU 75 HD13 LEU 75 -6.298 -1.193 2.608 553 HD21 LEU 75 HD21 LEU 75 -2.955 -0.932 4.301 554 HD22 LEU 75 HD22 LEU 75 -4.255 0.079 3.674 555 HD23 LEU 75 HD23 LEU 75 -3.372 -0.990 2.589 556 H ASN 76 HN ASN 76 -6.093 -2.969 8.161 557 HA ASN 76 HA ASN 76 -7.484 -0.676 9.129 558 HB2 ASN 76 HB2 ASN 76 -8.677 -2.144 10.573 559 HB3 ASN 76 HB1 ASN 76 -8.447 -2.993 9.054 560 HD21 ASN 76 HD21 ASN 76 -5.629 -3.648 9.680 561 HD22 ASN 76 HD22 ASN 76 -5.705 -4.908 10.860 562 H LYS 77 HN LYS 77 -4.389 -1.469 9.649 563 HA LYS 77 HA LYS 77 -4.392 -0.662 12.469 564 HB2 LYS 77 HB2 LYS 77 -2.147 -1.794 10.789 565 HB3 LYS 77 HB1 LYS 77 -2.048 -1.425 12.502 566 HG2 LYS 77 HG2 LYS 77 -3.867 -3.480 11.259 567 HG3 LYS 77 HG1 LYS 77 -2.339 -3.818 12.072 568 HD2 LYS 77 HD2 LYS 77 -4.642 -2.418 13.418 569 HD3 LYS 77 HD1 LYS 77 -4.438 -4.168 13.441 570 HE2 LYS 77 HE2 LYS 77 -2.249 -3.897 14.503 571 HE3 LYS 77 HE1 LYS 77 -2.452 -2.147 14.476 572 HZ1 LYS 77 HZ1 LYS 77 -3.003 -3.093 16.634 573 HZ2 LYS 77 HZ2 LYS 77 -4.203 -4.050 15.932 574 HZ3 LYS 77 HZ3 LYS 77 -4.356 -2.368 15.929 575 H ILE 78 HN ILE 78 -4.117 0.693 9.438 576 HA ILE 78 HA ILE 78 -1.869 2.384 9.715 577 HB ILE 78 HB ILE 78 -4.350 2.863 8.054 578 HG12 ILE 78 HG12 ILE 78 -1.695 1.672 7.237 579 HG13 ILE 78 HG11 ILE 78 -3.139 0.721 7.578 580 HG21 ILE 78 HG21 ILE 78 -1.580 4.047 7.839 581 HG22 ILE 78 HG22 ILE 78 -3.023 4.889 8.409 582 HG23 ILE 78 HG23 ILE 78 -2.922 4.347 6.732 583 HD11 ILE 78 HD11 ILE 78 -2.880 2.795 5.413 584 HD12 ILE 78 HD12 ILE 78 -4.295 1.791 5.734 585 HD13 ILE 78 HD13 ILE 78 -2.792 1.049 5.186 586 H THR 79 HN THR 79 -1.571 4.241 10.779 587 HA THR 79 HA THR 79 -3.830 5.287 12.298 588 HB THR 79 HB THR 79 -2.161 6.491 13.631 589 HG1 THR 79 HG1 THR 79 -0.297 6.876 12.722 590 HG21 THR 79 HG21 THR 79 -1.025 4.551 14.621 591 HG22 THR 79 HG22 THR 79 -1.438 3.589 13.202 592 HG23 THR 79 HG23 THR 79 -2.715 4.191 14.260 593 H SER 80 HN SER 80 -1.458 6.235 9.869 594 HA SER 80 HA SER 80 -3.218 8.302 8.931 595 HB2 SER 80 HB2 SER 80 -2.021 9.432 10.816 596 HB3 SER 80 HB1 SER 80 -0.501 9.141 9.972 597 HG SER 80 HG SER 80 -1.920 11.228 9.696 598 H ILE 81 HN ILE 81 -2.983 8.573 6.795 599 HA ILE 81 HA ILE 81 -0.487 7.656 5.532 600 HB ILE 81 HB ILE 81 -2.147 6.178 4.750 601 HG12 ILE 81 HG12 ILE 81 -1.940 8.384 2.680 602 HG13 ILE 81 HG11 ILE 81 -0.793 7.067 2.895 603 HG21 ILE 81 HG21 ILE 81 -4.102 7.324 5.595 604 HG22 ILE 81 HG22 ILE 81 -4.343 6.862 3.910 605 HG23 ILE 81 HG23 ILE 81 -3.970 8.536 4.319 606 HD11 ILE 81 HD11 ILE 81 -2.588 5.474 2.309 607 HD12 ILE 81 HD12 ILE 81 -2.173 6.594 1.011 608 HD13 ILE 81 HD13 ILE 81 -3.641 6.845 1.961 609 H ARG 82 HN ARG 82 0.689 9.389 5.081 610 HA ARG 82 HA ARG 82 -0.613 11.639 3.730 611 HB2 ARG 82 HB2 ARG 82 0.975 13.191 4.995 612 HB3 ARG 82 HB1 ARG 82 -0.385 12.527 5.905 613 HG2 ARG 82 HG2 ARG 82 1.317 12.270 7.404 614 HG3 ARG 82 HG1 ARG 82 1.376 10.706 6.589 615 HD2 ARG 82 HD2 ARG 82 3.210 11.387 5.240 616 HD3 ARG 82 HD1 ARG 82 3.051 13.063 5.762 617 HE ARG 82 HE ARG 82 4.231 10.859 7.268 618 HH11 ARG 82 HH11 ARG 82 3.168 14.196 7.243 619 HH12 ARG 82 HH12 ARG 82 4.179 14.661 8.573 620 HH21 ARG 82 HH21 ARG 82 5.574 11.465 9.018 621 HH22 ARG 82 HH22 ARG 82 5.530 13.109 9.595 622 H THR 83 HN THR 83 0.819 12.933 2.454 623 HA THR 83 HA THR 83 2.795 11.347 1.101 624 HB THR 83 HB THR 83 2.275 14.304 0.763 625 HG1 THR 83 HG1 THR 83 0.642 12.186 0.221 626 HG21 THR 83 HG21 THR 83 3.298 12.201 -1.150 627 HG22 THR 83 HG22 THR 83 4.290 13.403 -0.320 628 HG23 THR 83 HG23 THR 83 3.087 13.919 -1.504 629 H LYS 84 HN LYS 84 5.029 11.611 1.183 630 HA LYS 84 HA LYS 84 6.091 12.585 3.592 631 HB2 LYS 84 HB2 LYS 84 7.232 10.926 2.113 632 HB3 LYS 84 HB1 LYS 84 7.650 12.269 1.051 633 HG2 LYS 84 HG2 LYS 84 9.218 13.065 2.438 634 HG3 LYS 84 HG1 LYS 84 8.274 12.697 3.885 635 HD2 LYS 84 HD2 LYS 84 10.052 11.229 4.067 636 HD3 LYS 84 HD1 LYS 84 8.819 10.240 3.279 637 HE2 LYS 84 HE2 LYS 84 10.678 9.810 1.973 638 HE3 LYS 84 HE1 LYS 84 9.893 11.121 1.088 639 HZ1 LYS 84 HZ1 LYS 84 12.183 11.646 1.237 640 HZ2 LYS 84 HZ2 LYS 84 12.236 11.316 2.891 641 HZ3 LYS 84 HZ3 LYS 84 11.393 12.673 2.333 642 H VAL 85 HN VAL 85 6.118 14.541 4.194 643 HA VAL 85 HA VAL 85 5.300 16.674 2.712 644 HB VAL 85 HB VAL 85 5.718 17.892 4.695 645 HG11 VAL 85 HG11 VAL 85 4.971 15.087 5.392 646 HG12 VAL 85 HG12 VAL 85 3.882 16.342 4.804 647 HG13 VAL 85 HG13 VAL 85 4.647 16.509 6.383 648 HG21 VAL 85 HG21 VAL 85 7.528 15.634 5.489 649 HG22 VAL 85 HG22 VAL 85 7.043 16.948 6.570 650 HG23 VAL 85 HG23 VAL 85 8.012 17.297 5.135 651 H ASP 86 HN ASP 86 8.498 15.363 3.024 652 HA ASP 86 HA ASP 86 9.672 17.852 2.021 653 HB2 ASP 86 HB2 ASP 86 11.694 17.242 2.913 654 HB3 ASP 86 HB1 ASP 86 10.600 16.456 4.036 655 H ASN 87 HN ASN 87 8.459 14.986 0.879 656 HA ASN 87 HA ASN 87 9.685 15.388 -1.711 657 HB2 ASN 87 HB2 ASN 87 11.267 13.804 -0.631 658 HB3 ASN 87 HB1 ASN 87 9.933 12.700 -0.337 659 HD21 ASN 87 HD21 ASN 87 11.067 11.130 -1.569 660 HD22 ASN 87 HD22 ASN 87 11.052 11.183 -3.298 661 H LEU 88 HN LEU 88 7.822 15.668 -2.762 662 HA LEU 88 HA LEU 88 5.407 14.456 -1.900 663 HB2 LEU 88 HB2 LEU 88 6.133 16.120 -4.298 664 HB3 LEU 88 HB1 LEU 88 4.514 15.489 -4.069 665 HG LEU 88 HG LEU 88 5.930 17.318 -2.128 666 HD11 LEU 88 HD11 LEU 88 5.459 18.472 -4.218 667 HD12 LEU 88 HD12 LEU 88 4.379 19.034 -2.943 668 HD13 LEU 88 HD13 LEU 88 3.788 17.911 -4.168 669 HD21 LEU 88 HD21 LEU 88 3.688 17.541 -1.148 670 HD22 LEU 88 HD22 LEU 88 4.294 15.888 -1.058 671 HD23 LEU 88 HD23 LEU 88 3.089 16.321 -2.272 672 H LYS 89 HN LYS 89 7.887 13.315 -3.877 673 HA LYS 89 HA LYS 89 6.210 11.585 -5.481 674 HB2 LYS 89 HB2 LYS 89 9.209 11.686 -5.102 675 HB3 LYS 89 HB1 LYS 89 8.392 10.557 -6.172 676 HG2 LYS 89 HG2 LYS 89 9.086 12.245 -7.590 677 HG3 LYS 89 HG1 LYS 89 7.392 12.628 -7.283 678 HD2 LYS 89 HD2 LYS 89 8.056 14.280 -5.620 679 HD3 LYS 89 HD1 LYS 89 9.755 13.887 -5.901 680 HE2 LYS 89 HE2 LYS 89 9.502 14.563 -8.247 681 HE3 LYS 89 HE1 LYS 89 7.826 15.000 -7.927 682 HZ1 LYS 89 HZ1 LYS 89 10.194 16.229 -6.622 683 HZ2 LYS 89 HZ2 LYS 89 8.581 16.663 -6.356 684 HZ3 LYS 89 HZ3 LYS 89 9.290 16.929 -7.868 685 H SER 90 HN SER 90 7.287 11.629 -2.338 686 HA SER 90 HA SER 90 7.089 8.707 -2.120 687 HB2 SER 90 HB2 SER 90 9.323 9.728 -1.521 688 HB3 SER 90 HB1 SER 90 8.510 10.544 -0.185 689 HG SER 90 HG SER 90 8.974 7.791 -0.579 690 H LEU 91 HN LEU 91 6.168 7.967 -0.073 691 HA LEU 91 HA LEU 91 4.132 9.777 1.018 692 HB2 LEU 91 HB2 LEU 91 3.215 8.429 -0.878 693 HB3 LEU 91 HB1 LEU 91 3.626 6.978 0.010 694 HG LEU 91 HG LEU 91 2.093 8.165 1.854 695 HD11 LEU 91 HD11 LEU 91 0.222 9.279 0.856 696 HD12 LEU 91 HD12 LEU 91 0.878 9.032 -0.761 697 HD13 LEU 91 HD13 LEU 91 1.695 10.112 0.365 698 HD21 LEU 91 HD21 LEU 91 1.791 5.919 1.040 699 HD22 LEU 91 HD22 LEU 91 1.160 6.523 -0.495 700 HD23 LEU 91 HD23 LEU 91 0.246 6.770 0.994 701 H GLU 92 HN GLU 92 4.368 9.737 3.160 702 HA GLU 92 HA GLU 92 5.685 7.429 4.389 703 HB2 GLU 92 HB2 GLU 92 6.561 9.741 4.798 704 HB3 GLU 92 HB1 GLU 92 5.051 10.119 5.616 705 HG2 GLU 92 HG2 GLU 92 5.534 8.249 7.194 706 HG3 GLU 92 HG1 GLU 92 7.121 8.102 6.439 707 H ILE 93 HN ILE 93 4.380 5.910 5.197 708 HA ILE 93 HA ILE 93 1.755 6.781 6.207 709 HB ILE 93 HB ILE 93 2.591 4.178 4.951 710 HG12 ILE 93 HG12 ILE 93 0.462 6.226 4.312 711 HG13 ILE 93 HG11 ILE 93 1.954 5.960 3.418 712 HG21 ILE 93 HG21 ILE 93 0.324 3.340 5.439 713 HG22 ILE 93 HG22 ILE 93 0.021 4.772 6.422 714 HG23 ILE 93 HG23 ILE 93 1.263 3.615 6.908 715 HD11 ILE 93 HD11 ILE 93 1.206 3.856 2.644 716 HD12 ILE 93 HD12 ILE 93 -0.101 5.014 2.383 717 HD13 ILE 93 HD13 ILE 93 -0.182 3.878 3.730 718 H SER 94 HN SER 94 1.629 6.856 8.281 719 HA SER 94 HA SER 94 3.300 5.158 9.950 720 HB2 SER 94 HB2 SER 94 1.316 7.319 10.726 721 HB3 SER 94 HB1 SER 94 2.474 6.532 11.801 722 HG SER 94 HG SER 94 3.747 7.510 9.646 723 H VAL 95 HN VAL 95 2.586 3.328 10.776 724 HA VAL 95 HA VAL 95 -0.310 2.889 10.973 725 HB VAL 95 HB VAL 95 0.075 1.733 8.996 726 HG11 VAL 95 HG11 VAL 95 2.762 0.947 10.098 727 HG12 VAL 95 HG12 VAL 95 2.412 2.038 8.751 728 HG13 VAL 95 HG13 VAL 95 2.088 0.309 8.596 729 HG21 VAL 95 HG21 VAL 95 -0.945 0.189 10.542 730 HG22 VAL 95 HG22 VAL 95 0.636 -0.303 11.147 731 HG23 VAL 95 HG23 VAL 95 0.169 -0.686 9.490 732 H SER 96 HN SER 96 -0.953 1.395 12.593 733 HA SER 96 HA SER 96 0.739 1.283 14.866 734 HB2 SER 96 HB2 SER 96 -1.762 1.305 14.981 735 HB3 SER 96 HB1 SER 96 -1.771 -0.327 14.321 736 HG SER 96 HG SER 96 -0.383 0.390 16.688 737 H SER 97 HN SER 97 2.453 0.051 14.957 738 HA SER 97 HA SER 97 2.595 -2.243 13.145 739 HB2 SER 97 HB2 SER 97 5.022 -1.331 12.804 740 HB3 SER 97 HB1 SER 97 3.677 -0.598 11.933 741 HG SER 97 HG SER 97 3.702 1.118 13.283 742 H VAL 98 HN VAL 98 4.184 -3.754 13.541 743 HA VAL 98 HA VAL 98 5.065 -3.974 16.325 744 HB VAL 98 HB VAL 98 5.560 -6.353 15.708 745 HG11 VAL 98 HG11 VAL 98 