NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
533705 | 2l01 | 17025 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 H1 MET 1 8.675 20.606 1.921 2 H2 MET 1 H2 MET 1 9.334 21.380 0.573 3 H3 MET 1 H3 MET 1 10.325 20.459 1.590 4 HA MET 1 HA MET 1 8.118 19.427 -0.095 5 HB2 MET 1 HB2 MET 1 11.143 19.099 -0.365 6 HB3 MET 1 HB3 MET 1 9.946 18.320 -1.395 7 HG2 MET 1 HG2 MET 1 9.231 20.500 -2.253 8 HG3 MET 1 HG3 MET 1 10.360 21.317 -1.173 9 HE1 MET 1 HE1 MET 1 13.017 21.226 -1.464 10 HE2 MET 1 HE2 MET 1 13.832 20.261 -2.693 11 HE3 MET 1 HE3 MET 1 12.975 19.464 -1.374 12 H LYS 2 H LYS 2 7.178 18.338 1.691 13 HA LYS 2 HA LYS 2 8.732 16.154 2.964 14 HB2 LYS 2 HB2 LYS 2 6.280 17.686 3.925 15 HB3 LYS 2 HB3 LYS 2 6.954 16.294 4.768 16 HG2 LYS 2 HG2 LYS 2 8.957 17.474 5.332 17 HG3 LYS 2 HG3 LYS 2 8.607 18.771 4.193 18 HD2 LYS 2 HD2 LYS 2 8.233 19.488 6.523 19 HD3 LYS 2 HD3 LYS 2 6.744 19.549 5.581 20 HE2 LYS 2 HE2 LYS 2 6.021 17.407 6.602 21 HE3 LYS 2 HE3 LYS 2 7.509 17.359 7.552 22 HZ1 LYS 2 HZ1 LYS 2 6.841 19.398 8.642 23 HZ2 LYS 2 HZ2 LYS 2 5.633 18.227 8.817 24 HZ3 LYS 2 HZ3 LYS 2 5.440 19.486 7.701 25 H MET 3 H MET 3 8.336 14.268 1.989 26 HA MET 3 HA MET 3 6.016 13.831 0.320 27 HB2 MET 3 HB2 MET 3 8.531 12.197 0.844 28 HB3 MET 3 HB3 MET 3 7.240 11.645 -0.222 29 HG2 MET 3 HG2 MET 3 8.848 14.188 -0.599 30 HG3 MET 3 HG3 MET 3 9.087 12.670 -1.472 31 HE1 MET 3 HE1 MET 3 8.844 13.953 -3.835 32 HE2 MET 3 HE2 MET 3 8.627 15.480 -2.976 33 HE3 MET 3 HE3 MET 3 7.481 15.001 -4.228 34 H LEU 4 H LEU 4 4.455 12.327 0.530 35 HA LEU 4 HA LEU 4 3.649 11.094 2.919 36 HB2 LEU 4 HB2 LEU 4 2.973 10.422 0.033 37 HB3 LEU 4 HB3 LEU 4 2.231 9.584 1.376 38 HG LEU 4 HG LEU 4 0.678 11.225 0.539 39 HD11 LEU 4 HD11 LEU 4 1.797 12.203 3.168 40 HD12 LEU 4 HD12 LEU 4 0.641 10.890 2.939 41 HD13 LEU 4 HD13 LEU 4 0.186 12.541 2.526 42 HD21 LEU 4 HD21 LEU 4 1.100 13.632 0.457 43 HD22 LEU 4 HD22 LEU 4 2.218 12.755 -0.585 44 HD23 LEU 4 HD23 LEU 4 2.772 13.376 0.972 45 H LYS 5 H LYS 5 6.188 10.128 0.795 46 HA LYS 5 HA LYS 5 6.395 7.354 1.353 47 HB2 LYS 5 HB2 LYS 5 7.649 8.407 -0.481 48 HB3 LYS 5 HB3 LYS 5 8.534 9.411 0.669 49 HG2 LYS 5 HG2 LYS 5 9.607 7.415 1.622 50 HG3 LYS 5 HG3 LYS 5 8.705 6.380 0.514 51 HD2 LYS 5 HD2 LYS 5 10.719 8.498 -0.334 52 HD3 LYS 5 HD3 LYS 5 11.083 6.779 -0.161 53 HE2 LYS 5 HE2 LYS 5 9.412 6.269 -1.928 54 HE3 LYS 5 HE3 LYS 5 9.096 7.997 -2.112 55 HZ1 LYS 5 HZ1 LYS 5 10.624 7.319 -3.769 56 HZ2 LYS 5 HZ2 LYS 5 11.641 6.584 -2.637 57 HZ3 LYS 5 HZ3 LYS 5 11.470 8.267 -2.653 58 H GLU 6 H GLU 6 7.785 10.218 2.965 59 HA GLU 6 HA GLU 6 9.378 8.927 4.910 60 HB2 GLU 6 HB2 GLU 6 8.037 11.666 4.945 61 HB3 GLU 6 HB3 GLU 6 9.245 11.151 6.123 62 HG2 GLU 6 HG2 GLU 6 10.964 11.056 4.465 63 HG3 GLU 6 HG3 GLU 6 9.802 11.204 3.147 64 H LYS 7 H LYS 7 6.058 10.145 5.035 65 HA LYS 7 HA LYS 7 5.161 9.307 7.536 66 HB2 LYS 7 HB2 LYS 7 3.856 10.700 5.972 67 HB3 LYS 7 HB3 LYS 7 3.719 9.351 4.851 68 HG2 LYS 7 HG2 LYS 7 2.399 8.123 6.648 69 HG3 LYS 7 HG3 LYS 7 2.407 9.633 7.572 70 HD2 LYS 7 HD2 LYS 7 1.322 10.760 5.589 71 HD3 LYS 7 HD3 LYS 7 1.209 9.171 4.817 72 HE2 LYS 7 HE2 LYS 7 -0.086 9.887 7.483 73 HE3 LYS 7 HE3 LYS 7 -0.919 9.913 5.927 74 HZ1 LYS 7 HZ1 LYS 7 0.325 7.526 7.176 75 HZ2 LYS 7 HZ2 LYS 7 -0.495 7.551 5.697 76 HZ3 LYS 7 HZ3 LYS 7 -1.330 7.868 7.133 77 H ALA 8 H ALA 8 5.041 7.496 4.455 78 HA ALA 8 HA ALA 8 3.933 5.075 5.352 79 HB1 ALA 8 HB1 ALA 8 4.679 4.155 3.211 80 HB2 ALA 8 HB2 ALA 8 5.814 5.498 2.998 81 HB3 ALA 8 HB3 ALA 8 4.069 5.798 2.987 82 H GLY 9 H GLY 9 7.251 6.202 5.403 83 HA2 GLY 9 HA2 GLY 9 8.533 3.693 6.003 84 HA3 GLY 9 HA3 GLY 9 9.231 5.294 6.181 85 H ALA 10 H ALA 10 7.328 6.379 7.990 86 HA ALA 10 HA ALA 10 8.162 5.384 10.535 87 HB1 ALA 10 HB1 ALA 10 7.563 7.748 10.171 88 HB2 ALA 10 HB2 ALA 10 6.590 7.044 11.465 89 HB3 ALA 10 HB3 ALA 10 5.889 7.287 9.862 90 H LEU 11 H LEU 11 5.186 5.056 8.634 91 HA LEU 11 HA LEU 11 3.628 3.498 10.416 92 HB2 LEU 11 HB2 LEU 11 3.593 3.505 7.369 93 HB3 LEU 11 HB3 LEU 11 2.312 2.883 8.403 94 HG LEU 11 HG LEU 11 3.173 5.804 8.276 95 HD11 LEU 11 HD11 LEU 11 1.084 6.225 7.070 96 HD12 LEU 11 HD12 LEU 11 0.739 4.494 7.038 97 HD13 LEU 11 HD13 LEU 11 2.139 5.132 6.173 98 HD21 LEU 11 HD21 LEU 11 1.150 6.268 9.590 99 HD22 LEU 11 HD22 LEU 11 2.252 5.211 10.469 100 HD23 LEU 11 HD23 LEU 11 0.809 4.539 9.703 101 H ALA 12 H ALA 12 5.954 2.620 7.886 102 HA ALA 12 HA ALA 12 5.715 -0.165 7.872 103 HB1 ALA 12 HB1 ALA 12 8.232 1.467 7.407 104 HB2 ALA 12 HB2 ALA 12 6.989 1.123 6.204 105 HB3 ALA 12 HB3 ALA 12 7.947 -0.201 6.875 106 H GLY 13 H GLY 13 7.750 1.912 9.900 107 HA2 GLY 13 HA2 GLY 13 9.258 -0.017 11.256 108 HA3 GLY 13 HA3 GLY 13 8.854 1.572 11.883 109 H GLN 14 H GLN 14 6.242 1.546 12.372 110 HA GLN 14 HA GLN 14 6.054 0.045 14.787 111 HB2 GLN 14 HB2 GLN 14 3.784 1.078 14.999 112 HB3 GLN 14 HB3 GLN 14 5.062 2.245 14.671 113 HG2 GLN 14 HG2 GLN 14 4.371 2.178 12.238 114 HG3 GLN 14 HG3 GLN 14 2.988 1.199 12.722 115 HE21 GLN 14 HE21 GLN 14 4.259 3.910 14.599 116 HE22 GLN 14 HE22 GLN 14 2.902 4.940 14.355 117 H ILE 15 H ILE 15 4.634 -0.483 11.559 118 HA ILE 15 HA ILE 15 2.894 -2.634 12.305 119 HB ILE 15 HB ILE 15 4.057 -1.925 9.576 120 HG12 ILE 15 HG12 ILE 15 1.271 -1.426 10.738 121 HG13 ILE 15 HG13 ILE 15 2.536 -0.210 10.607 122 HG21 ILE 15 HG21 ILE 15 1.814 -3.893 10.190 123 HG22 ILE 15 HG22 ILE 15 3.418 -4.313 9.590 124 HG23 ILE 15 HG23 ILE 15 2.317 -3.380 8.578 125 HD11 ILE 15 HD11 ILE 15 1.158 -1.604 8.314 126 HD12 ILE 15 HD12 ILE 15 2.455 -0.416 8.158 127 HD13 ILE 15 HD13 ILE 15 0.905 0.055 8.852 128 H TRP 16 H TRP 16 6.206 -2.560 10.982 129 HA TRP 16 HA TRP 16 6.736 -5.310 10.937 130 HB2 TRP 16 HB2 TRP 16 8.215 -3.571 9.907 131 HB3 TRP 16 HB3 TRP 16 8.716 -3.053 11.514 132 HD1 TRP 16 HD1 TRP 16 9.192 -5.907 8.997 133 HE1 TRP 16 HE1 TRP 16 11.206 -7.333 9.719 134 HE3 TRP 16 HE3 TRP 16 10.118 -3.784 13.563 135 HZ2 TRP 16 HZ2 TRP 16 12.945 -7.556 11.922 136 HZ3 TRP 16 HZ3 TRP 16 11.971 -4.668 14.925 137 HH2 TRP 16 HH2 TRP 16 13.352 -6.520 14.119 138 H GLU 17 H GLU 17 7.156 -2.942 13.585 139 HA GLU 17 HA GLU 17 8.287 -4.722 15.504 140 HB2 GLU 17 HB2 GLU 17 6.870 -2.050 15.855 141 HB3 GLU 17 HB3 GLU 17 7.682 -2.903 17.168 142 HG2 GLU 17 HG2 GLU 17 9.827 -2.720 15.984 143 HG3 GLU 17 HG3 GLU 17 9.032 -1.915 14.632 144 H ALA 18 H ALA 18 4.954 -4.019 14.633 145 HA ALA 18 HA ALA 18 3.677 -5.351 16.840 146 HB1 ALA 18 HB1 ALA 18 2.614 -4.792 14.048 147 HB2 ALA 18 HB2 ALA 18 2.483 -3.716 15.440 148 HB3 ALA 18 HB3 ALA 18 1.649 -5.270 15.452 149 H LEU 19 H LEU 19 4.783 -6.362 13.628 150 HA LEU 19 HA LEU 19 3.888 -9.116 13.903 151 HB2 LEU 19 HB2 LEU 19 5.640 -7.737 11.835 152 HB3 LEU 19 HB3 LEU 19 5.048 -9.390 11.698 153 HG LEU 19 HG LEU 19 3.228 -6.943 11.865 154 HD11 LEU 19 HD11 LEU 19 4.528 -6.844 9.801 155 HD12 LEU 19 HD12 LEU 19 2.835 -7.195 9.468 156 HD13 LEU 19 HD13 LEU 19 4.035 -8.489 9.386 157 HD21 LEU 19 HD21 LEU 19 2.586 -9.829 11.150 158 HD22 LEU 19 HD22 LEU 19 1.447 -8.478 11.141 159 HD23 LEU 19 HD23 LEU 19 2.163 -9.012 12.658 160 H ASN 20 H ASN 20 6.670 -7.325 14.823 161 HA ASN 20 HA ASN 20 8.524 -9.538 15.084 162 HB2 ASN 20 HB2 ASN 20 9.361 -7.244 14.724 163 HB3 ASN 20 HB3 ASN 20 8.571 -6.685 16.189 164 HD21 ASN 20 HD21 ASN 20 9.485 -7.236 18.214 165 HD22 ASN 20 HD22 ASN 20 11.112 -7.800 18.341 166 H GLY 21 H GLY 21 8.655 -10.912 16.827 167 HA2 GLY 21 HA2 GLY 21 8.497 -11.603 19.076 168 HA3 GLY 21 HA3 GLY 21 7.474 -10.224 19.438 169 H THR 22 H THR 22 6.149 -11.479 16.703 170 HA THR 22 HA THR 22 4.584 -13.629 18.016 171 HB THR 22 HB THR 22 3.099 -11.692 17.970 172 HG1 THR 22 HG1 THR 22 1.466 -12.863 17.274 173 HG21 THR 22 HG21 THR 22 4.137 -10.382 16.148 174 HG22 THR 22 HG22 THR 22 2.405 -10.587 15.880 175 HG23 THR 22 HG23 THR 22 3.558 -11.565 14.970 176 H GLU 23 H GLU 23 3.434 -15.018 16.391 177 HA GLU 23 HA GLU 23 5.278 -15.679 14.211 178 HB2 GLU 23 HB2 GLU 23 4.163 -17.865 14.142 179 HB3 GLU 23 HB3 GLU 23 4.689 -17.483 15.778 180 HG2 GLU 23 HG2 GLU 23 2.411 -16.925 16.435 181 HG3 GLU 23 HG3 GLU 23 1.845 -17.135 14.777 182 H GLY 24 H GLY 24 2.567 -13.780 14.438 183 HA2 GLY 24 HA2 GLY 24 2.152 -12.962 11.989 184 HA3 GLY 24 HA3 GLY 24 1.424 -14.550 11.811 185 H LEU 25 H LEU 25 0.361 -11.705 11.708 186 HA LEU 25 HA LEU 25 -2.030 -12.091 13.416 187 HB2 LEU 25 HB2 LEU 25 -0.556 -9.454 12.971 188 HB3 LEU 25 HB3 LEU 25 -2.094 -9.613 13.806 189 HG LEU 25 HG LEU 25 0.583 -10.713 14.777 190 HD11 LEU 25 HD11 LEU 25 -1.043 -8.362 15.809 191 HD12 LEU 25 HD12 LEU 25 0.490 -8.274 14.936 192 HD13 LEU 25 HD13 LEU 25 0.435 -9.001 16.539 193 HD21 LEU 25 HD21 LEU 25 -1.257 -12.160 15.500 194 HD22 LEU 25 HD22 LEU 25 -2.127 -10.769 16.151 195 HD23 LEU 25 HD23 LEU 25 -0.595 -11.270 16.871 196 H THR 26 H THR 26 -4.010 -11.202 12.466 197 HA THR 26 HA THR 26 -3.923 -10.646 9.562 198 HB THR 26 HB THR 26 -6.352 -10.814 9.560 199 HG1 THR 26 HG1 THR 26 -7.456 -10.369 11.284 200 HG21 THR 26 HG21 THR 26 -6.714 -13.120 10.353 201 HG22 THR 26 HG22 THR 26 -5.214 -13.044 11.280 202 HG23 THR 26 HG23 THR 26 -5.167 -12.974 9.516 203 H GLN 27 H GLN 27 -5.670 -8.824 8.913 204 HA GLN 27 HA GLN 27 -4.376 -6.427 9.346 205 HB2 GLN 27 HB2 GLN 27 -5.881 -6.904 7.423 206 HB3 GLN 27 HB3 GLN 27 -7.280 -6.761 8.484 207 HG2 GLN 27 HG2 GLN 27 -6.824 -4.391 8.854 208 HG3 GLN 27 HG3 GLN 27 -5.315 -4.505 7.953 209 HE21 GLN 27 HE21 GLN 27 -8.783 -4.318 7.689 210 HE22 GLN 27 HE22 GLN 27 -8.834 -4.035 5.992 211 H LYS 28 H LYS 28 -7.330 -7.544 11.042 212 HA LYS 28 HA LYS 28 -7.770 -5.215 12.604 213 HB2 LYS 28 HB2 LYS 28 -8.580 -8.095 13.133 214 HB3 LYS 28 HB3 LYS 28 -9.133 -6.728 14.102 215 HG2 LYS 28 HG2 LYS 28 -10.163 -5.746 12.040 216 HG3 LYS 28 HG3 LYS 28 -9.692 -7.204 11.153 217 HD2 LYS 28 HD2 LYS 28 -11.099 -8.570 12.684 218 HD3 LYS 28 HD3 LYS 28 -11.576 -7.106 13.552 219 HE2 LYS 28 HE2 LYS 28 -13.350 -7.719 12.021 220 HE3 LYS 28 HE3 LYS 28 -12.594 -6.244 11.424 221 HZ1 LYS 28 HZ1 LYS 28 -12.087 -8.991 10.419 222 HZ2 LYS 28 HZ2 LYS 28 -11.336 -7.591 9.841 223 HZ3 LYS 28 HZ3 LYS 28 -13.003 -7.804 9.640 224 H GLN 29 H GLN 29 -5.867 -8.169 13.370 225 HA GLN 29 HA GLN 29 -5.234 -7.343 16.058 226 HB2 GLN 29 HB2 GLN 29 -4.073 -9.557 14.328 227 HB3 GLN 29 HB3 GLN 29 -3.518 -9.241 15.962 228 HG2 GLN 29 HG2 GLN 29 -5.020 -11.008 16.219 229 HG3 GLN 29 HG3 GLN 29 -5.948 -9.594 16.705 230 HE21 GLN 29 HE21 GLN 29 -5.598 -12.117 14.367 231 HE22 GLN 29 HE22 GLN 29 -7.071 -11.832 13.519 232 H ILE 30 H ILE 30 -3.594 -6.995 12.945 233 HA ILE 30 HA ILE 30 -1.100 -6.032 13.922 234 HB ILE 30 HB ILE 30 -2.431 -5.453 11.232 235 HG12 ILE 30 HG12 ILE 30 -0.330 -7.559 11.930 236 HG13 ILE 30 HG13 ILE 30 -2.044 -7.900 11.754 237 HG21 ILE 30 HG21 ILE 30 -0.647 -3.815 11.717 238 HG22 ILE 30 HG22 ILE 30 -0.152 -4.902 10.421 239 HG23 ILE 30 HG23 ILE 30 0.489 -5.125 12.051 240 HD11 ILE 30 HD11 ILE 30 -1.918 -7.234 9.395 241 HD12 ILE 30 HD12 ILE 30 -0.835 -8.568 9.791 242 HD13 ILE 30 HD13 ILE 30 -0.186 -6.942 9.586 243 H LYS 31 H LYS 31 -3.991 -4.256 12.657 244 HA LYS 31 HA LYS 31 -3.021 -1.666 13.272 245 HB2 LYS 31 HB2 LYS 31 -5.186 -0.803 12.773 246 HB3 LYS 31 HB3 LYS 31 -4.904 -2.144 11.671 247 HG2 LYS 31 HG2 LYS 31 -6.351 -3.591 13.072 248 HG3 LYS 31 HG3 LYS 31 -6.643 -2.232 14.162 249 HD2 LYS 31 HD2 LYS 31 -7.430 -2.362 11.217 250 HD3 LYS 31 HD3 LYS 31 -8.526 -2.552 12.589 251 HE2 LYS 31 HE2 LYS 31 -6.970 -0.030 11.887 252 HE3 LYS 31 HE3 LYS 31 -8.690 -0.294 11.617 253 HZ1 LYS 31 HZ1 LYS 31 -8.395 0.999 13.585 254 HZ2 LYS 31 HZ2 LYS 31 -7.315 -0.120 14.239 255 HZ3 LYS 31 HZ3 LYS 31 -8.942 -0.533 14.050 256 H LYS 32 H LYS 32 -4.589 -4.065 15.277 257 HA LYS 32 HA LYS 32 -5.324 -2.454 17.510 258 HB2 LYS 32 HB2 LYS 32 -6.183 -4.755 17.135 259 HB3 LYS 32 HB3 LYS 32 -4.566 -5.406 17.330 260 HG2 LYS 32 HG2 LYS 32 -5.745 -5.859 19.351 261 HG3 LYS 32 HG3 LYS 32 -4.586 -4.581 19.715 262 HD2 LYS 32 HD2 LYS 32 -6.679 -4.044 20.806 263 HD3 LYS 32 HD3 LYS 32 -6.446 -2.896 19.487 264 HE2 LYS 32 HE2 LYS 32 -8.037 -4.159 18.091 265 HE3 LYS 32 HE3 LYS 32 -8.230 -5.363 19.367 266 HZ1 LYS 32 HZ1 LYS 32 -9.029 -2.506 19.474 267 HZ2 LYS 32 HZ2 LYS 32 -9.080 -3.557 20.800 268 HZ3 LYS 32 HZ3 LYS 32 -10.051 -3.856 19.450 269 H ALA 33 H ALA 33 -2.416 -4.460 16.823 270 HA ALA 33 HA ALA 33 -1.055 -3.805 19.267 271 HB1 ALA 33 HB1 ALA 33 0.815 -5.102 18.336 272 HB2 ALA 33 HB2 ALA 33 0.039 -5.112 16.748 273 HB3 ALA 33 HB3 ALA 33 -0.714 -5.950 18.105 274 H THR 34 H THR 34 -1.075 -2.366 16.083 275 HA THR 34 HA THR 34 1.346 -0.755 16.426 276 HB THR 34 HB THR 34 0.657 0.254 14.215 277 HG1 THR 34 HG1 THR 34 -1.209 -1.539 13.537 278 HG21 THR 34 HG21 THR 34 2.096 -1.748 14.208 279 HG22 THR 34 HG22 THR 34 0.989 -1.743 12.835 280 HG23 THR 34 HG23 THR 34 0.664 -2.781 14.224 281 H LYS 35 H LYS 35 -1.986 -0.409 17.190 282 HA LYS 35 HA LYS 35 -3.328 1.240 17.957 283 HB2 LYS 35 HB2 LYS 35 -0.865 3.031 17.946 284 HB3 LYS 35 HB3 LYS 35 -2.418 3.470 18.643 285 HG2 LYS 35 HG2 LYS 35 -0.911 1.039 19.641 286 HG3 LYS 35 HG3 LYS 35 -0.477 2.654 20.188 287 HD2 LYS 35 HD2 LYS 35 -1.935 1.906 21.865 288 HD3 LYS 35 HD3 LYS 35 -2.984 2.896 20.855 289 HE2 LYS 35 HE2 LYS 35 -4.133 0.850 21.496 290 HE3 LYS 35 HE3 LYS 35 -3.824 0.823 19.762 291 HZ1 LYS 35 HZ1 LYS 35 -3.326 -1.306 20.733 292 HZ2 LYS 35 HZ2 LYS 35 -2.261 -0.605 21.842 293 HZ3 LYS 35 HZ3 LYS 35 -1.889 -0.596 20.196 294 H LEU 36 H LEU 36 -2.604 0.841 14.998 295 HA LEU 36 HA LEU 36 -2.924 3.309 13.614 296 HB2 LEU 36 HB2 LEU 36 -3.513 0.461 12.744 297 HB3 LEU 36 HB3 LEU 36 -3.764 1.828 11.671 298 HG LEU 36 HG LEU 36 -1.092 0.992 12.859 299 HD11 LEU 36 HD11 LEU 36 -2.111 0.702 10.022 300 HD12 LEU 36 HD12 LEU 36 -1.877 -0.603 11.189 301 HD13 LEU 36 HD13 LEU 36 -0.488 0.302 10.595 302 HD21 LEU 36 HD21 LEU 36 -1.137 3.401 12.537 303 HD22 LEU 36 HD22 LEU 36 -1.704 3.203 10.880 304 HD23 LEU 36 HD23 LEU 36 -0.089 2.652 11.333 305 H LYS 37 H LYS 37 -4.623 4.623 13.672 306 HA LYS 37 HA LYS 37 -7.195 3.938 14.693 307 HB2 LYS 37 HB2 LYS 37 -6.471 6.406 13.047 308 HB3 LYS 37 HB3 LYS 37 -7.824 6.239 14.165 309 HG2 LYS 37 HG2 LYS 37 -4.869 6.304 14.900 310 HG3 LYS 37 HG3 LYS 37 -6.032 7.612 15.139 311 HD2 LYS 37 HD2 LYS 37 -6.122 4.879 16.503 312 HD3 LYS 37 HD3 LYS 37 -5.545 6.371 17.247 313 HE2 LYS 37 HE2 LYS 37 -7.822 7.346 17.018 314 HE3 LYS 37 HE3 LYS 37 -8.387 5.839 16.295 315 HZ1 LYS 37 HZ1 LYS 37 -8.932 5.946 18.626 316 HZ2 LYS 37 HZ2 LYS 37 -7.307 6.150 19.036 317 HZ3 LYS 37 HZ3 LYS 37 -7.828 4.696 18.347 318 H ALA 38 H ALA 38 -5.833 4.078 11.462 319 HA ALA 38 HA ALA 38 -8.321 3.006 10.276 320 HB1 ALA 38 HB1 ALA 38 -8.064 4.489 8.329 321 HB2 ALA 38 HB2 ALA 38 -6.646 5.240 9.070 322 HB3 ALA 38 HB3 ALA 38 -8.235 5.428 9.814 323 H ASP 39 H ASP 39 -8.075 1.569 8.644 324 HA ASP 39 HA ASP 39 -5.777 0.038 8.158 325 HB2 ASP 39 HB2 ASP 39 -7.115 -0.823 6.141 326 HB3 ASP 39 HB3 ASP 39 -7.897 -0.963 7.715 327 H LYS 40 H LYS 40 -6.752 3.025 6.737 328 HA LYS 40 HA LYS 40 -5.583 3.151 4.235 329 HB2 LYS 40 HB2 LYS 40 -5.479 5.419 6.272 330 HB3 LYS 40 HB3 LYS 40 -5.548 5.570 4.513 331 HG2 LYS 40 HG2 LYS 40 -7.769 4.313 6.150 332 HG3 LYS 40 HG3 LYS 40 -7.699 6.050 5.821 333 HD2 LYS 40 HD2 LYS 40 -7.816 3.869 3.703 334 HD3 LYS 40 HD3 LYS 40 -9.217 4.757 4.306 335 HE2 LYS 40 HE2 LYS 40 -8.173 6.875 3.484 336 HE3 LYS 40 HE3 LYS 40 -6.853 5.924 2.793 337 HZ1 LYS 40 HZ1 LYS 40 -8.478 6.399 1.125 338 HZ2 LYS 40 HZ2 LYS 40 -9.723 5.754 2.069 339 HZ3 LYS 40 HZ3 LYS 40 -8.519 4.739 1.455 340 H ASP 41 H ASP 41 -4.075 3.760 7.365 341 HA ASP 41 HA ASP 41 -1.444 4.422 6.414 342 HB2 ASP 41 HB2 ASP 41 -2.389 3.619 9.201 343 HB3 ASP 41 HB3 ASP 41 -0.857 4.402 8.814 344 H PHE 42 H PHE 42 -3.064 1.498 7.500 345 HA PHE 42 HA PHE 42 -0.881 -0.233 7.880 346 HB2 PHE 42 HB2 PHE 42 -3.047 -0.925 8.671 347 HB3 PHE 42 HB3 PHE 42 -3.763 -0.775 7.075 348 HD1 PHE 42 HD1 PHE 42 -1.105 -2.738 8.887 349 HD2 PHE 42 HD2 PHE 42 -4.060 -2.732 5.789 350 HE1 PHE 42 HE1 PHE 42 -0.718 -5.132 8.497 351 HE2 PHE 42 HE2 PHE 42 -3.669 -5.131 5.419 352 HZ PHE 42 HZ PHE 42 -1.998 -6.333 6.772 353 H PHE 43 H PHE 43 -2.711 0.555 4.920 354 HA PHE 43 HA PHE 43 -1.554 -1.411 3.233 355 HB2 PHE 43 HB2 PHE 43 -2.808 1.251 2.451 356 HB3 PHE 43 HB3 PHE 43 -2.530 -0.109 1.366 357 HD1 PHE 43 HD2 PHE 43 -3.492 -2.448 2.715 358 HD2 PHE 43 HD1 PHE 43 -5.112 1.512 2.840 359 HE1 PHE 43 HE2 PHE 43 -5.697 -3.369 3.283 360 HE2 PHE 43 HE1 PHE 43 -7.317 0.598 3.404 361 HZ PHE 43 HZ PHE 43 -7.618 -1.850 3.618 362 H LEU 44 H LEU 44 -0.655 2.018 3.770 363 HA LEU 44 HA LEU 44 1.458 2.140 1.858 364 HB2 LEU 44 HB2 LEU 44 0.679 3.853 4.221 365 HB3 LEU 44 HB3 LEU 44 2.228 4.128 3.449 366 HG LEU 44 HG LEU 44 1.021 4.520 1.271 367 HD11 LEU 44 HD11 LEU 44 -1.381 5.005 1.265 368 HD12 LEU 44 HD12 LEU 44 -1.501 4.485 2.948 369 HD13 LEU 44 HD13 LEU 44 -1.061 3.324 1.694 370 HD21 LEU 44 HD21 LEU 44 1.794 6.401 2.657 371 HD22 LEU 44 HD22 LEU 44 0.255 6.408 3.522 372 HD23 LEU 44 HD23 LEU 44 0.304 6.801 1.802 373 H GLY 45 H GLY 45 1.495 1.572 5.395 374 HA2 GLY 45 HA2 GLY 45 4.304 1.292 5.714 375 HA3 GLY 45 HA3 GLY 45 3.076 0.681 6.812 376 H LEU 46 H LEU 46 1.756 -1.144 5.261 377 HA LEU 46 HA LEU 46 3.244 -3.512 5.463 378 HB2 LEU 46 HB2 LEU 46 0.791 -3.466 5.489 379 HB3 LEU 46 HB3 LEU 46 0.749 -2.898 3.829 380 HG LEU 46 HG LEU 46 1.708 -5.075 3.068 381 HD11 LEU 46 HD11 LEU 46 1.846 -6.961 4.638 382 HD12 LEU 46 HD12 LEU 46 1.489 -5.877 5.981 383 HD13 LEU 46 HD13 LEU 46 2.976 -5.675 5.048 384 HD21 LEU 46 HD21 LEU 46 -0.301 -6.440 3.405 385 HD22 LEU 46 HD22 LEU 46 -0.748 -4.764 3.088 386 HD23 LEU 46 HD23 LEU 46 -0.817 -5.398 4.732 387 H GLY 47 H GLY 47 2.598 -1.459 2.691 388 HA2 GLY 47 HA2 GLY 47 3.630 -3.085 0.597 389 HA3 GLY 47 HA3 GLY 47 3.417 -1.340 0.530 390 H TRP 48 H TRP 48 5.107 -0.811 2.796 391 HA TRP 48 HA TRP 48 7.699 -0.682 1.582 392 HB2 TRP 48 HB2 TRP 48 6.545 1.026 3.151 393 HB3 TRP 48 HB3 TRP 48 7.009 -0.036 4.475 394 HD1 TRP 48 HD1 TRP 48 9.691 -0.208 5.005 395 HE1 TRP 48 HE1 TRP 48 11.628 1.350 4.393 396 HE3 TRP 48 HE3 TRP 48 7.346 2.615 1.468 397 HZ2 TRP 48 HZ2 TRP 48 12.102 3.480 2.634 398 HZ3 TRP 48 HZ3 TRP 48 8.605 4.415 0.364 399 HH2 TRP 48 HH2 TRP 48 10.933 4.857 0.950 400 H LEU 49 H LEU 49 6.193 -2.757 4.011 401 HA LEU 49 HA LEU 49 8.582 -4.153 4.815 402 HB2 LEU 49 HB2 LEU 49 5.622 -4.698 5.084 403 HB3 LEU 49 HB3 LEU 49 6.775 -5.940 5.519 404 HG LEU 49 HG LEU 49 7.644 -4.654 7.358 405 HD11 LEU 49 HD11 LEU 49 6.929 -2.394 7.900 406 HD12 LEU 49 HD12 LEU 49 5.982 -2.329 6.409 407 HD13 LEU 49 HD13 LEU 49 7.741 -2.460 