3.212 -7.077 15.616 746 HG12 VAL 98 HG12 VAL 98 2.730 -5.425 15.230 747 HG13 VAL 98 HG13 VAL 98 3.463 -5.789 16.793 748 HG21 VAL 98 HG21 VAL 98 4.680 -7.261 13.627 749 HG22 VAL 98 HG22 VAL 98 5.871 -6.003 13.296 750 HG23 VAL 98 HG23 VAL 98 4.152 -5.653 13.133 751 H HIS 99 HN HIS 99 7.344 -5.538 16.005 752 HA HIS 99 HA HIS 99 9.373 -3.773 15.722 753 HB2 HIS 99 HB2 HIS 99 9.407 -6.699 14.980 754 HB3 HIS 99 HB1 HIS 99 10.859 -5.715 15.111 755 HD1 HIS 99 HD1 HIS 99 9.790 -8.230 16.946 756 HD2 HIS 99 HD2 HIS 99 10.060 -4.205 17.952 757 HE1 HIS 99 HE1 HIS 99 9.916 -8.166 19.457 758 HE2 HIS 99 HE2 HIS 99 9.893 -5.716 20.040 759 H ILE 100 HN ILE 100 9.331 -2.288 14.124 760 HA ILE 100 HA ILE 100 10.536 -2.622 11.685 761 HB ILE 100 HB ILE 100 8.428 -3.997 11.185 762 HG12 ILE 100 HG12 ILE 100 8.995 -1.605 9.422 763 HG13 ILE 100 HG11 ILE 100 9.914 -3.106 9.431 764 HG21 ILE 100 HG21 ILE 100 6.423 -2.714 10.537 765 HG22 ILE 100 HG22 ILE 100 7.170 -1.257 11.191 766 HG23 ILE 100 HG23 ILE 100 6.774 -2.602 12.261 767 HD11 ILE 100 HD11 ILE 100 8.368 -3.025 7.561 768 HD12 ILE 100 HD12 ILE 100 7.016 -2.821 8.676 769 HD13 ILE 100 HD13 ILE 100 7.942 -4.322 8.677 770 H SER 101 HN SER 101 10.500 -0.632 10.460 771 HA SER 101 HA SER 101 9.815 1.676 12.075 772 HB2 SER 101 HB2 SER 101 12.057 1.469 10.957 773 HB3 SER 101 HB1 SER 101 11.240 1.598 9.401 774 HG SER 101 HG SER 101 12.161 3.582 10.605 775 H THR 102 HN THR 102 9.047 3.640 10.629 776 HA THR 102 HA THR 102 6.389 3.152 9.853 777 HB THR 102 HB THR 102 8.232 5.461 9.148 778 HG1 THR 102 HG1 THR 102 6.982 6.444 10.931 779 HG21 THR 102 HG21 THR 102 6.191 6.773 8.806 780 HG22 THR 102 HG22 THR 102 5.217 5.326 9.068 781 HG23 THR 102 HG23 THR 102 6.289 5.426 7.671 782 H TYR 103 HN TYR 103 5.436 3.014 7.796 783 HA TYR 103 HA TYR 103 7.172 1.743 5.845 784 HB2 TYR 103 HB2 TYR 103 5.341 0.386 6.139 785 HB3 TYR 103 HB1 TYR 103 4.258 1.732 6.454 786 HD1 TYR 103 HD1 TYR 103 2.624 2.116 4.912 787 HD2 TYR 103 HD2 TYR 103 6.277 0.377 3.572 788 HE1 TYR 103 HE1 TYR 103 1.702 1.945 2.643 789 HE2 TYR 103 HE2 TYR 103 5.348 0.212 1.297 790 HH TYR 103 HH TYR 103 3.117 0.089 0.217 791 H LEU 104 HN LEU 104 7.943 2.763 4.173 792 HA LEU 104 HA LEU 104 6.651 5.242 3.313 793 HB2 LEU 104 HB2 LEU 104 9.437 4.352 3.519 794 HB3 LEU 104 HB1 LEU 104 9.072 5.244 2.047 795 HG LEU 104 HG LEU 104 8.309 6.286 4.770 796 HD11 LEU 104 HD11 LEU 104 10.720 5.911 4.789 797 HD12 LEU 104 HD12 LEU 104 10.352 7.635 4.714 798 HD13 LEU 104 HD13 LEU 104 10.877 6.781 3.263 799 HD21 LEU 104 HD21 LEU 104 7.232 7.258 2.776 800 HD22 LEU 104 HD22 LEU 104 8.825 7.677 2.143 801 HD23 LEU 104 HD23 LEU 104 8.245 8.413 3.637 802 H PHE 105 HN PHE 105 5.410 5.100 1.688 803 HA PHE 105 HA PHE 105 5.853 3.165 -0.457 804 HB2 PHE 105 HB2 PHE 105 3.583 3.276 0.292 805 HB3 PHE 105 HB1 PHE 105 3.592 5.031 0.288 806 HD1 PHE 105 HD1 PHE 105 3.472 6.259 -1.850 807 HD2 PHE 105 HD2 PHE 105 3.076 2.029 -1.662 808 HE1 PHE 105 HE1 PHE 105 2.459 6.263 -4.083 809 HE2 PHE 105 HE2 PHE 105 2.067 2.034 -3.906 810 HZ PHE 105 HZ PHE 105 1.757 4.150 -5.117 811 H THR 106 HN THR 106 7.153 3.834 -2.107 812 HA THR 106 HA THR 106 7.190 6.729 -2.649 813 HB THR 106 HB THR 106 9.563 4.879 -2.789 814 HG1 THR 106 HG1 THR 106 8.548 5.584 -0.640 815 HG21 THR 106 HG21 THR 106 10.854 6.918 -3.073 816 HG22 THR 106 HG22 THR 106 9.383 7.889 -2.989 817 HG23 THR 106 HG23 THR 106 9.641 6.790 -4.346 818 H PHE 107 HN PHE 107 6.776 7.310 -4.641 819 HA PHE 107 HA PHE 107 7.097 5.333 -6.795 820 HB2 PHE 107 HB2 PHE 107 4.925 7.060 -6.130 821 HB3 PHE 107 HB1 PHE 107 5.588 7.583 -7.674 822 HD1 PHE 107 HD1 PHE 107 3.107 5.711 -6.354 823 HD2 PHE 107 HD2 PHE 107 6.287 5.333 -9.146 824 HE1 PHE 107 HE1 PHE 107 1.898 3.892 -7.467 825 HE2 PHE 107 HE2 PHE 107 5.080 3.508 -10.271 826 HZ PHE 107 HZ PHE 107 2.918 2.794 -9.467 827 H LYS 108 HN LYS 108 7.373 6.688 -8.991 828 HA LYS 108 HA LYS 108 9.823 8.132 -8.659 829 HB2 LYS 108 HB2 LYS 108 9.952 8.245 -11.051 830 HB3 LYS 108 HB1 LYS 108 9.466 6.627 -10.589 831 HG2 LYS 108 HG2 LYS 108 7.469 8.694 -11.439 832 HG3 LYS 108 HG1 LYS 108 8.343 7.723 -12.614 833 HD2 LYS 108 HD2 LYS 108 6.561 6.680 -10.421 834 HD3 LYS 108 HD1 LYS 108 6.140 6.802 -12.123 835 HE2 LYS 108 HE2 LYS 108 8.402 5.140 -11.025 836 HE3 LYS 108 HE1 LYS 108 6.810 4.516 -11.446 837 HZ1 LYS 108 HZ1 LYS 108 7.206 5.294 -13.736 838 HZ2 LYS 108 HZ2 LYS 108 8.319 4.122 -13.241 839 HZ3 LYS 108 HZ3 LYS 108 8.778 5.746 -13.297 840 H THR 109 HN THR 109 6.478 8.961 -9.041 841 HA THR 109 HA THR 109 7.201 11.797 -9.054 842 HB THR 109 HB THR 109 5.390 12.262 -10.693 843 HG1 THR 109 HG1 THR 109 4.767 10.375 -11.989 844 HG21 THR 109 HG21 THR 109 6.652 11.439 -12.676 845 HG22 THR 109 HG22 THR 109 7.653 10.484 -11.581 846 HG23 THR 109 HG23 THR 109 7.658 12.246 -11.471 847 H ARG 110 HN ARG 110 5.256 13.207 -8.619 848 HA ARG 110 HA ARG 110 3.905 12.319 -6.290 849 HB2 ARG 110 HB2 ARG 110 4.334 14.671 -6.521 850 HB3 ARG 110 HB1 ARG 110 3.479 14.732 -8.058 851 HG2 ARG 110 HG2 ARG 110 1.457 13.897 -6.636 852 HG3 ARG 110 HG1 ARG 110 2.392 14.549 -5.290 853 HD2 ARG 110 HD2 ARG 110 2.407 16.727 -6.274 854 HD3 ARG 110 HD1 ARG 110 1.695 16.109 -7.768 855 HE ARG 110 HE ARG 110 0.142 15.791 -5.321 856 HH11 ARG 110 HH11 ARG 110 0.698 17.599 -8.267 857 HH12 ARG 110 HH12 ARG 110 -0.896 18.283 -8.300 858 HH21 ARG 110 HH21 ARG 110 -1.964 16.653 -5.371 859 HH22 ARG 110 HH22 ARG 110 -2.417 17.738 -6.649 860 H GLU 111 HN GLU 111 2.846 12.869 -9.637 861 HA GLU 111 HA GLU 111 0.113 12.553 -9.165 862 HB2 GLU 111 HB2 GLU 111 1.661 12.046 -11.705 863 HB3 GLU 111 HB1 GLU 111 -0.087 12.211 -11.598 864 HG2 GLU 111 HG2 GLU 111 0.213 14.496 -10.728 865 HG3 GLU 111 HG1 GLU 111 1.954 14.319 -10.939 866 H GLU 112 HN GLU 112 2.601 10.167 -9.727 867 HA GLU 112 HA GLU 112 0.800 8.011 -10.203 868 HB2 GLU 112 HB2 GLU 112 3.724 8.086 -9.447 869 HB3 GLU 112 HB1 GLU 112 2.835 6.582 -9.708 870 HG2 GLU 112 HG2 GLU 112 3.348 8.770 -11.709 871 HG3 GLU 112 HG1 GLU 112 4.046 7.150 -11.688 872 H ARG 113 HN ARG 113 2.558 9.161 -7.324 873 HA ARG 113 HA ARG 113 1.459 7.108 -5.656 874 HB2 ARG 113 HB2 ARG 113 2.544 8.217 -3.805 875 HB3 ARG 113 HB1 ARG 113 3.646 8.170 -5.167 876 HG2 ARG 113 HG2 ARG 113 3.975 10.298 -4.396 877 HG3 ARG 113 HG1 ARG 113 2.732 10.579 -5.614 878 HD2 ARG 113 HD2 ARG 113 1.024 10.465 -3.826 879 HD3 ARG 113 HD1 ARG 113 2.317 10.305 -2.639 880 HE ARG 113 HE ARG 113 3.072 12.552 -3.686 881 HH11 ARG 113 HH11 ARG 113 -0.209 11.508 -3.087 882 HH12 ARG 113 HH12 ARG 113 -0.838 13.109 -2.901 883 HH21 ARG 113 HH21 ARG 113 2.262 14.683 -3.378 884 HH22 ARG 113 HH22 ARG 113 0.581 14.920 -3.023 885 H GLU 114 HN GLU 114 0.537 10.337 -6.557 886 HA GLU 114 HA GLU 114 -1.269 11.025 -4.574 887 HB2 GLU 114 HB2 GLU 114 -0.617 11.896 -7.208 888 HB3 GLU 114 HB1 GLU 114 -2.362 11.771 -7.102 889 HG2 GLU 114 HG2 GLU 114 -0.638 13.312 -5.188 890 HG3 GLU 114 HG1 GLU 114 -1.483 14.014 -6.562 891 H SER 115 HN SER 115 -1.929 9.297 -7.609 892 HA SER 115 HA SER 115 -4.616 8.794 -7.222 893 HB2 SER 115 HB2 SER 115 -3.423 8.336 -9.339 894 HB3 SER 115 HB1 SER 115 -2.589 6.987 -8.571 895 HG SER 115 HG SER 115 -5.103 7.114 -9.616 896 H TRP 116 HN TRP 116 -1.837 6.768 -6.333 897 HA TRP 116 HA TRP 116 -3.214 4.595 -5.311 898 HB2 TRP 116 HB2 TRP 116 -0.736 4.797 -5.758 899 HB3 TRP 116 HB1 TRP 116 -0.604 5.646 -4.222 900 HD1 TRP 116 HD1 TRP 116 -1.060 2.200 -5.713 901 HE1 TRP 116 HE1 TRP 116 -0.832 0.436 -3.862 902 HE3 TRP 116 HE3 TRP 116 -1.022 5.300 -1.624 903 HZ2 TRP 116 HZ2 TRP 116 -0.659 0.363 -1.054 904 HZ3 TRP 116 HZ3 TRP 116 -0.818 4.287 0.603 905 HH2 TRP 116 HH2 TRP 116 -0.642 1.871 0.884 906 H GLN 117 HN GLN 117 -1.790 7.282 -3.420 907 HA GLN 117 HA GLN 117 -2.798 6.643 -0.946 908 HB2 GLN 117 HB2 GLN 117 -1.244 8.374 -0.957 909 HB3 GLN 117 HB1 GLN 117 -2.065 9.242 -2.246 910 HG2 GLN 117 HG2 GLN 117 -3.834 9.887 -0.728 911 HG3 GLN 117 HG1 GLN 117 -3.085 8.957 0.572 912 HE21 GLN 117 HE21 GLN 117 -2.872 10.758 1.885 913 HE22 GLN 117 HE22 GLN 117 -1.720 12.007 1.569 914 H ASN 118 HN ASN 118 -4.351 8.716 -3.400 915 HA ASN 118 HA ASN 118 -6.601 9.362 -1.842 916 HB2 ASN 118 HB2 ASN 118 -6.050 9.385 -4.793 917 HB3 ASN 118 HB1 ASN 118 -7.659 9.751 -4.185 918 HD21 ASN 118 HD21 ASN 118 -4.299 10.749 -4.162 919 HD22 ASN 118 HD22 ASN 118 -4.583 12.414 -3.759 920 H ASN 119 HN ASN 119 -5.978 6.694 -4.064 921 HA ASN 119 HA ASN 119 -8.584 5.570 -3.946 922 HB2 ASN 119 HB2 ASN 119 -5.938 4.215 -4.527 923 HB3 ASN 119 HB1 ASN 119 -7.526 3.523 -4.837 924 HD21 ASN 119 HD21 ASN 119 -5.357 4.055 -6.676 925 HD22 ASN 119 HD22 ASN 119 -5.974 5.129 -7.877 926 H LEU 120 HN LEU 120 -5.542 4.727 -2.296 927 HA LEU 120 HA LEU 120 -6.643 2.594 -0.823 928 HB2 LEU 120 HB2 LEU 120 -4.201 2.989 -1.305 929 HB3 LEU 120 HB1 LEU 120 -4.223 4.232 -0.075 930 HG LEU 120 HG LEU 120 -3.342 1.857 0.522 931 HD11 