6.338 408 HD21 LEU 49 HD21 LEU 49 5.644 -4.318 8.748 409 HD22 LEU 49 HD22 LEU 49 5.498 -5.793 7.796 410 HD23 LEU 49 HD23 LEU 49 4.622 -4.337 7.304 411 H LEU 50 H LEU 50 6.163 -4.585 2.300 412 HA LEU 50 HA LEU 50 7.024 -7.087 1.267 413 HB2 LEU 50 HB2 LEU 50 5.507 -4.826 -0.087 414 HB3 LEU 50 HB3 LEU 50 5.709 -6.435 -0.773 415 HG LEU 50 HG LEU 50 4.204 -5.783 1.798 416 HD11 LEU 50 HD11 LEU 50 2.172 -6.406 0.567 417 HD12 LEU 50 HD12 LEU 50 3.116 -6.613 -0.911 418 HD13 LEU 50 HD13 LEU 50 2.974 -5.017 -0.167 419 HD21 LEU 50 HD21 LEU 50 5.259 -7.981 1.950 420 HD22 LEU 50 HD22 LEU 50 4.561 -8.454 0.399 421 HD23 LEU 50 HD23 LEU 50 3.514 -8.146 1.783 422 H ARG 51 H ARG 51 8.001 -3.715 0.510 423 HA ARG 51 HA ARG 51 9.502 -4.271 -1.817 424 HB2 ARG 51 HB2 ARG 51 10.406 -2.101 -1.718 425 HB3 ARG 51 HB3 ARG 51 8.834 -1.942 -0.959 426 HG2 ARG 51 HG2 ARG 51 9.785 -1.625 1.196 427 HG3 ARG 51 HG3 ARG 51 11.339 -2.275 0.705 428 HD2 ARG 51 HD2 ARG 51 11.527 -0.231 -0.835 429 HD3 ARG 51 HD3 ARG 51 10.151 0.424 0.061 430 HE ARG 51 HE ARG 51 11.576 0.093 2.119 431 HH11 ARG 51 HH11 ARG 51 13.094 0.656 -0.954 432 HH12 ARG 51 HH12 ARG 51 14.524 1.303 -0.239 433 HH21 ARG 51 HH21 ARG 51 13.413 0.898 2.997 434 HH22 ARG 51 HH22 ARG 51 14.696 1.460 1.982 435 H GLU 52 H GLU 52 10.432 -4.372 1.581 436 HA GLU 52 HA GLU 52 13.226 -5.040 0.990 437 HB2 GLU 52 HB2 GLU 52 11.743 -4.446 3.588 438 HB3 GLU 52 HB3 GLU 52 13.447 -4.895 3.525 439 HG2 GLU 52 HG2 GLU 52 14.007 -2.878 2.301 440 HG3 GLU 52 HG3 GLU 52 12.304 -2.468 2.104 441 H ASP 53 H ASP 53 10.348 -6.763 1.319 442 HA ASP 53 HA ASP 53 9.824 -8.941 1.429 443 HB2 ASP 53 HB2 ASP 53 12.815 -9.192 0.995 444 HB3 ASP 53 HB3 ASP 53 11.824 -10.630 1.227 445 H LYS 54 H LYS 54 10.323 -7.417 3.883 446 HA LYS 54 HA LYS 54 11.458 -9.174 5.861 447 HB2 LYS 54 HB2 LYS 54 9.786 -6.632 6.099 448 HB3 LYS 54 HB3 LYS 54 10.538 -7.455 7.470 449 HG2 LYS 54 HG2 LYS 54 12.771 -7.055 6.509 450 HG3 LYS 54 HG3 LYS 54 12.043 -6.278 5.101 451 HD2 LYS 54 HD2 LYS 54 11.864 -5.271 7.973 452 HD3 LYS 54 HD3 LYS 54 12.952 -4.642 6.733 453 HE2 LYS 54 HE2 LYS 54 10.861 -4.069 5.372 454 HE3 LYS 54 HE3 LYS 54 9.921 -4.452 6.819 455 HZ1 LYS 54 HZ1 LYS 54 10.371 -2.098 6.652 456 HZ2 LYS 54 HZ2 LYS 54 12.036 -2.376 6.601 457 HZ3 LYS 54 HZ3 LYS 54 11.162 -2.735 8.005 458 H VAL 55 H VAL 55 8.365 -8.936 4.323 459 HA VAL 55 HA VAL 55 7.161 -10.783 6.278 460 HB VAL 55 HB VAL 55 4.995 -9.669 6.270 461 HG11 VAL 55 HG11 VAL 55 7.172 -7.708 7.067 462 HG12 VAL 55 HG12 VAL 55 6.523 -9.013 8.064 463 HG13 VAL 55 HG13 VAL 55 5.490 -7.658 7.606 464 HG21 VAL 55 HG21 VAL 55 5.012 -8.647 4.042 465 HG22 VAL 55 HG22 VAL 55 6.255 -7.500 4.546 466 HG23 VAL 55 HG23 VAL 55 4.642 -7.421 5.260 467 H VAL 56 H VAL 56 5.200 -11.814 5.465 468 HA VAL 56 HA VAL 56 4.924 -11.978 2.555 469 HB VAL 56 HB VAL 56 6.098 -14.012 3.211 470 HG11 VAL 56 HG11 VAL 56 5.539 -14.101 5.594 471 HG12 VAL 56 HG12 VAL 56 5.184 -15.650 4.826 472 HG13 VAL 56 HG13 VAL 56 3.871 -14.533 5.210 473 HG21 VAL 56 HG21 VAL 56 3.178 -14.660 2.638 474 HG22 VAL 56 HG22 VAL 56 4.542 -15.753 2.387 475 HG23 VAL 56 HG23 VAL 56 4.409 -14.274 1.433 476 H THR 57 H THR 57 2.843 -11.933 1.797 477 HA THR 57 HA THR 57 0.691 -11.474 3.793 478 HB THR 57 HB THR 57 -0.295 -9.862 2.098 479 HG1 THR 57 HG1 THR 57 1.319 -9.064 0.533 480 HG21 THR 57 HG21 THR 57 2.469 -9.137 3.134 481 HG22 THR 57 HG22 THR 57 0.953 -8.977 4.021 482 HG23 THR 57 HG23 THR 57 1.240 -7.991 2.588 483 H SER 58 H SER 58 -1.216 -12.435 3.459 484 HA SER 58 HA SER 58 -2.103 -13.505 0.929 485 HB2 SER 58 HB2 SER 58 -0.573 -15.345 1.712 486 HB3 SER 58 HB3 SER 58 -1.551 -15.509 3.172 487 HG SER 58 HG SER 58 -2.015 -16.418 0.628 488 H GLU 59 H GLU 59 -4.293 -14.519 1.161 489 HA GLU 59 HA GLU 59 -5.864 -13.032 3.153 490 HB2 GLU 59 HB2 GLU 59 -6.474 -12.854 0.750 491 HB3 GLU 59 HB3 GLU 59 -6.796 -14.586 0.696 492 HG2 GLU 59 HG2 GLU 59 -8.607 -14.248 2.403 493 HG3 GLU 59 HG3 GLU 59 -8.309 -12.512 2.324 494 H VAL 60 H VAL 60 -6.799 -13.924 4.825 495 HA VAL 60 HA VAL 60 -7.504 -16.801 4.900 496 HB VAL 60 HB VAL 60 -6.218 -15.219 7.188 497 HG11 VAL 60 HG11 VAL 60 -7.452 -18.005 7.316 498 HG12 VAL 60 HG12 VAL 60 -8.090 -16.558 8.101 499 HG13 VAL 60 HG13 VAL 60 -6.539 -17.225 8.613 500 HG21 VAL 60 HG21 VAL 60 -5.338 -17.780 5.794 501 HG22 VAL 60 HG22 VAL 60 -4.500 -17.009 7.145 502 HG23 VAL 60 HG23 VAL 60 -4.600 -16.187 5.586 503 H GLU 61 H GLU 61 -9.621 -16.831 4.856 504 HA GLU 61 HA GLU 61 -11.833 -16.416 5.096 505 HB2 GLU 61 HB2 GLU 61 -11.030 -15.455 7.874 506 HB3 GLU 61 HB3 GLU 61 -12.582 -16.150 7.399 507 HG2 GLU 61 HG2 GLU 61 -11.321 -18.293 6.837 508 HG3 GLU 61 HG3 GLU 61 -9.899 -17.553 7.551 509 H GLY 62 H GLY 62 -10.431 -14.209 3.862 510 HA2 GLY 62 HA2 GLY 62 -11.226 -12.199 2.939 511 HA3 GLY 62 HA3 GLY 62 -12.367 -12.043 4.258 512 H GLU 63 H GLU 63 -9.659 -12.630 5.891 513 HA GLU 63 HA GLU 63 -8.959 -9.815 6.321 514 HB2 GLU 63 HB2 GLU 63 -8.469 -12.412 7.798 515 HB3 GLU 63 HB3 GLU 63 -7.458 -11.018 8.157 516 HG2 GLU 63 HG2 GLU 63 -10.486 -10.978 8.333 517 HG3 GLU 63 HG3 GLU 63 -9.425 -11.363 9.687 518 H ILE 64 H ILE 64 -7.009 -8.873 5.798 519 HA ILE 64 HA ILE 64 -5.009 -10.267 4.263 520 HB ILE 64 HB ILE 64 -4.824 -7.508 5.584 521 HG12 ILE 64 HG12 ILE 64 -5.606 -8.302 2.740 522 HG13 ILE 64 HG13 ILE 64 -6.667 -7.587 3.950 523 HG21 ILE 64 HG21 ILE 64 -2.584 -8.423 5.084 524 HG22 ILE 64 HG22 ILE 64 -2.954 -7.073 4.015 525 HG23 ILE 64 HG23 ILE 64 -3.065 -8.728 3.413 526 HD11 ILE 64 HD11 ILE 64 -4.317 -6.245 2.600 527 HD12 ILE 64 HD12 ILE 64 -5.323 -5.514 3.855 528 HD13 ILE 64 HD13 ILE 64 -6.029 -5.950 2.300 529 H PHE 65 H PHE 65 -4.170 -11.950 5.409 530 HA PHE 65 HA PHE 65 -3.104 -11.670 8.114 531 HB2 PHE 65 HB2 PHE 65 -4.268 -13.754 7.550 532 HB3 PHE 65 HB3 PHE 65 -3.176 -14.048 6.201 533 HD1 PHE 65 HD2 PHE 65 -3.092 -13.543 9.937 534 HD2 PHE 65 HD1 PHE 65 -1.335 -15.499 6.558 535 HE1 PHE 65 HE2 PHE 65 -1.603 -14.803 11.433 536 HE2 PHE 65 HE1 PHE 65 0.153 -16.752 8.067 537 HZ PHE 65 HZ PHE 65 0.019 -16.407 10.503 538 H VAL 66 H VAL 66 -1.092 -10.991 8.486 539 HA VAL 66 HA VAL 66 1.032 -11.268 6.426 540 HB VAL 66 HB VAL 66 0.730 -8.901 8.333 541 HG11 VAL 66 HG11 VAL 66 2.403 -7.811 6.888 542 HG12 VAL 66 HG12 VAL 66 2.499 -9.259 5.885 543 HG13 VAL 66 HG13 VAL 66 3.036 -9.313 7.566 544 HG21 VAL 66 HG21 VAL 66 -0.070 -7.556 6.418 545 HG22 VAL 66 HG22 VAL 66 -1.182 -8.879 6.778 546 HG23 VAL 66 HG23 VAL 66 -0.084 -9.000 5.402 547 H LYS 67 H LYS 67 3.118 -11.785 7.174 548 HA LYS 67 HA LYS 67 3.791 -11.703 10.018 549 HB2 LYS 67 HB2 LYS 67 4.332 -14.142 10.167 550 HB3 LYS 67 HB3 LYS 67 2.614 -13.823 9.982 551 HG2 LYS 67 HG2 LYS 67 2.737 -14.405 7.589 552 HG3 LYS 67 HG3 LYS 67 4.467 -14.734 7.754 553 HD2 LYS 67 HD2 LYS 67 2.255 -16.196 9.254 554 HD3 LYS 67 HD3 LYS 67 3.047 -16.801 7.797 555 HE2 LYS 67 HE2 LYS 67 5.132 -17.084 8.940 556 HE3 LYS 67 HE3 LYS 67 4.592 -16.134 10.324 557 HZ1 LYS 67 HZ1 LYS 67 3.022 -17.836 10.876 558 HZ2 LYS 67 HZ2 LYS 67 4.570 -18.506 10.765 559 HZ3 LYS 67 HZ3 LYS 67 3.458 -18.747 9.518 560 H LEU 68 H LEU 68 6.073 -12.082 10.424 561 HA LEU 68 HA LEU 68 7.825 -11.170 8.394 562 HB2 LEU 68 HB2 LEU 68 8.527 -12.614 10.982 563 HB3 LEU 68 HB3 LEU 68 9.659 -11.716 9.980 564 HG LEU 68 HG LEU 68 7.351 -10.567 11.611 565 HD11 LEU 68 HD11 LEU 68 9.332 -11.134 12.940 566 HD12 LEU 68 HD12 LEU 68 9.089 -9.391 12.864 567 HD13 LEU 68 HD13 LEU 68 10.346 -10.148 11.880 568 HD21 LEU 68 HD21 LEU 68 7.486 -9.323 9.516 569 HD22 LEU 68 HD22 LEU 68 9.219 -9.073 9.738 570 HD23 LEU 68 HD23 LEU 68 8.066 -8.334 10.855 571 H VAL 69 H VAL 69 9.306 -12.230 7.052 572 HA VAL 69 HA VAL 69 8.663 -14.882 6.182 573 HB VAL 69 HB VAL 69 11.036 -13.117 5.402 574 HG11 VAL 69 HG11 VAL 69 11.252 -14.593 3.390 575 HG12 VAL 69 HG12 VAL 69 10.040 -15.680 4.073 576 HG13 VAL 69 HG13 VAL 69 11.587 -15.456 4.893 577 HG21 VAL 69 HG21 VAL 69 9.721 -12.613 3.367 578 HG22 VAL 69 HG22 VAL 69 8.854 -12.122 4.823 579 HG23 VAL 69 HG23 VAL 69 8.387 -13.598 3.976 580 H LEU 70 H LEU 70 9.015 -16.412 7.721 581 HA LEU 70 HA LEU 70 11.740 -16.877 8.779 582 HB2 LEU 70 HB2 LEU 70 9.144 -18.294 9.519 583 HB3 LEU 70 HB3 LEU 70 10.683 -18.402 10.367 584 HG LEU 70 HG LEU 70 8.935 -15.904 10.199 585 HD11 LEU 70 HD11 LEU 70 9.374 -17.779 12.545 586 HD12 LEU 70 HD12 LEU 70 7.896 -17.626 11.590 587 HD13 LEU 70 HD13 LEU 70 8.450 -16.274 12.574 588 HD21 LEU 70 HD21 LEU 70 10.469 -14.946 11.885 589 HD22 LEU 70 HD22 LEU 70 11.295 -15.299 10.370 590 HD23 LEU 70 HD23 LEU 70 11.503 -16.372 11.758 591 H GLU 71 H GLU 71 9.287 -18.153 6.623 592 HA GLU 71 HA GLU 71 11.031 -20.150 5.470 593 HB2 GLU 71 HB2 GLU 71 9.436 -20.966 7.686 594 HB3 GLU 71 HB3 GLU 71 8.548 -21.548 6.288 595 HG2 GLU 71 HG2 GLU 71 11.453 -22.167 6.914 596 HG3 GLU 71 HG3 GLU 71 10.087 -23.231 7.254 597 H HIS 72 H HIS 72 10.001 -21.211 3.543 598 HA HIS 72 HA HIS 72 8.570 -19.269 1.990 599 HB2 HIS 72 HB2 HIS 72 8.932 -20.683 0.096 600 HB3 HIS 72 HB3 HIS 72 10.369 -20.823 1.088 601 HD1 HIS 72 HD1 HIS 72 10.430 -23.128 2.605 602 HD2 HIS 72 HD2 HIS 72 7.854 -23.073 -0.655 603 HE1 HIS 72 HE1 HIS 72 9.883 -25.527 2.142 604 HE2 HIS 72 HE2 HIS 72 8.286 -25.476 0.209 605 H HIS 73 H HIS 73 6.486 -19.429 0.994 606 HA HIS 73 HA HIS 73 4.589 -21.407 2.104 607 HB2 HIS 73 HB2 HIS 73 4.275 -18.382 2.330 608 HB3 HIS 73 HB3 HIS 73 2.945 -19.507 2.568 609 HD1 HIS 73 HD1 HIS 73 3.885 -21.573 4.385 610 HD2 HIS 73 HD2 HIS 73 5.184 -17.648 4.812 611 HE1 HIS 73 HE1 HIS 73 4.725 -21.404 6.736 612 HE2 HIS 73 HE2 HIS 73 5.675 -19.087 6.904 613 H HIS 74 H HIS 74 3.350 -22.247 0.575 614 HA HIS 74 HA HIS 74 2.899 -20.834 -1.992 615 HB2 HIS 74 HB2 HIS 74 2.685 -23.780 -1.255 616 HB3 HIS 74 HB3 HIS 74 2.209 -23.136 -2.820 617 HD1 HIS 74 HD1 HIS 74 4.036 -22.647 -4.504 618 HD2 HIS 74 HD2 HIS 74 5.505 -23.791 -0.793 619 HE1 HIS 74 HE1 HIS 74 6.474 -23.096 -4.862 620 HE2 HIS 74 HE2 HIS 74 7.353 -23.754 -2.604 621 H HIS 75 H HIS 75 1.376 -20.408 0.610 622 HA HIS 75 HA HIS 75 -1.302 -21.370 0.279 623 HB2 HIS 75 HB2 HIS 75 -0.224 -20.535 2.447 624 HB3 HIS 75 HB3 HIS 75 -0.402 -18.900 1.836 625 HD1 HIS 75 HD1 HIS 75 -2.178 -21.545 3.648 626 HD2 HIS 75 HD2 HIS 75 -3.193 -18.053 1.651 627 HE1 HIS 75 HE1 HIS 75 -4.462 -20.942 4.480 628 HE2 HIS 75 HE2 HIS 75 -5.103 -18.893 3.173 629 H HIS 76 H HIS 76 -1.768 -20.941 -1.934 630 HA HIS 76 HA HIS 76 -1.584 -18.243 -3.001 631 HB2 HIS 76 HB2 HIS 76 -2.329 -19.311 -5.161 632 HB3 HIS 76 HB3 HIS 76 -0.844 -19.961 -4.491 633 HD1 HIS 76 HD1 HIS 76 -0.886 -22.443 -3.697 634 HD2 HIS 76 HD2 HIS 76 -4.460 -21.134 -5.369 635 HE1 HIS 76 HE1 HIS 76 -2.212 -24.521 -4.173 636 HE2 HIS 76 HE2 HIS 76 -4.285 -23.708 -5.335 637 H HIS 77 H HIS 77 -3.071 -17.033 -1.901 638 HA HIS 77 HA HIS 77 -5.852 -17.168 -2.683 639 HB2 HIS 77 HB2 HIS 77 -5.631 -18.866 -0.769 640 HB3 HIS 77 HB3 HIS 77 -5.232 -17.518 0.290 641 HD1 HIS 77 HD1 HIS 77 -7.263 -17.553 1.766 642 HD2 HIS 77 HD2 HIS 77 -8.276 -17.569 -2.264 643 HE1 HIS 77 HE1 HIS 77 -9.753 -17.320 1.706 644 HE2 HIS 77 HE2 HIS 77 -10.316 -17.125 -0.732 645 H1 MET 1 H MET 1 2.029 -19.497 -3.136 646 HA MET 1 HA MET 1 3.261 -18.947 -5.076 647 HB2 MET 1 HB2 MET 1 2.367 -20.801 -6.395 648 HB3 MET 1 HB3 MET 1 0.801 -20.008 -6.527 649 HG2 MET 1 HG2 MET 1 2.040 -19.832 -8.618 650 HG3 MET 1 HG3 MET 1 1.817 -18.236 -7.905 651 HE1 MET 1 HE1 MET 1 5.845 -20.533 -7.988 652 HE2 MET 1 HE2 MET 1 4.376 -21.095 -8.784 653 HE3 MET 1 HE3 MET 1 4.483 -21.100 -7.021 654 H LYS 2 H LYS 2 -0.232 -18.312 -5.629 655 HA LYS 2 HA LYS 2 0.201 -15.539 -6.268 656 HB2 LYS 2 HB2 LYS 2 -1.550 -16.793 -7.416 657 HB3 LYS 2 HB3 LYS 2 -2.355 -17.149 -5.890 658 HG2 LYS 2 HG2 LYS 2 -2.922 -14.785 -5.596 659 HG3 LYS 2 HG3 LYS 2 -2.021 -14.364 -7.058 660 HD2 LYS 2 HD2 LYS 2 -3.594 -15.678 -8.422 661 HD3 LYS 2 HD3 LYS 2 -4.476 -16.161 -6.969 662 HE2 LYS 2 HE2 LYS 2 -5.101 -13.805 -6.566 663 HE3 LYS 2 HE3 LYS 2 -4.200 -13.312 -8.004 664 HZ1 LYS 2 HZ1 LYS 2 -6.570 -15.099 -7.950 665 HZ2 LYS 2 HZ2 LYS 2 -5.687 -14.695 -9.334 666 HZ3 LYS 2 HZ3 LYS 2 -6.531 -13.498 -8.491 667 H MET 3 H MET 3 0.921 -14.355 -4.589 668 HA MET 3 HA MET 3 -0.439 -14.383 -1.967 669 HB2 MET 3 HB2 MET 3 2.199 -13.141 -2.859 670 HB3 MET 3 HB3 MET 3 1.557 -13.054 -1.222 671 HG2 MET 3 HG2 MET 3 1.701 -15.517 -1.047 672 HG3 MET 3 HG3 MET 3 2.376 -15.589 -2.677 673 HE1 MET 3 HE1 MET 3 5.849 -13.775 -2.156 674 HE2 MET 3 HE2 MET 3 4.347 -13.026 -2.696 675 HE3 MET 3 HE3 MET 3 4.814 -14.612 -3.313 676 H LEU 4 H LEU 4 -0.774 -12.257 -0.886 677 HA LEU 4 HA LEU 4 -2.062 -10.277 -2.510 678 HB2 LEU 4 HB2 LEU 4 -1.516 -10.597 0.419 679 HB3 LEU 4 HB3 LEU 4 -1.891 -8.981 -0.144 680 HG LEU 4 HG LEU 4 -4.087 -9.661 -0.920 681 HD11 LEU 4 HD11 LEU 4 -4.966 -11.945 -0.689 682 HD12 LEU 4 HD12 LEU 4 -3.376 -12.511 -0.175 683 HD13 LEU 4 HD13 LEU 4 -3.603 -11.878 -1.805 684 HD21 LEU 4 HD21 LEU 4 -3.583 -10.803 1.849 685 HD22 LEU 4 HD22 LEU 4 -5.151 -10.317 1.194 686 HD23 LEU 4 HD23 LEU 4 -3.898 -9.108 1.465 687 H LYS 5 H LYS 5 1.239 -10.687 -1.552 688 HA LYS 5 HA LYS 5 2.148 -8.039 -2.217 689 HB2 LYS 5 HB2 LYS 5 3.553 -9.628 -0.891 690 HB3 LYS 5 HB3 LYS 5 3.680 -10.682 -2.301 691 HG2 LYS 5 HG2 LYS 5 4.783 -8.767 -3.533 692 HG3 LYS 5 HG3 LYS 5 4.779 -7.862 -2.015 693 HD2 LYS 5 HD2 LYS 5 6.214 -9.619 -0.992 694 HD3 LYS 5 HD3 LYS 5 6.222 -10.493 -2.531 695 HE2 LYS 5 HE2 LYS 5 7.262 -8.488 -3.610 696 HE3 LYS 5 HE3 LYS 5 7.343 -7.713 -2.027 697 HZ1 LYS 5 HZ1 LYS 5 8.737 -10.184 -2.870 698 HZ2 LYS 5 HZ2 LYS 5 8.763 -9.561 -1.297 699 HZ3 LYS 5 HZ3 LYS 5 9.434 -8.677 -2.570 700 H GLU 6 H GLU 6 1.561 -11.028 -4.000 701 HA GLU 6 HA GLU 6 2.921 -10.341 -6.390 702 HB2 GLU 6 HB2 GLU 6 2.322 -12.681 -5.638 703 HB3 GLU 6 HB3 GLU 6 0.654 -12.352 -6.087 704 HG2 GLU 6 HG2 GLU 6 1.718 -13.621 -7.847 705 HG3 GLU 6 HG3 GLU 6 1.373 -11.998 -8.437 706 H LYS 7 H LYS 7 -0.526 -10.049 -5.424 707 HA LYS 7 HA LYS 7 -1.366 -8.883 -7.911 708 HB2 LYS 7 HB2 LYS 7 -3.504 -8.354 -6.755 709 HB3 LYS 7 HB3 LYS 7 -3.025 -10.030 -6.609 710 HG2 LYS 7 HG2 LYS 7 -3.912 -9.517 -4.510 711 HG3 LYS 7 HG3 LYS 7 -2.173 -9.427 -4.255 712 HD2 LYS 7 HD2 LYS 7 -3.314 -7.598 -3.094 713 HD3 LYS 7 HD3 LYS 7 -2.288 -6.951 -4.373 714 HE2 LYS 7 HE2 LYS 7 -4.414 -5.758 -4.334 715 HE3 LYS 7 HE3 LYS 7 -4.306 -6.697 -5.821 716 HZ1 LYS 7 HZ1 LYS 7 -6.495 -6.837 -4.768 717 HZ2 LYS 7 HZ2 LYS 7 -5.799 -7.524 -3.391 718 HZ3 LYS 7 HZ3 LYS 7 -5.751 -8.354 -4.862 719 H ALA 8 H ALA 8 0.014 -7.541 -4.983 720 HA ALA 8 HA ALA 8 -0.513 -4.784 -5.415 721 HB1 ALA 8 HB1 ALA 8 1.391 -4.374 -3.898 722 HB2 ALA 8 HB2 ALA 8 1.883 -6.066 -4.044 723 HB3 ALA 8 HB3 ALA 8 0.348 -5.656 -3.276 724 H GLY 9 H GLY 9 2.222 -6.850 -6.384 725 HA2 GLY 9 HA2 GLY 9 3.664 -4.973 -7.934 726 HA3 GLY 9 HA3 GLY 9 3.785 -6.719 -8.053 727 H ALA 10 H ALA 10 1.150 -7.324 -8.822 728 HA ALA 10 HA ALA 10 1.201 -7.043 -11.618 729 HB1 ALA 10 HB1 ALA 10 0.023 -8.862 -10.446 730 HB2 ALA 10 HB2 ALA 10 -1.042 -8.039 -11.588 731 HB3 ALA 10 HB3 ALA 10 -1.180 -7.714 -9.856 732 H LEU 11 H LEU 11 -0.815 -5.323 -9.205 733 HA LEU 11 HA LEU 11 -2.275 -3.702 -11.022 734 HB2 LEU 11 HB2 LEU 11 -1.665 -3.316 -8.070 735 HB3 LEU 11 HB3 LEU 11 -2.773 -2.290 -8.974 736 HG LEU 11 HG LEU 11 -3.134 -5.286 -8.565 737 HD11 LEU 11 HD11 LEU 11 -4.557 -2.985 -7.203 738 HD12 LEU 11 HD12 LEU 11 -3.389 -4.084 -6.461 739 HD13 LEU 11 HD13 LEU 11 -4.939 -4.701 -7.025 740 HD21 LEU 11 HD21 LEU 11 -5.017 -3.244 -9.800 741 HD22 LEU 11 HD22 LEU 11 -5.390 -4.943 -9.486 742 HD23 LEU 11 HD23 LEU 11 -4.148 -4.520 -10.661 743 H ALA 12 H ALA 12 0.882 -3.269 -9.516 744 HA ALA 12 HA ALA 12 1.250 -0.513 -9.686 745 HB1 ALA 12 HB1 ALA 12 3.651 -0.962 -9.622 746 HB2 ALA 12 HB2 ALA 12 3.367 -2.644 -10.097 747 HB3 ALA 12 HB3 ALA 12 2.789 -2.055 -8.537 748 H GLY 13 H GLY 13 1.518 -2.908 -12.253 749 HA2 GLY 13 HA2 GLY 13 2.653 -1.369 -14.313 750 HA3 GLY 13 HA3 GLY 13 1.563 -2.725 -14.541 751 H GLN 14 H GLN 14 -0.836 -1.897 -13.634 752 HA GLN 14 HA GLN 14 -1.698 -0.126 -15.732 753 HB2 GLN 14 HB2 GLN 14 -4.000 -0.582 -14.918 754 HB3 GLN 14 HB3 GLN 14 -3.067 -2.050 -15.192 755 HG2 GLN 14 HG2 GLN 14 -2.641 -2.156 -12.714 756 HG3 GLN 14 HG3 GLN 14 -3.742 -0.792 -12.519 757 HE21 GLN 14 HE21 GLN 14 -3.490 -4.167 -13.406 758 HE22 GLN 14 HE22 GLN 14 -5.163 -4.543 -13.223 759 H ILE 15 H ILE 15 -1.279 0.261 -12.224 760 HA ILE 15 HA ILE 15 -2.532 2.795 -11.907 761 HB ILE 15 HB ILE 15 -0.131 1.728 -10.334 762 HG12 ILE 15 HG12 ILE 15 -1.981 0.106 -10.225 763 HG13 ILE 15 HG13 ILE 15 -1.766 0.876 -8.663 764 HG21 ILE 15 HG21 ILE 15 -2.163 3.857 -9.543 765 HG22 ILE 15 HG22 ILE 15 -0.467 4.132 -9.949 766 HG23 ILE 15 HG23 ILE 15 -0.887 3.219 -8.500 767 HD11 ILE 15 HD11 ILE 15 -4.102 0.559 -9.197 768 HD12 ILE 15 HD12 ILE 15 -3.926 1.505 -10.675 769 HD13 ILE 15 HD13 ILE 15 -3.723 2.277 -9.099 770 H TRP 16 H TRP 16 0.848 1.890 -12.610 771 HA TRP 16 HA TRP 16 1.961 4.414 -13.079 772 HB2 TRP 16 HB2 TRP 16 3.247 2.254 -12.892 773 HB3 TRP 16 HB3 TRP 16 2.694 1.813 -14.502 774 HD1 TRP 16 HD1 TRP 16 5.191 4.092 -12.702 775 HE1 TRP 16 HE1 TRP 16 6.826 5.079 -14.422 776 HE3 TRP 16 HE3 TRP 16 2.950 2.467 -17.017 777 HZ2 TRP 16 HZ2 TRP 16 7.143 5.166 -17.212 778 HZ3 TRP 16 HZ3 TRP 16 3.989 3.044 -19.170 779 HH2 TRP 16 HH2 TRP 16 6.042 4.369 -19.266 780 H GLU 17 H GLU 17 0.286 2.225 -15.381 781 HA GLU 17 HA GLU 17 0.670 3.732 -17.731 782 HB2 GLU 17 HB2 GLU 17 -1.475 1.723 -16.993 783 HB3 GLU 17 HB3 GLU 17 -1.434 2.494 -18.574 784 HG2 GLU 17 HG2 GLU 17 0.744 0.759 -17.391 785 HG3 GLU 17 HG3 GLU 17 -0.420 0.263 -18.615 786 H ALA 18 H ALA 18 -1.848 4.022 -15.246 787 HA ALA 18 HA ALA 18 -3.500 5.915 -16.589 788 HB1 ALA 18 HB1 ALA 18 -3.078 5.515 -13.606 789 HB2 ALA 18 HB2 ALA 18 -4.241 4.650 -14.611 790 HB3 ALA 18 HB3 ALA 18 -4.424 6.385 -14.354 791 H LEU 19 H LEU 19 -0.612 6.269 -14.560 792 HA LEU 19 HA LEU 19 -0.569 9.172 -14.628 793 HB2 LEU 19 HB2 LEU 19 1.509 7.137 -13.741 794 HB3 LEU 19 HB3 LEU 19 1.667 8.877 -13.524 795 HG LEU 19 HG LEU 19 -0.486 7.132 -12.246 796 HD11 LEU 19 HD11 LEU 19 0.680 7.573 -10.122 797 HD12 LEU 19 HD12 LEU 19 1.963 8.419 -10.992 798 HD13 LEU 19 HD13 LEU 19 1.703 6.692 -11.256 799 HD21 LEU 19 HD21 LEU 19 -1.322 9.384 -12.685 800 HD22 LEU 19 HD22 LEU 19 0.093 10.096 -11.906 801 HD23 LEU 19 HD23 LEU 19 -1.064 9.162 -10.955 802 H ASN 20 H ASN 20 0.576 6.663 -16.720 803 HA ASN 20 HA ASN 20 2.790 7.958 -17.945 804 HB2 ASN 20 HB2 ASN 20 2.495 5.534 -18.062 805 HB3 ASN 20 HB3 ASN 20 0.970 5.715 -18.913 806 HD21 ASN 20 HD21 ASN 20 1.706 4.429 -20.612 807 HD22 ASN 20 HD22 ASN 20 2.875 4.980 -21.755 808 H GLY 21 H GLY 21 2.794 9.659 -19.293 809 HA2 GLY 21 HA2 GLY 21 2.251 11.000 -21.109 810 HA3 GLY 21 HA3 GLY 21 0.796 10.056 -21.373 811 H THR 22 H THR 22 0.991 11.100 -18.130 812 HA THR 22 HA THR 22 -0.729 13.482 -18.649 813 HB THR 22 HB THR 22 -1.966 13.043 -16.593 814 HG1 THR 22 HG1 THR 22 -0.590 10.624 -16.140 815 HG21 THR 22 HG21 THR 22 -3.054 10.873 -17.056 816 HG22 THR 22 HG22 THR 22 -1.732 10.437 -18.143 817 HG23 THR 22 HG23 THR 22 -2.799 11.784 -18.548 818 H GLU 23 H GLU 23 -0.715 15.123 -16.909 819 HA GLU 23 HA GLU 23 1.869 15.728 -15.754 820 HB2 GLU 23 HB2 GLU 23 -0.829 17.133 -15.433 821 HB3 GLU 23 HB3 GLU 23 0.701 17.758 -14.838 822 HG2 GLU 23 HG2 GLU 23 0.119 18.933 -16.847 823 HG3 GLU 23 HG3 GLU 23 1.525 17.925 -17.172 824 H GLY 24 H GLY 24 0.037 13.384 -14.803 825 HA2 GLY 24 HA2 GLY 24 0.108 12.298 -12.695 826 HA3 GLY 24 HA3 GLY 24 0.130 13.866 -11.900 827 H LEU 25 H LEU 25 -1.679 11.579 -11.489 828 HA LEU 25 HA LEU 25 -4.284 12.926 -11.934 829 HB2 LEU 25 HB2 LEU 25 -3.737 9.932 -12.152 830 HB3 LEU 25 HB3 LEU 25 -5.343 10.645 -12.101 831 HG LEU 25 HG LEU 25 -3.289 10.949 -14.330 832 HD11 LEU 25 HD11 LEU 25 -4.438 8.794 -14.318 833 HD12 LEU 25 HD12 LEU 25 -4.956 9.765 -15.692 834 HD13 LEU 25 HD13 LEU 25 -6.010 9.601 -14.282 835 HD21 LEU 25 HD21 LEU 25 -4.473 13.077 -14.086 836 HD22 LEU 25 HD22 LEU 25 -6.031 12.248 -14.114 837 HD23 LEU 25 HD23 LEU 25 -5.003 12.252 -15.552 838 H THR 26 H THR 26 -5.905 12.402 -10.324 839 HA THR 26 HA THR 26 -4.871 11.893 -7.649 840 HB THR 26 HB THR 26 -7.141 12.348 -6.854 841 HG1 THR 26 HG1 THR 26 -8.863 12.383 -8.142 842 HG21 THR 26 HG21 THR 26 -5.759 14.327 -7.368 843 HG22 THR 26 HG22 THR 26 -7.465 14.651 -7.682 844 HG23 THR 26 HG23 THR 26 -6.368 14.333 -9.028 845 H GLN 27 H GLN 27 -6.217 10.361 -6.226 846 HA GLN 27 HA GLN 27 -5.778 7.726 -6.984 847 HB2 GLN 27 HB2 GLN 27 -7.032 7.094 -4.941 848 HB3 GLN 27 HB3 GLN 27 -5.890 8.401 -4.649 849 HG2 GLN 27 HG2 GLN 27 -7.731 10.036 -4.694 850 HG3 GLN 27 HG3 GLN 27 -8.888 8.746 -5.015 851 HE21 GLN 27 HE21 GLN 27 -9.336 7.246 -3.337 852 HE22 GLN 27 HE22 GLN 27 -9.019 7.632 -1.686 853 H LYS 28 H LYS 28 -8.820 9.549 -7.077 854 HA LYS 28 HA LYS 28 -10.509 7.399 -7.914 855 HB2 LYS 28 HB2 LYS 28 -10.923 10.410 -8.067 856 HB3 LYS 28 HB3 LYS 28 -12.188 9.208 -8.341 857 HG2 LYS 28 HG2 LYS 28 -12.030 8.436 -6.035 858 HG3 LYS 28 HG3 LYS 28 -10.639 9.491 -5.743 859 HD2 LYS 28 HD2 LYS 28 -12.090 11.475 -6.163 860 HD3 LYS 28 HD3 LYS 28 -13.477 10.399 -6.372 861 HE2 LYS 28 HE2 LYS 28 -13.364 9.700 -4.061 862 HE3 LYS 28 HE3 LYS 28 -11.823 10.530 -3.825 863 HZ1 LYS 28 HZ1 LYS 28 -12.941 12.634 -4.194 864 HZ2 LYS 28 HZ2 LYS 28 -13.658 11.790 -2.913 865 HZ3 LYS 28 HZ3 LYS 28 -14.418 11.838 -4.419 866 H GLN 29 H GLN 29 -8.735 9.909 -9.725 867 HA GLN 29 HA GLN 29 -9.869 9.387 -12.296 868 HB2 GLN 29 HB2 GLN 29 -7.160 10.584 -11.573 869 HB3 GLN 29 HB3 GLN 29 -7.850 10.585 -13.197 870 HG2 GLN 29 HG2 GLN 29 -9.744 11.967 -12.353 871 HG3 GLN 29 HG3 GLN 29 -8.983 11.999 -10.762 872 HE21 GLN 29 HE21 GLN 29 -8.774 13.149 -14.062 873 HE22 GLN 29 HE22 GLN 29 -7.627 14.402 -13.756 874 H ILE 30 H ILE 30 -6.960 8.131 -10.661 875 HA ILE 30 HA ILE 30 -6.083 6.372 -12.724 876 HB ILE 30 HB ILE 30 -5.631 6.243 -9.708 877 HG12 ILE 30 HG12 ILE 30 -3.861 7.343 -11.942 878 HG13 ILE 30 HG13 ILE 30 -4.752 8.308 -10.768 879 HG21 ILE 30 HG21 ILE 30 -5.236 4.016 -10.680 880 HG22 ILE 30 HG22 ILE 30 -3.715 4.747 -10.171 881 HG23 ILE 30 HG23 ILE 30 -4.147 4.714 -11.882 882 HD11 ILE 30 HD11 ILE 30 -2.418 8.206 -10.197 883 HD12 ILE 30 HD12 ILE 30 -2.453 6.445 -10.180 884 HD13 ILE 30 HD13 ILE 30 -3.362 7.361 -8.973 885 H LYS 31 H LYS 31 -8.047 5.798 -9.792 886 HA LYS 31 HA LYS 31 -8.537 3.058 -9.980 887 HB2 LYS 31 HB2 LYS 31 -9.040 4.447 -8.012 888 HB3 LYS 31 HB3 LYS 31 -10.335 5.254 -8.888 889 HG2 LYS 31 HG2 LYS 31 -11.610 3.155 -8.981 890 HG3 LYS 31 HG3 LYS 31 -10.288 2.305 -8.167 891 HD2 LYS 31 HD2 LYS 31 -10.602 3.727 -6.167 892 HD3 LYS 31 HD3 LYS 31 -11.906 4.598 -6.983 893 HE2 LYS 31 HE2 LYS 31 -11.925 1.640 -6.281 894 HE3 LYS 31 HE3 LYS 31 -12.758 2.914 -5.398 895 HZ1 LYS 31 HZ1 LYS 31 -13.291 2.128 -8.212 896 HZ2 LYS 31 HZ2 LYS 31 -14.090 3.357 -7.368 897 HZ3 LYS 31 HZ3 LYS 31 -14.255 1.749 -6.874 898 H LYS 32 H LYS 32 -10.318 5.732 -11.469 899 HA LYS 32 HA LYS 32 -12.401 4.266 -12.734 900 HB2 LYS 32 HB2 LYS 32 -12.518 6.699 -12.349 901 HB3 LYS 32 HB3 LYS 32 -11.144 6.960 -13.411 902 HG2 LYS 32 HG2 LYS 32 -13.168 7.586 -14.565 903 HG3 LYS 32 HG3 LYS 32 -12.494 6.147 -15.336 904 HD2 LYS 32 HD2 LYS 32 -14.158 4.728 -14.223 905 HD3 LYS 32 HD3 LYS 32 -14.776 6.111 -13.311 906 HE2 LYS 32 HE2 LYS 32 -14.916 5.744 -16.328 907 HE3 LYS 32 HE3 LYS 32 -16.260 5.592 -15.193 908 HZ1 LYS 32 HZ1 LYS 32 -15.932 7.946 -14.611 909 HZ2 LYS 32 HZ2 LYS 32 -16.315 7.737 -16.244 910 HZ3 LYS 32 HZ3 LYS 32 -14.722 8.065 -15.786 911 H ALA 33 H ALA 33 -9.232 5.449 -13.907 912 HA ALA 33 HA ALA 33 -9.475 4.530 -16.598 913 HB1 ALA 33 HB1 ALA 33 -7.086 5.109 -16.788 914 HB2 ALA 33 HB2 ALA 33 -6.972 5.247 -15.029 915 HB3 ALA 33 HB3 ALA 33 -7.979 6.375 -15.939 916 H THR 34 H THR 34 -8.378 2.971 -13.664 917 HA THR 34 HA THR 34 -7.101 0.717 -15.049 918 HB THR 34 HB THR 34 -6.442 -0.041 -12.760 919 HG1 THR 34 HG1 THR 34 -7.069 2.281 -11.466 920 HG21 THR 34 HG21 THR 34 -5.752 2.874 -13.305 921 HG22 THR 34 HG22 THR 34 -4.918 1.474 -13.989 922 HG23 THR 34 HG23 THR 34 -4.854 1.777 -12.252 923 H LYS 35 H LYS 35 -10.166 1.484 -13.729 924 HA LYS 35 HA LYS 35 -12.119 0.379 -13.545 925 HB2 LYS 35 HB2 LYS 35 -11.394 -0.743 -15.695 926 HB3 LYS 35 HB3 LYS 35 -10.737 -2.064 -14.741 927 HG2 LYS 35 HG2 LYS 35 -13.033 -2.550 -13.891 928 HG3 LYS 35 HG3 LYS 35 -13.665 -1.253 -14.911 929 HD2 LYS 35 HD2 LYS 35 -12.980 -2.453 -16.931 930 HD3 LYS 35 HD3 LYS 35 -12.188 -3.705 -15.965 931 HE2 LYS 35 HE2 LYS 35 -14.362 -4.497 -16.785 932 HE3 LYS 35 HE3 LYS 35 -14.389 -4.357 -15.028 933 HZ1 LYS 35 HZ1 LYS 35 -15.520 -2.205 -15.295 934 HZ2 LYS 35 HZ2 LYS 35 -16.404 -3.484 -15.957 935 HZ3 LYS 35 HZ3 LYS 35 -15.553 -2.432 -16.969 936 H LEU 36 H LEU 36 -10.109 0.395 -11.401 937 HA LEU 36 HA LEU 36 -10.444 -2.012 -9.847 938 HB2 LEU 36 HB2 LEU 36 -9.463 0.762 -9.080 939 HB3 LEU 36 HB3 LEU 36 -9.558 -0.565 -7.931 940 HG LEU 36 HG LEU 36 -7.793 -0.482 -10.419 941 HD11 LEU 36 HD11 LEU 36 -7.036 -0.363 -7.478 942 HD12 LEU 36 HD12 LEU 36 -6.976 0.977 -8.628 943 HD13 LEU 36 HD13 LEU 36 -5.915 -0.411 -8.843 944 HD21 LEU 36 HD21 LEU 36 -8.029 -2.678 -8.326 945 HD22 LEU 36 HD22 LEU 36 -6.838 -2.615 -9.629 946 HD23 LEU 36 HD23 LEU 36 -8.548 -2.780 -10.012 947 H LYS 37 H LYS 37 -12.139 -2.602 -8.675 948 HA LYS 37 HA LYS 37 -14.537 -1.016 -8.457 949 HB2 LYS 37 HB2 LYS 37 -14.598 -3.449 -8.862 950 HB3 LYS 37 HB3 LYS 37 -13.807 -3.754 -7.319 951 HG2 LYS 37 HG2 LYS 37 -15.773 -2.970 -6.104 952 HG3 LYS 37 HG3 LYS 37 -16.547 -2.475 -7.615 953 HD2 LYS 37 HD2 LYS 37 -16.590 -4.845 -8.361 954 HD3 LYS 37 HD3 LYS 37 -15.834 -5.334 -6.840 955 HE2 LYS 37 HE2 LYS 37 -18.542 -3.969 -7.068 956 HE3 LYS 37 HE3 LYS 37 -18.303 -5.706 -6.892 957 HZ1 LYS 37 HZ1 LYS 37 -17.211 -5.276 -4.757 958 HZ2 LYS 37 HZ2 LYS 37 -18.802 -4.710 -4.781 959 HZ3 LYS 37 HZ3 LYS 37 -17.521 -3.621 -4.922 960 H ALA 38 H ALA 38 -12.225 -2.351 -6.110 961 HA ALA 38 HA ALA 38 -13.148 -0.500 -3.989 962 HB1 ALA 38 HB1 ALA 38 -11.401 -2.981 -3.774 963 HB2 ALA 38 HB2 ALA 38 -13.120 -2.892 -3.390 964 HB3 ALA 38 HB3 ALA 38 -11.956 -1.985 -2.423 965 H ASP 39 H ASP 39 -11.825 1.093 -3.241 966 HA ASP 39 HA ASP 39 -9.456 1.888 -4.623 967 HB2 ASP 39 HB2 ASP 39 -9.300 3.681 -2.847 968 HB3 ASP 39 HB3 ASP 39 -10.843 3.623 -3.695 969 H LYS 40 H LYS 40 -9.990 -0.122 -1.866 970 HA LYS 40 HA LYS 40 -7.662 0.015 -0.371 971 HB2 LYS 40 HB2 LYS 40 -9.143 -2.557 -1.045 972 HB3 LYS 40 HB3 LYS 40 -8.167 -2.246 0.392 973 HG2 LYS 40 HG2 LYS 40 -10.727 -0.758 -0.283 974 HG3 LYS 40 HG3 LYS 40 -10.665 -2.199 0.743 975 HD2 LYS 40 HD2 LYS 40 -9.195 -0.974 2.332 976 HD3 LYS 40 HD3 LYS 40 -9.281 0.457 1.300 977 HE2 LYS 40 HE2 LYS 40 -11.738 0.563 1.686 978 HE3 LYS 40 HE3 LYS 40 -11.629 -0.854 2.732 979 HZ1 LYS 40 HZ1 LYS 40 -10.137 0.422 4.181 980 HZ2 LYS 40 HZ2 LYS 40 -11.667 1.128 4.040 981 HZ3 LYS 40 HZ3 LYS 40 -10.356 1.782 3.200 982 H ASP 41 H ASP 41 -8.157 -1.560 -3.478 983 HA ASP 41 HA ASP 41 -5.715 -3.091 -3.576 984 HB2 ASP 41 HB2 ASP 41 -7.601 -2.244 -5.820 985 HB3 ASP 41 HB3 ASP 41 -6.369 -3.496 -5.931 986 H PHE 42 H PHE 42 -6.733 0.111 -4.692 987 HA PHE 42 HA PHE 42 -4.669 0.819 -6.433 988 HB2 PHE 42 HB2 PHE 42 -6.579 2.254 -6.368 989 HB3 PHE 42 HB3 PHE 42 -6.450 2.500 -4.631 990 HD1 PHE 42 HD2 PHE 42 -4.694 3.249 -7.860 991 HD2 PHE 42 HD1 PHE 42 -5.306 4.420 -3.789 992 HE1 PHE 42 HE2 PHE 42 -3.401 5.296 -8.244 993 HE2 PHE 42 HE1 PHE 42 -3.999 6.467 -4.189 994 HZ PHE 42 HZ PHE 42 -3.047 6.906 -6.420 995 H PHE 43 H PHE 43 -4.780 1.118 -2.890 996 HA PHE 43 HA PHE 43 -2.418 2.630 -2.508 997 HB2 PHE 43 HB2 PHE 43 -3.697 0.644 -0.585 998 HB3 PHE 43 HB3 PHE 43 -2.531 1.892 -0.149 999 HD1 PHE 43 HD1 PHE 43 -3.190 4.336 -0.395 1000 HD2 PHE 43 HD2 PHE 43 -6.025 1.161 -0.769 1001 HE1 PHE 43 HE1 PHE 43 -5.036 5.924 -0.059 1002 HE2 PHE 43 HE2 PHE 43 -7.857 2.751 -0.430 1003 HZ PHE 43 HZ PHE 43 -7.366 5.141 -0.077 1004 H LEU 44 H LEU 44 -2.900 -0.854 -2.851 1005 HA LEU 44 HA LEU 44 -0.238 -1.635 -2.091 1006 HB2 LEU 44 HB2 LEU 44 -2.577 -3.071 -3.368 1007 HB3 LEU 44 HB3 LEU 44 -1.007 -3.847 -3.312 1008 HG LEU 44 HG LEU 44 -1.027 -3.632 -0.802 1009 HD11 LEU 44 HD11 LEU 44 -3.906 -2.746 -1.127 1010 HD12 LEU 44 HD12 LEU 44 -2.571 -1.750 -0.543 1011 HD13 LEU 44 HD13 LEU 44 -3.100 -3.145 0.394 1012 HD21 LEU 44 HD21 LEU 44 -2.590 -5.474 -0.384 1013 HD22 LEU 44 HD22 LEU 44 -1.679 -5.746 -1.868 1014 HD23 LEU 44 HD23 LEU 44 -3.357 -5.201 -1.952 1015 H GLY 45 H GLY 45 -1.854 -0.955 -5.194 1016 HA2 GLY 45 HA2 GLY 45 0.339 -1.587 -6.927 1017 HA3 GLY 45 HA3 GLY 45 -1.025 -0.547 -7.314 1018 H LEU 46 H LEU 46 -0.830 1.504 -5.629 1019 HA LEU 46 HA LEU 46 1.115 3.266 -6.634 1020 HB2 LEU 46 HB2 LEU 46 -1.017 4.063 -5.745 1021 HB3 LEU 46 HB3 LEU 46 -0.646 3.416 -4.156 1022 HG LEU 46 HG LEU 46 1.218 5.095 -3.943 1023 HD11 LEU 46 HD11 LEU 46 1.702 5.471 -6.300 1024 HD12 LEU 46 HD12 LEU 46 1.339 6.990 -5.486 1025 HD13 LEU 46 HD13 LEU 46 0.126 6.239 -6.525 1026 HD21 LEU 46 HD21 LEU 46 -1.516 6.323 -4.436 1027 HD22 LEU 46 HD22 LEU 46 -0.207 7.038 -3.491 1028 HD23 LEU 46 HD23 LEU 46 -0.981 5.554 -2.939 1029 H GLY 47 H GLY 47 1.035 1.311 -3.722 1030 HA2 GLY 47 HA2 GLY 47 3.243 2.394 -2.300 1031 HA3 GLY 47 HA3 GLY 47 2.563 0.786 -2.083 1032 H TRP 48 H TRP 48 2.983 -0.027 -4.822 1033 HA TRP 48 HA TRP 48 5.707 -0.936 -4.732 1034 HB2 TRP 48 HB2 TRP 48 3.574 -2.146 -5.657 1035 HB3 TRP 48 HB3 TRP 48 3.856 -1.217 -7.124 1036 HD1 TRP 48 HD1 TRP 48 6.215 -1.777 -8.466 1037 HE1 TRP 48 HE1 TRP 48 7.645 -3.904 -8.484 1038 HE3 TRP 48 HE3 TRP 48 4.260 -4.108 -4.351 1039 HZ2 TRP 48 HZ2 TRP 48 7.919 -6.231 -6.964 1040 HZ3 TRP 48 HZ3 TRP 48 5.163 -6.307 -3.705 1041 HH2 TRP 48 HH2 TRP 48 6.955 -7.358 -5.000 1042 H LEU 49 H LEU 49 3.975 1.605 -6.457 1043 HA LEU 49 HA LEU 49 6.098 2.419 -8.199 1044 HB2 LEU 49 HB2 LEU 49 3.565 3.721 -7.190 1045 HB3 LEU 49 HB3 LEU 49 4.726 4.683 -8.076 1046 HG LEU 49 HG LEU 49 4.410 3.399 -10.096 1047 HD11 LEU 49 HD11 LEU 49 2.664 1.521 -8.512 1048 HD12 LEU 49 HD12 LEU 49 4.263 1.168 -9.177 1049 HD13 LEU 49 HD13 LEU 49 2.911 1.484 -10.263 1050 HD21 LEU 49 HD21 LEU 49 1.704 3.925 -8.817 1051 HD22 LEU 49 HD22 LEU 49 2.022 3.773 -10.551 1052 HD23 LEU 49 HD23 LEU 49 2.706 5.123 -9.648 1053 H LEU 50 H LEU 50 5.170 3.269 -4.903 1054 HA LEU 50 HA LEU 50 7.095 5.333 -4.463 1055 HB2 LEU 50 HB2 LEU 50 5.461 3.628 -2.552 1056 HB3 LEU 50 HB3 LEU 50 6.531 4.913 -2.002 1057 HG LEU 50 HG LEU 50 4.103 5.298 -3.807 1058 HD11 LEU 50 HD11 LEU 50 3.442 4.732 -1.511 1059 HD12 LEU 50 HD12 LEU 50 3.060 6.411 -1.884 1060 HD13 LEU 50 HD13 LEU 50 4.461 6.029 -0.877 1061 HD21 LEU 50 HD21 LEU 50 5.992 7.360 -2.609 1062 HD22 LEU 50 HD22 LEU 50 4.517 7.706 -3.511 1063 HD23 LEU 50 HD23 LEU 50 5.866 6.921 -4.315 1064 H ARG 51 H ARG 51 7.112 1.805 -3.877 1065 HA ARG 51 HA ARG 51 9.402 1.654 -2.273 1066 HB2 ARG 51 HB2 ARG 51 9.423 -0.667 -2.593 1067 HB3 ARG 51 HB3 ARG 51 7.736 -0.248 -2.779 1068 HG2 ARG 51 HG2 ARG 51 7.720 -0.784 -5.056 1069 HG3 ARG 51 HG3 ARG 51 9.441 -0.512 -5.245 1070 HD2 ARG 51 HD2 ARG 51 9.774 -2.605 -3.802 1071 HD3 ARG 51 HD3 ARG 51 8.050 -2.914 -4.062 1072 HE ARG 51 HE ARG 51 8.739 -2.644 -6.553 1073 HH11 ARG 51 HH11 ARG 51 10.605 -4.308 -4.152 1074 HH12 ARG 51 HH12 ARG 51 11.424 -5.262 -5.328 1075 HH21 ARG 51 HH21 ARG 51 9.805 -3.872 -8.001 1076 HH22 ARG 51 HH22 ARG 51 10.982 -5.020 -7.474 1077 H GLU 52 H GLU 52 9.158 1.848 -5.788 1078 HA GLU 52 HA GLU 52 12.085 1.607 -6.131 1079 HB2 GLU 52 HB2 GLU 52 9.789 1.419 -8.119 1080 HB3 GLU 52 HB3 GLU 52 11.483 1.408 -8.601 1081 HG2 GLU 52 HG2 GLU 52 11.868 -0.671 -7.403 1082 HG3 GLU 52 HG3 GLU 52 10.241 -0.633 -6.728 1083 H ASP 53 H ASP 53 9.800 4.031 -5.715 1084 HA ASP 53 HA ASP 53 9.884 6.286 -5.770 1085 HB2 ASP 53 HB2 ASP 53 12.127 5.960 -4.786 1086 HB3 ASP 53 HB3 ASP 53 12.830 5.822 -6.390 1087 H LYS 54 H LYS 54 9.190 4.780 -8.222 1088 HA LYS 54 HA LYS 54 10.157 6.396 -10.447 1089 HB2 LYS 54 HB2 LYS 54 8.777 4.954 -11.867 1090 HB3 LYS 54 HB3 LYS 54 9.796 4.008 -10.790 1091 HG2 LYS 54 HG2 LYS 54 7.756 3.720 -9.286 1092 HG3 LYS 54 HG3 LYS 54 6.800 4.462 -10.572 1093 HD2 LYS 54 HD2 LYS 54 6.634 2.024 -10.739 1094 HD3 LYS 54 HD3 LYS 54 7.521 2.649 -12.132 1095 HE2 LYS 54 HE2 LYS 54 9.665 2.041 -11.007 1096 HE3 LYS 54 HE3 LYS 54 8.753 1.369 -9.659 1097 HZ1 LYS 54 HZ1 LYS 54 9.491 -0.342 -11.153 1098 HZ2 LYS 54 HZ2 LYS 54 8.707 0.395 -12.457 1099 HZ3 LYS 54 HZ3 LYS 54 7.803 -0.250 -11.184 1100 H VAL 55 H VAL 55 7.943 6.994 -8.079 1101 HA VAL 55 HA VAL 55 6.557 9.034 -9.712 1102 HB VAL 55 HB VAL 55 4.449 8.723 -8.446 1103 HG11 VAL 55 HG11 VAL 55 4.665 7.624 -10.624 1104 HG12 VAL 55 HG12 VAL 55 3.675 6.652 -9.533 1105 HG13 VAL 55 HG13 VAL 55 5.348 6.188 -9.852 1106 HG21 VAL 55 HG21 VAL 55 4.078 6.709 -7.034 1107 HG22 VAL 55 HG22 VAL 55 5.331 7.753 -6.361 1108 HG23 VAL 55 HG23 VAL 55 5.781 6.274 -7.214 1109 H VAL 56 H VAL 56 5.719 10.854 -8.494 1110 HA VAL 56 HA VAL 56 6.772 11.291 -5.779 1111 HB VAL 56 HB VAL 56 6.510 13.772 -6.242 1112 HG11 VAL 56 HG11 VAL 56 8.576 13.995 -7.583 1113 HG12 VAL 56 HG12 VAL 56 8.454 12.296 -8.051 1114 HG13 VAL 56 HG13 VAL 56 8.723 12.729 -6.361 1115 HG21 VAL 56 HG21 VAL 56 4.894 13.640 -8.126 1116 HG22 VAL 56 HG22 VAL 56 6.124 12.886 -9.142 1117 HG23 VAL 56 HG23 VAL 56 6.330 14.554 -8.599 1118 H THR 57 H THR 57 5.347 11.751 -4.135 1119 HA THR 57 HA THR 57 2.452 11.754 -4.761 1120 HB THR 57 HB THR 57 2.216 11.283 -2.220 1121 HG1 THR 57 HG1 THR 57 4.637 11.846 -2.028 1122 HG21 THR 57 HG21 THR 57 2.655 8.868 -2.485 1123 HG22 THR 57 HG22 THR 57 3.551 9.189 -3.971 1124 HG23 THR 57 HG23 THR 57 1.821 9.534 -3.892 1125 H SER 58 H SER 58 1.049 13.168 -3.878 1126 HA SER 58 HA SER 58 1.807 15.403 -2.157 1127 HB2 SER 58 HB2 SER 58 0.596 15.822 -4.941 1128 HB3 SER 58 HB3 SER 58 0.740 17.081 -3.714 1129 HG SER 58 HG SER 58 3.119 15.826 -4.198 1130 H GLU 59 H GLU 59 -0.274 16.673 -1.565 1131 HA GLU 59 HA GLU 59 -2.720 14.986 -1.753 1132 HB2 GLU 59 HB2 GLU 59 -1.764 15.080 0.578 1133 HB3 GLU 59 HB3 GLU 59 -1.969 16.830 0.564 1134 HG2 GLU 59 HG2 GLU 59 -4.453 16.428 0.184 1135 HG3 GLU 59 HG3 GLU 59 -4.148 14.716 0.464 1136 H VAL 60 H VAL 60 -4.286 15.932 -2.898 1137 HA VAL 60 HA VAL 60 -4.510 18.894 -3.013 1138 HB VAL 60 HB VAL 60 -5.479 16.767 -4.988 1139 HG11 VAL 60 HG11 VAL 60 -7.213 18.526 -4.827 1140 HG12 VAL 60 HG12 VAL 60 -6.382 18.613 -6.379 1141 HG13 VAL 60 HG13 VAL 60 -5.995 19.773 -5.105 1142 HG21 VAL 60 HG21 VAL 60 -3.081 17.334 -5.165 1143 HG22 VAL 60 HG22 VAL 60 -3.487 19.047 -5.310 1144 HG23 VAL 60 HG23 VAL 60 -3.966 17.917 -6.580 1145 H GLU 61 H GLU 61 -5.821 19.471 -1.416 1146 HA GLU 61 HA GLU 61 -7.678 19.894 -0.205 1147 HB2 GLU 61 HB2 GLU 61 -9.203 18.660 -2.528 1148 HB3 GLU 61 HB3 GLU 61 -9.814 19.844 -1.372 1149 HG2 GLU 61 HG2 GLU 61 -8.115 21.481 -2.270 1150 HG3 GLU 61 HG3 GLU 61 -7.678 20.288 -3.479 1151 H GLY 62 H GLY 62 -6.432 17.431 0.538 1152 HA2 GLY 62 HA2 GLY 62 -6.896 15.781 2.107 1153 HA3 GLY 62 HA3 GLY 62 -8.610 16.077 1.900 1154 H GLU 63 H GLU 63 -7.157 15.557 -1.107 1155 HA GLU 63 HA GLU 63 -7.793 12.652 -1.113 1156 HB2 GLU 63 HB2 GLU 63 -9.374 14.103 -2.446 1157 HB3 GLU 63 HB3 GLU 63 -8.023 14.606 -3.458 1158 HG2 GLU 63 HG2 GLU 63 -7.707 12.304 -4.229 1159 HG3 GLU 63 HG3 GLU 63 -8.977 11.739 -3.147 1160 H ILE 64 H ILE 64 -6.381 11.266 -2.327 1161 HA ILE 64 HA ILE 64 -3.610 12.029 -2.251 1162 HB ILE 64 HB ILE 64 -4.911 9.493 -3.353 1163 HG12 ILE 64 HG12 ILE 64 -3.536 10.040 -0.685 1164 HG13 ILE 64 HG13 ILE 64 -5.262 9.779 -0.930 1165 HG21 ILE 64 HG21 ILE 64 -2.659 8.456 -3.291 1166 HG22 ILE 64 HG22 ILE 64 -1.953 10.004 -2.825 1167 HG23 ILE 64 HG23 ILE 64 -2.701 9.819 -4.412 1168 HD11 ILE 64 HD11 ILE 64 -3.066 7.754 -1.350 1169 HD12 ILE 64 HD12 ILE 64 -4.782 7.480 -1.664 1170 HD13 ILE 64 HD13 ILE 64 -4.227 7.809 -0.024 1171 H PHE 65 H PHE 65 -2.569 13.120 -3.784 1172 HA PHE 65 HA PHE 65 -3.213 12.699 -6.655 1173 HB2 PHE 65 HB2 PHE 65 -3.465 15.071 -5.923 1174 HB3 PHE 65 HB3 PHE 65 -1.804 15.076 -5.337 1175 HD1 PHE 65 HD2 PHE 65 -3.905 14.823 -8.412 1176 HD2 PHE 65 HD1 PHE 65 0.030 15.489 -6.867 1177 HE1 PHE 65 HE2 PHE 65 -3.137 15.509 -10.640 1178 HE2 PHE 65 HE1 PHE 65 0.789 16.169 -9.107 1179 HZ PHE 65 HZ PHE 65 -0.794 16.179 -10.995 1180 H VAL 66 H VAL 66 -1.630 11.786 -7.882 1181 HA VAL 66 HA VAL 66 1.167 11.804 -6.962 1182 HB VAL 66 HB VAL 66 0.276 9.685 -6.130 1183 HG11 VAL 66 HG11 VAL 66 -0.565 9.036 -8.975 1184 HG12 VAL 66 HG12 VAL 66 -1.645 9.390 -7.625 1185 HG13 VAL 66 HG13 VAL 66 -0.650 7.932 -7.597 1186 HG21 VAL 66 HG21 VAL 66 2.603 9.676 -6.937 1187 HG22 VAL 66 HG22 VAL 66 2.056 9.199 -8.546 1188 HG23 VAL 66 HG23 VAL 66 1.846 8.100 -7.183 1189 H LYS 67 H LYS 67 2.711 11.586 -8.571 1190 HA LYS 67 HA LYS 67 1.852 11.728 -11.398 1191 HB2 LYS 67 HB2 LYS 67 2.032 14.061 -10.609 1192 HB3 LYS 67 HB3 LYS 67 3.619 13.739 -9.914 1193 HG2 LYS 67 HG2 LYS 67 4.427 13.247 -12.258 1194 HG3 LYS 67 HG3 LYS 67 2.871 13.838 -12.846 1195 HD2 LYS 67 HD2 LYS 67 3.320 16.058 -11.949 1196 HD3 LYS 67 HD3 LYS 67 4.796 15.488 -11.156 1197 HE2 LYS 67 HE2 LYS 67 5.767 