LEU 120 HD11 LEU 120 -3.625 3.661 2.135 932 HD12 LEU 120 HD12 LEU 120 -4.086 2.103 2.820 933 HD13 LEU 120 HD13 LEU 120 -5.330 3.243 2.306 934 HD21 LEU 120 HD21 LEU 120 -5.005 0.320 1.355 935 HD22 LEU 120 HD22 LEU 120 -5.289 0.644 -0.356 936 HD23 LEU 120 HD23 LEU 120 -6.298 1.416 0.868 937 H GLU 121 HN GLU 121 -6.191 6.022 -0.035 938 HA GLU 121 HA GLU 121 -6.840 5.868 2.680 939 HB2 GLU 121 HB2 GLU 121 -5.918 7.885 1.608 940 HB3 GLU 121 HB1 GLU 121 -7.441 8.129 0.768 941 HG2 GLU 121 HG2 GLU 121 -8.591 8.513 2.835 942 HG3 GLU 121 HG1 GLU 121 -7.152 8.093 3.761 943 H SER 122 HN SER 122 -8.955 6.541 -0.096 944 HA SER 122 HA SER 122 -11.356 6.656 1.357 945 HB2 SER 122 HB2 SER 122 -10.909 5.809 -1.523 946 HB3 SER 122 HB1 SER 122 -12.462 6.268 -0.825 947 HG SER 122 HG SER 122 -10.179 7.884 -1.293 948 H PHE 123 HN PHE 123 -9.761 3.922 -0.264 949 HA PHE 123 HA PHE 123 -11.692 1.970 0.322 950 HB2 PHE 123 HB2 PHE 123 -9.874 1.650 -1.301 951 HB3 PHE 123 HB1 PHE 123 -8.697 1.675 0.004 952 HD1 PHE 123 HD1 PHE 123 -11.976 -0.075 -0.168 953 HD2 PHE 123 HD2 PHE 123 -7.737 -0.425 -0.046 954 HE1 PHE 123 HE1 PHE 123 -12.186 -2.516 0.056 955 HE2 PHE 123 HE2 PHE 123 -7.940 -2.862 0.179 956 HZ PHE 123 HZ PHE 123 -10.165 -3.910 0.232 957 H ARG 124 HN ARG 124 -8.817 2.996 2.078 958 HA ARG 124 HA ARG 124 -9.005 1.365 4.332 959 HB2 ARG 124 HB2 ARG 124 -7.035 2.639 3.979 960 HB3 ARG 124 HB1 ARG 124 -7.934 4.143 3.873 961 HG2 ARG 124 HG2 ARG 124 -8.492 3.885 6.292 962 HG3 ARG 124 HG1 ARG 124 -7.381 2.511 6.337 963 HD2 ARG 124 HD2 ARG 124 -5.547 3.920 5.652 964 HD3 ARG 124 HD1 ARG 124 -6.635 5.290 5.441 965 HE ARG 124 HE ARG 124 -6.188 4.046 8.075 966 HH11 ARG 124 HH11 ARG 124 -6.367 6.874 6.017 967 HH12 ARG 124 HH12 ARG 124 -6.106 7.992 7.314 968 HH21 ARG 124 HH21 ARG 124 -5.830 5.511 9.779 969 HH22 ARG 124 HH22 ARG 124 -5.790 7.218 9.454 970 H LYS 125 HN LYS 125 -10.505 4.477 3.606 971 HA LYS 125 HA LYS 125 -11.728 4.811 6.133 972 HB2 LYS 125 HB2 LYS 125 -12.383 6.032 3.451 973 HB3 LYS 125 HB1 LYS 125 -13.133 6.517 4.969 974 HG2 LYS 125 HG2 LYS 125 -11.029 7.260 5.843 975 HG3 LYS 125 HG1 LYS 125 -10.171 6.613 4.445 976 HD2 LYS 125 HD2 LYS 125 -10.382 8.996 4.206 977 HD3 LYS 125 HD1 LYS 125 -11.404 8.205 3.005 978 HE2 LYS 125 HE2 LYS 125 -13.363 8.595 4.387 979 HE3 LYS 125 HE1 LYS 125 -12.356 9.316 5.642 980 HZ1 LYS 125 HZ1 LYS 125 -12.726 10.375 2.893 981 HZ2 LYS 125 HZ2 LYS 125 -11.739 11.060 4.081 982 HZ3 LYS 125 HZ3 LYS 125 -13.415 11.011 4.302 983 H ILE 126 HN ILE 126 -12.723 3.121 3.223 984 HA ILE 126 HA ILE 126 -15.426 2.744 3.947 985 HB ILE 126 HB ILE 126 -13.634 0.966 2.282 986 HG12 ILE 126 HG12 ILE 126 -15.652 3.033 1.392 987 HG13 ILE 126 HG11 ILE 126 -13.920 3.337 1.504 988 HG21 ILE 126 HG21 ILE 126 -15.682 0.030 1.358 989 HG22 ILE 126 HG22 ILE 126 -16.649 1.048 2.425 990 HG23 ILE 126 HG23 ILE 126 -15.626 -0.218 3.106 991 HD11 ILE 126 HD11 ILE 126 -15.280 1.339 -0.282 992 HD12 ILE 126 HD12 ILE 126 -13.537 1.546 -0.131 993 HD13 ILE 126 HD13 ILE 126 -14.527 2.857 -0.767 994 H MET 127 HN MET 127 -12.471 1.210 5.002 995 HA MET 127 HA MET 127 -14.008 -0.970 6.240 996 HB2 MET 127 HB2 MET 127 -11.032 -0.725 5.775 997 HB3 MET 127 HB1 MET 127 -11.852 -2.128 6.445 998 HG2 MET 127 HG2 MET 127 -13.010 -2.500 4.365 999 HG3 MET 127 HG1 MET 127 -12.322 -1.026 3.686 1000 HE1 MET 127 HE1 MET 127 -9.826 -0.713 3.008 1001 HE2 MET 127 HE2 MET 127 -8.559 -1.909 3.280 1002 HE3 MET 127 HE3 MET 127 -9.295 -1.080 4.650 1003 H SER 128 HN SER 128 -11.511 1.449 7.016 1004 HA SER 128 HA SER 128 -11.616 0.645 9.820 1005 HB2 SER 128 HB2 SER 128 -9.425 1.063 8.658 1006 HB3 SER 128 HB1 SER 128 -9.873 2.764 8.540 1007 HG SER 128 HG SER 128 -9.754 1.337 10.995 1008 H MET 129 HN MET 129 -12.395 3.364 7.741 1009 HA MET 129 HA MET 129 -13.621 4.735 10.024 1010 HB2 MET 129 HB2 MET 129 -13.009 5.729 7.218 1011 HB3 MET 129 HB1 MET 129 -13.854 6.667 8.449 1012 HG2 MET 129 HG2 MET 129 -11.886 6.538 9.899 1013 HG3 MET 129 HG1 MET 129 -11.037 5.631 8.648 1014 HE1 MET 129 HE1 MET 129 -9.292 9.158 8.628 1015 HE2 MET 129 HE2 MET 129 -9.042 7.420 8.786 1016 HE3 MET 129 HE3 MET 129 -9.938 8.299 10.026 1017 H LYS 130 HN LYS 130 -14.718 2.365 9.060 1018 HA LYS 130 HA LYS 130 -16.625 2.642 7.037 1019 HB2 LYS 130 HB2 LYS 130 -15.726 0.483 7.923 1020 HB3 LYS 130 HB1 LYS 130 -16.723 0.708 9.354 1021 HG2 LYS 130 HG2 LYS 130 -18.731 0.678 7.962 1022 HG3 LYS 130 HG1 LYS 130 -17.728 0.456 6.527 1023 HD2 LYS 130 HD2 LYS 130 -17.712 -1.449 8.856 1024 HD3 LYS 130 HD1 LYS 130 -18.781 -1.634 7.466 1025 HE2 LYS 130 HE2 LYS 130 -16.843 -1.734 5.983 1026 HE3 LYS 130 HE1 LYS 130 -15.769 -1.531 7.365 1027 HZ1 LYS 130 HZ1 LYS 130 -17.653 -3.795 7.042 1028 HZ2 LYS 130 HZ2 LYS 130 -16.474 -3.620 8.239 1029 HZ3 LYS 130 HZ3 LYS 130 -16.016 -3.856 6.629 Start of MODEL 10 1 H1 SER 12 HT1 SER 12 -19.327 -8.974 -3.244 2 H2 SER 12 HT2 SER 12 -19.970 -7.582 -3.960 3 H3 SER 12 HT3 SER 12 -20.430 -9.109 -4.520 4 HA SER 12 HA SER 12 -21.479 -9.599 -2.416 5 HB2 SER 12 HB2 SER 12 -21.688 -7.851 -0.728 6 HB3 SER 12 HB1 SER 12 -19.984 -8.124 -1.074 7 HG SER 12 HG SER 12 -21.480 -5.879 -1.383 8 H ALA 13 HN ALA 13 -23.308 -7.392 -1.631 9 HA ALA 13 HA ALA 13 -25.244 -7.765 -3.563 10 HB1 ALA 13 HB1 ALA 13 -25.054 -5.537 -1.565 11 HB2 ALA 13 HB2 ALA 13 -25.848 -7.097 -1.338 12 HB3 ALA 13 HB3 ALA 13 -26.488 -5.939 -2.511 13 H LYS 14 HN LYS 14 -24.136 -4.474 -2.886 14 HA LYS 14 HA LYS 14 -24.240 -3.987 -5.786 15 HB2 LYS 14 HB2 LYS 14 -25.180 -2.016 -3.705 16 HB3 LYS 14 HB1 LYS 14 -25.406 -1.935 -5.443 17 HG2 LYS 14 HG2 LYS 14 -26.737 -3.835 -3.527 18 HG3 LYS 14 HG1 LYS 14 -27.487 -2.507 -4.409 19 HD2 LYS 14 HD2 LYS 14 -26.761 -3.721 -6.527 20 HD3 LYS 14 HD1 LYS 14 -26.420 -5.102 -5.478 21 HE2 LYS 14 HE2 LYS 14 -29.088 -3.715 -5.655 22 HE3 LYS 14 HE1 LYS 14 -28.664 -5.170 -6.550 23 HZ1 LYS 14 HZ1 LYS 14 -28.347 -6.331 -4.467 24 HZ2 LYS 14 HZ2 LYS 14 -29.902 -5.670 -4.533 25 HZ3 LYS 14 HZ3 LYS 14 -28.710 -4.929 -3.591 26 H ASP 15 HN ASP 15 -21.794 -4.453 -5.031 27 HA ASP 15 HA ASP 15 -19.722 -3.590 -5.179 28 HB2 ASP 15 HB2 ASP 15 -21.163 -0.968 -5.418 29 HB3 ASP 15 HB1 ASP 15 -19.411 -1.112 -5.434 30 H ILE 16 HN ILE 16 -21.082 -3.961 -2.530 31 HA ILE 16 HA ILE 16 -19.926 -1.755 -1.009 32 HB ILE 16 HB ILE 16 -21.764 -3.979 -0.124 33 HG12 ILE 16 HG12 ILE 16 -23.094 -1.786 0.510 34 HG13 ILE 16 HG11 ILE 16 -22.078 -1.071 -0.735 35 HG21 ILE 16 HG21 ILE 16 -21.830 -2.900 2.075 36 HG22 ILE 16 HG22 ILE 16 -20.603 -1.748 1.551 37 HG23 ILE 16 HG23 ILE 16 -20.201 -3.459 1.691 38 HD11 ILE 16 HD11 ILE 16 -24.220 -1.763 -1.625 39 HD12 ILE 16 HD12 ILE 16 -23.919 -3.418 -1.094 40 HD13 ILE 16 HD13 ILE 16 -22.906 -2.695 -2.345 41 H LYS 17 HN LYS 17 -20.048 -5.226 -0.113 42 HA LYS 17 HA LYS 17 -17.791 -4.789 1.559 43 HB2 LYS 17 HB2 LYS 17 -19.320 -7.286 0.894 44 HB3 LYS 17 HB1 LYS 17 -18.026 -7.211 2.087 45 HG2 LYS 17 HG2 LYS 17 -19.295 -5.465 3.288 46 HG3 LYS 17 HG1 LYS 17 -20.616 -5.686 2.141 47 HD2 LYS 17 HD2 LYS 17 -20.866 -7.990 2.834 48 HD3 LYS 17 HD1 LYS 17 -19.484 -7.831 3.921 49 HE2 LYS 17 HE2 LYS 17 -22.018 -6.218 4.110 50 HE3 LYS 17 HE1 LYS 17 -21.669 -7.649 5.078 51 HZ1 LYS 17 HZ1 LYS 17 -20.087 -5.135 5.073 52 HZ2 LYS 17 HZ2 LYS 17 -19.756 -6.505 6.007 53 HZ3 LYS 17 HZ3 LYS 17 -21.166 -5.617 6.283 54 H ASP 18 HN ASP 18 -18.197 -7.215 -1.016 55 HA ASP 18 HA ASP 18 -15.363 -7.722 -1.035 56 HB2 ASP 18 HB2 ASP 18 -17.417 -8.732 -2.998 57 HB3 ASP 18 HB1 ASP 18 -15.843 -9.432 -2.654 58 H GLU 19 HN GLU 19 -17.693 -6.115 -3.053 59 HA GLU 19 HA GLU 19 -16.175 -6.126 -5.411 60 HB2 GLU 19 HB2 GLU 19 -18.612 -4.660 -4.483 61 HB3 GLU 19 HB1 GLU 19 -17.887 -4.280 -6.045 62 HG2 GLU 19 HG2 GLU 19 -18.851 -6.986 -5.156 63 HG3 GLU 19 HG1 GLU 19 -19.723 -5.884 -6.219 64 H LYS 20 HN LYS 20 -16.427 -3.698 -2.816 65 HA LYS 20 HA LYS 20 -14.960 -1.688 -4.148 66 HB2 LYS 20 HB2 LYS 20 -15.206 -2.308 -1.201 67 HB3 LYS 20 HB1 LYS 20 -14.346 -0.907 -1.824 68 HG2 LYS 20 HG2 LYS 20 -17.269 -1.486 -2.263 69 HG3 LYS 20 HG1 LYS 20 -16.614 -0.369 -1.063 70 HD2 LYS 20 HD2 LYS 20 -15.598 0.946 -2.878 71 HD3 LYS 20 HD1 LYS 20 -16.316 -0.151 -4.060 72 HE2 LYS 20 HE2 LYS 20 -18.544 0.450 -3.275 73 HE3 LYS 20 HE1 LYS 20 -17.839 1.521 -2.067 74 HZ1 LYS 20 HZ1 LYS 20 -18.605 2.714 -4.039 75 HZ2 LYS 20 HZ2 LYS 20 -17.535 1.832 -5.004 76 HZ3 LYS 20 HZ3 LYS 20 -16.937 2.883 -3.821 77 H ILE 21 HN ILE 21 -13.990 -4.381 -2.105 78 HA ILE 21 HA ILE 21 -11.256 -3.858 -1.914 79 HB ILE 21 HB ILE 21 -12.684 -6.522 -1.973 80 HG12 ILE 21 HG12 ILE 21 -11.733 -4.944 0.425 81 HG13 ILE 21 HG11 ILE 21 -13.382 -4.866 -0.195 82 HG21 ILE 21 HG21 ILE 21 -10.324 -6.818 -2.422 83 HG22 ILE 21 HG22 ILE 21 -10.711 -7.397 -0.802 84 HG23 ILE 21 HG23 ILE 21 -9.910 -5.841 -1.012 85 HD11 ILE 21 HD11 ILE 21 -13.646 -7.252 0.223 86 HD12 ILE 21 HD12 ILE 21 -13.210 -6.379 1.691 87 HD13 ILE 21 HD13 