14.989 -13.391 1198 HE3 LYS 67 HE3 LYS 67 4.311 15.634 -14.157 1199 HZ1 LYS 67 HZ1 LYS 67 6.021 17.281 -14.133 1200 HZ2 LYS 67 HZ2 LYS 67 6.230 17.123 -12.457 1201 HZ3 LYS 67 HZ3 LYS 67 4.796 17.767 -13.071 1202 H LEU 68 H LEU 68 3.671 11.102 -12.886 1203 HA LEU 68 HA LEU 68 5.634 9.310 -11.847 1204 HB2 LEU 68 HB2 LEU 68 5.540 10.742 -14.531 1205 HB3 LEU 68 HB3 LEU 68 6.660 9.442 -14.134 1206 HG LEU 68 HG LEU 68 3.627 9.226 -14.374 1207 HD11 LEU 68 HD11 LEU 68 4.794 9.317 -16.527 1208 HD12 LEU 68 HD12 LEU 68 4.082 7.731 -16.250 1209 HD13 LEU 68 HD13 LEU 68 5.822 7.962 -16.047 1210 HD21 LEU 68 HD21 LEU 68 3.902 6.807 -13.926 1211 HD22 LEU 68 HD22 LEU 68 4.345 7.794 -12.538 1212 HD23 LEU 68 HD23 LEU 68 5.606 7.070 -13.542 1213 H VAL 69 H VAL 69 7.888 9.585 -11.537 1214 HA VAL 69 HA VAL 69 8.656 12.110 -10.386 1215 HB VAL 69 HB VAL 69 9.226 9.756 -9.530 1216 HG11 VAL 69 HG11 VAL 69 11.275 8.660 -10.350 1217 HG12 VAL 69 HG12 VAL 69 11.434 9.870 -11.623 1218 HG13 VAL 69 HG13 VAL 69 10.058 8.765 -11.627 1219 HG21 VAL 69 HG21 VAL 69 10.234 11.717 -8.480 1220 HG22 VAL 69 HG22 VAL 69 11.509 11.756 -9.700 1221 HG23 VAL 69 HG23 VAL 69 11.420 10.408 -8.565 1222 H LEU 70 H LEU 70 8.583 11.419 -13.553 1223 HA LEU 70 HA LEU 70 11.111 11.527 -14.675 1224 HB2 LEU 70 HB2 LEU 70 8.488 12.505 -15.868 1225 HB3 LEU 70 HB3 LEU 70 9.942 12.134 -16.785 1226 HG LEU 70 HG LEU 70 8.250 10.132 -15.226 1227 HD11 LEU 70 HD11 LEU 70 7.682 9.196 -17.425 1228 HD12 LEU 70 HD12 LEU 70 8.601 10.477 -18.222 1229 HD13 LEU 70 HD13 LEU 70 7.160 10.874 -17.280 1230 HD21 LEU 70 HD21 LEU 70 10.610 9.482 -15.121 1231 HD22 LEU 70 HD22 LEU 70 10.755 9.625 -16.875 1232 HD23 LEU 70 HD23 LEU 70 9.715 8.385 -16.171 1233 H GLU 71 H GLU 71 8.842 14.324 -14.301 1234 HA GLU 71 HA GLU 71 11.079 16.206 -14.162 1235 HB2 GLU 71 HB2 GLU 71 10.349 17.570 -16.078 1236 HB3 GLU 71 HB3 GLU 71 10.750 15.944 -16.594 1237 HG2 GLU 71 HG2 GLU 71 8.825 16.397 -17.833 1238 HG3 GLU 71 HG3 GLU 71 8.180 15.496 -16.463 1239 H HIS 72 H HIS 72 9.759 18.645 -14.396 1240 HA HIS 72 HA HIS 72 7.614 18.575 -12.373 1241 HB2 HIS 72 HB2 HIS 72 8.823 20.413 -11.075 1242 HB3 HIS 72 HB3 HIS 72 9.524 18.803 -10.979 1243 HD1 HIS 72 HD1 HIS 72 10.113 22.126 -12.729 1244 HD2 HIS 72 HD2 HIS 72 12.179 18.664 -11.724 1245 HE1 HIS 72 HE1 HIS 72 12.506 22.583 -13.310 1246 HE2 HIS 72 HE2 HIS 72 13.691 20.414 -12.885 1247 H HIS 73 H HIS 73 6.446 19.165 -14.529 1248 HA HIS 73 HA HIS 73 6.286 21.993 -15.076 1249 HB2 HIS 73 HB2 HIS 73 4.361 19.697 -15.620 1250 HB3 HIS 73 HB3 HIS 73 3.946 21.359 -16.010 1251 HD1 HIS 73 HD1 HIS 73 4.870 18.584 -17.783 1252 HD2 HIS 73 HD2 HIS 73 6.522 22.393 -17.600 1253 HE1 HIS 73 HE1 HIS 73 6.088 18.886 -19.954 1254 HE2 HIS 73 HE2 HIS 73 7.080 21.192 -19.822 1255 H HIS 74 H HIS 74 6.388 22.737 -12.823 1256 HA HIS 74 HA HIS 74 4.026 22.341 -11.135 1257 HB2 HIS 74 HB2 HIS 74 6.241 22.287 -10.037 1258 HB3 HIS 74 HB3 HIS 74 6.570 23.933 -10.573 1259 HD1 HIS 74 HD1 HIS 74 5.707 25.807 -9.110 1260 HD2 HIS 74 HD2 HIS 74 4.139 22.114 -8.018 1261 HE1 HIS 74 HE1 HIS 74 4.464 26.212 -6.970 1262 HE2 HIS 74 HE2 HIS 74 3.382 24.009 -6.425 1263 H HIS 75 H HIS 75 2.448 23.368 -12.346 1264 HA HIS 75 HA HIS 75 2.467 26.337 -12.308 1265 HB2 HIS 75 HB2 HIS 75 0.378 26.020 -13.824 1266 HB3 HIS 75 HB3 HIS 75 1.959 25.709 -14.527 1267 HD1 HIS 75 HD1 HIS 75 2.412 23.399 -15.423 1268 HD2 HIS 75 HD2 HIS 75 -1.177 23.621 -13.343 1269 HE1 HIS 75 HE1 HIS 75 1.266 21.205 -15.829 1270 HE2 HIS 75 HE2 HIS 75 -0.823 21.307 -14.443 1271 H HIS 76 H HIS 76 1.026 27.415 -11.020 1272 HA HIS 76 HA HIS 76 -0.293 27.846 -9.234 1273 HB2 HIS 76 HB2 HIS 76 -1.778 25.344 -10.140 1274 HB3 HIS 76 HB3 HIS 76 -2.362 26.424 -8.882 1275 HD1 HIS 76 HD1 HIS 76 -3.693 28.413 -9.620 1276 HD2 HIS 76 HD2 HIS 76 -1.674 26.627 -12.777 1277 HE1 HIS 76 HE1 HIS 76 -4.539 29.551 -11.679 1278 HE2 HIS 76 HE2 HIS 76 -3.403 28.372 -13.586 1279 H HIS 77 H HIS 77 -1.502 26.045 -7.272 1280 HA HIS 77 HA HIS 77 0.728 25.590 -5.568 1281 HB2 HIS 77 HB2 HIS 77 -1.628 26.122 -4.807 1282 HB3 HIS 77 HB3 HIS 77 -2.103 24.491 -5.253 1283 HD1 HIS 77 HD1 HIS 77 -0.754 26.458 -2.500 1284 HD2 HIS 77 HD2 HIS 77 -0.787 22.440 -3.560 1285 HE1 HIS 77 HE1 HIS 77 -0.135 25.210 -0.412 1286 HE2 HIS 77 HE2 HIS 77 -0.331 22.786 -1.039 Start of MODEL 2 1 H1 MET 1 H1 MET 1 9.593 17.642 3.671 2 H2 MET 1 H2 MET 1 11.163 18.003 4.174 3 H3 MET 1 H3 MET 1 9.920 17.895 5.311 4 HA MET 1 HA MET 1 10.979 15.701 3.641 5 HB2 MET 1 HB2 MET 1 12.530 16.379 5.419 6 HB3 MET 1 HB3 MET 1 11.262 16.213 6.624 7 HG2 MET 1 HG2 MET 1 11.177 13.792 6.221 8 HG3 MET 1 HG3 MET 1 12.406 13.946 4.966 9 HE1 MET 1 HE1 MET 1 14.962 14.468 5.430 10 HE2 MET 1 HE2 MET 1 15.594 14.905 7.016 11 HE3 MET 1 HE3 MET 1 14.498 16.000 6.173 12 H LYS 2 H LYS 2 8.590 16.663 6.124 13 HA LYS 2 HA LYS 2 7.342 14.152 6.451 14 HB2 LYS 2 HB2 LYS 2 6.570 16.979 7.065 15 HB3 LYS 2 HB3 LYS 2 5.263 15.818 7.001 16 HG2 LYS 2 HG2 LYS 2 5.852 15.977 9.275 17 HG3 LYS 2 HG3 LYS 2 6.510 14.443 8.725 18 HD2 LYS 2 HD2 LYS 2 8.285 16.887 8.787 19 HD3 LYS 2 HD3 LYS 2 7.917 16.048 10.291 20 HE2 LYS 2 HE2 LYS 2 9.241 14.812 7.851 21 HE3 LYS 2 HE3 LYS 2 10.051 15.279 9.345 22 HZ1 LYS 2 HZ1 LYS 2 8.651 13.638 10.514 23 HZ2 LYS 2 HZ2 LYS 2 9.642 12.928 9.349 24 HZ3 LYS 2 HZ3 LYS 2 8.000 13.148 9.034 25 H MET 3 H MET 3 6.898 13.060 4.609 26 HA MET 3 HA MET 3 4.761 14.035 2.789 27 HB2 MET 3 HB2 MET 3 7.332 12.621 1.938 28 HB3 MET 3 HB3 MET 3 5.975 12.957 0.871 29 HG2 MET 3 HG2 MET 3 6.348 15.338 1.056 30 HG3 MET 3 HG3 MET 3 7.604 15.090 2.272 31 HE1 MET 3 HE1 MET 3 10.475 13.439 0.159 32 HE2 MET 3 HE2 MET 3 9.248 12.600 1.107 33 HE3 MET 3 HE3 MET 3 10.005 14.062 1.740 34 H LEU 4 H LEU 4 3.674 12.197 1.596 35 HA LEU 4 HA LEU 4 2.953 9.998 3.209 36 HB2 LEU 4 HB2 LEU 4 2.697 10.362 0.204 37 HB3 LEU 4 HB3 LEU 4 2.064 8.958 1.041 38 HG LEU 4 HG LEU 4 0.609 10.556 2.407 39 HD11 LEU 4 HD11 LEU 4 0.148 12.778 1.501 40 HD12 LEU 4 HD12 LEU 4 1.410 12.566 0.287 41 HD13 LEU 4 HD13 LEU 4 1.836 12.641 1.996 42 HD21 LEU 4 HD21 LEU 4 -0.307 9.185 0.587 43 HD22 LEU 4 HD22 LEU 4 0.119 10.433 -0.588 44 HD23 LEU 4 HD23 LEU 4 -1.099 10.762 0.647 45 H LYS 5 H LYS 5 5.503 10.329 0.819 46 HA LYS 5 HA LYS 5 6.502 7.700 0.616 47 HB2 LYS 5 HB2 LYS 5 7.248 9.469 -0.870 48 HB3 LYS 5 HB3 LYS 5 7.817 10.438 0.482 49 HG2 LYS 5 HG2 LYS 5 9.714 9.542 -0.685 50 HG3 LYS 5 HG3 LYS 5 9.609 8.782 0.903 51 HD2 LYS 5 HD2 LYS 5 8.562 6.765 -0.193 52 HD3 LYS 5 HD3 LYS 5 8.817 7.534 -1.767 53 HE2 LYS 5 HE2 LYS 5 11.277 7.620 -1.265 54 HE3 LYS 5 HE3 LYS 5 10.969 6.739 0.230 55 HZ1 LYS 5 HZ1 LYS 5 11.704 5.252 -1.443 56 HZ2 LYS 5 HZ2 LYS 5 10.522 5.774 -2.535 57 HZ3 LYS 5 HZ3 LYS 5 10.071 4.918 -1.135 58 H GLU 6 H GLU 6 7.287 10.293 2.929 59 HA GLU 6 HA GLU 6 9.462 8.904 4.165 60 HB2 GLU 6 HB2 GLU 6 9.520 11.307 3.872 61 HB3 GLU 6 HB3 GLU 6 8.055 11.516 4.811 62 HG2 GLU 6 HG2 GLU 6 10.498 10.328 6.120 63 HG3 GLU 6 HG3 GLU 6 10.426 12.062 5.839 64 H LYS 7 H LYS 7 6.220 9.897 5.370 65 HA LYS 7 HA LYS 7 6.338 8.666 7.892 66 HB2 LYS 7 HB2 LYS 7 3.871 8.706 7.909 67 HB3 LYS 7 HB3 LYS 7 4.554 10.232 7.365 68 HG2 LYS 7 HG2 LYS 7 3.915 9.870 5.121 69 HG3 LYS 7 HG3 LYS 7 3.653 8.145 5.371 70 HD2 LYS 7 HD2 LYS 7 1.539 9.384 5.135 71 HD3 LYS 7 HD3 LYS 7 1.678 8.589 6.704 72 HE2 LYS 7 HE2 LYS 7 0.720 10.886 6.877 73 HE3 LYS 7 HE3 LYS 7 2.221 10.720 7.783 74 HZ1 LYS 7 HZ1 LYS 7 2.163 12.790 6.583 75 HZ2 LYS 7 HZ2 LYS 7 1.912 11.989 5.118 76 HZ3 LYS 7 HZ3 LYS 7 3.379 11.806 5.937 77 H ALA 8 H ALA 8 5.550 7.249 4.733 78 HA ALA 8 HA ALA 8 4.407 4.811 5.504 79 HB1 ALA 8 HB1 ALA 8 6.231 5.332 3.129 80 HB2 ALA 8 HB2 ALA 8 4.490 5.632 3.184 81 HB3 ALA 8 HB3 ALA 8 5.099 3.978 3.299 82 H GLY 9 H GLY 9 7.786 5.807 5.433 83 HA2 GLY 9 HA2 GLY 9 8.961 3.251 6.034 84 HA3 GLY 9 HA3 GLY 9 9.742 4.817 6.155 85 H ALA 10 H ALA 10 7.952 6.028 8.016 86 HA ALA 10 HA ALA 10 8.982 5.107 10.516 87 HB1 ALA 10 HB1 ALA 10 8.421 7.472 10.110 88 HB2 ALA 10 HB2 ALA 10 7.547 6.852 11.515 89 HB3 ALA 10 HB3 ALA 10 6.712 7.056 9.972 90 H LEU 11 H LEU 11 5.693 5.066 9.158 91 HA LEU 11 HA LEU 11 4.341 3.561 11.075 92 HB2 LEU 11 HB2 LEU 11 3.861 3.672 8.070 93 HB3 LEU 11 HB3 LEU 11 2.703 3.074 9.251 94 HG LEU 11 HG LEU 11 3.712 5.949 9.118 95 HD11 LEU 11 HD11 LEU 11 1.505 6.542 8.234 96 HD12 LEU 11 HD12 LEU 11 1.056 4.836 8.171 97 HD13 LEU 11 HD13 LEU 11 2.363 5.444 7.152 98 HD21 LEU 11 HD21 LEU 11 3.062 5.286 11.392 99 HD22 LEU 11 HD22 LEU 11 1.484 4.755 10.803 100 HD23 LEU 11 HD23 LEU 11 1.928 6.462 10.725 101 H ALA 12 H ALA 12 6.239 2.522 8.251 102 HA ALA 12 HA ALA 12 5.746 -0.231 8.258 103 HB1 ALA 12 HB1 ALA 12 8.362 1.140 7.557 104 HB2 ALA 12 HB2 ALA 12 6.985 0.930 6.477 105 HB3 ALA 12 HB3 ALA 12 7.859 -0.488 7.057 106 H GLY 13 H GLY 13 8.231 1.587 10.040 107 HA2 GLY 13 HA2 GLY 13 9.669 -0.529 11.164 108 HA3 GLY 13 HA3 GLY 13 9.554 1.084 11.838 109 H GLN 14 H GLN 14 7.035 1.358 12.667 110 HA GLN 14 HA GLN 14 6.971 -0.158 15.081 111 HB2 GLN 14 HB2 GLN 14 4.871 1.106 15.569 112 HB3 GLN 14 HB3 GLN 14 6.220 2.134 15.098 113 HG2 GLN 14 HG2 GLN 14 5.275 2.303 12.810 114 HG3 GLN 14 HG3 GLN 14 3.906 1.317 13.320 115 HE21 GLN 14 HE21 GLN 14 2.497 3.015 12.766 116 HE22 GLN 14 HE22 GLN 14 2.309 4.400 13.774 117 H ILE 15 H ILE 15 5.113 -0.465 12.040 118 HA ILE 15 HA ILE 15 3.232 -2.392 12.977 119 HB ILE 15 HB ILE 15 4.214 -1.796 10.158 120 HG12 ILE 15 HG12 ILE 15 1.552 -1.171 11.519 121 HG13 ILE 15 HG13 ILE 15 2.858 -0.011 11.298 122 HG21 ILE 15 HG21 ILE 15 1.946 -3.667 10.940 123 HG22 ILE 15 HG22 ILE 15 3.469 -4.143 10.186 124 HG23 ILE 15 HG23 ILE 15 2.319 -3.148 9.295 125 HD11 ILE 15 HD11 ILE 15 2.599 -0.229 8.852 126 HD12 ILE 15 HD12 ILE 15 1.131 0.335 9.651 127 HD13 ILE 15 HD13 ILE 15 1.251 -1.339 9.115 128 H TRP 16 H TRP 16 6.340 -2.800 11.233 129 HA TRP 16 HA TRP 16 6.367 -5.614 11.161 130 HB2 TRP 16 HB2 TRP 16 7.872 -4.128 9.798 131 HB3 TRP 16 HB3 TRP 16 8.798 -3.766 11.253 132 HD1 TRP 16 HD1 TRP 16 8.177 -6.563 8.715 133 HE1 TRP 16 HE1 TRP 16 9.962 -8.390 9.001 134 HE3 TRP 16 HE3 TRP 16 10.450 -4.825 12.955 135 HZ2 TRP 16 HZ2 TRP 16 12.067 -9.008 10.772 136 HZ3 TRP 16 HZ3 TRP 16 12.341 -6.088 13.883 137 HH2 TRP 16 HH2 TRP 16 13.132 -8.140 12.818 138 H GLU 17 H GLU 17 7.779 -3.386 13.569 139 HA GLU 17 HA GLU 17 8.917 -5.301 15.304 140 HB2 GLU 17 HB2 GLU 17 7.908 -2.475 15.714 141 HB3 GLU 17 HB3 GLU 17 8.618 -3.387 17.038 142 HG2 GLU 17 HG2 GLU 17 10.101 -2.942 14.438 143 HG3 GLU 17 HG3 GLU 17 10.129 -1.753 15.737 144 H ALA 18 H ALA 18 5.594 -4.082 15.078 145 HA ALA 18 HA ALA 18 4.620 -5.369 17.467 146 HB1 ALA 18 HB1 ALA 18 3.091 -4.318 15.065 147 HB2 ALA 18 HB2 ALA 18 3.512 -3.395 16.508 148 HB3 ALA 18 HB3 ALA 18 2.393 -4.754 16.630 149 H LEU 19 H LEU 19 4.861 -6.278 14.057 150 HA LEU 19 HA LEU 19 3.473 -8.791 14.248 151 HB2 LEU 19 HB2 LEU 19 5.466 -7.713 12.220 152 HB3 LEU 19 HB3 LEU 19 4.619 -9.239 12.028 153 HG LEU 19 HG LEU 19 3.234 -6.531 12.200 154 HD11 LEU 19 HD11 LEU 19 2.871 -6.726 9.779 155 HD12 LEU 19 HD12 LEU 19 3.840 -8.201 9.734 156 HD13 LEU 19 HD13 LEU 19 4.591 -6.661 10.163 157 HD21 LEU 19 HD21 LEU 19 2.151 -9.279 11.483 158 HD22 LEU 19 HD22 LEU 19 1.246 -7.766 11.403 159 HD23 LEU 19 HD23 LEU 19 1.810 -8.369 12.956 160 H ASN 20 H ASN 20 6.722 -7.743 14.980 161 HA ASN 20 HA ASN 20 8.027 -10.262 14.584 162 HB2 ASN 20 HB2 ASN 20 9.164 -8.006 14.430 163 HB3 ASN 20 HB3 ASN 20 9.077 -7.887 16.184 164 HD21 ASN 20 HD21 ASN 20 10.592 -9.497 13.504 165 HD22 ASN 20 HD22 ASN 20 11.826 -10.282 14.414 166 H GLY 21 H GLY 21 8.677 -11.806 16.032 167 HA2 GLY 21 HA2 GLY 21 8.853 -12.947 18.062 168 HA3 GLY 21 HA3 GLY 21 7.992 -11.650 18.877 169 H THR 22 H THR 22 6.222 -12.357 16.160 170 HA THR 22 HA THR 22 4.556 -14.425 17.499 171 HB THR 22 HB THR 22 2.515 -13.334 16.893 172 HG1 THR 22 HG1 THR 22 3.863 -11.231 15.558 173 HG21 THR 22 HG21 THR 22 2.609 -11.097 17.943 174 HG22 THR 22 HG22 THR 22 4.371 -11.123 17.856 175 HG23 THR 22 HG23 THR 22 3.522 -12.280 18.883 176 H GLU 23 H GLU 23 2.843 -15.242 15.779 177 HA GLU 23 HA GLU 23 4.262 -16.261 13.467 178 HB2 GLU 23 HB2 GLU 23 1.334 -16.612 14.210 179 HB3 GLU 23 HB3 GLU 23 2.255 -17.609 13.090 180 HG2 GLU 23 HG2 GLU 23 2.690 -17.402 16.083 181 HG3 GLU 23 HG3 GLU 23 1.895 -18.732 15.249 182 H GLY 24 H GLY 24 2.994 -13.281 13.828 183 HA2 GLY 24 HA2 GLY 24 2.467 -11.716 12.133 184 HA3 GLY 24 HA3 GLY 24 1.938 -13.023 11.086 185 H LEU 25 H LEU 25 0.528 -10.497 11.890 186 HA LEU 25 HA LEU 25 -1.820 -11.597 13.350 187 HB2 LEU 25 HB2 LEU 25 -0.711 -8.765 13.383 188 HB3 LEU 25 HB3 LEU 25 -2.274 -9.192 14.043 189 HG LEU 25 HG LEU 25 -0.842 -8.993 15.898 190 HD11 LEU 25 HD11 LEU 25 -0.776 -11.198 16.924 191 HD12 LEU 25 HD12 LEU 25 -1.024 -11.960 15.352 192 HD13 LEU 25 HD13 LEU 25 -2.287 -10.941 16.049 193 HD21 LEU 25 HD21 LEU 25 1.340 -10.057 16.155 194 HD22 LEU 25 HD22 LEU 25 1.312 -8.987 14.757 195 HD23 LEU 25 HD23 LEU 25 1.223 -10.735 14.529 196 H THR 26 H THR 26 -3.913 -10.563 12.870 197 HA THR 26 HA THR 26 -4.392 -10.074 10.033 198 HB THR 26 HB THR 26 -6.776 -9.892 10.648 199 HG1 THR 26 HG1 THR 26 -7.457 -9.826 12.726 200 HG21 THR 26 HG21 THR 26 -7.182 -12.134 11.560 201 HG22 THR 26 HG22 THR 26 -5.494 -12.253 12.064 202 HG23 THR 26 HG23 THR 26 -5.903 -12.177 10.346 203 H GLN 27 H GLN 27 -5.766 -8.111 9.398 204 HA GLN 27 HA GLN 27 -4.417 -5.709 9.822 205 HB2 GLN 27 HB2 GLN 27 -5.927 -6.133 7.906 206 HB3 GLN 27 HB3 GLN 27 -7.321 -6.085 8.977 207 HG2 GLN 27 HG2 GLN 27 -6.848 -3.691 9.455 208 HG3 GLN 27 HG3 GLN 27 -5.481 -3.754 8.344 209 HE21 GLN 27 HE21 GLN 27 -7.927 -2.115 8.255 210 HE22 GLN 27 HE22 GLN 27 -8.661 -2.437 6.730 211 H LYS 28 H LYS 28 -7.363 -6.883 11.455 212 HA LYS 28 HA LYS 28 -7.898 -4.694 13.136 213 HB2 LYS 28 HB2 LYS 28 -8.384 -7.654 13.621 214 HB3 LYS 28 HB3 LYS 28 -9.090 -6.363 14.590 215 HG2 LYS 28 HG2 LYS 28 -9.562 -6.772 11.619 216 HG3 LYS 28 HG3 LYS 28 -10.660 -7.285 12.899 217 HD2 LYS 28 HD2 LYS 28 -9.850 -4.395 12.359 218 HD3 LYS 28 HD3 LYS 28 -11.348 -5.142 11.800 219 HE2 LYS 28 HE2 LYS 28 -12.029 -5.526 14.150 220 HE3 LYS 28 HE3 LYS 28 -10.531 -4.775 14.705 221 HZ1 LYS 28 HZ1 LYS 28 -12.658 -3.443 13.128 222 HZ2 LYS 28 HZ2 LYS 28 -11.230 -2.718 13.673 223 HZ3 LYS 28 HZ3 LYS 28 -12.384 -3.258 14.785 224 H GLN 29 H GLN 29 -5.924 -7.603 13.874 225 HA GLN 29 HA GLN 29 -5.297 -6.869 16.555 226 HB2 GLN 29 HB2 GLN 29 -3.924 -8.831 14.683 227 HB3 GLN 29 HB3 GLN 29 -3.598 -8.709 16.409 228 HG2 GLN 29 HG2 GLN 29 -6.304 -9.422 15.235 229 HG3 GLN 29 HG3 GLN 29 -5.100 -10.599 15.750 230 HE21 GLN 29 HE21 GLN 29 -6.458 -11.488 17.307 231 HE22 GLN 29 HE22 GLN 29 -6.871 -10.674 18.766 232 H ILE 30 H ILE 30 -3.561 -6.394 13.502 233 HA ILE 30 HA ILE 30 -1.178 -5.231 14.525 234 HB ILE 30 HB ILE 30 -2.571 -4.749 11.847 235 HG12 ILE 30 HG12 ILE 30 -0.283 -6.667 12.453 236 HG13 ILE 30 HG13 ILE 30 -1.970 -7.159 12.390 237 HG21 ILE 30 HG21 ILE 30 -0.925 -2.970 12.291 238 HG22 ILE 30 HG22 ILE 30 -0.356 -4.024 10.995 239 HG23 ILE 30 HG23 ILE 30 0.320 -4.179 12.619 240 HD11 ILE 30 HD11 ILE 30 -2.070 -6.496 10.041 241 HD12 ILE 30 HD12 ILE 30 -0.825 -7.706 10.345 242 HD13 ILE 30 HD13 ILE 30 -0.371 -6.019 10.109 243 H LYS 31 H LYS 31 -4.296 -3.875 13.538 244 HA LYS 31 HA LYS 31 -3.620 -1.116 13.811 245 HB2 LYS 31 HB2 LYS 31 -5.547 -2.281 12.470 246 HB3 LYS 31 HB3 LYS 31 -6.455 -2.185 13.972 247 HG2 LYS 31 HG2 LYS 31 -6.372 0.235 13.942 248 HG3 LYS 31 HG3 LYS 31 -5.228 0.224 12.592 249 HD2 LYS 31 HD2 LYS 31 -7.014 -0.917 11.200 250 HD3 LYS 31 HD3 LYS 31 -8.143 -0.653 12.532 251 HE2 LYS 31 HE2 LYS 31 -6.663 1.551 11.059 252 HE3 LYS 31 HE3 LYS 31 -8.315 1.044 10.711 253 HZ1 LYS 31 HZ1 LYS 31 -8.330 2.969 12.098 254 HZ2 LYS 31 HZ2 LYS 31 -7.336 2.231 13.249 255 HZ3 LYS 31 HZ3 LYS 31 -8.907 1.657 12.993 256 H LYS 32 H LYS 32 -4.878 -3.522 16.076 257 HA LYS 32 HA LYS 32 -5.313 -1.773 18.305 258 HB2 LYS 32 HB2 LYS 32 -4.593 -4.734 18.238 259 HB3 LYS 32 HB3 LYS 32 -5.106 -3.867 19.682 260 HG2 LYS 32 HG2 LYS 32 -6.798 -4.185 17.190 261 HG3 LYS 32 HG3 LYS 32 -6.897 -5.243 18.595 262 HD2 LYS 32 HD2 LYS 32 -7.337 -2.243 18.815 263 HD3 LYS 32 HD3 LYS 32 -8.643 -3.344 18.384 264 HE2 LYS 32 HE2 LYS 32 -8.772 -2.915 20.758 265 HE3 LYS 32 HE3 LYS 32 -8.247 -4.579 20.533 266 HZ1 LYS 32 HZ1 LYS 32 -7.059 -3.383 22.285 267 HZ2 LYS 32 HZ2 LYS 32 -6.430 -2.323 21.135 268 HZ3 LYS 32 HZ3 LYS 32 -6.028 -3.963 21.082 269 H ALA 33 H ALA 33 -2.550 -3.850 17.391 270 HA ALA 33 HA ALA 33 -0.885 -3.313 19.603 271 HB1 ALA 33 HB1 ALA 33 0.882 -4.398 18.295 272 HB2 ALA 33 HB2 ALA 33 -0.083 -4.235 16.822 273 HB3 ALA 33 HB3 ALA 33 -0.641 -5.273 18.137 274 H THR 34 H THR 34 -1.137 -1.662 16.491 275 HA THR 34 HA THR 34 1.076 0.201 17.155 276 HB THR 34 HB THR 34 0.972 0.878 14.764 277 HG1 THR 34 HG1 THR 34 -0.660 -1.214 13.987 278 HG21 THR 34 HG21 THR 34 2.462 -1.007 15.368 279 HG22 THR 34 HG22 THR 34 1.787 -1.215 13.752 280 HG23 THR 34 HG23 THR 34 1.134 -2.145 15.102 281 H LYS 35 H LYS 35 -2.318 0.017 17.134 282 HA LYS 35 HA LYS 35 -4.058 1.383 17.313 283 HB2 LYS 35 HB2 LYS 35 -3.953 3.194 18.968 284 HB3 LYS 35 HB3 LYS 35 -3.186 1.718 19.526 285 HG2 LYS 35 HG2 LYS 35 -0.956 2.729 19.100 286 HG3 LYS 35 HG3 LYS 35 -1.746 4.213 18.561 287 HD2 LYS 35 HD2 LYS 35 -0.947 4.374 20.904 288 HD3 LYS 35 HD3 LYS 35 -2.699 4.558 20.791 289 HE2 LYS 35 HE2 LYS 35 -2.976 2.185 21.491 290 HE3 LYS 35 HE3 LYS 35 -1.224 2.026 21.622 291 HZ1 LYS 35 HZ1 LYS 35 -2.880 3.911 23.195 292 HZ2 LYS 35 HZ2 LYS 35 -1.221 3.646 23.368 293 HZ3 LYS 35 HZ3 LYS 35 -2.317 2.417 23.745 294 H LEU 36 H LEU 36 -2.934 1.663 14.906 295 HA LEU 36 HA LEU 36 -2.632 4.328 13.963 296 HB2 LEU 36 HB2 LEU 36 -3.450 1.802 12.471 297 HB3 LEU 36 HB3 LEU 36 -3.028 3.323 11.689 298 HG LEU 36 HG LEU 36 -1.144 1.667 13.413 299 HD11 LEU 36 HD11 LEU 36 -1.628 0.534 11.305 300 HD12 LEU 36 HD12 LEU 36 0.030 1.124 11.335 301 HD13 LEU 36 HD13 LEU 36 -1.195 1.986 10.399 302 HD21 LEU 36 HD21 LEU 36 -0.614 4.052 13.553 303 HD22 LEU 36 HD22 LEU 36 -0.584 4.175 11.793 304 HD23 LEU 36 HD23 LEU 36 0.622 3.197 12.634 305 H LYS 37 H LYS 37 -4.058 5.792 13.141 306 HA LYS 37 HA LYS 37 -6.762 5.780 14.089 307 HB2 LYS 37 HB2 LYS 37 -5.432 7.676 12.110 308 HB3 LYS 37 HB3 LYS 37 -6.921 7.992 13.001 309 HG2 LYS 37 HG2 LYS 37 -5.697 8.073 15.102 310 HG3 LYS 37 HG3 LYS 37 -4.199 7.594 14.288 311 HD2 LYS 37 HD2 LYS 37 -4.282 9.693 12.944 312 HD3 LYS 37 HD3 LYS 37 -5.751 10.174 13.804 313 HE2 LYS 37 HE2 LYS 37 -3.710 11.280 14.690 314 HE3 LYS 37 HE3 LYS 37 -4.525 10.295 15.906 315 HZ1 LYS 37 HZ1 LYS 37 -2.111 10.022 15.927 316 HZ2 LYS 37 HZ2 LYS 37 -2.147 9.441 14.340 317 HZ3 LYS 37 HZ3 LYS 37 -2.897 8.568 15.576 318 H ALA 38 H ALA 38 -5.449 6.066 10.790 319 HA ALA 38 HA ALA 38 -7.923 5.020 9.582 320 HB1 ALA 38 HB1 ALA 38 -6.913 5.752 7.432 321 HB2 ALA 38 HB2 ALA 38 -5.453 6.260 8.297 322 HB3 ALA 38 HB3 ALA 38 -6.991 7.068 8.608 323 H ASP 39 H ASP 39 -7.985 3.143 8.408 324 HA ASP 39 HA ASP 39 -6.058 1.081 8.502 325 HB2 ASP 39 HB2 ASP 39 -7.368 0.194 6.456 326 HB3 ASP 39 HB3 ASP 39 -8.282 0.450 7.940 327 H LYS 40 H LYS 40 -6.371 3.849 6.429 328 HA LYS 40 HA LYS 40 -4.593 3.233 4.344 329 HB2 LYS 40 HB2 LYS 40 -5.203 5.958 5.555 330 HB3 LYS 40 HB3 LYS 40 -4.438 5.682 3.989 331 HG2 LYS 40 HG2 LYS 40 -6.524 4.472 3.270 332 HG3 LYS 40 HG3 LYS 40 -7.274 4.960 4.787 333 HD2 LYS 40 HD2 LYS 40 -7.074 7.304 4.197 334 HD3 LYS 40 HD3 LYS 40 -6.138 6.920 2.752 335 HE2 LYS 40 HE2 LYS 40 -8.141 5.760 1.806 336 HE3 LYS 40 HE3 LYS 40 -9.058 6.214 3.244 337 HZ1 LYS 40 HZ1 LYS 40 -9.431 7.705 1.357 338 HZ2 LYS 40 HZ2 LYS 40 -7.796 8.136 1.374 339 HZ3 LYS 40 HZ3 LYS 40 -8.781 8.511 2.690 340 H ASP 41 H ASP 41 -3.924 4.310 7.649 341 HA ASP 41 HA ASP 41 -1.166 4.935 7.341 342 HB2 ASP 41 HB2 ASP 41 -2.550 3.767 9.791 343 HB3 ASP 41 HB3 ASP 41 -0.997 4.596 9.780 344 H PHE 42 H PHE 42 -2.910 1.915 8.021 345 HA PHE 42 HA PHE 42 -0.639 0.214 8.270 346 HB2 PHE 42 HB2 PHE 42 -2.740 -0.523 9.223 347 HB3 PHE 42 HB3 PHE 42 -3.562 -0.395 7.673 348 HD1 PHE 42 HD1 PHE 42 -0.518 -2.145 9.060 349 HD2 PHE 42 HD2 PHE 42 -4.028 -2.442 6.629 350 HE1 PHE 42 HE1 PHE 42 -0.010 -4.503 8.608 351 HE2 PHE 42 HE2 PHE 42 -3.518 -4.807 6.190 352 HZ PHE 42 HZ PHE 42 -1.506 -5.840 7.178 353 H PHE 43 H PHE 43 -2.617 1.211 5.478 354 HA PHE 43 HA PHE 43 -1.506 -0.658 3.626 355 HB2 PHE 43 HB2 PHE 43 -2.897 1.995 3.109 356 HB3 PHE 43 HB3 PHE 43 -2.531 0.794 1.872 357 HD1 PHE 43 HD2 PHE 43 -3.249 -1.750 3.255 358 HD2 PHE 43 HD1 PHE 43 -5.258 2.021 3.203 359 HE1 PHE 43 HE2 PHE 43 -5.390 -2.868 3.684 360 HE2 PHE 43 HE1 PHE 43 -7.387 0.890 3.622 361 HZ PHE 43 HZ PHE 43 -7.460 -1.559 3.863 362 H LEU 44 H LEU 44 -0.592 2.705 4.437 363 HA LEU 44 HA LEU 44 1.530 2.901 2.513 364 HB2 LEU 44 HB2 LEU 44 0.679 4.512 4.910 365 HB3 LEU 44 HB3 LEU 44 2.298 4.772 4.287 366 HG LEU 44 HG LEU 44 1.381 5.416 2.083 367 HD11 LEU 44 HD11 LEU 44 -1.381 5.095 3.290 368 HD12 LEU 44 HD12 LEU 44 -0.669 4.072 2.041 369 HD13 LEU 44 HD13 LEU 44 -1.006 5.767 1.700 370 HD21 LEU 44 HD21 LEU 44 1.781 7.169 3.749 371 HD22 LEU 44 HD22 LEU 44 0.132 6.989 4.355 372 HD23 LEU 44 HD23 LEU 44 0.412 7.578 2.714 373 H GLY 45 H GLY 45 1.438 2.020 5.972 374 HA2 GLY 45 HA2 GLY 45 4.185 1.555 6.406 375 HA3 GLY 45 HA3 GLY 45 2.873 0.803 7.294 376 H LEU 46 H LEU 46 1.653 -0.851 5.650 377 HA LEU 46 HA LEU 46 3.310 -3.109 5.319 378 HB2 LEU 46 HB2 LEU 46 0.890 -3.291 5.701 379 HB3 LEU 46 HB3 LEU 46 0.562 -2.522 4.158 380 HG LEU 46 HG LEU 46 1.580 -4.495 2.987 381 HD11 LEU 46 HD11 LEU 46 2.022 -6.575 4.202 382 HD12 LEU 46 HD12 LEU 46 1.721 -5.759 5.738 383 HD13 LEU 46 HD13 LEU 46 3.094 -5.280 4.736 384 HD21 LEU 46 HD21 LEU 46 -0.298 -6.034 3.336 385 HD22 LEU 46 HD22 LEU 46 -0.855 -4.363 3.287 386 HD23 LEU 46 HD23 LEU 46 -0.724 -5.202 4.834 387 H GLY 47 H GLY 47 2.324 -0.591 3.048 388 HA2 GLY 47 HA2 GLY 47 3.202 -1.748 0.612 389 HA3 GLY 47 HA3 GLY 47 3.056 -0.024 0.933 390 H TRP 48 H TRP 48 4.910 0.071 3.123 391 HA TRP 48 HA TRP 48 7.451 0.070 1.765 392 HB2 TRP 48 HB2 TRP 48 6.640 1.743 3.549 393 HB3 TRP 48 HB3 TRP 48 7.001 0.501 4.738 394 HD1 TRP 48 HD1 TRP 48 9.685 -0.099 5.077 395 HE1 TRP 48 HE1 TRP 48 11.785 1.304 4.598 396 HE3 TRP 48 HE3 TRP 48 7.615 3.468 2.055 397 HZ2 TRP 48 HZ2 TRP 48 12.477 3.636 3.166 398 HZ3 TRP 48 HZ3 TRP 48 9.057 5.259 1.179 399 HH2 TRP 48 HH2 TRP 48 11.437 5.346 1.725 400 H LEU 49 H LEU 49 5.892 -2.006 4.257 401 HA LEU 49 HA LEU 49 8.001 -3.775 4.802 402 HB2 LEU 49 HB2 LEU 49 5.001 -4.070 4.814 403 HB3 LEU 49 HB3 LEU 49 5.960 -5.523 4.977 404 HG LEU 49 HG LEU 49 6.883 -4.809 7.086 405 HD11 LEU 49 HD11 LEU 49 6.418 -2.653 8.109 406 HD12 LEU 49 HD12 LEU 49 5.557 -2.142 6.649 407 HD13 LEU 49 HD13 LEU 49 7.290 -2.475 6.587 408 HD21 LEU 49 HD21 LEU 49 3.933 -4.085 7.078 409 HD22 LEU 49 HD22 LEU 49 4.891 -4.561 8.483 410 HD23 LEU 49 HD23 LEU 49 4.582 -5.722 7.196 411 H LEU 50 H LEU 50 5.823 -3.697 2.018 412 HA LEU 50 HA LEU 50 6.702 -6.054 0.714 413 HB2 LEU 50 HB2 LEU 50 5.500 -3.524 -0.469 414 HB3 LEU 50 HB3 LEU 50 5.718 -5.028 -1.352 415 HG LEU 50 HG LEU 50 3.874 -4.621 1.043 416 HD11 LEU 50 HD11 LEU 50 2.040 -4.987 -0.565 417 HD12 LEU 50 HD12 LEU 50 3.208 -5.050 -1.889 418 HD13 LEU 50 HD13 LEU 50 2.995 -3.560 -0.967 419 HD21 LEU 50 HD21 LEU 50 4.342 -7.129 -0.608 420 HD22 LEU 50 HD22 LEU 50 3.098 -6.930 0.630 421 HD23 LEU 50 HD23 LEU 50 4.801 -6.885 1.080 422 H ARG 51 H ARG 51 7.918 -2.646 0.439 423 HA ARG 51 HA ARG 51 9.906 -3.353 -1.554 424 HB2 ARG 51 HB2 ARG 51 10.744 -1.079 -1.389 425 HB3 ARG 51 HB3 ARG 51 8.999 -1.064 -1.457 426 HG2 ARG 51 HG2 ARG 51 9.397 0.584 0.111 427 HG3 ARG 51 HG3 ARG 51 9.140 -0.814 1.140 428 HD2 ARG 51 HD2 ARG 51 11.023 0.371 2.026 429 HD3 ARG 51 HD3 ARG 51 11.659 -1.084 1.257 430 HE ARG 51 HE ARG 51 11.652 1.205 -0.474 431 HH11 ARG 51 HH11 ARG 51 13.528 -0.460 1.888 432 HH12 ARG 51 HH12 ARG 51 14.984 0.351 1.436 433 HH21 ARG 51 HH21 ARG 51 13.507 2.232 -1.019 434 HH22 ARG 51 HH22 ARG 51 14.970 1.869 -0.179 435 H GLU 52 H GLU 52 9.754 -3.613 1.854 436 HA GLU 52 HA GLU 52 12.624 -3.823 2.306 437 HB2 GLU 52 HB2 GLU 52 10.209 -4.421 4.061 438 HB3 GLU 52 HB3 GLU 52 11.871 -4.602 4.606 439 HG2 GLU 52 HG2 GLU 52 10.655 -1.979 3.681 440 HG3 GLU 52 HG3 GLU 52 10.743 -2.498 5.359 441 H ASP 53 H ASP 53 9.876 -5.882 1.622 442 HA ASP 53 HA ASP 53 9.510 -8.067 1.269 443 HB2 ASP 53 HB2 ASP 53 11.444 -7.702 -0.367 444 HB3 ASP 53 HB3 ASP 53 12.506 -8.397 0.843 445 H LYS 54 H LYS 54 9.934 -7.093 3.908 446 HA LYS 54 HA LYS 54 11.237 -9.242 5.429 447 HB2 LYS 54 HB2 LYS 54 9.967 -6.617 6.294 448 HB3 LYS 54 HB3 LYS 54 10.573 -7.813 7.435 449 HG2 LYS 54 HG2 LYS 54 12.844 -7.564 6.350 450 HG3 LYS 54 HG3 LYS 54 12.182 -6.211 5.428 451 HD2 LYS 54 HD2 LYS 54 12.282 -6.386 8.471 452 HD3 LYS 54 HD3 LYS 54 13.408 -5.463 7.470 453 HE2 LYS 54 HE2 LYS 54 11.539 -4.027 6.712 454 HE3 LYS 54 HE3 LYS 54 10.418 -4.973 7.690 455 HZ1 LYS 54 HZ1 LYS 54 12.704 -3.428 8.757 456 HZ2 LYS 54 HZ2 LYS 54 11.529 -4.243 9.662 457 HZ3 LYS 54 HZ3 LYS 54 11.101 -2.894 8.733 458 H VAL 55 H VAL 55 8.201 -8.836 4.078 459 HA VAL 55 HA VAL 55 6.884 -10.468 6.194 460 HB VAL 55 HB VAL 55 4.704 -9.375 5.678 461 HG11 VAL 55 HG11 VAL 55 6.854 -7.439 6.608 462 HG12 VAL 55 HG12 VAL 55 6.014 -8.622 7.613 463 HG13 VAL 55 HG13 VAL 55 5.120 -7.281 6.903 464 HG21 VAL 55 HG21 VAL 55 5.166 -8.576 3.382 465 HG22 VAL 55 HG22 VAL 55 6.340 -7.414 4.006 466 HG23 VAL 55 HG23 VAL 55 4.630 -7.241 4.407 467 H VAL 56 H VAL 56 5.476 -12.065 5.570 468 HA VAL 56 HA VAL 56 5.103 -12.609 2.687 469 HB VAL 56 HB VAL 56 4.589 -14.478 5.045 470 HG11 VAL 56 HG11 VAL 56 4.444 -16.273 3.338 471 HG12 VAL 56 HG12 VAL 56 4.649 -15.076 2.057 472 HG13 VAL 56 HG13 VAL 56 3.210 -15.036 3.078 473 HG21 VAL 56 HG21 VAL 56 6.985 -14.447 3.168 474 HG22 VAL 56 HG22 VAL 56 6.660 -15.676 4.392 475 HG23 VAL 56 HG23 VAL 56 6.999 -14.013 4.880 476 H THR 57 H THR 57 3.092 -12.166 1.849 477 HA THR 57 HA THR 57 1.039 -11.153 3.745 478 HB THR 57 HB THR 57 0.174 -9.941 1.663 479 HG1 THR 57 HG1 THR 57 1.641 -11.519 0.325 480 HG21 THR 57 HG21 THR 57 1.931 -8.206 1.681 481 HG22 THR 57 HG22 THR 57 3.022 -9.314 2.522 482 HG23 THR 57 HG23 THR 57 1.546 -8.751 3.314 483 H SER 58 H SER 58 -0.935 -12.093 3.898 484 HA SER 58 HA SER 58 -2.006 -13.733 1.679 485 HB2 SER 58 HB2 SER 58 -2.024 -14.526 4.629 486 HB3 SER 58 HB3 SER 58 -2.919 -15.370 3.363 487 HG SER 58 HG SER 58 -1.122 -16.272 2.674 488 H GLU 59 H GLU 59 -4.394 -14.114 1.961 489 HA GLU 59 HA GLU 59 -5.781 -11.919 3.402 490 HB2 GLU 59 HB2 GLU 59 -5.659 -11.447 0.953 491 HB3 GLU 59 HB3 GLU 59 -6.486 -12.964 0.620 492 HG2 GLU 59 HG2 GLU 59 -8.474 -12.132 1.854 493 HG3 GLU 59 HG3 GLU 59 -7.635 -10.616 2.161 494 H VAL 60 H VAL 60 -7.280 -12.634 4.748 495 HA VAL 60 HA VAL 60 -8.291 -15.420 4.563 496 HB VAL 60 HB VAL 60 -7.579 -13.821 7.065 497 HG11 VAL 60 HG11 VAL 60 -8.979 -16.528 6.920 498 HG12 VAL 60 HG12 VAL 60 -9.687 -15.027 7.523 499 HG13 VAL 60 HG13 VAL 60 -8.353 -15.787 8.394 500 HG21 VAL 60 HG21 VAL 60 -6.524 -16.459 5.994 501 HG22 VAL 60 HG22 VAL 60 -6.024 -15.695 7.507 502 HG23 VAL 60 HG23 VAL 60 -5.665 -14.913 5.965 503 H GLU 61 H GLU 61 -10.247 -15.218 3.777 504 HA GLU 61 HA GLU 61 -12.448 -14.767 3.514 505 HB2 GLU 61 HB2 GLU 61 -12.369 -14.423 6.532 506 HB3 GLU 61 HB3 GLU 61 -13.753 -14.927 5.562 507 HG2 GLU 61 HG2 GLU 61 -12.414 -16.980 4.896 508 HG3 GLU 61 HG3 GLU 61 -11.191 -16.471 6.048 509 H GLY 62 H GLY 62 -11.208 -12.536 2.743 510 HA2 GLY 62 HA2 GLY 62 -12.139 -10.482 2.013 511 HA3 GLY 62 HA3 GLY 62 -13.102 -10.400 3.471 512 H GLU 63 H GLU 63 -10.459 -11.030 5.014 513 HA GLU 63 HA GLU 63 -9.597 -8.190 5.169 514 HB2 GLU 63 HB2 GLU 63 -10.758 -9.283 7.173 515 HB3 GLU 63 HB3 GLU 63 -9.334 -10.294 7.358 516 HG2 GLU 63 HG2 GLU 63 -7.945 -8.293 7.737 517 HG3 GLU 63 HG3 GLU 63 -9.353 -7.260 7.485 518 H ILE 64 H ILE 64 -7.362 -7.722 5.670 519 HA ILE 64 HA ILE 64 -5.428 -9.448 4.341 520 HB ILE 64 HB ILE 64 -5.028 -6.768 5.751 521 HG12 ILE 64 HG12 ILE 64 -5.466 -7.398 2.794 522 HG13 ILE 64 HG13 ILE 64 -6.607 -6.572 3.848 523 HG21 ILE 64 HG21 ILE 64 -2.913 -6.633 4.459 524 HG22 ILE 64 HG22 ILE 64 -3.196 -8.259 3.833 525 HG23 ILE 64 HG23 ILE 64 -2.916 -8.017 5.557 526 HD11 ILE 64 HD11 ILE 64 -5.024 -4.696 4.055 527 HD12 ILE 64 HD12 ILE 64 -5.489 -5.010 2.383 528 HD13 ILE 64 HD13 ILE 64 -3.912 -5.533 2.968 529 H PHE 65 H PHE 65 -4.211 -10.948 5.356 530 HA PHE 65 HA PHE 65 -3.548 -10.711 8.242 531 HB2 PHE 65 HB2 PHE 65 -5.176 -12.515 7.954 532 HB3 PHE 65 HB3 PHE 65 -4.243 -13.211 6.637 533 HD1 PHE 65 HD2 PHE 65 -3.498 -12.157 10.179 534 HD2 PHE 65 HD1 PHE 65 -3.243 -15.247 7.244 535 HE1 PHE 65 HE2 PHE 65 -2.357 -13.603 11.798 536 HE2 PHE 65 HE1 PHE 65 -2.095 -16.682 8.876 537 HZ PHE 65 HZ PHE 65 -1.668 -15.871 11.155 538 H VAL 66 H VAL 66 -1.415 -10.056 8.229 539 HA VAL 66 HA VAL 66 0.396 -11.226 6.186 540 HB VAL 66 HB VAL 66 1.855 -9.268 6.421 541 HG11 VAL 66 HG11 VAL 66 0.377 -7.621 5.321 542 HG12 VAL 66 HG12 VAL 66 -1.036 -8.541 5.838 543 HG13 VAL 66 HG13 VAL 66 0.115 -9.252 4.703 544 HG21 VAL 66 HG21 VAL 66 -0.234 -8.151 8.335 545 HG22 VAL 66 HG22 VAL 66 1.132 -7.248 7.675 546 HG23 VAL 66 HG23 VAL 66 1.418 -8.615 8.752 547 H LYS 67 H LYS 67 2.254 -12.121 6.674 548 HA LYS 67 HA LYS 67 2.925 -12.742 9.494 549 HB2 LYS 67 HB2 LYS 67 3.283 -14.434 6.963 550 HB3 LYS 67 HB3 LYS 67 3.961 -14.856 8.524 551 HG2 LYS 67 HG2 LYS 67 2.012 -16.191 8.156 552 HG3 LYS 67 HG3 LYS 67 1.664 -15.042 9.447 553 HD2 LYS 67 HD2 LYS 67 -0.262 -15.236 7.968 554 HD3 LYS 67 HD3 LYS 67 0.422 -13.624 7.829 555 HE2 LYS 67 HE2 LYS 67 -0.162 -14.374 5.620 556 HE3 LYS 67 HE3 LYS 67 1.597 -14.386 5.731 557 HZ1 LYS 67 HZ1 LYS 67 -0.120 -16.777 6.095 558 HZ2 LYS 67 HZ2 LYS 67 1.566 -16.742 6.010 559 HZ3 LYS 67 HZ3 LYS 67 0.643 -16.360 4.644 560 H LEU 68 H LEU 68 5.467 -13.529 9.456 561 HA LEU 68 HA LEU 68 6.960 -11.417 7.980 562 HB2 LEU 68 HB2 LEU 68 7.748 -12.911 10.511 563 HB3 LEU 68 HB3 LEU 68 8.772 -11.759 9.663 564 HG LEU 68 HG LEU 68 6.177 -11.151 11.130 565 HD11 LEU 68 HD11 LEU 68 7.618 -9.740 12.532 566 HD12 LEU 68 HD12 LEU 68 9.036 -10.259 11.617 567 HD13 LEU 68 HD13 LEU 68 8.123 -11.427 12.577 568 HD21 LEU 68 HD21 LEU 68 6.218 -9.783 9.113 569 HD22 LEU 68 HD22 LEU 68 7.874 -9.273 9.450 570 HD23 LEU 68 HD23 LEU 68 6.561 -8.778 10.522 571 H VAL 69 H VAL 69 8.736 -11.916 6.728 572 HA VAL 69 HA VAL 69 9.478 -14.604 6.062 573 HB VAL 69 HB VAL 69 11.040 -11.999 5.714 574 HG11 VAL 69 HG11 VAL 69 12.569 -13.926 5.638 575 HG12 VAL 69 HG12 VAL 69 12.394 -13.221 4.031 576 HG13 VAL 69 HG13 VAL 69 11.543 -14.714 4.434 577 HG21 VAL 69 HG21 VAL 69 9.302 -13.502 3.721 578 HG22 VAL 69 HG22 VAL 69 10.263 -12.066 3.360 579 HG23 VAL 69 HG23 VAL 69 8.907 -11.961 4.487 580 H LEU 70 H LEU 70 10.108 -15.854 7.746 581 HA LEU 70 HA LEU 70 11.341 -14.964 10.149 582 HB2 LEU 70 HB2 LEU 70 11.089 -17.768 8.999 583 HB3 LEU 70 HB3 LEU 70 11.526 -17.395 10.663 584 HG LEU 70 HG LEU 70 8.839 -16.763 9.360 585 HD11 LEU 70 HD11 LEU 70 9.141 -19.161 9.733 586 HD12 LEU 70 HD12 LEU 70 7.920 -18.499 10.815 587 HD13 LEU 70 HD13 LEU 70 9.535 -18.866 11.430 588 HD21 LEU 70 HD21 LEU 70 9.412 -15.081 11.054 589 HD22 LEU 70 HD22 LEU 70 9.731 -16.351 12.238 590 HD23 LEU 70 HD23 LEU 70 8.094 -16.109 11.621 591 H GLU 71 H GLU 71 12.654 -16.002 7.102 592 HA GLU 71 HA GLU 71 15.370 -16.380 7.843 593 HB2 GLU 71 HB2 GLU 71 14.374 -17.047 5.659 594 HB3 GLU 71 HB3 GLU 71 14.158 -15.355 5.239 595 HG2 GLU 71 HG2 GLU 71 16.677 -15.103 5.366 596 HG3 GLU 71 HG3 GLU 71 16.768 -16.853 5.563 597 H HIS 72 H HIS 72 16.378 -14.801 9.074 598 HA HIS 72 HA HIS 72 16.023 -11.947 8.321 599 HB2 HIS 72 HB2 HIS 72 16.088 -11.340 10.733 600 HB3 HIS 72 HB3 HIS 72 14.710 -12.351 10.323 601 HD1 HIS 72 HD1 HIS 72 18.171 -12.763 11.882 602 HD2 HIS 72 HD2 HIS 72 14.383 -14.468 12.009 603 HE1 HIS 72 HE1 HIS 72 18.277 -14.490 13.700 604 HE2 HIS 72 HE2 HIS 72 16.022 -15.600 13.662 605 H HIS 73 H HIS 73 17.761 -10.627 8.335 606 HA HIS 73 HA HIS 73 20.373 -11.617 9.351 607 HB2 HIS 73 HB2 HIS 73 19.762 -9.568 7.183 608 HB3 HIS 73 HB3 HIS 73 21.380 -9.903 7.795 609 HD1 HIS 73 HD1 HIS 73 22.426 -12.226 7.176 610 HD2 HIS 73 HD2 HIS 73 18.781 -11.430 5.332 611 HE1 HIS 73 HE1 HIS 73 22.203 -13.941 5.357 612 HE2 HIS 73 HE2 HIS 73 20.041 -13.391 4.200 613 H HIS 74 H HIS 74 17.868 -9.361 9.844 614 HA HIS 74 HA HIS 74 19.476 -7.831 11.809 615 HB2 HIS 74 HB2 HIS 74 17.101 -7.052 10.100 616 HB3 HIS 74 HB3 HIS 74 17.360 -6.233 11.637 617 HD1 HIS 74 HD1 HIS 74 19.273 -6.902 8.401 618 HD2 HIS 74 HD2 HIS 74 19.068 -4.122 11.478 619 HE1 HIS 74 HE1 HIS 74 20.897 -5.091 7.781 620 HE2 HIS 74 HE2 HIS 74 20.607 -3.340 9.561 621 H HIS 75 H HIS 75 18.363 -7.243 13.821 622 HA HIS 75 HA HIS 75 16.504 -9.362 14.754 623 HB2 HIS 75 HB2 HIS 75 17.440 -9.126 16.984 624 HB3 HIS 75 HB3 HIS 75 18.757 -9.377 15.842 625 HD1 HIS 75 HD1 HIS 75 17.342 -6.869 18.219 626 HD2 HIS 75 HD2 HIS 75 20.498 -7.157 15.540 627 HE1 HIS 75 HE1 HIS 75 18.799 -4.889 18.694 628 HE2 HIS 75 HE2 HIS 75 20.800 -5.197 17.201 629 H HIS 76 H HIS 76 15.310 -8.613 16.835 630 HA HIS 76 HA HIS 76 13.601 -6.372 16.163 631 HB2 HIS 76 HB2 HIS 76 12.649 -8.452 16.997 632 HB3 HIS 76 HB3 HIS 76 13.603 -8.356 18.469 633 HD1 HIS 76 HD1 HIS 76 10.844 -6.397 16.720 634 HD2 HIS 76 HD2 HIS 76 12.246 -7.195 20.547 635 HE1 HIS 76 HE1 HIS 76 9.133 -5.433 18.279 636 HE2 HIS 76 HE2 HIS 76 9.917 -6.072 20.572 637 H HIS 77 H HIS 77 13.541 -4.373 17.112 638 HA HIS 77 HA HIS 77 15.515 -3.677 19.183 639 HB2 HIS 77 HB2 HIS 77 15.360 -2.185 17.242 640 HB3 HIS 77 HB3 HIS 77 13.634 -1.955 17.505 641 HD1 HIS 77 HD1 HIS 77 13.121 0.205 18.581 642 HD2 HIS 77 HD2 HIS 77 16.872 -1.172 19.715 643 HE1 HIS 77 HE1 HIS 77 14.062 1.986 20.064 644 HE2 HIS 77 HE2 HIS 77 16.378 1.199 20.635 645 H1 MET 1 H MET 1 3.777 -15.472 -7.349 646 HA MET 1 HA MET 1 2.424 -15.174 -9.151 647 HB2 MET 1 HB2 MET 1 1.414 -17.962 -8.430 648 HB3 MET 1 HB3 MET 1 1.152 -17.148 -9.972 649 HG2 MET 1 HG2 MET 1 3.831 -18.006 -8.845 650 HG3 MET 1 HG3 MET 1 2.946 -18.787 -10.156 651 HE1 MET 1 HE1 MET 1 3.211 -16.139 -13.041 652 HE2 MET 1 HE2 MET 1 1.875 -16.284 -11.900 653 HE3 MET 1 HE3 MET 1 2.623 -17.734 -12.573 654 H LYS 2 H LYS 2 0.585 -16.695 -6.500 655 HA LYS 2 HA LYS 2 -1.688 -14.855 -6.964 656 HB2 LYS 2 HB2 LYS 2 -1.499 -17.394 -5.294 657 HB3 LYS 2 HB3 LYS 2 -2.933 -16.368 -5.380 658 HG2 LYS 2 HG2 LYS 2 -3.086 -16.804 -7.819 659 HG3 LYS 2 HG3 LYS 2 -1.672 -17.859 -7.708 660 HD2 LYS 2 HD2 LYS 2 -2.909 -19.371 -6.197 661 HD3 LYS 2 HD3 LYS 2 -4.315 -18.305 -6.259 662 HE2 LYS 2 HE2 LYS 2 -4.589 -18.762 -8.654 663 HE3 LYS 2 HE3 LYS 2 -3.124 -19.749 -8.655 664 HZ1 LYS 2 HZ1 LYS 2 -4.191 -21.291 -7.160 665 HZ2 LYS 2 HZ2 LYS 2 -5.132 -21.084 -8.547 666 HZ3 LYS 2 HZ3 LYS 2 -5.584 -20.336 -7.100 667 H MET 3 H MET 3 1.072 -14.996 -5.144 668 HA MET 3 HA MET 3 0.390 -14.105 -2.571 669 HB2 MET 3 HB2 MET 3 2.618 -14.952 -3.262 670 HB3 MET 3 HB3 MET 3 2.871 -13.517 -4.247 671 HG2 MET 3 HG2 MET 3 4.123 -13.432 -2.144 672 HG3 MET 3 HG3 MET 3 2.948 -12.126 -2.257 673 HE1 MET 3 HE1 MET 3 2.361 -15.839 0.451 674 HE2 MET 3 HE2 MET 3 3.772 -15.616 -0.581 675 HE3 MET 3 HE3 MET 3 2.191 -15.925 -1.301 676 H LEU 4 H LEU 4 0.061 -12.046 -1.658 677 HA LEU 4 HA LEU 4 -0.995 -9.986 -3.290 678 HB2 LEU 4 HB2 LEU 4 -0.096 -9.777 -0.411 679 HB3 LEU 4 HB3 LEU 4 -1.090 -8.599 -1.245 680 HG LEU 4 HG LEU 4 -1.891 -11.458 -0.559 681 HD11 LEU 4 HD11 LEU 4 -2.908 -8.819 0.534 682 HD12 LEU 4 HD12 LEU 4 -1.881 -9.979 1.383 683 HD13 LEU 4 HD13 LEU 4 -3.528 -10.422 0.942 684 HD21 LEU 4 HD21 LEU 4 -4.132 -10.873 -1.445 685 HD22 LEU 4 HD22 LEU 4 -2.898 -10.850 -2.700 686 HD23 LEU 4 HD23 LEU 4 -3.495 -9.331 -2.025 687 H LYS 5 H LYS 5 2.238 -10.555 -2.173 688 HA LYS 5 HA LYS 5 3.554 -8.137 -2.799 689 HB2 LYS 5 HB2 LYS 5 4.581 -10.054 -1.573 690 HB3 LYS 5 HB3 LYS 5 4.527 -11.016 -3.044 691 HG2 LYS 5 HG2 LYS 5 6.774 -10.317 -2.768 692 HG3 LYS 5 HG3 LYS 5 6.114 -9.350 -4.090 693 HD2 LYS 5 HD2 LYS 5 5.822 -7.442 -2.566 694 HD3 LYS 5 HD3 LYS 5 6.410 -8.414 -1.209 695 HE2 LYS 5 HE2 LYS 5 7.985 -7.517 -3.645 696 HE3 LYS 5 HE3 LYS 5 8.218 -7.012 -1.974 697 HZ1 LYS 5 HZ1 LYS 5 8.712 -9.718 -3.087 698 HZ2 LYS 5 HZ2 LYS 5 8.821 -9.326 -1.447 699 HZ3 LYS 5 HZ3 LYS 5 9.876 -8.612 -2.555 700 H GLU 6 H GLU 6 2.704 -10.948 -4.829 701 HA GLU 6 HA GLU 6 4.106 -10.047 -7.162 702 HB2 GLU 6 HB2 GLU 6 3.806 -12.446 -6.734 703 HB3 GLU 6 HB3 GLU 6 2.062 -12.273 -6.835 704 HG2 GLU 6 HG2 GLU 6 2.963 -13.281 -8.876 705 HG3 GLU 6 HG3 GLU 6 2.220 -11.723 -9.223 706 H LYS 7 H LYS 7 0.604 -10.223 -6.300 707 HA LYS 7 HA LYS 7 -0.341 -9.019 -8.701 708 HB2 LYS 7 HB2 LYS 7 -2.500 -8.714 -7.530 709 HB3 LYS 7 HB3 LYS 7 -1.852 -10.325 -7.303 710 HG2 LYS 7 HG2 LYS 7 -2.590 -9.897 -5.163 711 HG3 LYS 7 HG3 LYS 7 -0.933 -9.329 -5.038 712 HD2 LYS 7 HD2 LYS 7 -2.039 -7.563 -4.027 713 HD3 LYS 7 HD3 LYS 7 -2.009 -6.982 -5.686 714 HE2 LYS 7 HE2 LYS 7 -4.353 -8.330 -4.296 715 HE3 LYS 7 HE3 LYS 7 -4.211 -6.616 -4.684 716 HZ1 LYS 7 HZ1 LYS 7 -4.082 -7.350 -7.074 717 