ILE 21 -11.994 -7.327 0.835 88 H GLN 22 HN GLN 22 -13.006 -5.937 -4.205 89 HA GLN 22 HA GLN 22 -10.667 -6.755 -5.571 90 HB2 GLN 22 HB2 GLN 22 -13.540 -6.873 -6.498 91 HB3 GLN 22 HB1 GLN 22 -12.197 -7.807 -7.150 92 HG2 GLN 22 HG2 GLN 22 -11.905 -8.854 -4.924 93 HG3 GLN 22 HG1 GLN 22 -13.338 -7.989 -4.372 94 HE21 GLN 22 HE21 GLN 22 -12.131 -10.546 -6.395 95 HE22 GLN 22 HE22 GLN 22 -13.656 -11.310 -6.677 96 H GLN 23 HN GLN 23 -12.960 -4.141 -6.114 97 HA GLN 23 HA GLN 23 -11.947 -3.479 -8.701 98 HB2 GLN 23 HB2 GLN 23 -13.724 -2.022 -6.764 99 HB3 GLN 23 HB1 GLN 23 -13.201 -1.293 -8.276 100 HG2 GLN 23 HG2 GLN 23 -14.249 -3.042 -9.539 101 HG3 GLN 23 HG1 GLN 23 -14.663 -3.909 -8.063 102 HE21 GLN 23 HE21 GLN 23 -16.318 -3.165 -6.782 103 HE22 GLN 23 HE22 GLN 23 -17.501 -2.035 -7.357 104 H TYR 24 HN TYR 24 -11.574 -1.919 -5.502 105 HA TYR 24 HA TYR 24 -9.764 0.040 -6.389 106 HB2 TYR 24 HB2 TYR 24 -10.454 -1.094 -3.707 107 HB3 TYR 24 HB1 TYR 24 -9.039 -0.052 -3.858 108 HD1 TYR 24 HD1 TYR 24 -12.705 -0.206 -4.146 109 HD2 TYR 24 HD2 TYR 24 -9.275 2.303 -4.258 110 HE1 TYR 24 HE1 TYR 24 -14.154 1.773 -4.014 111 HE2 TYR 24 HE2 TYR 24 -10.714 4.292 -4.125 112 HH TYR 24 HH TYR 24 -13.033 4.922 -4.619 113 H ARG 25 HN ARG 25 -9.306 -3.276 -5.419 114 HA ARG 25 HA ARG 25 -6.600 -3.369 -4.903 115 HB2 ARG 25 HB2 ARG 25 -8.174 -5.260 -4.659 116 HB3 ARG 25 HB1 ARG 25 -8.204 -5.429 -6.406 117 HG2 ARG 25 HG2 ARG 25 -5.791 -5.905 -6.382 118 HG3 ARG 25 HG1 ARG 25 -5.814 -5.796 -4.620 119 HD2 ARG 25 HD2 ARG 25 -5.915 -8.122 -5.413 120 HD3 ARG 25 HD1 ARG 25 -7.346 -7.667 -4.492 121 HE ARG 25 HE ARG 25 -7.775 -7.258 -7.261 122 HH11 ARG 25 HH11 ARG 25 -7.485 -9.834 -4.910 123 HH12 ARG 25 HH12 ARG 25 -8.559 -10.903 -5.756 124 HH21 ARG 25 HH21 ARG 25 -9.178 -8.665 -8.391 125 HH22 ARG 25 HH22 ARG 25 -9.524 -10.234 -7.737 126 H LYS 26 HN LYS 26 -8.218 -3.139 -8.016 127 HA LYS 26 HA LYS 26 -6.073 -3.908 -9.677 128 HB2 LYS 26 HB2 LYS 26 -8.278 -1.933 -10.284 129 HB3 LYS 26 HB1 LYS 26 -7.287 -2.774 -11.466 130 HG2 LYS 26 HG2 LYS 26 -8.248 -4.893 -10.805 131 HG3 LYS 26 HG1 LYS 26 -9.195 -4.090 -9.550 132 HD2 LYS 26 HD2 LYS 26 -9.408 -3.561 -12.511 133 HD3 LYS 26 HD1 LYS 26 -10.520 -4.555 -11.572 134 HE2 LYS 26 HE2 LYS 26 -10.975 -2.536 -10.155 135 HE3 LYS 26 HE1 LYS 26 -10.026 -1.594 -11.302 136 HZ1 LYS 26 HZ1 LYS 26 -11.574 -2.204 -13.044 137 HZ2 LYS 26 HZ2 LYS 26 -12.402 -1.470 -11.768 138 HZ3 LYS 26 HZ3 LYS 26 -12.472 -3.146 -11.965 139 H THR 27 HN THR 27 -7.224 -0.679 -8.761 140 HA THR 27 HA THR 27 -4.985 0.622 -9.997 141 HB THR 27 HB THR 27 -7.142 1.737 -9.942 142 HG1 THR 27 HG1 THR 27 -5.823 3.391 -9.998 143 HG21 THR 27 HG21 THR 27 -8.024 2.659 -7.812 144 HG22 THR 27 HG22 THR 27 -6.816 1.706 -6.946 145 HG23 THR 27 HG23 THR 27 -8.067 0.895 -7.894 146 H LEU 28 HN LEU 28 -5.651 -0.748 -6.952 147 HA LEU 28 HA LEU 28 -3.808 0.779 -5.399 148 HB2 LEU 28 HB2 LEU 28 -5.631 -1.452 -5.020 149 HB3 LEU 28 HB1 LEU 28 -4.130 -1.681 -4.142 150 HG LEU 28 HG LEU 28 -5.883 -0.640 -2.760 151 HD11 LEU 28 HD11 LEU 28 -3.528 1.132 -3.374 152 HD12 LEU 28 HD12 LEU 28 -3.566 -0.215 -2.237 153 HD13 LEU 28 HD13 LEU 28 -4.531 1.227 -1.930 154 HD21 LEU 28 HD21 LEU 28 -5.658 1.669 -4.689 155 HD22 LEU 28 HD22 LEU 28 -6.581 1.658 -3.186 156 HD23 LEU 28 HD23 LEU 28 -7.050 0.600 -4.518 157 H THR 29 HN THR 29 -3.423 -1.667 -7.719 158 HA THR 29 HA THR 29 -1.003 -2.749 -6.551 159 HB THR 29 HB THR 29 -2.099 -3.303 -9.311 160 HG1 THR 29 HG1 THR 29 -3.591 -3.778 -7.520 161 HG21 THR 29 HG21 THR 29 0.217 -3.995 -8.990 162 HG22 THR 29 HG22 THR 29 -0.832 -5.411 -9.056 163 HG23 THR 29 HG23 THR 29 -0.214 -4.842 -7.504 164 H LYS 30 HN LYS 30 0.815 -1.665 -6.669 165 HA LYS 30 HA LYS 30 1.532 -0.261 -9.146 166 HB2 LYS 30 HB2 LYS 30 1.588 0.899 -6.357 167 HB3 LYS 30 HB1 LYS 30 2.438 1.614 -7.716 168 HG2 LYS 30 HG2 LYS 30 -0.532 1.163 -7.709 169 HG3 LYS 30 HG1 LYS 30 0.225 2.645 -7.122 170 HD2 LYS 30 HD2 LYS 30 1.351 2.828 -9.366 171 HD3 LYS 30 HD1 LYS 30 0.325 1.501 -9.901 172 HE2 LYS 30 HE2 LYS 30 -0.782 4.017 -8.705 173 HE3 LYS 30 HE1 LYS 30 -0.471 3.847 -10.431 174 HZ1 LYS 30 HZ1 LYS 30 -2.761 3.338 -9.901 175 HZ2 LYS 30 HZ2 LYS 30 -2.284 2.132 -8.820 176 HZ3 LYS 30 HZ3 LYS 30 -1.977 1.955 -10.474 177 H ILE 31 HN ILE 31 3.726 -0.342 -9.645 178 HA ILE 31 HA ILE 31 5.459 -1.907 -7.898 179 HB ILE 31 HB ILE 31 6.084 -0.559 -10.541 180 HG12 ILE 31 HG12 ILE 31 4.400 -2.431 -10.640 181 HG13 ILE 31 HG11 ILE 31 5.860 -2.703 -11.584 182 HG21 ILE 31 HG21 ILE 31 8.090 -2.000 -10.551 183 HG22 ILE 31 HG22 ILE 31 7.687 -2.534 -8.919 184 HG23 ILE 31 HG23 ILE 31 8.089 -0.843 -9.220 185 HD11 ILE 31 HD11 ILE 31 6.731 -4.148 -9.826 186 HD12 ILE 31 HD12 ILE 31 5.169 -4.714 -10.420 187 HD13 ILE 31 HD13 ILE 31 5.271 -3.870 -8.876 188 H VAL 32 HN VAL 32 6.336 -0.875 -6.217 189 HA VAL 32 HA VAL 32 7.238 1.906 -6.569 190 HB VAL 32 HB VAL 32 6.303 2.567 -4.451 191 HG11 VAL 32 HG11 VAL 32 3.930 2.443 -4.952 192 HG12 VAL 32 HG12 VAL 32 4.223 1.118 -6.079 193 HG13 VAL 32 HG13 VAL 32 4.863 2.727 -6.423 194 HG21 VAL 32 HG21 VAL 32 6.533 0.477 -3.227 195 HG22 VAL 32 HG22 VAL 32 5.273 -0.263 -4.216 196 HG23 VAL 32 HG23 VAL 32 4.873 1.066 -3.127 197 H LYS 33 HN LYS 33 8.541 2.594 -4.578 198 HA LYS 33 HA LYS 33 10.359 0.390 -3.895 199 HB2 LYS 33 HB2 LYS 33 10.850 3.357 -3.561 200 HB3 LYS 33 HB1 LYS 33 12.034 2.055 -3.490 201 HG2 LYS 33 HG2 LYS 33 11.870 1.632 -5.819 202 HG3 LYS 33 HG1 LYS 33 10.459 2.681 -5.974 203 HD2 LYS 33 HD2 LYS 33 11.861 4.597 -5.320 204 HD3 LYS 33 HD1 LYS 33 13.268 3.534 -5.282 205 HE2 LYS 33 HE2 LYS 33 12.887 3.023 -7.671 206 HE3 LYS 33 HE1 LYS 33 11.546 4.168 -7.679 207 HZ1 LYS 33 HZ1 LYS 33 13.518 5.210 -8.536 208 HZ2 LYS 33 HZ2 LYS 33 14.398 4.803 -7.153 209 HZ3 LYS 33 HZ3 LYS 33 13.131 5.915 -7.048 210 H ILE 34 HN ILE 34 10.186 -0.439 -1.917 211 HA ILE 34 HA ILE 34 8.712 1.068 0.098 212 HB ILE 34 HB ILE 34 9.059 -1.771 -0.485 213 HG12 ILE 34 HG12 ILE 34 7.088 -0.135 1.099 214 HG13 ILE 34 HG11 ILE 34 6.934 -0.627 -0.580 215 HG21 ILE 34 HG21 ILE 34 9.093 -0.956 2.416 216 HG22 ILE 34 HG22 ILE 34 10.459 -1.663 1.551 217 HG23 ILE 34 HG23 ILE 34 8.982 -2.600 1.785 218 HD11 ILE 34 HD11 ILE 34 6.856 -2.386 1.854 219 HD12 ILE 34 HD12 ILE 34 6.896 -2.992 0.200 220 HD13 ILE 34 HD13 ILE 34 5.532 -2.020 0.748 221 H LYS 35 HN LYS 35 9.537 1.624 2.042 222 HA LYS 35 HA LYS 35 12.438 1.240 2.420 223 HB2 LYS 35 HB2 LYS 35 11.341 3.575 1.589 224 HB3 LYS 35 HB1 LYS 35 11.228 3.784 3.325 225 HG2 LYS 35 HG2 LYS 35 13.584 3.571 3.588 226 HG3 LYS 35 HG1 LYS 35 13.779 3.096 1.899 227 HD2 LYS 35 HD2 LYS 35 12.785 5.776 2.872 228 HD3 LYS 35 HD1 LYS 35 14.407 5.443 2.267 229 HE2 LYS 35 HE2 LYS 35 13.397 4.765 0.093 230 HE3 LYS 35 HE1 LYS 35 11.821 5.247 0.717 231 HZ1 LYS 35 HZ1 LYS 35 12.681 7.502 0.993 232 HZ2 LYS 35 HZ2 LYS 35 12.779 6.999 -0.617 233 HZ3 LYS 35 HZ3 LYS 35 14.168 7.029 0.347 234 H THR 36 HN THR 36 12.688 0.109 4.263 235 HA THR 36 HA THR 36 10.872 0.659 6.513 236 HB THR 36 HB THR 36 10.647 -1.737 6.978 237 HG1 THR 36 HG1 THR 36 11.827 -2.269 4.445 238 HG21 THR 36 HG21 THR 36 9.195 -2.356 5.116 239 HG22 THR 36 HG22 THR 36 9.906 -1.076 4.131 240 HG23 THR 36 HG23 THR 36 8.954 -0.665 5.559 241 H ALA 37 HN ALA 37 11.766 -1.089 8.351 242 HA ALA 37 HA ALA 37 14.493 -0.268 8.889 243 HB1 ALA 37 HB1 ALA 37 14.187 -1.389 11.040 244 HB2 ALA 37 HB2 ALA 37 12.637 -2.028 10.494 245 HB3 ALA 37 HB3 ALA 37 12.846 -0.291 10.710 246 H ILE 38 HN ILE 38 12.837 -2.865 7.469 247 HA ILE 38 HA ILE 38 14.867 -4.850 8.056 248 HB ILE 38 HB ILE 38 12.528 -5.146 6.169 249 HG12 ILE 38 HG12 ILE 38 12.614 -5.786 9.128 250 HG13 ILE 38 HG11 ILE 38 11.759 -4.420 8.421 251 HG21 ILE 38 HG21 ILE 38 12.790 -7.536 6.694 252 HG22 ILE 38 HG22 ILE 38 14.180 -7.148 7.707 253 HG23 ILE 38 HG23 ILE 38 14.246 -6.853 5.970 254 HD11 ILE 38 HD11 ILE 38 10.316 -5.955 7.194 255 HD12 ILE 38 HD12 ILE 38 10.244 -6.246 8.932 256 HD13 ILE 38 HD13 ILE 38 11.177 -7.326 7.896 257 H PHE 39 HN PHE 39 13.425 -3.441 5.109 258 HA PHE 39 HA PHE 39 15.972 -3.103 3.877 259 HB2 PHE 39 HB2 PHE 39 15.373 -4.629 1.892 260 HB3 PHE 39 HB1 PHE 39 16.012 -5.375 3.348 261 HD1 PHE 39 HD1 PHE 39 15.086 -7.395 3.804 262 HD2 PHE 39 HD2 PHE 39 12.604 -4.365 2.144 263 HE1 PHE 39 HE1 PHE 39 13.167 -8.929 3.880 264 HE2 PHE 39 HE2 PHE 39 10.682 -5.894 2.222 265 HZ PHE 39 HZ PHE 39 10.962 -8.181 3.090 266 H HIS 40 HN HIS 40 15.925 -1.775 2.135 267 HA HIS 40 HA HIS 40 13.321 -0.739 1.279 268 HB2 HIS 40 HB2 HIS 40 14.785 1.039 1.775 269 HB3 HIS 40 HB1 HIS 40 16.157 0.259 1.010 270 HD1 HIS 40 HD1 HIS 40 16.527 0.724 -1.458 271 HD2 HIS 40 HD2 HIS 40 12.965 2.299 -0.004 272 HE1 HIS 40 HE1 HIS 40 15.682 2.258 -3.261 273 HE2 HIS 40 HE2 HIS 40 13.649 3.359 -2.266 274 H GLU 41 HN GLU 41 12.440 -1.820 -0.355 275 HA GLU 41 HA GLU 41 14.142 -2.757 -2.548 276 HB2 GLU 41 HB2 GLU 41 12.124 -4.447 -1.058 277 HB3 GLU 41 HB1 GLU 41 12.902 -4.919 -2.559 278 HG2 GLU 41 HG2 GLU 41 14.358 -4.347 0.012 279 HG3 GLU 41 HG1 GLU 41 13.894 -5.953 -0.545 280 H THR 42 HN THR 42 13.071 -2.928 -4.544 281 HA THR 42 HA THR 42 10.673 -1.374 -4.832 282 HB THR 42 HB THR 42 11.898 -3.137 -6.955 283 HG1 THR 42 HG1 THR 42 12.957 -0.924 -5.702 284 HG21 THR 42 HG21 THR 42 11.001 -1.424 -8.456 285 HG22 THR 42 HG22 THR 42 10.390 -0.522 -7.064 286 HG23 THR 42 HG23 THR 42 9.726 -2.115 -7.448 287 H VAL 43 HN VAL 43 8.587 -2.132 -5.019 288 HA VAL 43 HA VAL 43 8.173 -5.023 -5.085 289 HB VAL 43 HB VAL 43 8.486 -4.193 -2.690 290 HG11 VAL 43 HG11 VAL 43 5.787 -2.987 -3.257 291 HG12 VAL 43 HG12 VAL 43 7.265 -2.130 -2.807 292 HG13 VAL 43 HG13 VAL 43 6.476 -3.202 -1.650 293 HG21 VAL 43 HG21 VAL 43 7.492 -6.348 -3.215 294 HG22 VAL 43 HG22 VAL 43 5.911 -5.585 -3.391 295 HG23 VAL 43 HG23 VAL 43 6.709 -5.610 -1.818 296 H LYS 44 HN LYS 44 6.008 -5.656 -5.562 297 HA LYS 44 HA LYS 44 4.354 -3.546 -6.743 298 HB2 LYS 44 HB2 LYS 44 4.848 -5.818 -7.896 299 HB3 LYS 44 HB1 LYS 44 3.730 -6.492 -6.719 300 HG2 LYS 44 HG2 LYS 44 1.988 -4.951 -7.528 301 HG3 LYS 44 HG1 LYS 44 3.101 -4.412 -8.786 302 HD2 LYS 44 HD2 LYS 44 1.584 -6.101 -9.664 303 HD3 LYS 44 HD1 LYS 44 3.238 -6.718 -9.634 304 HE2 LYS 44 HE2 LYS 44 2.781 -7.962 -7.614 305 HE3 LYS 44 HE1 LYS 44 1.166 -7.265 -7.509 306 HZ1 LYS 44 HZ1 LYS 44 2.136 -9.027 -9.693 307 HZ2 LYS 44 HZ2 LYS 44 0.574 -8.394 -9.547 308 HZ3 LYS 44 HZ3 LYS 44 1.143 -9.510 -8.411 309 H VAL 45 HN VAL 45 3.022 -2.589 -5.344 310 HA VAL 45 HA VAL 45 2.127 -4.087 -2.999 311 HB VAL 45 HB VAL 45 3.042 -1.901 -2.522 312 HG11 VAL 45 HG11 VAL 45 2.669 -0.824 -4.670 313 HG12 VAL 45 HG12 VAL 45 2.015 0.157 -3.359 314 HG13 VAL 45 HG13 VAL 45 0.931 -0.796 -4.372 315 HG21 VAL 45 HG21 VAL 45 0.042 -1.865 -2.222 316 HG22 VAL 45 HG22 VAL 45 1.189 -0.895 -1.296 317 HG23 VAL 45 HG23 VAL 45 1.183 -2.651 -1.130 318 H THR 46 HN THR 46 0.142 -4.897 -2.834 319 HA THR 46 HA THR 46 -2.012 -3.750 -4.449 320 HB THR 46 HB THR 46 -1.009 -5.752 -5.644 321 HG1 THR 46 HG1 THR 46 -3.024 -5.372 -6.310 322 HG21 THR 46 HG21 THR 46 -0.526 -7.132 -3.681 323 HG22 THR 46 HG22 THR 46 -1.586 -7.980 -4.808 324 HG23 THR 46 HG23 THR 46 -2.252 -7.260 -3.342 325 H CYS 47 HN CYS 47 -4.162 -4.900 -3.707 326 HA CYS 47 HA CYS 47 -4.040 -5.099 -0.785 327 HB2 CYS 47 HB2 CYS 47 -5.581 -3.455 -1.176 328 HB3 CYS 47 HB1 CYS 47 -6.156 -4.171 -2.675 329 HG CYS 47 HG CYS 47 -7.554 -6.240 -1.269 330 H SER 48 HN SER 48 -5.226 -6.705 0.271 331 HA SER 48 HA SER 48 -4.928 -9.268 -0.947 332 HB2 SER 48 HB2 SER 48 -6.010 -10.034 1.241 333 HB3 SER 48 HB1 SER 48 -4.489 -9.158 1.380 334 HG SER 48 HG SER 48 -5.632 -7.310 1.936 335 H LYS 49 HN LYS 49 -6.740 -10.911 -0.887 336 HA LYS 49 HA LYS 49 -8.990 -9.948 -2.344 337 HB2 LYS 49 HB2 LYS 49 -7.958 -12.243 -2.559 338 HB3 LYS 49 HB1 LYS 49 -8.669 -12.637 -1.000 339 HG2 LYS 49 HG2 LYS 49 -10.888 -12.327 -1.885 340 HG3 LYS 49 HG1 LYS 49 -10.230 -11.804 -3.436 341 HD2 LYS 49 HD2 LYS 49 -9.173 -14.015 -3.703 342 HD3 LYS 49 HD1 LYS 49 -9.902 -14.529 -2.181 343 HE2 LYS 49 HE2 LYS 49 -12.124 -14.204 -3.114 344 HE3 LYS 49 HE1 LYS 49 -11.424 -13.615 -4.620 345 HZ1 LYS 49 HZ1 LYS 49 -11.116 -16.349 -3.507 346 HZ2 LYS 49 HZ2 LYS 49 -10.393 -15.793 -4.929 347 HZ3 LYS 49 HZ3 LYS 49 -12.074 -15.915 -4.828 348 H ASP 50 HN ASP 50 -8.294 -10.723 0.971 349 HA ASP 50 HA ASP 50 -10.982 -10.517 1.918 350 HB2 ASP 50 HB2 ASP 50 -8.326 -10.383 3.354 351 HB3 ASP 50 HB1 ASP 50 -9.882 -10.318 4.175 352 H GLY 51 HN GLY 51 -8.462 -8.314 1.155 353 HA2 GLY 51 HA2 GLY 51 -8.562 -6.017 0.940 354 HA3 GLY 51 HA1 GLY 51 -10.190 -6.060 1.598 355 H LYS 52 HN LYS 52 -8.593 -7.764 3.774 356 HA LYS 52 HA LYS 52 -8.751 -5.649 5.665 357 HB2 LYS 52 HB2 LYS 52 -9.342 -7.976 6.212 358 HB3 LYS 52 HB1 LYS 52 -7.661 -8.444 6.002 359 HG2 LYS 52 HG2 LYS 52 -7.008 -7.019 7.857 360 HG3 LYS 52 HG1 LYS 52 -8.681 -6.494 8.058 361 HD2 LYS 52 HD2 LYS 52 -9.352 -8.757 8.601 362 HD3 LYS 52 HD1 LYS 52 -7.709 -9.336 8.318 363 HE2 LYS 52 HE2 LYS 52 -6.904 -7.915 10.148 364 HE3 LYS 52 HE1 LYS 52 -8.553 -7.363 10.438 365 HZ1 LYS 52 HZ1 LYS 52 -9.171 -9.654 10.945 366 HZ2 LYS 52 HZ2 LYS 52 -7.953 -9.104 11.977 367 HZ3 LYS 52 HZ3 LYS 52 -7.574 -10.154 10.707 368 H MET 53 HN MET 53 -6.187 -6.963 3.753 369 HA MET 53 HA MET 53 -4.288 -5.312 5.247 370 HB2 MET 53 HB2 MET 53 -2.642 -6.995 5.413 371 HB3 MET 53 HB1 MET 53 -4.134 -7.755 5.941 372 HG2 MET 53 HG2 MET 53 -4.367 -8.774 3.707 373 HG3 MET 53 HG1 MET 53 -2.831 -8.055 3.249 374 HE1 MET 53 HE1 MET 53 -3.748 -9.603 6.783 375 HE2 MET 53 HE2 MET 53 -3.296 -11.285 6.513 376 HE3 MET 53 HE3 MET 53 -4.638 -10.579 5.617 377 H LEU 54 HN LEU 54 -2.390 -4.756 4.096 378 HA LEU 54 HA LEU 54 -2.863 -4.586 1.205 379 HB2 LEU 54 HB2 LEU 54 -2.510 -2.531 2.659 380 HB3 LEU 54 HB1 LEU 54 -0.861 -3.074 2.880 381 HG LEU 54 HG LEU 54 -0.571 -2.946 0.386 382 HD11 LEU 54 HD11 LEU 54 -2.915 -3.055 -0.271 383 HD12 LEU 54 HD12 LEU 54 -2.172 -1.570 -0.865 384 HD13 LEU 54 HD13 LEU 54 -3.228 -1.523 0.544 385 HD21 LEU 54 HD21 LEU 54 -1.326 -0.380 1.775 386 HD22 LEU 54 HD22 LEU 54 -0.249 -0.551 0.390 387 HD23 LEU 54 HD23 LEU 54 0.216 -1.216 1.954 388 H GLU 55 HN GLU 55 -1.908 -6.250 0.185 389 HA GLU 55 HA GLU 55 0.518 -7.392 1.352 390 HB2 GLU 55 HB2 GLU 55 -1.241 -8.520 -0.826 391 HB3 GLU 55 HB1 GLU 55 0.088 -9.346 -0.027 392 HG2 GLU 55 HG2 GLU 55 -1.234 -9.028 2.135 393 HG3 GLU 55 HG1 GLU 55 -2.585 -8.592 1.090 394 H TRP 56 HN TRP 56 2.430 -7.344 0.350 395 HA TRP 56 HA TRP 56 2.451 -6.297 -2.385 396 HB2 TRP 56 HB2 TRP 56 4.732 -5.262 -1.644 397 HB3 TRP 56 HB1 TRP 56 3.225 -4.434 -1.298 398 HD1 TRP 56 HD1 TRP 56 5.254 -7.120 0.664 399 HE1 TRP 56 HE1 TRP 56 5.496 -6.283 3.086 400 HE3 TRP 56 HE3 TRP 56 2.732 -2.706 0.252 401 HZ2 TRP 56 HZ2 TRP 56 4.709 -4.062 4.618 402 HZ3 TRP 56 HZ3 TRP 56 2.522 -1.288 2.241 403 HH2 TRP 56 HH2 TRP 56 3.486 -1.947 4.381 404 H TYR 57 HN TYR 57 3.641 -7.290 -3.814 405 HA TYR 57 HA TYR 57 5.213 -9.606 -2.891 406 HB2 TYR 57 HB2 TYR 57 3.729 -9.237 -5.508 407 HB3 TYR 57 HB1 TYR 57 4.669 -10.660 -5.058 408 HD1 TYR 57 HD1 TYR 57 1.587 -8.752 -4.393 409 HD2 TYR 57 HD2 TYR 57 3.766 -12.307 -3.555 410 HE1 TYR 57 HE1 TYR 57 -0.420 -9.735 -3.369 411 HE2 TYR 57 HE2 TYR 57 1.765 -13.299 -2.530 412 HH TYR 57 HH TYR 57 -1.352 -11.884 -2.833 413 H LYS 58 HN LYS 58 7.236 -9.799 -3.557 414 HA LYS 58 HA LYS 58 8.971 -7.928 -4.168 415 HB2 LYS 58 HB2 LYS 58 10.393 -9.587 -5.306 416 HB3 LYS 58 HB1 LYS 58 9.651 -10.227 -3.848 417 HG2 LYS 58 HG2 LYS 58 8.365 -10.692 -6.504 418 HG3 LYS 58 HG1 LYS 58 9.744 -11.669 -6.005 419 HD2 LYS 58 HD2 LYS 58 8.576 -12.627 -4.225 420 HD3 LYS 58 HD1 LYS 58 7.368 -11.339 -4.204 421 HE2 LYS 58 HE2 LYS 58 6.302 -12.142 -6.119 422 HE3 LYS 58 HE1 LYS 58 7.683 -13.142 -6.572 423 HZ1 LYS 58 HZ1 LYS 58 7.207 -14.620 -4.767 424 HZ2 LYS 58 HZ2 LYS 58 5.800 -14.417 -5.680 425 HZ3 LYS 58 HZ3 LYS 58 5.962 -13.624 -4.199 426 H GLY 59 HN GLY 59 9.002 -6.312 -5.544 427 HA2 GLY 59 HA2 GLY 59 7.856 -6.718 -8.231 428 HA3 GLY 59 HA1 GLY 59 7.854 -5.187 -7.367 429 H LYS 60 HN LYS 60 10.708 -6.979 -7.055 430 HA LYS 60 HA LYS 60 12.115 -5.085 -8.729 431 HB2 LYS 60 HB2 LYS 60 13.656 -7.304 -7.513 432 HB3 LYS 60 HB1 LYS 60 14.036 -5.597 -7.611 433 HG2 LYS 60 HG2 LYS 60 13.768 -5.815 -5.369 434 HG3 LYS 60 HG1 LYS 60 12.117 -5.402 -5.835 435 HD2 LYS 60 HD2 LYS 60 11.408 -7.663 -5.668 436 HD3 LYS 60 HD1 LYS 60 13.064 -8.252 -5.584 437 HE2 LYS 60 HE2 LYS 60 11.852 -6.466 -3.490 438 HE3 LYS 60 HE1 LYS 60 11.752 -8.223 -3.418 439 HZ1 LYS 60 HZ1 LYS 60 14.194 -8.296 -3.462 440 HZ2 LYS 60 HZ2 LYS 60 13.600 -7.459 -2.121 441 HZ3 LYS 60 HZ3 LYS 60 14.247 -6.600 -3.426 442 H ASN 61 HN ASN 61 12.816 -8.509 -8.302 443 HA ASN 61 HA ASN 61 11.922 -9.436 -10.777 444 HB2 ASN 61 HB2 ASN 61 14.264 -9.894 -11.769 445 HB3 ASN 61 HB1 ASN 61 13.578 -8.291 -11.972 446 HD21 ASN 61 HD21 ASN 61 14.565 -6.558 -11.031 447 HD22 ASN 61 HD22 ASN 61 16.095 -6.650 -10.231 448 H ASP 62 HN ASP 62 15.110 -10.353 -9.589 449 HA ASP 62 HA ASP 62 13.896 -12.774 -8.418 450 HB2 ASP 62 HB2 ASP 62 15.025 -13.218 -10.587 451 HB3 ASP 62 HB1 ASP 62 16.523 -12.589 -9.918 452 H SER 63 HN SER 63 14.772 -10.161 -7.279 453 HA SER 63 HA SER 63 16.834 -11.090 -5.421 454 HB2 SER 63 HB2 SER 63 16.737 -8.651 -4.653 455 HB3 SER 63 HB1 SER 63 17.378 -8.945 -6.268 456 HG SER 63 HG SER 63 15.942 -7.369 -6.594 457 H ASP 64 HN ASP 64 14.244 -12.206 -5.364 458 HA ASP 64 HA ASP 64 13.056 -11.110 -2.926 459 HB2 ASP 64 HB2 ASP 64 11.150 -12.660 -3.474 460 HB3 ASP 64 HB1 ASP 64 11.433 -11.397 -4.661 461 H GLY 65 HN GLY 65 14.300 -11.866 -1.299 462 HA2 GLY 65 HA2 GLY 65 15.439 -14.480 -1.293 463 HA3 GLY 65 HA1 GLY 65 15.441 -13.343 0.043 464 H LYS 66 HN LYS 66 12.368 -13.293 -0.371 465 HA LYS 66 HA LYS 66 11.899 -15.540 1.446 466 HB2 LYS 66 HB2 