HZ2 LYS 7 HZ2 LYS 7 -5.574 -7.550 -6.310 718 HZ3 LYS 7 HZ3 LYS 7 -4.563 -8.886 -6.547 719 H ALA 8 H ALA 8 0.968 -7.624 -5.755 720 HA ALA 8 HA ALA 8 0.315 -4.911 -6.097 721 HB1 ALA 8 HB1 ALA 8 2.369 -4.412 -4.822 722 HB2 ALA 8 HB2 ALA 8 2.932 -6.070 -5.065 723 HB3 ALA 8 HB3 ALA 8 1.484 -5.761 -4.104 724 H GLY 9 H GLY 9 3.023 -6.793 -7.499 725 HA2 GLY 9 HA2 GLY 9 4.132 -4.734 -9.123 726 HA3 GLY 9 HA3 GLY 9 4.392 -6.457 -9.307 727 H ALA 10 H ALA 10 1.772 -7.315 -9.822 728 HA ALA 10 HA ALA 10 1.508 -6.953 -12.599 729 HB1 ALA 10 HB1 ALA 10 0.651 -8.934 -11.413 730 HB2 ALA 10 HB2 ALA 10 -0.610 -8.187 -12.400 731 HB3 ALA 10 HB3 ALA 10 -0.593 -7.944 -10.649 732 H LEU 11 H LEU 11 -0.395 -5.567 -9.936 733 HA LEU 11 HA LEU 11 -2.103 -3.920 -11.515 734 HB2 LEU 11 HB2 LEU 11 -1.291 -3.772 -8.589 735 HB3 LEU 11 HB3 LEU 11 -2.542 -2.764 -9.306 736 HG LEU 11 HG LEU 11 -2.690 -5.805 -9.296 737 HD11 LEU 11 HD11 LEU 11 -3.941 -3.905 -7.298 738 HD12 LEU 11 HD12 LEU 11 -2.624 -5.036 -6.982 739 HD13 LEU 11 HD13 LEU 11 -4.222 -5.645 -7.400 740 HD21 LEU 11 HD21 LEU 11 -4.068 -4.717 -11.013 741 HD22 LEU 11 HD22 LEU 11 -4.823 -3.696 -9.787 742 HD23 LEU 11 HD23 LEU 11 -5.081 -5.443 -9.764 743 H ALA 12 H ALA 12 1.046 -3.397 -9.939 744 HA ALA 12 HA ALA 12 1.282 -0.623 -10.077 745 HB1 ALA 12 HB1 ALA 12 2.885 -2.074 -8.899 746 HB2 ALA 12 HB2 ALA 12 3.706 -0.941 -9.975 747 HB3 ALA 12 HB3 ALA 12 3.524 -2.639 -10.444 748 H GLY 13 H GLY 13 2.051 -3.023 -12.597 749 HA2 GLY 13 HA2 GLY 13 3.260 -1.370 -14.502 750 HA3 GLY 13 HA3 GLY 13 2.372 -2.841 -14.858 751 H GLN 14 H GLN 14 -0.184 -2.310 -14.314 752 HA GLN 14 HA GLN 14 -0.950 -0.634 -16.525 753 HB2 GLN 14 HB2 GLN 14 -3.278 -1.371 -15.984 754 HB3 GLN 14 HB3 GLN 14 -2.141 -2.697 -16.202 755 HG2 GLN 14 HG2 GLN 14 -1.968 -2.960 -13.753 756 HG3 GLN 14 HG3 GLN 14 -3.115 -1.638 -13.534 757 HE21 GLN 14 HE21 GLN 14 -4.479 -3.072 -12.385 758 HE22 GLN 14 HE22 GLN 14 -5.439 -4.251 -13.196 759 H ILE 15 H ILE 15 -0.998 -0.207 -13.003 760 HA ILE 15 HA ILE 15 -2.632 2.136 -12.932 761 HB ILE 15 HB ILE 15 -0.557 1.103 -10.952 762 HG12 ILE 15 HG12 ILE 15 -3.608 1.131 -10.825 763 HG13 ILE 15 HG13 ILE 15 -2.629 -0.279 -11.210 764 HG21 ILE 15 HG21 ILE 15 -1.442 2.733 -9.301 765 HG22 ILE 15 HG22 ILE 15 -2.447 3.454 -10.556 766 HG23 ILE 15 HG23 ILE 15 -0.690 3.548 -10.676 767 HD11 ILE 15 HD11 ILE 15 -2.683 1.192 -8.571 768 HD12 ILE 15 HD12 ILE 15 -1.655 -0.195 -8.948 769 HD13 ILE 15 HD13 ILE 15 -3.408 -0.377 -8.927 770 H TRP 16 H TRP 16 0.926 1.715 -12.984 771 HA TRP 16 HA TRP 16 1.629 4.440 -13.157 772 HB2 TRP 16 HB2 TRP 16 3.224 2.553 -12.615 773 HB3 TRP 16 HB3 TRP 16 3.194 2.086 -14.312 774 HD1 TRP 16 HD1 TRP 16 4.628 4.766 -11.965 775 HE1 TRP 16 HE1 TRP 16 6.391 6.138 -13.227 776 HE3 TRP 16 HE3 TRP 16 3.932 2.865 -16.661 777 HZ2 TRP 16 HZ2 TRP 16 7.365 6.399 -15.854 778 HZ3 TRP 16 HZ3 TRP 16 5.313 3.731 -18.497 779 HH2 TRP 16 HH2 TRP 16 7.000 5.462 -18.104 780 H GLU 17 H GLU 17 0.952 2.043 -15.739 781 HA GLU 17 HA GLU 17 1.468 3.772 -17.940 782 HB2 GLU 17 HB2 GLU 17 -0.130 1.210 -17.686 783 HB3 GLU 17 HB3 GLU 17 0.009 2.065 -19.221 784 HG2 GLU 17 HG2 GLU 17 2.432 1.155 -17.646 785 HG3 GLU 17 HG3 GLU 17 1.616 0.114 -18.808 786 H ALA 18 H ALA 18 -1.416 3.342 -15.960 787 HA ALA 18 HA ALA 18 -3.206 4.899 -17.576 788 HB1 ALA 18 HB1 ALA 18 -4.024 3.372 -15.821 789 HB2 ALA 18 HB2 ALA 18 -4.614 5.014 -15.556 790 HB3 ALA 18 HB3 ALA 18 -3.282 4.384 -14.579 791 H LEU 19 H LEU 19 -0.914 5.660 -14.992 792 HA LEU 19 HA LEU 19 -1.429 8.495 -14.897 793 HB2 LEU 19 HB2 LEU 19 0.843 6.762 -13.872 794 HB3 LEU 19 HB3 LEU 19 0.747 8.492 -13.571 795 HG LEU 19 HG LEU 19 -1.339 6.473 -12.645 796 HD11 LEU 19 HD11 LEU 19 -0.421 6.805 -10.388 797 HD12 LEU 19 HD12 LEU 19 0.866 7.817 -11.049 798 HD13 LEU 19 HD13 LEU 19 0.781 6.107 -11.476 799 HD21 LEU 19 HD21 LEU 19 -2.279 8.701 -13.016 800 HD22 LEU 19 HD22 LEU 19 -1.008 9.430 -12.034 801 HD23 LEU 19 HD23 LEU 19 -2.191 8.360 -11.291 802 H ASN 20 H ASN 20 0.495 6.431 -16.919 803 HA ASN 20 HA ASN 20 2.412 8.433 -17.738 804 HB2 ASN 20 HB2 ASN 20 2.946 5.976 -17.612 805 HB3 ASN 20 HB3 ASN 20 1.855 5.699 -18.962 806 HD21 ASN 20 HD21 ASN 20 3.546 4.879 -20.231 807 HD22 ASN 20 HD22 ASN 20 4.765 5.893 -20.909 808 H GLY 21 H GLY 21 2.535 9.368 -19.836 809 HA2 GLY 21 HA2 GLY 21 1.579 10.331 -21.759 810 HA3 GLY 21 HA3 GLY 21 0.045 9.557 -21.384 811 H THR 22 H THR 22 0.743 10.710 -18.480 812 HA THR 22 HA THR 22 -0.145 13.508 -18.880 813 HB THR 22 HB THR 22 -1.849 13.361 -17.148 814 HG1 THR 22 HG1 THR 22 -1.184 10.594 -16.875 815 HG21 THR 22 HG21 THR 22 -2.236 11.014 -19.039 816 HG22 THR 22 HG22 THR 22 -2.628 12.697 -19.397 817 HG23 THR 22 HG23 THR 22 -3.510 11.837 -18.134 818 H GLU 23 H GLU 23 -0.235 14.516 -16.451 819 HA GLU 23 HA GLU 23 2.397 14.013 -15.200 820 HB2 GLU 23 HB2 GLU 23 0.523 16.386 -14.850 821 HB3 GLU 23 HB3 GLU 23 2.112 16.224 -14.120 822 HG2 GLU 23 HG2 GLU 23 2.307 17.731 -15.954 823 HG3 GLU 23 HG3 GLU 23 3.112 16.231 -16.406 824 H GLY 24 H GLY 24 -0.116 12.373 -14.751 825 HA2 GLY 24 HA2 GLY 24 -0.495 11.050 -12.834 826 HA3 GLY 24 HA3 GLY 24 0.022 12.371 -11.809 827 H LEU 25 H LEU 25 -2.035 11.182 -10.885 828 HA LEU 25 HA LEU 25 -4.399 12.872 -11.240 829 HB2 LEU 25 HB2 LEU 25 -4.436 9.862 -11.732 830 HB3 LEU 25 HB3 LEU 25 -5.887 10.789 -11.394 831 HG LEU 25 HG LEU 25 -4.108 11.214 -13.828 832 HD11 LEU 25 HD11 LEU 25 -5.922 10.134 -15.105 833 HD12 LEU 25 HD12 LEU 25 -6.769 9.771 -13.598 834 HD13 LEU 25 HD13 LEU 25 -5.200 9.034 -13.931 835 HD21 LEU 25 HD21 LEU 25 -6.821 12.390 -13.116 836 HD22 LEU 25 HD22 LEU 25 -5.984 12.610 -14.654 837 HD23 LEU 25 HD23 LEU 25 -5.286 13.260 -13.174 838 H THR 26 H THR 26 -6.070 12.373 -9.493 839 HA THR 26 HA THR 26 -4.891 11.596 -6.943 840 HB THR 26 HB THR 26 -7.077 12.023 -5.937 841 HG1 THR 26 HG1 THR 26 -8.875 12.557 -7.326 842 HG21 THR 26 HG21 THR 26 -5.788 14.060 -6.486 843 HG22 THR 26 HG22 THR 26 -7.523 14.352 -6.628 844 HG23 THR 26 HG23 THR 26 -6.548 14.117 -8.081 845 H GLN 27 H GLN 27 -6.019 9.893 -5.577 846 HA GLN 27 HA GLN 27 -5.765 7.334 -6.557 847 HB2 GLN 27 HB2 GLN 27 -5.745 7.724 -4.182 848 HB3 GLN 27 HB3 GLN 27 -7.358 8.428 -4.201 849 HG2 GLN 27 HG2 GLN 27 -8.350 6.243 -4.630 850 HG3 GLN 27 HG3 GLN 27 -6.753 5.509 -4.763 851 HE21 GLN 27 HE21 GLN 27 -7.196 4.054 -3.094 852 HE22 GLN 27 HE22 GLN 27 -7.308 4.535 -1.445 853 H LYS 28 H LYS 28 -8.751 9.190 -6.179 854 HA LYS 28 HA LYS 28 -10.578 7.199 -7.072 855 HB2 LYS 28 HB2 LYS 28 -10.959 10.217 -6.971 856 HB3 LYS 28 HB3 LYS 28 -12.237 9.002 -6.980 857 HG2 LYS 28 HG2 LYS 28 -11.498 8.183 -4.773 858 HG3 LYS 28 HG3 LYS 28 -10.171 9.344 -4.773 859 HD2 LYS 28 HD2 LYS 28 -11.926 10.199 -3.355 860 HD3 LYS 28 HD3 LYS 28 -11.864 11.199 -4.806 861 HE2 LYS 28 HE2 LYS 28 -13.818 10.002 -5.720 862 HE3 LYS 28 HE3 LYS 28 -13.865 8.964 -4.293 863 HZ1 LYS 28 HZ1 LYS 28 -15.466 10.763 -4.159 864 HZ2 LYS 28 HZ2 LYS 28 -14.233 11.907 -4.297 865 HZ3 LYS 28 HZ3 LYS 28 -14.304 10.907 -2.939 866 H GLN 29 H GLN 29 -8.893 9.836 -8.773 867 HA GLN 29 HA GLN 29 -10.239 9.516 -11.303 868 HB2 GLN 29 HB2 GLN 29 -7.606 10.869 -10.600 869 HB3 GLN 29 HB3 GLN 29 -8.361 10.951 -12.189 870 HG2 GLN 29 HG2 GLN 29 -10.264 12.152 -11.279 871 HG3 GLN 29 HG3 GLN 29 -9.645 11.967 -9.637 872 HE21 GLN 29 HE21 GLN 29 -10.260 14.410 -11.165 873 HE22 GLN 29 HE22 GLN 29 -8.814 15.349 -11.152 874 H ILE 30 H ILE 30 -7.264 8.174 -9.916 875 HA ILE 30 HA ILE 30 -6.296 6.821 -12.224 876 HB ILE 30 HB ILE 30 -5.873 6.133 -9.277 877 HG12 ILE 30 HG12 ILE 30 -4.064 7.705 -11.161 878 HG13 ILE 30 HG13 ILE 30 -5.140 8.450 -9.991 879 HG21 ILE 30 HG21 ILE 30 -5.327 4.196 -10.701 880 HG22 ILE 30 HG22 ILE 30 -3.855 4.898 -10.030 881 HG23 ILE 30 HG23 ILE 30 -4.290 5.211 -11.712 882 HD11 ILE 30 HD11 ILE 30 -2.811 6.650 -9.341 883 HD12 ILE 30 HD12 ILE 30 -3.877 7.434 -8.170 884 HD13 ILE 30 HD13 ILE 30 -2.844 8.408 -9.216 885 H LYS 31 H LYS 31 -8.379 5.783 -9.531 886 HA LYS 31 HA LYS 31 -8.909 3.138 -10.332 887 HB2 LYS 31 HB2 LYS 31 -10.495 5.147 -8.694 888 HB3 LYS 31 HB3 LYS 31 -11.057 3.493 -8.929 889 HG2 LYS 31 HG2 LYS 31 -9.197 2.582 -7.744 890 HG3 LYS 31 HG3 LYS 31 -8.332 4.120 -7.766 891 HD2 LYS 31 HD2 LYS 31 -9.288 3.605 -5.529 892 HD3 LYS 31 HD3 LYS 31 -9.927 5.102 -6.203 893 HE2 LYS 31 HE2 LYS 31 -11.682 3.737 -5.096 894 HE3 LYS 31 HE3 LYS 31 -12.013 3.977 -6.810 895 HZ1 LYS 31 HZ1 LYS 31 -12.399 1.704 -5.998 896 HZ2 LYS 31 HZ2 LYS 31 -10.739 1.549 -5.704 897 HZ3 LYS 31 HZ3 LYS 31 -11.301 1.791 -7.278 898 H LYS 32 H LYS 32 -10.249 6.171 -11.515 899 HA LYS 32 HA LYS 32 -12.451 5.138 -13.007 900 HB2 LYS 32 HB2 LYS 32 -12.239 7.510 -12.315 901 HB3 LYS 32 HB3 LYS 32 -10.819 7.692 -13.331 902 HG2 LYS 32 HG2 LYS 32 -12.725 8.736 -14.390 903 HG3 LYS 32 HG3 LYS 32 -12.219 7.338 -15.343 904 HD2 LYS 32 HD2 LYS 32 -14.075 6.011 -14.458 905 HD3 LYS 32 HD3 LYS 32 -14.530 7.317 -13.357 906 HE2 LYS 32 HE2 LYS 32 -16.025 7.247 -15.303 907 HE3 LYS 32 HE3 LYS 32 -15.101 8.748 -15.286 908 HZ1 LYS 32 HZ1 LYS 32 -13.622 7.803 -16.951 909 HZ2 LYS 32 HZ2 LYS 32 -15.221 7.794 -17.494 910 HZ3 LYS 32 HZ3 LYS 32 -14.506 6.368 -16.950 911 H ALA 33 H ALA 33 -9.049 5.843 -13.827 912 HA ALA 33 HA ALA 33 -9.281 5.219 -16.640 913 HB1 ALA 33 HB1 ALA 33 -6.852 5.592 -16.695 914 HB2 ALA 33 HB2 ALA 33 -6.799 5.597 -14.928 915 HB3 ALA 33 HB3 ALA 33 -7.664 6.871 -15.789 916 H THR 34 H THR 34 -8.024 3.508 -13.803 917 HA THR 34 HA THR 34 -6.991 1.225 -15.269 918 HB THR 34 HB THR 34 -6.481 0.286 -13.001 919 HG1 THR 34 HG1 THR 34 -7.074 2.599 -11.634 920 HG21 THR 34 HG21 THR 34 -4.815 1.769 -14.055 921 HG22 THR 34 HG22 THR 34 -4.831 1.972 -12.302 922 HG23 THR 34 HG23 THR 34 -5.603 3.178 -13.335 923 H LYS 35 H LYS 35 -10.002 2.102 -13.920 924 HA LYS 35 HA LYS 35 -12.019 1.145 -13.678 925 HB2 LYS 35 HB2 LYS 35 -10.868 -1.267 -15.143 926 HB3 LYS 35 HB3 LYS 35 -12.576 -1.007 -14.815 927 HG2 LYS 35 HG2 LYS 35 -10.812 0.707 -16.598 928 HG3 LYS 35 HG3 LYS 35 -12.019 -0.459 -17.142 929 HD2 LYS 35 HD2 LYS 35 -12.632 2.035 -15.507 930 HD3 LYS 35 HD3 LYS 35 -12.792 1.922 -17.259 931 HE2 LYS 35 HE2 LYS 35 -14.321 0.175 -15.293 932 HE3 LYS 35 HE3 LYS 35 -14.960 1.648 -16.021 933 HZ1 LYS 35 HZ1 LYS 35 -14.720 0.639 -18.198 934 HZ2 LYS 35 HZ2 LYS 35 -15.690 -0.325 -17.207 935 HZ3 LYS 35 HZ3 LYS 35 -14.092 -0.769 -17.514 936 H LEU 36 H LEU 36 -9.733 0.702 -11.752 937 HA LEU 36 HA LEU 36 -10.259 -1.750 -10.344 938 HB2 LEU 36 HB2 LEU 36 -8.793 0.771 -9.492 939 HB3 LEU 36 HB3 LEU 36 -8.934 -0.650 -8.468 940 HG LEU 36 HG LEU 36 -7.482 -0.503 -11.143 941 HD11 LEU 36 HD11 LEU 36 -5.446 -0.893 -9.825 942 HD12 LEU 36 HD12 LEU 36 -6.390 -0.872 -8.332 943 HD13 LEU 36 HD13 LEU 36 -6.259 0.589 -9.318 944 HD21 LEU 36 HD21 LEU 36 -7.825 -2.894 -9.301 945 HD22 LEU 36 HD22 LEU 36 -6.786 -2.835 -10.728 946 HD23 LEU 36 HD23 LEU 36 -8.533 -2.701 -10.907 947 H LYS 37 H LYS 37 -12.184 -2.111 -9.443 948 HA LYS 37 HA LYS 37 -14.047 -0.166 -8.510 949 HB2 LYS 37 HB2 LYS 37 -14.851 -2.304 -9.298 950 HB3 LYS 37 HB3 LYS 37 -13.840 -3.187 -8.165 951 HG2 LYS 37 HG2 LYS 37 -16.179 -3.280 -7.494 952 HG3 LYS 37 HG3 LYS 37 -15.229 -2.405 -6.292 953 HD2 LYS 37 HD2 LYS 37 -16.054 -0.248 -7.275 954 HD3 LYS 37 HD3 LYS 37 -17.058 -1.177 -8.397 955 HE2 LYS 37 HE2 LYS 37 -18.369 -0.390 -6.464 956 HE3 LYS 37 HE3 LYS 37 -18.292 -2.151 -6.502 957 HZ1 LYS 37 HZ1 LYS 37 -16.612 -0.397 -4.786 958 HZ2 LYS 37 HZ2 LYS 37 -16.579 -2.084 -4.804 959 HZ3 LYS 37 HZ3 LYS 37 -17.957 -1.276 -4.270 960 H ALA 38 H ALA 38 -11.805 -2.352 -6.782 961 HA ALA 38 HA ALA 38 -12.576 -1.355 -4.154 962 HB1 ALA 38 HB1 ALA 38 -10.393 -3.338 -4.899 963 HB2 ALA 38 HB2 ALA 38 -12.054 -3.745 -4.462 964 HB3 ALA 38 HB3 ALA 38 -10.990 -3.000 -3.269 965 H ASP 39 H ASP 39 -11.342 -0.155 -2.777 966 HA ASP 39 HA ASP 39 -9.276 1.590 -3.692 967 HB2 ASP 39 HB2 ASP 39 -9.159 2.301 -1.314 968 HB3 ASP 39 HB3 ASP 39 -10.820 2.220 -1.879 969 H LYS 40 H LYS 40 -9.347 -1.459 -2.014 970 HA LYS 40 HA LYS 40 -6.892 -1.694 -0.791 971 HB2 LYS 40 HB2 LYS 40 -8.517 -3.890 -2.136 972 HB3 LYS 40 HB3 LYS 40 -7.300 -4.143 -0.887 973 HG2 LYS 40 HG2 LYS 40 -9.802 -2.484 -0.466 974 HG3 LYS 40 HG3 LYS 40 -9.712 -4.219 -0.116 975 HD2 LYS 40 HD2 LYS 40 -7.911 -3.780 1.533 976 HD3 LYS 40 HD3 LYS 40 -7.991 -2.053 1.159 977 HE2 LYS 40 HE2 LYS 40 -10.277 -3.689 2.310 978 HE3 LYS 40 HE3 LYS 40 -9.209 -2.637 3.242 979 HZ1 LYS 40 HZ1 LYS 40 -11.206 -1.459 2.760 980 HZ2 LYS 40 HZ2 LYS 40 -11.110 -1.814 1.112 981 HZ3 LYS 40 HZ3 LYS 40 -9.983 -0.774 1.820 982 H ASP 41 H ASP 41 -7.675 -2.524 -4.164 983 HA ASP 41 HA ASP 41 -5.198 -3.852 -4.735 984 HB2 ASP 41 HB2 ASP 41 -7.384 -2.764 -6.549 985 HB3 ASP 41 HB3 ASP 41 -6.003 -3.684 -7.141 986 H PHE 42 H PHE 42 -6.364 -0.544 -5.022 987 HA PHE 42 HA PHE 42 -4.293 0.491 -6.652 988 HB2 PHE 42 HB2 PHE 42 -6.338 1.777 -6.377 989 HB3 PHE 42 HB3 PHE 42 -6.095 1.891 -4.633 990 HD1 PHE 42 HD2 PHE 42 -4.441 2.784 -7.876 991 HD2 PHE 42 HD1 PHE 42 -4.977 3.779 -3.751 992 HE1 PHE 42 HE2 PHE 42 -3.123 4.823 -8.189 993 HE2 PHE 42 HE1 PHE 42 -3.641 5.813 -4.073 994 HZ PHE 42 HZ PHE 42 -2.722 6.338 -6.295 995 H PHE 43 H PHE 43 -4.565 0.144 -3.096 996 HA PHE 43 HA PHE 43 -2.344 1.760 -2.390 997 HB2 PHE 43 HB2 PHE 43 -3.583 -0.566 -0.872 998 HB3 PHE 43 HB3 PHE 43 -2.396 0.544 -0.193 999 HD1 PHE 43 HD1 PHE 43 -3.064 3.154 -0.460 1000 HD2 PHE 43 HD2 PHE 43 -5.823 -0.113 -0.407 1001 HE1 PHE 43 HE1 PHE 43 -4.855 4.666 0.277 1002 HE2 PHE 43 HE2 PHE 43 -7.605 1.400 0.318 1003 HZ PHE 43 HZ PHE 43 -7.128 3.797 0.669 1004 H LEU 44 H LEU 44 -2.529 -1.782 -2.889 1005 HA LEU 44 HA LEU 44 0.211 -2.310 -2.287 1006 HB2 LEU 44 HB2 LEU 44 -1.941 -3.925 -3.684 1007 HB3 LEU 44 HB3 LEU 44 -0.295 -4.525 -3.569 1008 HG LEU 44 HG LEU 44 -0.453 -4.418 -1.067 1009 HD11 LEU 44 HD11 LEU 44 -2.621 -4.180 0.054 1010 HD12 LEU 44 HD12 LEU 44 -3.388 -3.780 -1.484 1011 HD13 LEU 44 HD13 LEU 44 -2.176 -2.699 -0.797 1012 HD21 LEU 44 HD21 LEU 44 -1.852 -6.410 -0.788 1013 HD22 LEU 44 HD22 LEU 44 -0.856 -6.532 -2.236 1014 HD23 LEU 44 HD23 LEU 44 -2.573 -6.143 -2.379 1015 H GLY 45 H GLY 45 -1.515 -1.747 -5.371 1016 HA2 GLY 45 HA2 GLY 45 0.656 -2.017 -7.158 1017 HA3 GLY 45 HA3 GLY 45 -0.756 -1.006 -7.418 1018 H LEU 46 H LEU 46 -0.561 0.890 -5.504 1019 HA LEU 46 HA LEU 46 1.306 2.782 -6.456 1020 HB2 LEU 46 HB2 LEU 46 -0.788 3.500 -5.462 1021 HB3 LEU 46 HB3 LEU 46 -0.402 2.705 -3.946 1022 HG LEU 46 HG LEU 46 1.424 4.351 -3.546 1023 HD11 LEU 46 HD11 LEU 46 1.635 6.362 -4.931 1024 HD12 LEU 46 HD12 LEU 46 0.459 5.711 -6.073 1025 HD13 LEU 46 HD13 LEU 46 2.011 4.903 -5.844 1026 HD21 LEU 46 HD21 LEU 46 -1.273 5.654 -4.046 1027 HD22 LEU 46 HD22 LEU 46 0.003 6.270 -2.993 1028 HD23 LEU 46 HD23 LEU 46 -0.808 4.757 -2.597 1029 H GLY 47 H GLY 47 1.391 0.567 -3.724 1030 HA2 GLY 47 HA2 GLY 47 3.655 1.572 -2.334 1031 HA3 GLY 47 HA3 GLY 47 3.053 -0.080 -2.264 1032 H TRP 48 H TRP 48 3.295 -0.561 -5.090 1033 HA TRP 48 HA TRP 48 6.082 -1.281 -5.284 1034 HB2 TRP 48 HB2 TRP 48 3.992 -2.621 -6.085 1035 HB3 TRP 48 HB3 TRP 48 4.046 -1.589 -7.506 1036 HD1 TRP 48 HD1 TRP 48 6.250 -1.884 -9.128 1037 HE1 TRP 48 HE1 TRP 48 7.846 -3.870 -9.436 1038 HE3 TRP 48 HE3 TRP 48 5.034 -4.557 -4.948 1039 HZ2 TRP 48 HZ2 TRP 48 8.495 -6.282 -8.092 1040 HZ3 TRP 48 HZ3 TRP 48 6.172 -6.696 -4.540 1041 HH2 TRP 48 HH2 TRP 48 7.869 -7.546 -6.080 1042 H LEU 49 H LEU 49 3.981 1.186 -6.742 1043 HA LEU 49 HA LEU 49 5.845 2.309 -8.564 1044 HB2 LEU 49 HB2 LEU 49 3.406 3.358 -7.126 1045 HB3 LEU 49 HB3 LEU 49 4.422 4.497 -7.984 1046 HG LEU 49 HG LEU 49 3.934 3.484 -10.118 1047 HD11 LEU 49 HD11 LEU 49 2.463 1.311 -8.634 1048 HD12 LEU 49 HD12 LEU 49 3.997 1.140 -9.492 1049 HD13 LEU 49 HD13 LEU 49 2.528 1.511 -10.390 1050 HD21 LEU 49 HD21 LEU 49 1.505 3.778 -10.270 1051 HD22 LEU 49 HD22 LEU 49 2.207 5.016 -9.228 1052 HD23 LEU 49 HD23 LEU 49 1.360 3.640 -8.513 1053 H LEU 50 H LEU 50 5.256 2.926 -5.132 1054 HA LEU 50 HA LEU 50 7.254 4.935 -4.751 1055 HB2 LEU 50 HB2 LEU 50 5.732 3.172 -2.794 1056 HB3 LEU 50 HB3 LEU 50 6.866 4.412 -2.276 1057 HG LEU 50 HG LEU 50 4.346 4.966 -3.901 1058 HD11 LEU 50 HD11 LEU 50 3.740 4.189 -1.666 1059 HD12 LEU 50 HD12 LEU 50 3.400 5.907 -1.835 1060 HD13 LEU 50 HD13 LEU 50 4.820 5.377 -0.928 1061 HD21 LEU 50 HD21 LEU 50 6.305 6.878 -2.576 1062 HD22 LEU 50 HD22 LEU 50 4.793 7.338 -3.365 1063 HD23 LEU 50 HD23 LEU 50 6.095 6.626 -4.311 1064 H ARG 51 H ARG 51 7.255 1.376 -4.422 1065 HA ARG 51 HA ARG 51 9.739 1.095 -3.124 1066 HB2 ARG 51 HB2 ARG 51 9.527 -1.192 -3.413 1067 HB3 ARG 51 HB3 ARG 51 7.868 -0.694 -3.628 1068 HG2 ARG 51 HG2 ARG 51 7.916 -2.041 -5.449 1069 HG3 ARG 51 HG3 ARG 51 8.735 -0.697 -6.235 1070 HD2 ARG 51 HD2 ARG 51 10.927 -1.736 -5.595 1071 HD3 ARG 51 HD3 ARG 51 10.033 -3.122 -4.953 1072 HE ARG 51 HE ARG 51 9.234 -2.627 -7.617 1073 HH11 ARG 51 HH11 ARG 51 11.938 -3.948 -5.891 1074 HH12 ARG 51 HH12 ARG 51 12.492 -4.831 -7.269 1075 HH21 ARG 51 HH21 ARG 51 9.993 -3.730 -9.334 1076 HH22 ARG 51 HH22 ARG 51 11.401 -4.717 -9.181 1077 H GLU 52 H GLU 52 9.021 1.739 -6.488 1078 HA GLU 52 HA GLU 52 11.894 1.589 -7.206 1079 HB2 GLU 52 HB2 GLU 52 9.386 1.604 -8.925 1080 HB3 GLU 52 HB3 GLU 52 11.007 1.760 -9.598 1081 HG2 GLU 52 HG2 GLU 52 11.615 -0.441 -8.811 1082 HG3 GLU 52 HG3 GLU 52 10.099 -0.604 -7.930 1083 H ASP 53 H ASP 53 9.585 3.874 -6.259 1084 HA ASP 53 HA ASP 53 9.630 6.111 -6.026 1085 HB2 ASP 53 HB2 ASP 53 12.535 5.773 -6.873 1086 HB3 ASP 53 HB3 ASP 53 11.862 7.308 -6.324 1087 H LYS 54 H LYS 54 8.643 5.013 -8.443 1088 HA LYS 54 HA LYS 54 9.440 6.725 -10.671 1089 HB2 LYS 54 HB2 LYS 54 7.269 4.597 -10.439 1090 HB3 LYS 54 HB3 LYS 54 7.730 5.409 -11.936 1091 HG2 LYS 54 HG2 LYS 54 9.951 4.422 -11.845 1092 HG3 LYS 54 HG3 LYS 54 9.607 3.699 -10.273 1093 HD2 LYS 54 HD2 LYS 54 8.167 3.018 -12.868 1094 HD3 LYS 54 HD3 LYS 54 9.476 2.072 -12.154 1095 HE2 LYS 54 HE2 LYS 54 7.963 1.844 -10.084 1096 HE3 LYS 54 HE3 LYS 54 6.665 2.477 -11.099 1097 HZ1 LYS 54 HZ1 LYS 54 8.267 0.033 -11.624 1098 HZ2 LYS 54 HZ2 LYS 54 7.051 0.641 -12.638 1099 HZ3 LYS 54 HZ3 LYS 54 6.661 0.083 -11.090 1100 H VAL 55 H VAL 55 7.344 7.047 -8.038 1101 HA VAL 55 HA VAL 55 5.760 9.153 -9.394 1102 HB VAL 55 HB VAL 55 3.751 8.548 -8.087 1103 HG11 VAL 55 HG11 VAL 55 3.948 7.671 -10.368 1104 HG12 VAL 55 HG12 VAL 55 3.094 6.523 -9.336 1105 HG13 VAL 55 HG13 VAL 55 4.779 6.232 -9.767 1106 HG21 VAL 55 HG21 VAL 55 3.605 6.395 -6.860 1107 HG22 VAL 55 HG22 VAL 55 4.809 7.466 -6.142 1108 HG23 VAL 55 HG23 VAL 55 5.324 6.111 -7.151 1109 H VAL 56 H VAL 56 5.068 10.884 -8.093 