LYS 66 11.137 -13.166 1.964 467 HB3 LYS 66 HB1 LYS 66 9.942 -13.369 0.689 468 HG2 LYS 66 HG2 LYS 66 8.839 -13.849 2.710 469 HG3 LYS 66 HG1 LYS 66 9.140 -15.407 1.936 470 HD2 LYS 66 HD2 LYS 66 11.314 -15.403 3.339 471 HD3 LYS 66 HD1 LYS 66 10.490 -14.182 4.309 472 HE2 LYS 66 HE2 LYS 66 8.600 -15.762 4.586 473 HE3 LYS 66 HE1 LYS 66 9.547 -16.976 3.725 474 HZ1 LYS 66 HZ1 LYS 66 10.303 -15.680 6.288 475 HZ2 LYS 66 HZ2 LYS 66 11.232 -16.825 5.459 476 HZ3 LYS 66 HZ3 LYS 66 9.733 -17.262 6.108 477 H LYS 67 HN LYS 67 11.343 -14.540 -1.786 478 HA LYS 67 HA LYS 67 10.135 -15.311 -3.539 479 HB2 LYS 67 HB2 LYS 67 10.346 -17.850 -1.925 480 HB3 LYS 67 HB1 LYS 67 9.583 -17.801 -3.508 481 HG2 LYS 67 HG2 LYS 67 12.442 -17.061 -2.906 482 HG3 LYS 67 HG1 LYS 67 11.892 -18.558 -3.662 483 HD2 LYS 67 HD2 LYS 67 10.971 -17.279 -5.527 484 HD3 LYS 67 HD1 LYS 67 11.495 -15.778 -4.768 485 HE2 LYS 67 HE2 LYS 67 13.839 -16.639 -4.887 486 HE3 LYS 67 HE1 LYS 67 13.230 -17.990 -5.842 487 HZ1 LYS 67 HZ1 LYS 67 12.436 -16.441 -7.500 488 HZ2 LYS 67 HZ2 LYS 67 14.087 -16.188 -7.236 489 HZ3 LYS 67 HZ3 LYS 67 12.952 -15.121 -6.572 490 H LYS 68 HN LYS 68 8.856 -14.261 -1.098 491 HA LYS 68 HA LYS 68 6.081 -14.961 -1.677 492 HB2 LYS 68 HB2 LYS 68 7.361 -15.043 1.075 493 HB3 LYS 68 HB1 LYS 68 5.634 -15.091 0.800 494 HG2 LYS 68 HG2 LYS 68 7.560 -17.146 -0.245 495 HG3 LYS 68 HG1 LYS 68 6.655 -17.299 1.261 496 HD2 LYS 68 HD2 LYS 68 4.556 -17.170 0.027 497 HD3 LYS 68 HD1 LYS 68 5.447 -16.971 -1.485 498 HE2 LYS 68 HE2 LYS 68 5.621 -19.368 0.335 499 HE3 LYS 68 HE1 LYS 68 4.658 -19.281 -1.139 500 HZ1 LYS 68 HZ1 LYS 68 7.612 -19.000 -0.999 501 HZ2 LYS 68 HZ2 LYS 68 6.680 -18.947 -2.407 502 HZ3 LYS 68 HZ3 LYS 68 6.781 -20.376 -1.516 503 HA PRO 69 HA PRO 69 5.350 -10.554 -0.700 504 HB2 PRO 69 HB2 PRO 69 4.067 -11.302 1.885 505 HB3 PRO 69 HB1 PRO 69 3.506 -10.196 0.629 506 HG2 PRO 69 HG2 PRO 69 2.433 -12.618 0.887 507 HG3 PRO 69 HG1 PRO 69 2.703 -11.897 -0.709 508 HD2 PRO 69 HD2 PRO 69 4.201 -14.057 0.673 509 HD3 PRO 69 HD1 PRO 69 3.898 -13.822 -1.056 510 H ILE 70 HN ILE 70 6.549 -9.023 0.307 511 HA ILE 70 HA ILE 70 8.797 -9.981 1.784 512 HB ILE 70 HB ILE 70 9.579 -7.605 1.752 513 HG12 ILE 70 HG12 ILE 70 7.204 -7.190 -0.064 514 HG13 ILE 70 HG11 ILE 70 7.304 -6.574 1.588 515 HG21 ILE 70 HG21 ILE 70 10.062 -7.642 -0.659 516 HG22 ILE 70 HG22 ILE 70 8.837 -8.894 -0.872 517 HG23 ILE 70 HG23 ILE 70 10.278 -9.226 0.088 518 HD11 ILE 70 HD11 ILE 70 9.130 -5.846 -0.691 519 HD12 ILE 70 HD12 ILE 70 9.256 -5.249 0.963 520 HD13 ILE 70 HD13 ILE 70 7.845 -4.846 -0.013 521 H GLY 71 HN GLY 71 5.921 -9.627 2.959 522 HA2 GLY 71 HA2 GLY 71 5.562 -9.713 5.340 523 HA3 GLY 71 HA1 GLY 71 6.883 -8.570 5.535 524 H SER 72 HN SER 72 3.728 -8.894 4.050 525 HA SER 72 HA SER 72 3.142 -6.152 3.792 526 HB2 SER 72 HB2 SER 72 1.147 -8.401 4.057 527 HB3 SER 72 HB1 SER 72 0.975 -6.897 3.152 528 HG SER 72 HG SER 72 1.830 -9.193 2.241 529 H PHE 73 HN PHE 73 1.021 -5.293 4.853 530 HA PHE 73 HA PHE 73 0.887 -6.019 7.690 531 HB2 PHE 73 HB2 PHE 73 1.255 -3.857 8.475 532 HB3 PHE 73 HB1 PHE 73 2.377 -3.925 7.120 533 HD1 PHE 73 HD1 PHE 73 1.808 -2.770 4.997 534 HD2 PHE 73 HD2 PHE 73 -0.582 -2.401 8.485 535 HE1 PHE 73 HE1 PHE 73 0.711 -0.790 4.032 536 HE2 PHE 73 HE2 PHE 73 -1.697 -0.442 7.536 537 HZ PHE 73 HZ PHE 73 -1.045 0.379 5.300 538 HA PRO 74 HA PRO 74 -3.451 -5.576 6.899 539 HB2 PRO 74 HB2 PRO 74 -4.185 -5.092 9.582 540 HB3 PRO 74 HB1 PRO 74 -4.130 -6.641 8.751 541 HG2 PRO 74 HG2 PRO 74 -2.456 -5.812 10.845 542 HG3 PRO 74 HG1 PRO 74 -2.242 -7.239 9.822 543 HD2 PRO 74 HD2 PRO 74 -0.885 -4.610 9.713 544 HD3 PRO 74 HD1 PRO 74 -0.318 -6.207 9.187 545 H LEU 75 HN LEU 75 -4.754 -3.985 6.247 546 HA LEU 75 HA LEU 75 -3.921 -1.293 6.386 547 HB2 LEU 75 HB2 LEU 75 -6.491 -2.557 5.456 548 HB3 LEU 75 HB1 LEU 75 -6.158 -0.844 5.302 549 HG LEU 75 HG LEU 75 -4.448 -2.996 4.058 550 HD11 LEU 75 HD11 LEU 75 -5.523 -2.390 1.947 551 HD12 LEU 75 HD12 LEU 75 -6.619 -1.314 2.814 552 HD13 LEU 75 HD13 LEU 75 -6.685 -3.055 3.094 553 HD21 LEU 75 HD21 LEU 75 -3.706 -1.037 2.667 554 HD22 LEU 75 HD22 LEU 75 -3.204 -0.999 4.355 555 HD23 LEU 75 HD23 LEU 75 -4.553 0.000 3.814 556 H ASN 76 HN ASN 76 -5.973 -3.155 8.402 557 HA ASN 76 HA ASN 76 -7.508 -1.053 9.530 558 HB2 ASN 76 HB2 ASN 76 -7.853 -2.746 11.403 559 HB3 ASN 76 HB1 ASN 76 -8.346 -3.257 9.791 560 HD21 ASN 76 HD21 ASN 76 -5.845 -3.555 12.234 561 HD22 ASN 76 HD22 ASN 76 -5.210 -5.059 11.664 562 H LYS 77 HN LYS 77 -4.232 -1.944 9.898 563 HA LYS 77 HA LYS 77 -4.038 -0.978 12.633 564 HB2 LYS 77 HB2 LYS 77 -1.972 -2.098 10.738 565 HB3 LYS 77 HB1 LYS 77 -1.609 -1.561 12.372 566 HG2 LYS 77 HG2 LYS 77 -3.634 -3.698 11.756 567 HG3 LYS 77 HG1 LYS 77 -1.929 -4.035 12.063 568 HD2 LYS 77 HD2 LYS 77 -3.603 -2.464 14.004 569 HD3 LYS 77 HD1 LYS 77 -3.559 -4.228 14.033 570 HE2 LYS 77 HE2 LYS 77 -1.166 -4.199 14.372 571 HE3 LYS 77 HE1 LYS 77 -1.134 -2.445 14.222 572 HZ1 LYS 77 HZ1 LYS 77 -2.386 -2.243 16.234 573 HZ2 LYS 77 HZ2 LYS 77 -1.051 -3.239 16.533 574 HZ3 LYS 77 HZ3 LYS 77 -2.588 -3.917 16.346 575 H ILE 78 HN ILE 78 -3.973 0.410 9.583 576 HA ILE 78 HA ILE 78 -1.837 2.224 9.740 577 HB ILE 78 HB ILE 78 -4.494 2.663 8.363 578 HG12 ILE 78 HG12 ILE 78 -1.921 1.500 7.283 579 HG13 ILE 78 HG11 ILE 78 -3.358 0.568 7.693 580 HG21 ILE 78 HG21 ILE 78 -1.788 3.932 7.933 581 HG22 ILE 78 HG22 ILE 78 -3.232 4.720 8.580 582 HG23 ILE 78 HG23 ILE 78 -3.201 4.175 6.903 583 HD11 ILE 78 HD11 ILE 78 -4.618 1.711 5.969 584 HD12 ILE 78 HD12 ILE 78 -3.169 0.958 5.300 585 HD13 ILE 78 HD13 ILE 78 -3.208 2.700 5.579 586 H THR 79 HN THR 79 -1.549 4.133 10.759 587 HA THR 79 HA THR 79 -3.740 5.083 12.444 588 HB THR 79 HB THR 79 -2.050 6.418 13.626 589 HG1 THR 79 HG1 THR 79 0.081 6.354 13.029 590 HG21 THR 79 HG21 THR 79 -1.256 3.521 13.281 591 HG22 THR 79 HG22 THR 79 -2.478 4.139 14.395 592 HG23 THR 79 HG23 THR 79 -0.782 4.563 14.623 593 H SER 80 HN SER 80 -1.518 6.083 9.896 594 HA SER 80 HA SER 80 -3.382 8.053 8.943 595 HB2 SER 80 HB2 SER 80 -0.778 8.914 10.204 596 HB3 SER 80 HB1 SER 80 -1.686 9.936 9.091 597 HG SER 80 HG SER 80 -3.153 8.850 11.174 598 H ILE 81 HN ILE 81 -3.035 8.590 6.805 599 HA ILE 81 HA ILE 81 -0.587 7.550 5.533 600 HB ILE 81 HB ILE 81 -2.291 6.137 4.736 601 HG12 ILE 81 HG12 ILE 81 -2.025 8.343 2.673 602 HG13 ILE 81 HG11 ILE 81 -0.892 7.018 2.899 603 HG21 ILE 81 HG21 ILE 81 -4.028 8.562 4.323 604 HG22 ILE 81 HG22 ILE 81 -4.217 7.328 5.570 605 HG23 ILE 81 HG23 ILE 81 -4.457 6.911 3.873 606 HD11 ILE 81 HD11 ILE 81 -2.272 6.559 1.004 607 HD12 ILE 81 HD12 ILE 81 -3.737 6.813 1.955 608 HD13 ILE 81 HD13 ILE 81 -2.690 5.437 2.299 609 H ARG 82 HN ARG 82 0.659 9.266 5.074 610 HA ARG 82 HA ARG 82 -0.608 11.545 3.727 611 HB2 ARG 82 HB2 ARG 82 1.307 11.659 6.045 612 HB3 ARG 82 HB1 ARG 82 1.128 13.027 4.943 613 HG2 ARG 82 HG2 ARG 82 -0.905 11.834 6.817 614 HG3 ARG 82 HG1 ARG 82 -0.297 13.492 6.748 615 HD2 ARG 82 HD2 ARG 82 -1.360 13.752 4.533 616 HD3 ARG 82 HD1 ARG 82 -2.016 12.124 4.688 617 HE ARG 82 HE ARG 82 -2.722 14.191 6.655 618 HH11 ARG 82 HH11 ARG 82 -3.609 11.794 4.264 619 HH12 ARG 82 HH12 ARG 82 -5.317 11.960 4.525 620 HH21 ARG 82 HH21 ARG 82 -4.989 14.399 7.032 621 HH22 ARG 82 HH22 ARG 82 -6.100 13.441 6.103 622 H THR 83 HN THR 83 0.765 12.810 2.430 623 HA THR 83 HA THR 83 2.775 11.307 1.041 624 HB THR 83 HB THR 83 2.324 14.267 0.754 625 HG1 THR 83 HG1 THR 83 0.447 13.932 -0.275 626 HG21 THR 83 HG21 THR 83 4.112 13.205 -0.536 627 HG22 THR 83 HG22 THR 83 2.823 13.789 -1.589 628 HG23 THR 83 HG23 THR 83 2.948 12.068 -1.218 629 H LYS 84 HN LYS 84 5.021 11.654 1.160 630 HA LYS 84 HA LYS 84 5.952 12.608 3.648 631 HB2 LYS 84 HB2 LYS 84 7.149 10.933 2.199 632 HB3 LYS 84 HB1 LYS 84 7.676 12.300 1.219 633 HG2 LYS 84 HG2 LYS 84 9.145 13.014 2.752 634 HG3 LYS 84 HG1 LYS 84 8.080 12.622 4.107 635 HD2 LYS 84 HD2 LYS 84 9.814 11.113 4.375 636 HD3 LYS 84 HD1 LYS 84 8.615 10.177 3.482 637 HE2 LYS 84 HE2 LYS 84 10.604 9.732 2.350 638 HE3 LYS 84 HE1 LYS 84 9.841 10.996 1.384 639 HZ1 LYS 84 HZ1 LYS 84 12.045 11.329 3.335 640 HZ2 LYS 84 HZ2 LYS 84 11.223 12.627 2.629 641 HZ3 LYS 84 HZ3 LYS 84 12.121 11.561 1.663 642 H VAL 85 HN VAL 85 5.989 14.579 4.256 643 HA VAL 85 HA VAL 85 5.247 16.709 2.713 644 HB VAL 85 HB VAL 85 5.666 17.950 4.714 645 HG11 VAL 85 HG11 VAL 85 4.657 15.215 5.341 646 HG12 VAL 85 HG12 VAL 85 3.707 16.546 4.685 647 HG13 VAL 85 HG13 VAL 85 4.373 16.657 6.313 648 HG21 VAL 85 HG21 VAL 85 6.796 16.918 6.656 649 HG22 VAL 85 HG22 VAL 85 7.876 17.149 5.278 650 HG23 VAL 85 HG23 VAL 85 7.214 15.547 5.623 651 H ASP 86 HN ASP 86 8.415 15.374 3.198 652 HA ASP 86 HA ASP 86 9.661 17.839 2.209 653 HB2 ASP 86 HB2 ASP 86 11.655 17.197 3.194 654 HB3 ASP 86 HB1 ASP 86 10.479 16.537 4.316 655 H ASN 87 HN ASN 87 8.332 15.155 0.978 656 HA ASN 87 HA ASN 87 9.831 15.225 -1.476 657 HB2 ASN 87 HB2 ASN 87 11.173 13.710 0.070 658 HB3 ASN 87 HB1 ASN 87 9.802 12.615 0.045 659 HD21 ASN 87 HD21 ASN 87 12.546 12.265 -0.878 660 HD22 ASN 87 HD22 ASN 87 12.429 11.812 -2.543 661 H LEU 88 HN LEU 88 7.945 15.555 -2.578 662 HA LEU 88 HA LEU 88 5.514 14.310 -1.790 663 HB2 LEU 88 HB2 LEU 88 6.248 15.983 -4.181 664 HB3 LEU 88 HB1 LEU 88 4.627 15.374 -3.912 665 HG LEU 88 HG LEU 88 6.123 17.244 -2.070 666 HD11 LEU 88 HD11 LEU 88 4.478 18.903 -2.815 667 HD12 LEU 88 HD12 LEU 88 3.834 17.737 -3.970 668 HD13 LEU 88 HD13 LEU 88 5.485 18.331 -4.145 669 HD21 LEU 88 HD21 LEU 88 3.308 16.166 -1.974 670 HD22 LEU 88 HD22 LEU 88 3.931 17.461 -0.952 671 HD23 LEU 88 HD23 LEU 88 4.605 15.836 -0.825 672 H LYS 89 HN LYS 89 8.054 13.216 -3.732 673 HA LYS 89 HA LYS 89 6.409 11.486 -5.359 674 HB2 LYS 89 HB2 LYS 89 9.398 11.601 -4.930 675 HB3 LYS 89 HB1 LYS 89 8.612 10.436 -5.985 676 HG2 LYS 89 HG2 LYS 89 9.281 12.090 -7.445 677 HG3 LYS 89 HG1 LYS 89 7.592 12.488 -7.140 678 HD2 LYS 89 HD2 LYS 89 8.318 14.135 -5.452 679 HD3 LYS 89 HD1 LYS 89 9.999 13.780 -5.867 680 HE2 LYS 89 HE2 LYS 89 9.530 14.445 -8.192 681 HE3 LYS 89 HE1 LYS 89 7.886 14.862 -7.718 682 HZ1 LYS 89 HZ1 LYS 89 10.370 16.134 -6.707 683 HZ2 LYS 89 HZ2 LYS 89 8.807 16.505 -6.178 684 HZ3 LYS 89 HZ3 LYS 89 9.258 16.824 -7.775 685 H SER 90 HN SER 90 7.537 11.510 -2.201 686 HA SER 90 HA SER 90 7.252 8.604 -1.963 687 HB2 SER 90 HB2 SER 90 8.407 10.469 0.098 688 HB3 SER 90 HB1 SER 90 8.568 8.722 0.004 689 HG SER 90 HG SER 90 9.460 10.082 -2.217 690 H LEU 91 HN LEU 91 6.058 7.819 -0.175 691 HA LEU 91 HA LEU 91 4.059 9.681 0.915 692 HB2 LEU 91 HB2 LEU 91 3.108 8.359 -0.945 693 HB3 LEU 91 HB1 LEU 91 3.584 6.886 -0.129 694 HG LEU 91 HG LEU 91 2.061 7.906 1.799 695 HD11 LEU 91 HD11 LEU 91 1.579 9.958 0.542 696 HD12 LEU 91 HD12 LEU 91 0.124 9.028 0.893 697 HD13 LEU 91 HD13 LEU 91 0.828 8.990 -0.724 698 HD21 LEU 91 HD21 LEU 91 1.145 6.408 -0.645 699 HD22 LEU 91 HD22 LEU 91 0.179 6.598 0.817 700 HD23 LEU 91 HD23 LEU 91 1.715 5.735 0.884 701 H GLU 92 HN GLU 92 4.306 9.694 3.064 702 HA GLU 92 HA GLU 92 5.546 7.391 4.361 703 HB2 GLU 92 HB2 GLU 92 6.409 9.699 4.803 704 HB3 GLU 92 HB1 GLU 92 4.865 10.092 5.545 705 HG2 GLU 92 HG2 GLU 92 5.288 8.156 7.119 706 HG3 GLU 92 HG1 GLU 92 6.930 8.128 6.484 707 H ILE 93 HN ILE 93 4.206 5.873 5.081 708 HA ILE 93 HA ILE 93 1.590 6.749 6.099 709 HB ILE 93 HB ILE 93 2.423 4.145 4.848 710 HG12 ILE 93 HG12 ILE 93 0.321 6.220 4.192 711 HG13 ILE 93 HG11 ILE 93 1.810 5.912 3.298 712 HG21 ILE 93 HG21 ILE 93 0.143 3.327 5.329 713 HG22 ILE 93 HG22 ILE 93 -0.142 4.759 6.318 714 HG23 ILE 93 HG23 ILE 93 1.089 3.588 6.797 715 HD11 ILE 93 HD11 ILE 93 -0.255 4.988 2.276 716 HD12 ILE 93 HD12 ILE 93 -0.362 3.871 3.640 717 HD13 ILE 93 HD13 ILE 93 1.029 3.814 2.557 718 H SER 94 HN SER 94 1.444 6.794 8.157 719 HA SER 94 HA SER 94 3.199 5.197 9.823 720 HB2 SER 94 HB2 SER 94 1.100 7.233 10.616 721 HB3 SER 94 HB1 SER 94 2.363 6.564 11.651 722 HG SER 94 HG SER 94 3.898 7.526 10.206 723 H VAL 95 HN VAL 95 2.599 3.310 10.576 724 HA VAL 95 HA VAL 95 -0.259 2.793 10.968 725 HB VAL 95 HB VAL 95 0.002 1.621 8.988 726 HG11 VAL 95 HG11 VAL 95 2.781 0.881 9.870 727 HG12 VAL 95 HG12 VAL 95 2.313 1.987 8.571 728 HG13 VAL 95 HG13 VAL 95 1.991 0.257 8.419 729 HG21 VAL 95 HG21 VAL 95 0.833 -0.404 11.059 730 HG22 VAL 95 HG22 VAL 95 0.129 -0.764 9.483 731 HG23 VAL 95 HG23 VAL 95 -0.820 0.094 10.697 732 H SER 96 HN SER 96 -0.763 1.341 12.622 733 HA SER 96 HA SER 96 1.032 1.308 14.814 734 HB2 SER 96 HB2 SER 96 -1.504 1.287 14.938 735 HB3 SER 96 HB1 SER 96 -1.446 -0.399 14.421 736 HG SER 96 HG SER 96 -1.001 0.680 16.879 737 H SER 97 HN SER 97 2.790 0.106 14.814 738 HA SER 97 HA SER 97 2.842 -2.280 13.115 739 HB2 SER 97 HB2 SER 97 5.200 -1.393 12.503 740 HB3 SER 97 HB1 SER 97 3.791 -0.649 11.752 741 HG SER 97 HG SER 97 3.959 1.075 13.119 742 H VAL 98 HN VAL 98 4.484 -3.764 13.497 743 HA VAL 98 HA VAL 98 5.509 -3.813 16.245 744 HB VAL 98 HB VAL 98 6.041 -6.202 15.770 745 HG11 VAL 98 HG11 VAL 98 3.726 -7.021 15.751 746 HG12 VAL 98 HG12 VAL 98 3.175 -5.422 15.254 747 HG13 VAL 98 HG13 VAL 98 3.930 -5.642 16.832 748 HG21 VAL 98 HG21 VAL 98 4.606 -5.699 13.163 749 HG22 VAL 98 HG22 VAL 98 5.152 -7.267 13.756 750 HG23 VAL 98 HG23 VAL 98 6.330 -6.020 13.347 751 H HIS 99 HN HIS 99 7.783 -5.361 15.896 752 HA HIS 99 HA HIS 99 9.762 -3.587 15.466 753 HB2 HIS 99 HB2 HIS 99 10.063 -5.906 16.314 754 HB3 HIS 99 HB1 HIS 99 9.968 -6.492 14.656 755 HD1 HIS 99 HD1 HIS 99 12.246 -4.848 17.079 756 HD2 HIS 99 HD2 HIS 99 12.238 -5.895 13.058 757 HE1 HIS 99 HE1 HIS 99 14.633 -4.629 16.317 758 HE2 HIS 99 HE2 HIS 99 14.574 -5.129 13.848 759 H ILE 100 HN ILE 100 9.534 -2.174 13.820 760 HA ILE 100 HA ILE 100 10.743 -2.590 11.369 761 HB ILE 100 HB ILE 100 8.638 -3.989 10.950 762 HG12 ILE 100 HG12 ILE 100 9.171 -1.626 9.135 763 HG13 ILE 100 HG11 ILE 100 10.051 -3.150 9.129 764 HG21 ILE 100 HG21 ILE 100 7.350 -1.261 10.933 765 HG22 ILE 100 HG22 ILE 100 6.998 -2.586 12.045 766 HG23 ILE 100 HG23 ILE 100 6.599 -2.740 10.333 767 HD11 ILE 100 HD11 ILE 100 8.014 -4.318 8.452 768 HD12 ILE 100 HD12 ILE 100 8.464 -3.057 7.305 769 HD13 ILE 100 HD13 ILE 100 7.145 -2.783 8.442 770 H SER 101 HN SER 101 10.607 -0.635 10.047 771 HA SER 101 HA SER 101 10.021 1.703 11.650 772 HB2 SER 101 HB2 SER 101 12.162 1.556 10.405 773 HB3 SER 101 HB1 SER 101 11.264 1.503 8.892 774 HG SER 101 HG SER 101 12.090 3.633 10.179 775 H THR 102 HN THR 102 9.087 3.611 10.302 776 HA THR 102 HA THR 102 6.397 3.054 9.707 777 HB THR 102 HB THR 102 8.078 5.451 8.899 778 HG1 THR 102 HG1 THR 102 7.910 6.091 10.920 779 HG21 THR 102 HG21 THR 102 5.096 5.197 9.299 780 HG22 THR 102 HG22 THR 102 5.918 5.397 7.753 781 HG23 THR 102 HG23 THR 102 5.964 6.691 8.949 782 H TYR 103 HN TYR 103 5.308 3.051 7.672 783 HA TYR 103 HA TYR 103 6.930 1.736 5.659 784 HB2 TYR 103 HB2 TYR 103 5.026 0.472 6.052 785 HB3 TYR 103 HB1 TYR 103 4.007 1.887 6.277 786 HD1 TYR 103 HD1 TYR 103 2.358 2.096 4.718 787 HD2 TYR 103 HD2 TYR 103 6.104 0.498 3.469 788 HE1 TYR 103 HE1 TYR 103 1.499 1.888 2.427 789 HE2 TYR 103 HE2 TYR 103 5.243 0.294 1.173 790 HH TYR 103 HH TYR 103 3.034 0.082 0.046 791 H LEU 104 HN LEU 104 7.692 2.727 3.986 792 HA LEU 104 HA LEU 104 6.437 5.222 3.117 793 HB2 LEU 104 HB2 LEU 104 9.233 4.309 3.300 794 HB3 LEU 104 HB1 LEU 104 8.831 5.278 1.888 795 HG LEU 104 HG LEU 104 8.103 6.192 4.664 796 HD11 LEU 104 HD11 LEU 104 10.186 7.493 4.677 797 HD12 LEU 104 HD12 LEU 104 10.698 6.685 3.196 798 HD13 LEU 104 HD13 LEU 104 10.505 5.759 4.685 799 HD21 LEU 104 HD21 LEU 104 7.082 7.260 2.664 800 HD22 LEU 104 HD22 LEU 104 8.702 7.722 2.136 801 HD23 LEU 104 HD23 LEU 104 8.051 8.357 3.645 802 H PHE 105 HN PHE 105 5.257 5.075 1.454 803 HA PHE 105 HA PHE 105 5.766 3.110 -0.648 804 HB2 PHE 105 HB2 PHE 105 3.479 3.254 0.049 805 HB3 PHE 105 HB1 PHE 105 3.502 5.005 0.009 806 HD1 PHE 105 HD1 PHE 105 3.484 6.178 -2.182 807 HD2 PHE 105 HD2 PHE 105 2.909 1.978 -1.848 808 HE1 PHE 105 HE1 PHE 105 2.463 6.147 -4.409 809 HE2 PHE 105 HE2 PHE 105 1.890 1.943 -4.089 810 HZ PHE 105 HZ PHE 105 1.661 4.034 -5.371 811 H THR 106 HN THR 106 7.226 3.765 -2.149 812 HA THR 106 HA THR 106 7.427 6.664 -2.631 813 HB THR 106 HB THR 106 9.708 4.699 -2.817 814 HG1 THR 106 HG1 THR 106 8.913 4.893 -0.651 815 HG21 THR 106 HG21 THR 106 9.631 7.718 -2.688 816 HG22 THR 106 HG22 THR 106 9.994 6.748 -4.117 817 HG23 THR 106 HG23 THR 106 11.090 6.725 -2.737 818 H PHE 107 HN PHE 107 7.158 7.340 -4.625 819 HA PHE 107 HA PHE 107 7.433 5.397 -6.821 820 HB2 PHE 107 HB2 PHE 107 5.207 7.027 -6.093 821 HB3 PHE 107 HB1 PHE 107 5.836 7.616 -7.628 822 HD1 PHE 107 HD1 PHE 107 3.297 5.815 -6.533 823 HD2 PHE 107 HD2 PHE 107 6.728 5.239 -8.975 824 HE1 PHE 107 HE1 PHE 107 2.148 3.991 -7.717 825 HE2 PHE 107 HE2 PHE 107 5.585 3.423 -10.167 826 HZ PHE 107 HZ PHE 107 3.294 2.793 -9.539 827 H LYS 108 HN LYS 108 7.593 6.842 -8.990 828 HA LYS 108 HA LYS 108 10.051 8.298 -8.647 829 HB2 LYS 108 HB2 LYS 108 10.158 8.417 -11.065 830 HB3 LYS 108 HB1 LYS 108 9.775 6.780 -10.565 831 HG2 LYS 108 HG2 LYS 108 7.556 8.625 -11.301 832 HG3 LYS 108 HG1 LYS 108 8.548 7.934 -12.581 833 HD2 LYS 108 HD2 LYS 108 7.088 6.343 -10.479 834 HD3 LYS 108 HD1 LYS 108 6.492 6.650 -12.104 835 HE2 LYS 108 HE2 LYS 108 9.107 5.281 -11.514 836 HE3 LYS 108 HE1 LYS 108 7.594 4.419 -11.775 837 HZ1 LYS 108 HZ1 LYS 108 8.986 4.581 -13.781 838 HZ2 LYS 108 HZ2 LYS 108 8.832 6.264 -13.745 839 HZ3 LYS 108 HZ3 LYS 108 7.467 5.292 -13.985 840 H THR 109 HN THR 109 6.693 9.055 -9.085 841 HA THR 109 HA THR 109 7.341 11.913 -9.092 842 HB THR 109 HB THR 109 5.591 12.333 -10.796 843 HG1 THR 109 HG1 THR 109 5.138 10.270 -12.072 844 HG21 THR 109 HG21 THR 109 7.952 12.170 -11.456 845 HG22 THR 109 HG22 THR 109 6.875 11.586 -12.728 846 HG23 THR 109 HG23 THR 109 7.748 10.435 -11.714 847 H ARG 110 HN ARG 110 5.385 13.280 -8.582 848 HA ARG 