1110 HA VAL 56 HA VAL 56 6.197 11.125 -5.377 1111 HB VAL 56 HB VAL 56 5.263 13.383 -7.196 1112 HG11 VAL 56 HG11 VAL 56 6.374 14.894 -5.566 1113 HG12 VAL 56 HG12 VAL 56 6.759 13.510 -4.542 1114 HG13 VAL 56 HG13 VAL 56 5.074 13.968 -4.808 1115 HG21 VAL 56 HG21 VAL 56 8.118 12.518 -6.605 1116 HG22 VAL 56 HG22 VAL 56 7.648 13.949 -7.526 1117 HG23 VAL 56 HG23 VAL 56 7.275 12.341 -8.147 1118 H THR 57 H THR 57 4.772 11.091 -3.714 1119 HA THR 57 HA THR 57 1.876 11.171 -4.322 1120 HB THR 57 HB THR 57 1.643 10.020 -2.049 1121 HG1 THR 57 HG1 THR 57 3.706 8.910 -1.456 1122 HG21 THR 57 HG21 THR 57 2.299 7.795 -2.898 1123 HG22 THR 57 HG22 THR 57 3.248 8.555 -4.176 1124 HG23 THR 57 HG23 THR 57 1.491 8.739 -4.153 1125 H SER 58 H SER 58 0.443 12.292 -3.043 1126 HA SER 58 HA SER 58 1.301 14.338 -1.143 1127 HB2 SER 58 HB2 SER 58 0.012 15.034 -3.829 1128 HB3 SER 58 HB3 SER 58 0.272 16.178 -2.509 1129 HG SER 58 HG SER 58 2.611 15.099 -2.917 1130 H GLU 59 H GLU 59 -0.758 15.618 -0.402 1131 HA GLU 59 HA GLU 59 -3.148 13.837 -0.468 1132 HB2 GLU 59 HB2 GLU 59 -2.063 14.051 1.769 1133 HB3 GLU 59 HB3 GLU 59 -2.315 15.793 1.719 1134 HG2 GLU 59 HG2 GLU 59 -4.771 15.422 1.674 1135 HG3 GLU 59 HG3 GLU 59 -4.497 13.681 1.738 1136 H VAL 60 H VAL 60 -4.546 14.655 -1.925 1137 HA VAL 60 HA VAL 60 -5.211 17.552 -1.894 1138 HB VAL 60 HB VAL 60 -5.370 15.555 -4.197 1139 HG11 VAL 60 HG11 VAL 60 -7.327 17.038 -4.330 1140 HG12 VAL 60 HG12 VAL 60 -6.185 17.413 -5.621 1141 HG13 VAL 60 HG13 VAL 60 -6.284 18.456 -4.200 1142 HG21 VAL 60 HG21 VAL 60 -3.105 16.414 -3.801 1143 HG22 VAL 60 HG22 VAL 60 -3.707 18.073 -3.887 1144 HG23 VAL 60 HG23 VAL 60 -3.757 17.042 -5.319 1145 H GLU 61 H GLU 61 -7.143 17.975 -1.060 1146 HA GLU 61 HA GLU 61 -9.330 17.965 -0.504 1147 HB2 GLU 61 HB2 GLU 61 -9.534 16.005 -2.827 1148 HB3 GLU 61 HB3 GLU 61 -10.910 16.803 -2.071 1149 HG2 GLU 61 HG2 GLU 61 -8.639 18.313 -3.388 1150 HG3 GLU 61 HG3 GLU 61 -10.071 17.797 -4.261 1151 H GLY 62 H GLY 62 -7.612 16.250 0.974 1152 HA2 GLY 62 HA2 GLY 62 -7.915 14.867 2.797 1153 HA3 GLY 62 HA3 GLY 62 -9.528 14.478 2.238 1154 H GLU 63 H GLU 63 -8.438 13.645 -0.461 1155 HA GLU 63 HA GLU 63 -7.613 10.939 0.314 1156 HB2 GLU 63 HB2 GLU 63 -8.628 12.032 -2.342 1157 HB3 GLU 63 HB3 GLU 63 -8.203 10.349 -2.045 1158 HG2 GLU 63 HG2 GLU 63 -10.436 11.886 -0.677 1159 HG3 GLU 63 HG3 GLU 63 -10.626 10.681 -1.948 1160 H ILE 64 H ILE 64 -6.216 9.839 -1.472 1161 HA ILE 64 HA ILE 64 -3.604 11.075 -1.323 1162 HB ILE 64 HB ILE 64 -4.469 8.445 -2.606 1163 HG12 ILE 64 HG12 ILE 64 -3.274 8.964 0.152 1164 HG13 ILE 64 HG13 ILE 64 -4.947 8.524 -0.168 1165 HG21 ILE 64 HG21 ILE 64 -2.094 7.763 -2.493 1166 HG22 ILE 64 HG22 ILE 64 -1.658 9.368 -1.904 1167 HG23 ILE 64 HG23 ILE 64 -2.309 9.175 -3.532 1168 HD11 ILE 64 HD11 ILE 64 -4.194 6.348 -1.026 1169 HD12 ILE 64 HD12 ILE 64 -3.686 6.626 0.638 1170 HD13 ILE 64 HD13 ILE 64 -2.522 6.795 -0.675 1171 H PHE 65 H PHE 65 -2.464 12.030 -2.979 1172 HA PHE 65 HA PHE 65 -3.468 11.943 -5.764 1173 HB2 PHE 65 HB2 PHE 65 -3.530 14.235 -4.872 1174 HB3 PHE 65 HB3 PHE 65 -1.853 14.118 -4.357 1175 HD1 PHE 65 HD2 PHE 65 -3.993 13.982 -7.440 1176 HD2 PHE 65 HD1 PHE 65 -0.137 14.873 -5.825 1177 HE1 PHE 65 HE2 PHE 65 -3.276 14.847 -9.626 1178 HE2 PHE 65 HE1 PHE 65 0.575 15.735 -8.015 1179 HZ PHE 65 HZ PHE 65 -0.992 15.726 -9.916 1180 H VAL 66 H VAL 66 -2.053 11.207 -7.291 1181 HA VAL 66 HA VAL 66 0.738 10.552 -6.528 1182 HB VAL 66 HB VAL 66 -1.146 8.720 -8.094 1183 HG11 VAL 66 HG11 VAL 66 1.686 8.225 -7.104 1184 HG12 VAL 66 HG12 VAL 66 1.204 8.471 -8.785 1185 HG13 VAL 66 HG13 VAL 66 0.660 7.038 -7.911 1186 HG21 VAL 66 HG21 VAL 66 -1.824 8.786 -5.726 1187 HG22 VAL 66 HG22 VAL 66 -0.174 8.407 -5.230 1188 HG23 VAL 66 HG23 VAL 66 -1.117 7.216 -6.128 1189 H LYS 67 H LYS 67 1.991 11.790 -7.878 1190 HA LYS 67 HA LYS 67 1.221 11.961 -10.754 1191 HB2 LYS 67 HB2 LYS 67 2.271 14.041 -10.963 1192 HB3 LYS 67 HB3 LYS 67 1.510 14.162 -9.384 1193 HG2 LYS 67 HG2 LYS 67 3.665 13.767 -8.288 1194 HG3 LYS 67 HG3 LYS 67 4.439 13.519 -9.859 1195 HD2 LYS 67 HD2 LYS 67 3.741 15.897 -10.458 1196 HD3 LYS 67 HD3 LYS 67 3.256 16.102 -8.769 1197 HE2 LYS 67 HE2 LYS 67 5.495 17.013 -9.134 1198 HE3 LYS 67 HE3 LYS 67 5.594 15.607 -8.070 1199 HZ1 LYS 67 HZ1 LYS 67 6.178 15.639 -10.981 1200 HZ2 LYS 67 HZ2 LYS 67 6.255 14.276 -9.995 1201 HZ3 LYS 67 HZ3 LYS 67 7.320 15.558 -9.744 1202 H LEU 68 H LEU 68 3.255 12.037 -12.251 1203 HA LEU 68 HA LEU 68 5.054 9.860 -11.456 1204 HB2 LEU 68 HB2 LEU 68 4.827 11.357 -14.097 1205 HB3 LEU 68 HB3 LEU 68 5.905 10.001 -13.802 1206 HG LEU 68 HG LEU 68 2.865 9.942 -13.921 1207 HD11 LEU 68 HD11 LEU 68 4.003 9.904 -16.093 1208 HD12 LEU 68 HD12 LEU 68 3.210 8.367 -15.760 1209 HD13 LEU 68 HD13 LEU 68 4.962 8.509 -15.582 1210 HD21 LEU 68 HD21 LEU 68 2.993 7.521 -13.431 1211 HD22 LEU 68 HD22 LEU 68 3.531 8.498 -12.069 1212 HD23 LEU 68 HD23 LEU 68 4.718 7.683 -13.090 1213 H VAL 69 H VAL 69 7.296 10.016 -11.279 1214 HA VAL 69 HA VAL 69 8.591 12.569 -10.889 1215 HB VAL 69 HB VAL 69 9.794 9.780 -11.222 1216 HG11 VAL 69 HG11 VAL 69 11.489 11.496 -11.719 1217 HG12 VAL 69 HG12 VAL 69 11.850 10.711 -10.181 1218 HG13 VAL 69 HG13 VAL 69 11.127 12.322 -10.200 1219 HG21 VAL 69 HG21 VAL 69 9.191 11.344 -8.681 1220 HG22 VAL 69 HG22 VAL 69 10.012 9.783 -8.751 1221 HG23 VAL 69 HG23 VAL 69 8.326 9.914 -9.252 1222 H LEU 70 H LEU 70 8.354 10.179 -13.490 1223 HA LEU 70 HA LEU 70 9.934 11.782 -15.357 1224 HB2 LEU 70 HB2 LEU 70 8.446 9.173 -15.859 1225 HB3 LEU 70 HB3 LEU 70 9.619 9.931 -16.930 1226 HG LEU 70 HG LEU 70 10.213 8.709 -14.202 1227 HD11 LEU 70 HD11 LEU 70 10.978 7.756 -16.980 1228 HD12 LEU 70 HD12 LEU 70 9.778 7.021 -15.913 1229 HD13 LEU 70 HD13 LEU 70 11.478 7.019 -15.454 1230 HD21 LEU 70 HD21 LEU 70 11.674 10.633 -14.550 1231 HD22 LEU 70 HD22 LEU 70 12.126 10.051 -16.154 1232 HD23 LEU 70 HD23 LEU 70 12.606 9.145 -14.717 1233 H GLU 71 H GLU 71 8.414 13.621 -15.172 1234 HA GLU 71 HA GLU 71 5.790 13.435 -16.393 1235 HB2 GLU 71 HB2 GLU 71 7.460 15.825 -15.529 1236 HB3 GLU 71 HB3 GLU 71 5.833 15.955 -16.195 1237 HG2 GLU 71 HG2 GLU 71 4.946 14.634 -14.316 1238 HG3 GLU 71 HG3 GLU 71 6.568 14.493 -13.636 1239 H HIS 72 H HIS 72 5.189 14.629 -18.357 1240 HA HIS 72 HA HIS 72 7.036 13.801 -20.450 1241 HB2 HIS 72 HB2 HIS 72 4.107 14.605 -20.465 1242 HB3 HIS 72 HB3 HIS 72 4.998 14.251 -21.948 1243 HD1 HIS 72 HD1 HIS 72 5.186 11.863 -22.602 1244 HD2 HIS 72 HD2 HIS 72 4.033 12.289 -18.632 1245 HE1 HIS 72 HE1 HIS 72 4.772 9.538 -21.776 1246 HE2 HIS 72 HE2 HIS 72 4.361 9.817 -19.309 1247 H HIS 73 H HIS 73 6.706 15.196 -22.607 1248 HA HIS 73 HA HIS 73 7.669 17.941 -22.007 1249 HB2 HIS 73 HB2 HIS 73 8.193 16.179 -24.447 1250 HB3 HIS 73 HB3 HIS 73 8.841 17.795 -24.191 1251 HD1 HIS 73 HD1 HIS 73 10.665 18.047 -22.290 1252 HD2 HIS 73 HD2 HIS 73 9.593 14.127 -23.162 1253 HE1 HIS 73 HE1 HIS 73 12.428 16.617 -21.228 1254 HE2 HIS 73 HE2 HIS 73 11.865 14.271 -21.931 1255 H HIS 74 H HIS 74 5.901 19.255 -22.140 1256 HA HIS 74 HA HIS 74 3.715 18.823 -23.944 1257 HB2 HIS 74 HB2 HIS 74 4.303 20.702 -21.728 1258 HB3 HIS 74 HB3 HIS 74 3.331 21.416 -23.006 1259 HD1 HIS 74 HD1 HIS 74 3.238 18.768 -20.366 1260 HD2 HIS 74 HD2 HIS 74 0.719 20.426 -23.207 1261 HE1 HIS 74 HE1 HIS 74 0.952 17.915 -19.807 1262 HE2 HIS 74 HE2 HIS 74 -0.577 19.116 -21.393 1263 H HIS 75 H HIS 75 4.165 19.001 -26.040 1264 HA HIS 75 HA HIS 75 5.710 21.075 -27.285 1265 HB2 HIS 75 HB2 HIS 75 3.689 19.113 -28.461 1266 HB3 HIS 75 HB3 HIS 75 4.800 20.105 -29.403 1267 HD1 HIS 75 HD1 HIS 75 4.616 16.977 -27.411 1268 HD2 HIS 75 HD2 HIS 75 7.537 19.282 -29.259 1269 HE1 HIS 75 HE1 HIS 75 6.670 15.542 -27.455 1270 HE2 HIS 75 HE2 HIS 75 8.473 17.046 -28.348 1271 H HIS 76 H HIS 76 2.268 20.512 -26.667 1272 HA HIS 76 HA HIS 76 1.702 23.374 -26.927 1273 HB2 HIS 76 HB2 HIS 76 0.256 21.224 -28.520 1274 HB3 HIS 76 HB3 HIS 76 -0.506 22.771 -28.157 1275 HD1 HIS 76 HD1 HIS 76 1.761 21.167 -30.542 1276 HD2 HIS 76 HD2 HIS 76 0.891 25.045 -29.332 1277 HE1 HIS 76 HE1 HIS 76 2.726 22.653 -32.312 1278 HE2 HIS 76 HE2 HIS 76 2.398 24.979 -31.435 1279 H HIS 77 H HIS 77 0.411 24.092 -25.363 1280 HA HIS 77 HA HIS 77 -0.645 22.305 -23.327 1281 HB2 HIS 77 HB2 HIS 77 0.526 24.401 -22.702 1282 HB3 HIS 77 HB3 HIS 77 -0.684 25.350 -23.554 1283 HD1 HIS 77 HD1 HIS 77 -2.622 26.126 -22.191 1284 HD2 HIS 77 HD2 HIS 77 -0.596 23.001 -20.350 1285 HE1 HIS 77 HE1 HIS 77 -3.676 25.883 -19.930 1286 HE2 HIS 77 HE2 HIS 77 -2.502 23.935 -18.864 Start of MODEL 3 1 H1 MET 1 H1 MET 1 10.497 15.822 6.428 2 H2 MET 1 H2 MET 1 9.433 15.219 5.259 3 H3 MET 1 H3 MET 1 9.347 14.660 6.850 4 HA MET 1 HA MET 1 8.626 16.752 7.653 5 HB2 MET 1 HB2 MET 1 10.019 18.086 6.027 6 HB3 MET 1 HB3 MET 1 8.829 17.752 4.777 7 HG2 MET 1 HG2 MET 1 8.506 19.991 5.663 8 HG3 MET 1 HG3 MET 1 7.128 18.980 6.089 9 HE1 MET 1 HE1 MET 1 10.376 20.787 7.398 10 HE2 MET 1 HE2 MET 1 10.733 19.106 7.805 11 HE3 MET 1 HE3 MET 1 10.418 20.276 9.086 12 H LYS 2 H LYS 2 7.228 14.660 7.610 13 HA LYS 2 HA LYS 2 5.154 13.760 7.593 14 HB2 LYS 2 HB2 LYS 2 4.501 16.707 7.397 15 HB3 LYS 2 HB3 LYS 2 3.219 15.514 7.492 16 HG2 LYS 2 HG2 LYS 2 3.525 16.305 9.700 17 HG3 LYS 2 HG3 LYS 2 4.251 14.700 9.666 18 HD2 LYS 2 HD2 LYS 2 5.685 16.189 10.935 19 HD3 LYS 2 HD3 LYS 2 6.504 15.772 9.429 20 HE2 LYS 2 HE2 LYS 2 6.745 18.174 10.007 21 HE3 LYS 2 HE3 LYS 2 5.907 17.949 8.472 22 HZ1 LYS 2 HZ1 LYS 2 4.848 19.635 9.846 23 HZ2 LYS 2 HZ2 LYS 2 4.603 18.510 11.083 24 HZ3 LYS 2 HZ3 LYS 2 3.806 18.325 9.604 25 H MET 3 H MET 3 6.394 13.789 4.908 26 HA MET 3 HA MET 3 4.284 14.073 2.962 27 HB2 MET 3 HB2 MET 3 6.909 12.527 2.774 28 HB3 MET 3 HB3 MET 3 5.845 12.900 1.416 29 HG2 MET 3 HG2 MET 3 7.352 14.905 3.118 30 HG3 MET 3 HG3 MET 3 7.740 14.432 1.463 31 HE1 MET 3 HE1 MET 3 4.857 14.323 0.068 32 HE2 MET 3 HE2 MET 3 6.246 15.125 -0.669 33 HE3 MET 3 HE3 MET 3 4.706 15.973 -0.532 34 H LEU 4 H LEU 4 3.257 12.350 1.761 35 HA LEU 4 HA LEU 4 2.007 10.380 3.323 36 HB2 LEU 4 HB2 LEU 4 1.061 11.437 1.261 37 HB3 LEU 4 HB3 LEU 4 2.206 10.529 0.289 38 HG LEU 4 HG LEU 4 1.116 8.397 1.022 39 HD11 LEU 4 HD11 LEU 4 -0.901 10.180 2.417 40 HD12 LEU 4 HD12 LEU 4 0.241 9.076 3.188 41 HD13 LEU 4 HD13 LEU 4 -1.050 8.436 2.177 42 HD21 LEU 4 HD21 LEU 4 0.438 9.429 -1.091 43 HD22 LEU 4 HD22 LEU 4 -0.785 10.392 -0.257 44 HD23 LEU 4 HD23 LEU 4 -0.936 8.634 -0.323 45 H LYS 5 H LYS 5 4.866 10.185 1.282 46 HA LYS 5 HA LYS 5 5.068 7.334 1.160 47 HB2 LYS 5 HB2 LYS 5 6.068 8.953 -0.502 48 HB3 LYS 5 HB3 LYS 5 7.256 9.402 0.716 49 HG2 LYS 5 HG2 LYS 5 8.076 7.037 0.725 50 HG3 LYS 5 HG3 LYS 5 6.926 6.669 -0.566 51 HD2 LYS 5 HD2 LYS 5 8.060 8.402 -1.994 52 HD3 LYS 5 HD3 LYS 5 9.246 8.633 -0.706 53 HE2 LYS 5 HE2 LYS 5 9.922 6.249 -0.944 54 HE3 LYS 5 HE3 LYS 5 8.780 6.078 -2.281 55 HZ1 LYS 5 HZ1 LYS 5 10.996 6.491 -3.096 56 HZ2 LYS 5 HZ2 LYS 5 11.112 7.915 -2.196 57 HZ3 LYS 5 HZ3 LYS 5 10.005 7.806 -3.469 58 H GLU 6 H GLU 6 6.609 9.830 3.235 59 HA GLU 6 HA GLU 6 8.407 7.974 4.535 60 HB2 GLU 6 HB2 GLU 6 9.148 9.876 5.885 61 HB3 GLU 6 HB3 GLU 6 9.031 10.352 4.193 62 HG2 GLU 6 HG2 GLU 6 6.878 11.454 4.642 63 HG3 GLU 6 HG3 GLU 6 6.971 10.964 6.333 64 H LYS 7 H LYS 7 5.237 9.391 5.375 65 HA LYS 7 HA LYS 7 5.173 8.474 8.080 66 HB2 LYS 7 HB2 LYS 7 2.743 8.915 8.034 67 HB3 LYS 7 HB3 LYS 7 3.657 10.244 7.356 68 HG2 LYS 7 HG2 LYS 7 1.884 10.148 5.880 69 HG3 LYS 7 HG3 LYS 7 3.063 9.146 5.043 70 HD2 LYS 7 HD2 LYS 7 0.859 8.106 4.931 71 HD3 LYS 7 HD3 LYS 7 1.928 7.106 5.914 72 HE2 LYS 7 HE2 LYS 7 0.888 8.016 7.969 73 HE3 LYS 7 HE3 LYS 7 -0.162 9.042 6.990 74 HZ1 LYS 7 HZ1 LYS 7 -0.148 6.072 6.966 75 HZ2 LYS 7 HZ2 LYS 7 -1.169 7.065 6.057 76 HZ3 LYS 7 HZ3 LYS 7 -1.293 7.047 7.742 77 H ALA 8 H ALA 8 4.460 6.921 5.021 78 HA ALA 8 HA ALA 8 3.352 4.485 5.905 79 HB1 ALA 8 HB1 ALA 8 3.469 5.152 3.532 80 HB2 ALA 8 HB2 ALA 8 4.173 3.552 3.777 81 HB3 ALA 8 HB3 ALA 8 5.221 4.956 3.554 82 H GLY 9 H GLY 9 6.742 5.542 5.603 83 HA2 GLY 9 HA2 GLY 9 7.984 3.142 6.523 84 HA3 GLY 9 HA3 GLY 9 8.723 4.731 6.439 85 H ALA 10 H ALA 10 6.911 6.080 8.221 86 HA ALA 10 HA ALA 10 8.037 5.574 10.762 87 HB1 ALA 10 HB1 ALA 10 6.390 7.212 11.607 88 HB2 ALA 10 HB2 ALA 10 5.503 7.110 10.083 89 HB3 ALA 10 HB3 ALA 10 7.138 7.771 10.111 90 H LEU 11 H LEU 11 4.813 4.777 9.461 91 HA LEU 11 HA LEU 11 3.857 3.338 11.756 92 HB2 LEU 11 HB2 LEU 11 2.880 3.257 8.875 93 HB3 LEU 11 HB3 LEU 11 1.985 2.680 10.279 94 HG LEU 11 HG LEU 11 2.768 5.579 9.761 95 HD11 LEU 11 HD11 LEU 11 0.392 5.975 9.351 96 HD12 LEU 11 HD12 LEU 11 0.071 4.244 9.502 97 HD13 LEU 11 HD13 LEU 11 1.087 4.846 8.188 98 HD21 LEU 11 HD21 LEU 11 2.672 5.130 12.154 99 HD22 LEU 11 HD22 LEU 11 1.069 4.413 11.989 100 HD23 LEU 11 HD23 LEU 11 1.307 6.132 11.667 101 H ALA 12 H ALA 12 5.570 2.480 8.816 102 HA ALA 12 HA ALA 12 5.357 -0.294 8.704 103 HB1 ALA 12 HB1 ALA 12 7.517 -0.244 7.491 104 HB2 ALA 12 HB2 ALA 12 7.771 1.424 8.019 105 HB3 ALA 12 HB3 ALA 12 6.428 1.030 6.946 106 H GLY 13 H GLY 13 7.714 1.677 10.497 107 HA2 GLY 13 HA2 GLY 13 9.295 -0.284 11.676 108 HA3 GLY 13 HA3 GLY 13 8.952 1.286 12.387 109 H GLN 14 H GLN 14 6.307 1.172 12.971 110 HA GLN 14 HA GLN 14 6.192 -0.203 15.438 111 HB2 GLN 14 HB2 GLN 14 3.881 0.959 13.830 112 HB3 GLN 14 HB3 GLN 14 3.845 0.559 15.548 113 HG2 GLN 14 HG2 GLN 14 5.558 2.287 15.978 114 HG3 GLN 14 HG3 GLN 14 5.580 2.689 14.258 115 HE21 GLN 14 HE21 GLN 14 3.807 3.787 13.374 116 HE22 GLN 14 HE22 GLN 14 2.636 4.579 14.353 117 H ILE 15 H ILE 15 4.660 -0.935 12.307 118 HA ILE 15 HA ILE 15 3.182 -3.232 13.085 119 HB ILE 15 HB ILE 15 4.236 -2.408 10.339 120 HG12 ILE 15 HG12 ILE 15 1.462 -2.036 11.568 121 HG13 ILE 15 HG13 ILE 15 2.687 -0.777 11.464 122 HG21 ILE 15 HG21 ILE 15 2.507 -3.904 9.359 123 HG22 ILE 15 HG22 ILE 15 2.120 -4.504 10.971 124 HG23 ILE 15 HG23 ILE 15 3.713 -4.806 10.279 125 HD11 ILE 15 HD11 ILE 15 1.358 -2.136 9.122 126 HD12 ILE 15 HD12 ILE 15 2.571 -0.857 9.029 127 HD13 ILE 15 HD13 ILE 15 0.995 -0.528 9.748 128 H TRP 16 H TRP 16 6.437 -2.884 11.674 129 HA TRP 16 HA TRP 16 7.197 -5.573 11.432 130 HB2 TRP 16 HB2 TRP 16 8.450 -3.632 10.470 131 HB3 TRP 16 HB3 TRP 16 8.944 -3.149 12.088 132 HD1 TRP 16 HD1 TRP 16 9.767 -5.621 9.315 133 HE1 TRP 16 HE1 TRP 16 11.951 -6.852 9.891 134 HE3 TRP 16 HE3 TRP 16 10.389 -4.010 14.134 135 HZ2 TRP 16 HZ2 TRP 16 13.701 -7.119 12.082 136 HZ3 TRP 16 HZ3 TRP 16 12.333 -4.807 15.408 137 HH2 TRP 16 HH2 TRP 16 13.951 -6.335 14.406 138 H GLU 17 H GLU 17 7.512 -3.320 14.179 139 HA GLU 17 HA GLU 17 8.882 -5.061 15.974 140 HB2 GLU 17 HB2 GLU 17 7.282 -2.519 16.481 141 HB3 GLU 17 HB3 GLU 17 8.222 -3.346 17.725 142 HG2 GLU 17 HG2 GLU 17 10.280 -2.987 16.455 143 HG3 GLU 17 HG3 GLU 17 9.368 -2.226 15.151 144 H ALA 18 H ALA 18 5.441 -4.534 15.369 145 HA ALA 18 HA ALA 18 4.395 -6.044 17.567 146 HB1 ALA 18 HB1 ALA 18 3.162 -5.519 14.832 147 HB2 ALA 18 HB2 ALA 18 2.995 -4.485 16.252 148 HB3 ALA 18 HB3 ALA 18 2.296 -6.106 16.258 149 H LEU 19 H LEU 19 5.511 -6.872 14.329 150 HA LEU 19 HA LEU 19 4.760 -9.681 14.431 151 HB2 LEU 19 HB2 LEU 19 6.138 -7.887 12.439 152 HB3 LEU 19 HB3 LEU 19 6.284 -9.623 12.247 153 HG LEU 19 HG LEU 19 3.936 -9.893 11.851 154 HD11 LEU 19 HD11 LEU 19 2.284 -8.095 11.925 155 HD12 LEU 19 HD12 LEU 19 3.500 -6.975 12.538 156 HD13 LEU 19 HD13 LEU 19 3.002 -8.360 13.510 157 HD21 LEU 19 HD21 LEU 19 5.263 -9.126 9.941 158 HD22 LEU 19 HD22 LEU 19 4.891 -7.444 10.340 159 HD23 LEU 19 HD23 LEU 19 3.602 -8.544 9.842 160 H ASN 20 H ASN 20 7.514 -7.802 15.359 161 HA ASN 20 HA ASN 20 9.545 -9.756 15.117 162 HB2 ASN 20 HB2 ASN 20 10.016 -7.318 15.336 163 HB3 ASN 20 HB3 ASN 20 9.474 -7.366 17.008 164 HD21 ASN 20 HD21 ASN 20 11.972 -8.355 14.785 165 HD22 ASN 20 HD22 ASN 20 13.155 -8.753 15.978 166 H GLY 21 H GLY 21 9.855 -11.571 16.216 167 HA2 GLY 21 HA2 GLY 21 10.063 -13.054 17.968 168 HA3 GLY 21 HA3 GLY 21 9.511 -11.810 19.074 169 H THR 22 H THR 22 7.408 -12.401 16.396 170 HA THR 22 HA THR 22 5.668 -14.200 18.011 171 HB THR 22 HB THR 22 3.673 -13.136 17.101 172 HG1 THR 22 HG1 THR 22 4.500 -10.955 15.894 173 HG21 THR 22 HG21 THR 22 3.813 -10.866 18.061 174 HG22 THR 22 HG22 THR 22 5.572 -10.988 18.119 175 HG23 THR 22 HG23 THR 22 4.580 -12.054 19.120 176 H GLU 23 H GLU 23 4.076 -15.450 16.657 177 HA GLU 23 HA GLU 23 5.254 -16.506 14.203 178 HB2 GLU 23 HB2 GLU 23 2.918 -17.319 15.952 179 HB3 GLU 23 HB3 GLU 23 3.139 -18.045 14.362 180 HG2 GLU 23 HG2 GLU 23 5.273 -18.078 16.523 181 HG3 GLU 23 HG3 GLU 23 4.076 -19.358 16.317 182 H GLY 24 H GLY 24 3.657 -13.769 14.612 183 HA2 GLY 24 HA2 GLY 24 3.108 -12.477 12.696 184 HA3 GLY 24 HA3 GLY 24 2.431 -13.904 11.929 185 H LEU 25 H LEU 25 1.257 -11.350 12.160 186 HA LEU 25 HA LEU 25 -1.196 -11.947 13.697 187 HB2 LEU 25 HB2 LEU 25 0.165 -9.231 13.433 188 HB3 LEU 25 HB3 LEU 25 -1.425 -9.488 14.118 189 HG LEU 25 HG LEU 25 -0.178 -10.952 15.908 190 HD11 LEU 25 HD11 LEU 25 2.133 -10.308 16.386 191 HD12 LEU 25 HD12 LEU 25 2.181 -9.323 14.924 192 HD13 LEU 25 HD13 LEU 25 2.008 -11.074 14.804 193 HD21 LEU 25 HD21 LEU 25 0.138 -7.929 15.886 194 HD22 LEU 25 HD22 LEU 25 0.246 -8.962 17.316 195 HD23 LEU 25 HD23 LEU 25 -1.278 -8.829 16.438 196 H THR 26 H THR 26 -3.135 -11.139 12.734 197 HA THR 26 HA THR 26 -3.095 -10.706 9.836 198 HB THR 26 HB THR 26 -5.555 -10.861 9.944 199 HG1 THR 26 HG1 THR 26 -6.584 -11.201 11.974 200 HG21 THR 26 HG21 THR 26 -5.812 -13.164 10.783 201 HG22 THR 26 HG22 THR 26 -4.267 -13.043 11.625 202 HG23 THR 26 HG23 THR 26 -4.316 -12.999 9.860 203 H GLN 27 H GLN 27 -4.746 -8.974 9.026 204 HA GLN 27 HA GLN 27 -3.806 -6.429 9.714 205 HB2 GLN 27 HB2 GLN 27 -5.514 -5.515 8.230 206 HB3 GLN 27 HB3 GLN 27 -4.751 -6.924 7.508 207 HG2 GLN 27 HG2 GLN 27 -6.716 -8.284 7.990 208 HG3 GLN 27 HG3 GLN 27 -7.477 -6.937 8.841 209 HE21 GLN 27 HE21 GLN 27 -8.177 -5.109 7.609 210 HE22 GLN 27 HE22 GLN 27 -8.470 -5.239 5.911 211 H LYS 28 H LYS 28 -6.732 -8.106 10.814 212 HA LYS 28 HA LYS 28 -7.883 -6.089 12.411 213 HB2 LYS 28 HB2 LYS 28 -7.918 -9.121 12.692 214 HB3 LYS 28 HB3 LYS 28 -8.881 -8.058 13.721 215 HG2 LYS 28 HG2 LYS 28 -10.092 -7.215 11.774 216 HG3 LYS 28 HG3 LYS 28 -9.091 -8.197 10.698 217 HD2 LYS 28 HD2 LYS 28 -10.006 -10.250 11.631 218 HD3 LYS 28 HD3 LYS 28 -10.888 -9.352 12.869 219 HE2 LYS 28 HE2 LYS 28 -12.323 -8.348 11.171 220 HE3 LYS 28 HE3 LYS 28 -11.386 -9.104 9.881 221 HZ1 LYS 28 HZ1 LYS 28 -12.133 -11.234 10.543 222 HZ2 LYS 28 HZ2 LYS 28 -13.501 -10.242 10.460 223 HZ3 LYS 28 HZ3 LYS 28 -12.834 -10.639 11.962 224 H GLN 29 H GLN 29 -5.455 -8.552 13.260 225 HA GLN 29 HA GLN 29 -5.291 -7.967 