110 HA ARG 110 3.918 12.198 -6.393 849 HB2 ARG 110 HB2 ARG 110 4.304 14.553 -6.357 850 HB3 ARG 110 HB1 ARG 110 3.590 14.763 -7.952 851 HG2 ARG 110 HG2 ARG 110 1.452 13.766 -6.773 852 HG3 ARG 110 HG1 ARG 110 2.263 14.345 -5.317 853 HD2 ARG 110 HD2 ARG 110 2.332 16.587 -6.186 854 HD3 ARG 110 HD1 ARG 110 1.701 16.037 -7.742 855 HE ARG 110 HE ARG 110 -0.036 15.401 -5.550 856 HH11 ARG 110 HH11 ARG 110 0.895 17.988 -7.729 857 HH12 ARG 110 HH12 ARG 110 -0.662 18.745 -7.684 858 HH21 ARG 110 HH21 ARG 110 -2.063 16.386 -5.492 859 HH22 ARG 110 HH22 ARG 110 -2.352 17.836 -6.404 860 H GLU 111 HN GLU 111 3.165 12.898 -9.763 861 HA GLU 111 HA GLU 111 0.419 12.606 -9.712 862 HB2 GLU 111 HB2 GLU 111 2.302 11.786 -11.931 863 HB3 GLU 111 HB1 GLU 111 0.579 12.080 -12.105 864 HG2 GLU 111 HG2 GLU 111 0.910 14.411 -11.478 865 HG3 GLU 111 HG1 GLU 111 2.638 14.119 -11.301 866 H GLU 112 HN GLU 112 2.917 10.173 -9.782 867 HA GLU 112 HA GLU 112 1.185 7.974 -10.300 868 HB2 GLU 112 HB2 GLU 112 4.026 8.207 -9.327 869 HB3 GLU 112 HB1 GLU 112 3.220 6.649 -9.505 870 HG2 GLU 112 HG2 GLU 112 3.709 8.673 -11.680 871 HG3 GLU 112 HG1 GLU 112 4.583 7.162 -11.439 872 H ARG 113 HN ARG 113 2.784 9.154 -7.306 873 HA ARG 113 HA ARG 113 1.524 7.120 -5.738 874 HB2 ARG 113 HB2 ARG 113 2.440 8.408 -3.764 875 HB3 ARG 113 HB1 ARG 113 3.613 7.794 -4.909 876 HG2 ARG 113 HG2 ARG 113 4.304 9.956 -4.234 877 HG3 ARG 113 HG1 ARG 113 3.755 10.084 -5.894 878 HD2 ARG 113 HD2 ARG 113 3.108 11.914 -4.216 879 HD3 ARG 113 HD1 ARG 113 1.869 11.283 -5.295 880 HE ARG 113 HE ARG 113 1.751 9.812 -2.936 881 HH11 ARG 113 HH11 ARG 113 1.421 13.144 -3.871 882 HH12 ARG 113 HH12 ARG 113 0.085 13.461 -2.817 883 HH21 ARG 113 HH21 ARG 113 -0.039 10.205 -1.540 884 HH22 ARG 113 HH22 ARG 113 -0.736 11.790 -1.475 885 H GLU 114 HN GLU 114 0.790 10.398 -6.512 886 HA GLU 114 HA GLU 114 -0.985 11.143 -4.535 887 HB2 GLU 114 HB2 GLU 114 -0.135 12.477 -6.522 888 HB3 GLU 114 HB1 GLU 114 -1.405 11.720 -7.461 889 HG2 GLU 114 HG2 GLU 114 -2.043 13.931 -6.705 890 HG3 GLU 114 HG1 GLU 114 -3.074 12.686 -6.022 891 H SER 115 HN SER 115 -1.752 9.498 -7.567 892 HA SER 115 HA SER 115 -4.473 9.143 -7.186 893 HB2 SER 115 HB2 SER 115 -3.373 8.699 -9.322 894 HB3 SER 115 HB1 SER 115 -2.516 7.330 -8.618 895 HG SER 115 HG SER 115 -5.157 7.551 -9.445 896 H TRP 116 HN TRP 116 -1.796 6.997 -6.252 897 HA TRP 116 HA TRP 116 -3.292 4.827 -5.394 898 HB2 TRP 116 HB2 TRP 116 -0.808 4.921 -5.747 899 HB3 TRP 116 HB1 TRP 116 -0.676 5.733 -4.190 900 HD1 TRP 116 HD1 TRP 116 -1.337 2.332 -5.752 901 HE1 TRP 116 HE1 TRP 116 -1.179 0.525 -3.934 902 HE3 TRP 116 HE3 TRP 116 -1.054 5.355 -1.625 903 HZ2 TRP 116 HZ2 TRP 116 -0.973 0.397 -1.130 904 HZ3 TRP 116 HZ3 TRP 116 -0.881 4.299 0.583 905 HH2 TRP 116 HH2 TRP 116 -0.841 1.872 0.829 906 H GLN 117 HN GLN 117 -1.901 7.430 -3.346 907 HA GLN 117 HA GLN 117 -2.977 6.687 -0.923 908 HB2 GLN 117 HB2 GLN 117 -1.487 8.447 -0.745 909 HB3 GLN 117 HB1 GLN 117 -2.192 9.323 -2.095 910 HG2 GLN 117 HG2 GLN 117 -4.135 9.882 -0.713 911 HG3 GLN 117 HG1 GLN 117 -3.405 9.029 0.648 912 HE21 GLN 117 HE21 GLN 117 -1.687 9.980 1.740 913 HE22 GLN 117 HE22 GLN 117 -1.257 11.642 1.516 914 H ASN 118 HN ASN 118 -4.476 8.724 -3.409 915 HA ASN 118 HA ASN 118 -6.775 9.418 -1.970 916 HB2 ASN 118 HB2 ASN 118 -6.084 9.303 -4.879 917 HB3 ASN 118 HB1 ASN 118 -7.753 9.597 -4.402 918 HD21 ASN 118 HD21 ASN 118 -4.458 10.792 -4.152 919 HD22 ASN 118 HD22 ASN 118 -4.889 12.434 -3.820 920 H ASN 119 HN ASN 119 -6.060 6.639 -3.995 921 HA ASN 119 HA ASN 119 -8.715 5.585 -3.906 922 HB2 ASN 119 HB2 ASN 119 -6.102 4.226 -4.595 923 HB3 ASN 119 HB1 ASN 119 -7.709 3.577 -4.908 924 HD21 ASN 119 HD21 ASN 119 -5.487 4.302 -6.705 925 HD22 ASN 119 HD22 ASN 119 -6.158 5.412 -7.843 926 H LEU 120 HN LEU 120 -5.657 4.737 -2.279 927 HA LEU 120 HA LEU 120 -6.742 2.584 -0.814 928 HB2 LEU 120 HB2 LEU 120 -4.296 3.007 -1.249 929 HB3 LEU 120 HB1 LEU 120 -4.359 4.258 -0.030 930 HG LEU 120 HG LEU 120 -3.466 1.890 0.601 931 HD11 LEU 120 HD11 LEU 120 -5.486 3.299 2.332 932 HD12 LEU 120 HD12 LEU 120 -3.773 3.696 2.199 933 HD13 LEU 120 HD13 LEU 120 -4.268 2.150 2.886 934 HD21 LEU 120 HD21 LEU 120 -6.434 1.443 0.863 935 HD22 LEU 120 HD22 LEU 120 -5.164 0.372 1.451 936 HD23 LEU 120 HD23 LEU 120 -5.366 0.630 -0.280 937 H GLU 121 HN GLU 121 -6.322 6.016 -0.008 938 HA GLU 121 HA GLU 121 -7.030 5.818 2.695 939 HB2 GLU 121 HB2 GLU 121 -6.005 7.824 1.728 940 HB3 GLU 121 HB1 GLU 121 -7.468 8.135 0.804 941 HG2 GLU 121 HG2 GLU 121 -8.719 8.525 2.816 942 HG3 GLU 121 HG1 GLU 121 -7.335 8.064 3.807 943 H SER 122 HN SER 122 -9.041 6.371 -0.174 944 HA SER 122 HA SER 122 -11.491 6.591 1.255 945 HB2 SER 122 HB2 SER 122 -11.097 5.713 -1.623 946 HB3 SER 122 HB1 SER 122 -12.551 6.421 -0.918 947 HG SER 122 HG SER 122 -10.086 7.641 -1.548 948 H PHE 123 HN PHE 123 -9.799 3.908 -0.312 949 HA PHE 123 HA PHE 123 -11.750 1.930 0.128 950 HB2 PHE 123 HB2 PHE 123 -9.892 1.615 -1.427 951 HB3 PHE 123 HB1 PHE 123 -8.739 1.694 -0.101 952 HD1 PHE 123 HD1 PHE 123 -11.951 -0.174 -0.416 953 HD2 PHE 123 HD2 PHE 123 -7.720 -0.366 0.003 954 HE1 PHE 123 HE1 PHE 123 -12.089 -2.613 -0.153 955 HE2 PHE 123 HE2 PHE 123 -7.855 -2.801 0.270 956 HZ PHE 123 HZ PHE 123 -10.037 -3.929 0.191 957 H ARG 124 HN ARG 124 -8.993 2.997 2.055 958 HA ARG 124 HA ARG 124 -9.356 1.284 4.248 959 HB2 ARG 124 HB2 ARG 124 -7.306 2.445 4.117 960 HB3 ARG 124 HB1 ARG 124 -8.100 3.999 3.921 961 HG2 ARG 124 HG2 ARG 124 -8.832 3.944 6.235 962 HG3 ARG 124 HG1 ARG 124 -8.099 2.349 6.438 963 HD2 ARG 124 HD2 ARG 124 -5.939 3.185 6.302 964 HD3 ARG 124 HD1 ARG 124 -6.456 4.664 5.497 965 HE ARG 124 HE ARG 124 -6.786 5.616 7.537 966 HH11 ARG 124 HH11 ARG 124 -6.659 2.137 8.002 967 HH12 ARG 124 HH12 ARG 124 -6.675 2.256 9.730 968 HH21 ARG 124 HH21 ARG 124 -6.790 5.752 9.797 969 HH22 ARG 124 HH22 ARG 124 -6.731 4.302 10.750 970 H LYS 125 HN LYS 125 -10.748 4.443 3.470 971 HA LYS 125 HA LYS 125 -12.132 4.788 5.896 972 HB2 LYS 125 HB2 LYS 125 -12.672 5.875 3.137 973 HB3 LYS 125 HB1 LYS 125 -13.635 6.308 4.544 974 HG2 LYS 125 HG2 LYS 125 -11.689 7.264 5.617 975 HG3 LYS 125 HG1 LYS 125 -10.674 6.769 4.260 976 HD2 LYS 125 HD2 LYS 125 -11.884 8.230 2.767 977 HD3 LYS 125 HD1 LYS 125 -13.026 8.645 4.045 978 HE2 LYS 125 HE2 LYS 125 -10.069 9.220 4.149 979 HE3 LYS 125 HE1 LYS 125 -11.288 10.380 3.627 980 HZ1 LYS 125 HZ1 LYS 125 -10.677 10.685 5.949 981 HZ2 LYS 125 HZ2 LYS 125 -11.167 9.109 6.308 982 HZ3 LYS 125 HZ3 LYS 125 -12.303 10.253 5.803 983 H ILE 126 HN ILE 126 -12.910 2.950 3.009 984 HA ILE 126 HA ILE 126 -15.637 2.488 3.602 985 HB ILE 126 HB ILE 126 -13.704 0.750 2.051 986 HG12 ILE 126 HG12 ILE 126 -15.749 2.715 1.013 987 HG13 ILE 126 HG11 ILE 126 -14.047 3.113 1.234 988 HG21 ILE 126 HG21 ILE 126 -15.671 -0.510 2.760 989 HG22 ILE 126 HG22 ILE 126 -15.695 -0.232 1.018 990 HG23 ILE 126 HG23 ILE 126 -16.722 0.732 2.080 991 HD11 ILE 126 HD11 ILE 126 -13.479 1.306 -0.350 992 HD12 ILE 126 HD12 ILE 126 -14.454 2.591 -1.061 993 HD13 ILE 126 HD13 ILE 126 -15.201 1.054 -0.623 994 H MET 127 HN MET 127 -12.689 1.104 4.833 995 HA MET 127 HA MET 127 -14.187 -1.120 6.036 996 HB2 MET 127 HB2 MET 127 -11.213 -0.760 5.653 997 HB3 MET 127 HB1 MET 127 -11.979 -2.170 6.370 998 HG2 MET 127 HG2 MET 127 -13.084 -2.680 4.290 999 HG3 MET 127 HG1 MET 127 -12.447 -1.208 3.558 1000 HE1 MET 127 HE1 MET 127 -9.938 -0.814 2.925 1001 HE2 MET 127 HE2 MET 127 -8.634 -1.946 3.289 1002 HE3 MET 127 HE3 MET 127 -9.454 -1.094 4.598 1003 H SER 128 HN SER 128 -11.846 1.419 6.855 1004 HA SER 128 HA SER 128 -12.004 0.761 9.675 1005 HB2 SER 128 HB2 SER 128 -10.536 3.021 8.291 1006 HB3 SER 128 HB1 SER 128 -10.302 2.488 9.957 1007 HG SER 128 HG SER 128 -9.405 0.614 9.239 1008 H MET 129 HN MET 129 -13.083 3.266 7.466 1009 HA MET 129 HA MET 129 -14.477 4.617 9.673 1010 HB2 MET 129 HB2 MET 129 -13.819 5.603 6.867 1011 HB3 MET 129 HB1 MET 129 -14.732 6.514 8.074 1012 HG2 MET 129 HG2 MET 129 -12.779 6.451 9.571 1013 HG3 MET 129 HG1 MET 129 -11.871 5.610 8.317 1014 HE1 MET 129 HE1 MET 129 -14.443 8.635 7.997 1015 HE2 MET 129 HE2 MET 129 -13.314 9.985 8.082 1016 HE3 MET 129 HE3 MET 129 -13.525 8.924 9.475 1017 H LYS 130 HN LYS 130 -15.326 2.157 8.663 1018 HA LYS 130 HA LYS 130 -17.111 2.174 6.539 1019 HB2 LYS 130 HB2 LYS 130 -16.086 0.192 7.717 1020 HB3 LYS 130 HB1 LYS 130 -17.283 0.412 8.984 1021 HG2 LYS 130 HG2 LYS 130 -19.072 -0.006 7.413 1022 HG3 LYS 130 HG1 LYS 130 -17.909 -0.131 6.092 1023 HD2 LYS 130 HD2 LYS 130 -17.962 -1.940 8.506 1024 HD3 LYS 130 HD1 LYS 130 -18.678 -2.334 6.945 1025 HE2 LYS 130 HE2 LYS 130 -16.448 -2.077 5.903 1026 HE3 LYS 130 HE1 LYS 130 -15.762 -1.790 7.500 1027 HZ1 LYS 130 HZ1 LYS 130 -15.483 -4.086 6.783 1028 HZ2 LYS 130 HZ2 LYS 130 -17.157 -4.274 6.659 1029 HZ3 LYS 130 HZ3 LYS 130 -16.446 -3.995 8.168
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