16.039 226 HB2 GLN 29 HB2 GLN 29 -3.345 -9.381 14.186 227 HB3 GLN 29 HB3 GLN 29 -3.137 -9.301 15.934 228 HG2 GLN 29 HG2 GLN 29 -5.229 -10.546 16.254 229 HG3 GLN 29 HG3 GLN 29 -5.487 -10.583 14.509 230 HE21 GLN 29 HE21 GLN 29 -3.464 -11.783 17.123 231 HE22 GLN 29 HE22 GLN 29 -2.810 -13.121 16.253 232 H ILE 30 H ILE 30 -3.217 -6.945 13.306 233 HA ILE 30 HA ILE 30 -1.277 -5.564 14.888 234 HB ILE 30 HB ILE 30 -1.864 -5.212 11.913 235 HG12 ILE 30 HG12 ILE 30 0.176 -7.061 13.220 236 HG13 ILE 30 HG13 ILE 30 -1.391 -7.591 12.626 237 HG21 ILE 30 HG21 ILE 30 -0.465 -3.385 12.801 238 HG22 ILE 30 HG22 ILE 30 0.482 -4.430 11.742 239 HG23 ILE 30 HG23 ILE 30 0.659 -4.560 13.493 240 HD11 ILE 30 HD11 ILE 30 -0.749 -6.985 10.361 241 HD12 ILE 30 HD12 ILE 30 0.387 -8.126 11.080 242 HD13 ILE 30 HD13 ILE 30 0.818 -6.422 10.947 243 H LYS 31 H LYS 31 -4.052 -4.441 12.936 244 HA LYS 31 HA LYS 31 -3.798 -1.675 13.103 245 HB2 LYS 31 HB2 LYS 31 -5.437 -2.954 11.719 246 HB3 LYS 31 HB3 LYS 31 -6.359 -3.320 13.169 247 HG2 LYS 31 HG2 LYS 31 -6.855 -0.902 13.440 248 HG3 LYS 31 HG3 LYS 31 -5.944 -0.568 11.959 249 HD2 LYS 31 HD2 LYS 31 -7.522 -2.024 10.685 250 HD3 LYS 31 HD3 LYS 31 -8.440 -2.309 12.166 251 HE2 LYS 31 HE2 LYS 31 -8.942 0.125 12.278 252 HE3 LYS 31 HE3 LYS 31 -8.071 0.355 10.759 253 HZ1 LYS 31 HZ1 LYS 31 -10.445 0.198 10.409 254 HZ2 LYS 31 HZ2 LYS 31 -10.488 -1.330 11.128 255 HZ3 LYS 31 HZ3 LYS 31 -9.657 -1.106 9.671 256 H LYS 32 H LYS 32 -5.408 -3.867 15.391 257 HA LYS 32 HA LYS 32 -6.080 -1.935 17.383 258 HB2 LYS 32 HB2 LYS 32 -7.267 -4.076 17.261 259 HB3 LYS 32 HB3 LYS 32 -5.777 -4.961 17.547 260 HG2 LYS 32 HG2 LYS 32 -7.200 -4.918 19.552 261 HG3 LYS 32 HG3 LYS 32 -5.659 -4.103 19.839 262 HD2 LYS 32 HD2 LYS 32 -6.803 -1.900 19.486 263 HD3 LYS 32 HD3 LYS 32 -8.336 -2.754 19.283 264 HE2 LYS 32 HE2 LYS 32 -6.628 -2.834 21.799 265 HE3 LYS 32 HE3 LYS 32 -8.036 -1.797 21.567 266 HZ1 LYS 32 HZ1 LYS 32 -9.401 -3.778 21.293 267 HZ2 LYS 32 HZ2 LYS 32 -8.621 -3.782 22.793 268 HZ3 LYS 32 HZ3 LYS 32 -8.053 -4.769 21.543 269 H ALA 33 H ALA 33 -3.292 -4.143 16.984 270 HA ALA 33 HA ALA 33 -2.113 -3.698 19.550 271 HB1 ALA 33 HB1 ALA 33 -0.213 -4.997 18.688 272 HB2 ALA 33 HB2 ALA 33 -0.848 -4.850 17.044 273 HB3 ALA 33 HB3 ALA 33 -1.746 -5.758 18.259 274 H THR 34 H THR 34 -1.845 -1.973 16.544 275 HA THR 34 HA THR 34 0.395 -0.291 17.524 276 HB THR 34 HB THR 34 0.600 0.505 15.154 277 HG1 THR 34 HG1 THR 34 -0.968 -1.580 14.177 278 HG21 THR 34 HG21 THR 34 2.015 -1.389 15.879 279 HG22 THR 34 HG22 THR 34 1.558 -1.556 14.183 280 HG23 THR 34 HG23 THR 34 0.744 -2.525 15.416 281 H LYS 35 H LYS 35 -2.964 -0.329 17.239 282 HA LYS 35 HA LYS 35 -4.609 1.126 17.729 283 HB2 LYS 35 HB2 LYS 35 -2.986 1.826 19.548 284 HB3 LYS 35 HB3 LYS 35 -2.451 3.126 18.497 285 HG2 LYS 35 HG2 LYS 35 -4.840 3.998 18.535 286 HG3 LYS 35 HG3 LYS 35 -5.188 2.792 19.775 287 HD2 LYS 35 HD2 LYS 35 -3.104 5.006 19.995 288 HD3 LYS 35 HD3 LYS 35 -4.709 5.046 20.727 289 HE2 LYS 35 HE2 LYS 35 -4.125 3.091 22.120 290 HE3 LYS 35 HE3 LYS 35 -2.526 3.026 21.374 291 HZ1 LYS 35 HZ1 LYS 35 -2.051 5.206 22.275 292 HZ2 LYS 35 HZ2 LYS 35 -2.481 4.134 23.513 293 HZ3 LYS 35 HZ3 LYS 35 -3.593 5.290 22.975 294 H LEU 36 H LEU 36 -3.466 1.012 15.034 295 HA LEU 36 HA LEU 36 -3.465 3.570 13.794 296 HB2 LEU 36 HB2 LEU 36 -3.898 0.793 12.630 297 HB3 LEU 36 HB3 LEU 36 -3.800 2.245 11.640 298 HG LEU 36 HG LEU 36 -1.571 1.207 13.438 299 HD11 LEU 36 HD11 LEU 36 -1.793 1.122 10.415 300 HD12 LEU 36 HD12 LEU 36 -1.895 -0.256 11.514 301 HD13 LEU 36 HD13 LEU 36 -0.384 0.638 11.366 302 HD21 LEU 36 HD21 LEU 36 -1.510 3.645 13.274 303 HD22 LEU 36 HD22 LEU 36 -1.566 3.555 11.512 304 HD23 LEU 36 HD23 LEU 36 -0.163 2.933 12.385 305 H LYS 37 H LYS 37 -5.064 4.913 13.484 306 HA LYS 37 HA LYS 37 -7.739 4.600 14.168 307 HB2 LYS 37 HB2 LYS 37 -8.087 6.772 12.911 308 HB3 LYS 37 HB3 LYS 37 -6.757 6.805 14.063 309 HG2 LYS 37 HG2 LYS 37 -5.128 6.538 12.248 310 HG3 LYS 37 HG3 LYS 37 -6.433 6.406 11.066 311 HD2 LYS 37 HD2 LYS 37 -7.103 8.724 11.522 312 HD3 LYS 37 HD3 LYS 37 -5.861 8.863 12.770 313 HE2 LYS 37 HE2 LYS 37 -5.158 9.924 10.641 314 HE3 LYS 37 HE3 LYS 37 -4.101 8.581 11.081 315 HZ1 LYS 37 HZ1 LYS 37 -6.295 8.478 9.076 316 HZ2 LYS 37 HZ2 LYS 37 -5.305 7.179 9.506 317 HZ3 LYS 37 HZ3 LYS 37 -4.641 8.524 8.737 318 H ALA 38 H ALA 38 -6.183 4.202 11.018 319 HA ALA 38 HA ALA 38 -8.622 2.943 9.922 320 HB1 ALA 38 HB1 ALA 38 -6.865 4.904 8.384 321 HB2 ALA 38 HB2 ALA 38 -8.490 5.233 8.986 322 HB3 ALA 38 HB3 ALA 38 -8.248 4.015 7.732 323 H ASP 39 H ASP 39 -8.289 1.223 8.598 324 HA ASP 39 HA ASP 39 -5.906 -0.286 8.563 325 HB2 ASP 39 HB2 ASP 39 -7.114 -1.553 6.641 326 HB3 ASP 39 HB3 ASP 39 -7.900 -1.512 8.216 327 H LYS 40 H LYS 40 -6.967 2.312 6.526 328 HA LYS 40 HA LYS 40 -5.347 2.008 4.253 329 HB2 LYS 40 HB2 LYS 40 -6.152 4.642 5.553 330 HB3 LYS 40 HB3 LYS 40 -5.715 4.393 3.862 331 HG2 LYS 40 HG2 LYS 40 -8.181 3.331 5.283 332 HG3 LYS 40 HG3 LYS 40 -8.129 4.607 4.060 333 HD2 LYS 40 HD2 LYS 40 -7.423 2.980 2.357 334 HD3 LYS 40 HD3 LYS 40 -7.337 1.702 3.569 335 HE2 LYS 40 HE2 LYS 40 -9.385 1.530 2.212 336 HE3 LYS 40 HE3 LYS 40 -9.760 1.827 3.909 337 HZ1 LYS 40 HZ1 LYS 40 -9.780 3.835 1.726 338 HZ2 LYS 40 HZ2 LYS 40 -10.090 4.171 3.358 339 HZ3 LYS 40 HZ3 LYS 40 -11.130 3.162 2.488 340 H ASP 41 H ASP 41 -4.599 3.406 7.420 341 HA ASP 41 HA ASP 41 -1.955 4.340 6.899 342 HB2 ASP 41 HB2 ASP 41 -3.181 3.355 9.518 343 HB3 ASP 41 HB3 ASP 41 -1.713 4.316 9.377 344 H PHE 42 H PHE 42 -3.303 1.253 7.911 345 HA PHE 42 HA PHE 42 -0.903 -0.137 8.502 346 HB2 PHE 42 HB2 PHE 42 -2.976 -0.919 9.457 347 HB3 PHE 42 HB3 PHE 42 -3.724 -1.080 7.873 348 HD1 PHE 42 HD1 PHE 42 -0.791 -2.398 9.810 349 HD2 PHE 42 HD2 PHE 42 -3.842 -3.234 6.934 350 HE1 PHE 42 HE1 PHE 42 -0.074 -4.737 9.720 351 HE2 PHE 42 HE2 PHE 42 -3.116 -5.582 6.864 352 HZ PHE 42 HZ PHE 42 -1.232 -6.334 8.255 353 H PHE 43 H PHE 43 -2.852 0.060 5.493 354 HA PHE 43 HA PHE 43 -1.518 -1.985 4.047 355 HB2 PHE 43 HB2 PHE 43 -3.038 0.426 2.975 356 HB3 PHE 43 HB3 PHE 43 -2.553 -0.966 2.008 357 HD1 PHE 43 HD2 PHE 43 -3.206 -3.252 3.759 358 HD2 PHE 43 HD1 PHE 43 -5.391 0.359 3.057 359 HE1 PHE 43 HE2 PHE 43 -5.300 -4.395 4.349 360 HE2 PHE 43 HE1 PHE 43 -7.475 -0.793 3.644 361 HZ PHE 43 HZ PHE 43 -7.433 -3.168 4.292 362 H LEU 44 H LEU 44 -0.910 1.500 4.229 363 HA LEU 44 HA LEU 44 1.306 1.558 2.409 364 HB2 LEU 44 HB2 LEU 44 0.178 3.480 4.451 365 HB3 LEU 44 HB3 LEU 44 1.748 3.805 3.746 366 HG LEU 44 HG LEU 44 0.737 3.869 1.482 367 HD11 LEU 44 HD11 LEU 44 -1.684 3.940 1.139 368 HD12 LEU 44 HD12 LEU 44 -1.954 3.551 2.839 369 HD13 LEU 44 HD13 LEU 44 -1.173 2.379 1.777 370 HD21 LEU 44 HD21 LEU 44 1.028 5.948 2.748 371 HD22 LEU 44 HD22 LEU 44 -0.589 5.774 3.435 372 HD23 LEU 44 HD23 LEU 44 -0.388 6.032 1.701 373 H GLY 45 H GLY 45 0.980 1.105 5.909 374 HA2 GLY 45 HA2 GLY 45 3.691 1.258 6.690 375 HA3 GLY 45 HA3 GLY 45 2.423 0.399 7.546 376 H LEU 46 H LEU 46 1.741 -1.737 6.250 377 HA LEU 46 HA LEU 46 3.947 -3.528 6.254 378 HB2 LEU 46 HB2 LEU 46 2.401 -5.239 5.981 379 HB3 LEU 46 HB3 LEU 46 1.360 -3.977 6.595 380 HG LEU 46 HG LEU 46 1.127 -3.585 3.853 381 HD11 LEU 46 HD11 LEU 46 2.422 -5.557 3.281 382 HD12 LEU 46 HD12 LEU 46 0.746 -5.729 2.763 383 HD13 LEU 46 HD13 LEU 46 1.317 -6.585 4.200 384 HD21 LEU 46 HD21 LEU 46 -0.727 -3.604 5.436 385 HD22 LEU 46 HD22 LEU 46 -0.663 -5.366 5.511 386 HD23 LEU 46 HD23 LEU 46 -1.087 -4.558 3.999 387 H GLY 47 H GLY 47 2.398 -1.671 3.717 388 HA2 GLY 47 HA2 GLY 47 3.404 -2.889 1.382 389 HA3 GLY 47 HA3 GLY 47 2.948 -1.199 1.542 390 H TRP 48 H TRP 48 4.877 -0.602 3.638 391 HA TRP 48 HA TRP 48 7.284 -0.215 2.139 392 HB2 TRP 48 HB2 TRP 48 6.354 1.272 4.064 393 HB3 TRP 48 HB3 TRP 48 7.097 0.102 5.155 394 HD1 TRP 48 HD1 TRP 48 9.858 -0.131 4.941 395 HE1 TRP 48 HE1 TRP 48 11.611 1.567 4.176 396 HE3 TRP 48 HE3 TRP 48 6.779 3.253 2.684 397 HZ2 TRP 48 HZ2 TRP 48 11.697 4.046 2.822 398 HZ3 TRP 48 HZ3 TRP 48 7.768 5.267 1.683 399 HH2 TRP 48 HH2 TRP 48 10.180 5.661 1.751 400 H LEU 49 H LEU 49 6.330 -2.434 4.762 401 HA LEU 49 HA LEU 49 8.730 -3.804 5.226 402 HB2 LEU 49 HB2 LEU 49 5.830 -4.600 5.500 403 HB3 LEU 49 HB3 LEU 49 7.064 -5.804 5.771 404 HG LEU 49 HG LEU 49 7.924 -4.653 7.694 405 HD11 LEU 49 HD11 LEU 49 7.064 -2.520 8.492 406 HD12 LEU 49 HD12 LEU 49 6.080 -2.372 7.029 407 HD13 LEU 49 HD13 LEU 49 7.845 -2.383 6.918 408 HD21 LEU 49 HD21 LEU 49 4.891 -4.556 7.841 409 HD22 LEU 49 HD22 LEU 49 6.005 -4.632 9.212 410 HD23 LEU 49 HD23 LEU 49 5.886 -5.992 8.101 411 H LEU 50 H LEU 50 6.459 -4.187 2.582 412 HA LEU 50 HA LEU 50 7.388 -6.644 1.508 413 HB2 LEU 50 HB2 LEU 50 6.021 -4.353 0.047 414 HB3 LEU 50 HB3 LEU 50 6.172 -6.003 -0.548 415 HG LEU 50 HG LEU 50 4.499 -5.024 1.792 416 HD11 LEU 50 HD11 LEU 50 3.475 -4.676 -0.390 417 HD12 LEU 50 HD12 LEU 50 2.597 -5.889 0.535 418 HD13 LEU 50 HD13 LEU 50 3.665 -6.388 -0.781 419 HD21 LEU 50 HD21 LEU 50 4.986 -7.915 1.006 420 HD22 LEU 50 HD22 LEU 50 3.823 -7.345 2.206 421 HD23 LEU 50 HD23 LEU 50 5.547 -7.120 2.481 422 H ARG 51 H ARG 51 8.418 -3.261 0.864 423 HA ARG 51 HA ARG 51 10.244 -3.989 -1.260 424 HB2 ARG 51 HB2 ARG 51 10.824 -1.713 -1.424 425 HB3 ARG 51 HB3 ARG 51 9.156 -1.680 -0.885 426 HG2 ARG 51 HG2 ARG 51 10.173 -1.382 1.505 427 HG3 ARG 51 HG3 ARG 51 11.654 -0.956 0.651 428 HD2 ARG 51 HD2 ARG 51 10.405 1.069 1.198 429 HD3 ARG 51 HD3 ARG 51 10.403 0.840 -0.559 430 HE ARG 51 HE ARG 51 8.140 -0.283 0.839 431 HH11 ARG 51 HH11 ARG 51 9.278 2.579 -0.725 432 HH12 ARG 51 HH12 ARG 51 7.684 3.137 -1.069 433 HH21 ARG 51 HH21 ARG 51 6.119 0.438 0.379 434 HH22 ARG 51 HH22 ARG 51 5.905 1.940 -0.444 435 H GLU 52 H GLU 52 10.418 -3.801 2.198 436 HA GLU 52 HA GLU 52 13.296 -3.933 2.430 437 HB2 GLU 52 HB2 GLU 52 11.129 -4.523 4.497 438 HB3 GLU 52 HB3 GLU 52 12.843 -4.289 4.837 439 HG2 GLU 52 HG2 GLU 52 12.670 -1.943 4.093 440 HG3 GLU 52 HG3 GLU 52 10.959 -2.174 3.737 441 H ASP 53 H ASP 53 10.647 -6.153 2.050 442 HA ASP 53 HA ASP 53 10.317 -8.376 2.100 443 HB2 ASP 53 HB2 ASP 53 13.226 -8.388 1.214 444 HB3 ASP 53 HB3 ASP 53 12.187 -9.811 1.178 445 H LYS 54 H LYS 54 11.144 -7.094 4.578 446 HA LYS 54 HA LYS 54 12.569 -9.169 6.080 447 HB2 LYS 54 HB2 LYS 54 11.449 -6.454 6.867 448 HB3 LYS 54 HB3 LYS 54 12.042 -7.595 8.076 449 HG2 LYS 54 HG2 LYS 54 14.239 -7.634 6.810 450 HG3 LYS 54 HG3 LYS 54 13.625 -6.297 5.838 451 HD2 LYS 54 HD2 LYS 54 13.788 -6.137 8.873 452 HD3 LYS 54 HD3 LYS 54 15.172 -5.758 7.846 453 HE2 LYS 54 HE2 LYS 54 14.178 -3.670 8.313 454 HE3 LYS 54 HE3 LYS 54 13.640 -4.051 6.683 455 HZ1 LYS 54 HZ1 LYS 54 11.843 -3.180 7.963 456 HZ2 LYS 54 HZ2 LYS 54 12.066 -4.333 9.180 457 HZ3 LYS 54 HZ3 LYS 54 11.529 -4.811 7.648 458 H VAL 55 H VAL 55 9.508 -8.853 4.943 459 HA VAL 55 HA VAL 55 8.387 -10.606 7.048 460 HB VAL 55 HB VAL 55 6.139 -9.679 6.621 461 HG11 VAL 55 HG11 VAL 55 7.430 -8.788 8.503 462 HG12 VAL 55 HG12 VAL 55 6.406 -7.535 7.803 463 HG13 VAL 55 HG13 VAL 55 8.137 -7.550 7.460 464 HG21 VAL 55 HG21 VAL 55 6.436 -8.898 4.304 465 HG22 VAL 55 HG22 VAL 55 7.531 -7.627 4.850 466 HG23 VAL 55 HG23 VAL 55 5.830 -7.585 5.319 467 H VAL 56 H VAL 56 7.070 -12.273 6.366 468 HA VAL 56 HA VAL 56 6.647 -12.691 3.496 469 HB VAL 56 HB VAL 56 8.011 -14.496 4.352 470 HG11 VAL 56 HG11 VAL 56 5.914 -14.970 6.494 471 HG12 VAL 56 HG12 VAL 56 7.528 -14.307 6.746 472 HG13 VAL 56 HG13 VAL 56 7.337 -15.976 6.207 473 HG21 VAL 56 HG21 VAL 56 5.165 -15.513 3.993 474 HG22 VAL 56 HG22 VAL 56 6.634 -16.474 3.811 475 HG23 VAL 56 HG23 VAL 56 6.301 -15.149 2.693 476 H THR 57 H THR 57 4.626 -12.714 2.738 477 HA THR 57 HA THR 57 2.396 -12.230 4.627 478 HB THR 57 HB THR 57 1.257 -11.124 2.664 479 HG1 THR 57 HG1 THR 57 3.621 -10.845 1.244 480 HG21 THR 57 HG21 THR 57 2.622 -9.066 2.621 481 HG22 THR 57 HG22 THR 57 3.967 -9.936 3.361 482 HG23 THR 57 HG23 THR 57 2.466 -9.697 4.262 483 H SER 58 H SER 58 0.716 -13.614 4.655 484 HA SER 58 HA SER 58 0.265 -15.517 2.426 485 HB2 SER 58 HB2 SER 58 1.058 -16.705 4.462 486 HB3 SER 58 HB3 SER 58 -0.263 -16.000 5.394 487 HG SER 58 HG SER 58 -1.092 -17.899 4.798 488 H GLU 59 H GLU 59 -1.874 -15.862 1.801 489 HA GLU 59 HA GLU 59 -3.710 -13.645 2.455 490 HB2 GLU 59 HB2 GLU 59 -3.179 -13.946 0.076 491 HB3 GLU 59 HB3 GLU 59 -3.691 -15.630 0.133 492 HG2 GLU 59 HG2 GLU 59 -6.012 -14.923 0.555 493 HG3 GLU 59 HG3 GLU 59 -5.503 -13.232 0.566 494 H VAL 60 H VAL 60 -4.954 -14.139 4.157 495 HA VAL 60 HA VAL 60 -6.165 -16.847 4.419 496 HB VAL 60 HB VAL 60 -5.405 -14.822 6.576 497 HG11 VAL 60 HG11 VAL 60 -6.965 -17.412 6.992 498 HG12 VAL 60 HG12 VAL 60 -7.594 -15.779 7.213 499 HG13 VAL 60 HG13 VAL 60 -6.322 -16.381 8.274 500 HG21 VAL 60 HG21 VAL 60 -3.554 -16.231 5.753 501 HG22 VAL 60 HG22 VAL 60 -4.497 -17.686 6.100 502 HG23 VAL 60 HG23 VAL 60 -3.962 -16.644 7.423 503 H GLU 61 H GLU 61 -8.111 -16.735 3.520 504 HA GLU 61 HA GLU 61 -10.326 -16.384 3.254 505 HB2 GLU 61 HB2 GLU 61 -10.165 -15.077 6.000 506 HB3 GLU 61 HB3 GLU 61 -11.604 -15.774 5.257 507 HG2 GLU 61 HG2 GLU 61 -10.513 -18.020 5.341 508 HG3 GLU 61 HG3 GLU 61 -9.119 -17.292 6.119 509 H GLY 62 H GLY 62 -8.773 -14.455 1.956 510 HA2 GLY 62 HA2 GLY 62 -9.166 -12.563 0.695 511 HA3 GLY 62 HA3 GLY 62 -10.631 -12.269 1.608 512 H GLU 63 H GLU 63 -8.201 -12.590 3.854 513 HA GLU 63 HA GLU 63 -7.747 -9.658 4.014 514 HB2 GLU 63 HB2 GLU 63 -8.069 -11.658 6.296 515 HB3 GLU 63 HB3 GLU 63 -7.581 -9.976 6.502 516 HG2 GLU 63 HG2 GLU 63 -9.746 -9.257 5.496 517 HG3 GLU 63 HG3 GLU 63 -10.238 -10.949 5.410 518 H ILE 64 H ILE 64 -5.812 -8.962 5.132 519 HA ILE 64 HA ILE 64 -3.470 -10.393 4.186 520 HB ILE 64 HB ILE 64 -3.730 -7.702 5.588 521 HG12 ILE 64 HG12 ILE 64 -3.286 -8.407 2.650 522 HG13 ILE 64 HG13 ILE 64 -4.764 -7.752 3.344 523 HG21 ILE 64 HG21 ILE 64 -1.491 -8.621 6.029 524 HG22 ILE 64 HG22 ILE 64 -1.380 -7.264 4.909 525 HG23 ILE 64 HG23 ILE 64 -1.250 -8.917 4.306 526 HD11 ILE 64 HD11 ILE 64 -2.111 -6.323 3.132 527 HD12 ILE 64 HD12 ILE 64 -3.581 -5.659 3.850 528 HD13 ILE 64 HD13 ILE 64 -3.541 -6.058 2.135 529 H PHE 65 H PHE 65 -2.725 -12.022 5.389 530 HA PHE 65 HA PHE 65 -2.124 -11.592 8.262 531 HB2 PHE 65 HB2 PHE 65 -3.246 -13.739 7.898 532 HB3 PHE 65 HB3 PHE 65 -2.146 -14.147 6.587 533 HD1 PHE 65 HD2 PHE 65 -2.178 -13.426 10.271 534 HD2 PHE 65 HD1 PHE 65 -0.214 -15.457 7.059 535 HE1 PHE 65 HE2 PHE 65 -0.677 -14.528 11.873 536 HE2 PHE 65 HE1 PHE 65 1.286 -16.552 8.674 537 HZ PHE 65 HZ PHE 65 1.058 -16.086 11.082 538 H VAL 66 H VAL 66 -0.027 -11.145 8.780 539 HA VAL 66 HA VAL 66 2.136 -11.743 6.875 540 HB VAL 66 HB VAL 66 1.430 -9.491 6.265 541 HG11 VAL 66 HG11 VAL 66 1.877 -8.659 9.150 542 HG12 VAL 66 HG12 VAL 66 0.317 -8.801 8.337 543 HG13 VAL 66 HG13 VAL 66 1.474 -7.576 7.810 544 HG21 VAL 66 HG21 VAL 66 4.050 -9.383 7.798 545 HG22 VAL 66 HG22 VAL 66 3.549 -8.252 6.538 546 HG23 VAL 66 HG23 VAL 66 3.837 -9.947 6.140 547 H LYS 67 H LYS 67 4.135 -12.149 7.792 548 HA LYS 67 HA LYS 67 4.634 -11.542 10.641 549 HB2 LYS 67 HB2 LYS 67 5.424 -13.800 11.155 550 HB3 LYS 67 HB3 LYS 67 3.749 -13.867 10.632 551 HG2 LYS 67 HG2 LYS 67 4.442 -14.689 8.425 552 HG3 LYS 67 HG3 LYS 67 6.140 -14.593 8.908 553 HD2 LYS 67 HD2 LYS 67 4.021 -16.381 10.179 554 HD3 LYS 67 HD3 LYS 67 5.277 -16.915 9.060 555 HE2 LYS 67 HE2 LYS 67 7.017 -16.312 10.706 556 HE3 LYS 67 HE3 LYS 67 5.780 -15.703 11.809 557 HZ1 LYS 67 HZ1 LYS 67 4.855 -17.951 11.912 558 HZ2 LYS 67 HZ2 LYS 67 6.454 -17.893 12.464 559 HZ3 LYS 67 HZ3 LYS 67 6.111 -18.517 10.927 560 H LEU 68 H LEU 68 7.050 -11.879 11.158 561 HA LEU 68 HA LEU 68 8.713 -10.861 9.073 562 HB2 LEU 68 HB2 LEU 68 9.538 -12.167 11.694 563 HB3 LEU 68 HB3 LEU 68 10.631 -11.320 10.609 564 HG LEU 68 HG LEU 68 8.453 -10.157 12.375 565 HD11 LEU 68 HD11 LEU 68 11.414 -9.538 12.134 566 HD12 LEU 68 HD12 LEU 68 10.638 -10.480 13.410 567 HD13 LEU 68 HD13 LEU 68 10.275 -8.765 13.242 568 HD21 LEU 68 HD21 LEU 68 9.854 -8.704 10.109 569 HD22 LEU 68 HD22 LEU 68 8.880 -7.939 11.369 570 HD23 LEU 68 HD23 LEU 68 8.129 -9.061 10.239 571 H VAL 69 H VAL 69 10.328 -11.859 7.846 572 HA VAL 69 HA VAL 69 10.138 -14.613 7.131 573 HB VAL 69 HB VAL 69 12.440 -12.644 6.693 574 HG11 VAL 69 HG11 VAL 69 13.243 -14.171 4.906 575 HG12 VAL 69 HG12 VAL 69 12.006 -15.350 5.355 576 HG13 VAL 69 HG13 VAL 69 13.291 -14.943 6.494 577 HG21 VAL 69 HG21 VAL 69 11.540 -12.395 4.403 578 HG22 VAL 69 HG22 VAL 69 10.364 -11.901 5.619 579 HG23 VAL 69 HG23 VAL 69 10.192 -13.462 4.813 580 H LEU 70 H LEU 70 10.513 -16.157 8.652 581 HA LEU 70 HA LEU 70 12.530 -15.939 10.702 582 HB2 LEU 70 HB2 LEU 70 10.956 -18.383 9.780 583 HB3 LEU 70 HB3 LEU 70 11.945 -18.296 11.232 584 HG LEU 70 HG LEU 70 9.380 -16.734 10.710 585 HD11 LEU 70 HD11 LEU 70 9.917 -18.994 12.661 586 HD12 LEU 70 HD12 LEU 70 8.958 -19.090 11.180 587 HD13 LEU 70 HD13 LEU 70 8.414 -18.077 12.515 588 HD21 LEU 70 HD21 LEU 70 10.926 -15.363 12.028 589 HD22 LEU 70 HD22 LEU 70 11.148 -16.677 13.185 590 HD23 LEU 70 HD23 LEU 70 9.571 -15.899 13.019 591 H GLU 71 H GLU 71 14.415 -15.492 9.504 592 HA GLU 71 HA GLU 71 15.490 -16.972 7.356 593 HB2 GLU 71 HB2 GLU 71 16.251 -14.699 7.973 594 HB3 GLU 71 HB3 GLU 71 16.902 -15.305 9.491 595 HG2 GLU 71 HG2 GLU 71 18.494 -16.730 8.123 596 HG3 GLU 71 HG3 GLU 71 17.917 -15.881 6.691 597 H HIS 72 H HIS 72 15.841 -17.303 10.834 598 HA HIS 72 HA HIS 72 17.751 -19.524 10.644 599 HB2 HIS 72 HB2 HIS 72 16.585 -18.159 13.116 600 HB3 HIS 72 HB3 HIS 72 17.974 -19.240 13.069 601 HD1 HIS 72 HD1 HIS 72 20.211 -18.261 12.148 602 HD2 HIS 72 HD2 HIS 72 17.121 -15.493 12.361 603 HE1 HIS 72 HE1 HIS 72 21.285 -16.026 11.807 604 HE2 HIS 72 HE2 HIS 72 19.376 -14.399 11.721 605 H HIS 73 H HIS 73 16.874 -21.495 10.301 606 HA HIS 73 HA HIS 73 14.150 -22.158 11.285 607 HB2 HIS 73 HB2 HIS 73 15.770 -23.505 9.074 608 HB3 HIS 73 HB3 HIS 73 14.098 -23.856 9.500 609 HD1 HIS 73 HD1 HIS 73 16.116 -21.814 7.268 610 HD2 HIS 73 HD2 HIS 73 12.314 -21.567 8.913 611 HE1 HIS 73 HE1 HIS 73 14.888 -20.141 5.863 612 HE2 HIS 73 HE2 HIS 73 12.681 -19.848 7.024 613 H HIS 74 H HIS 74 15.566 -22.386 13.401 614 HA HIS 74 HA HIS 74 16.953 -24.944 13.689 615 HB2 HIS 74 HB2 HIS 74 16.348 -22.739 15.704 616 HB3 HIS 74 HB3 HIS 74 17.268 -24.193 16.077 617 HD1 HIS 74 HD1 HIS 74 19.683 -24.293 15.324 618 HD2 HIS 74 HD2 HIS 74 17.723 -20.871 14.024 619 HE1 HIS 74 HE1 HIS 74 21.483 -22.777 14.473 620 HE2 HIS 74 HE2 HIS 74 20.278 -20.748 13.616 621 H HIS 75 H HIS 75 15.497 -26.572 13.475 622 HA HIS 75 HA HIS 75 13.234 -26.777 15.394 623 HB2 HIS 75 HB2 HIS 75 13.529 -28.201 12.707 624 HB3 HIS 75 HB3 HIS 75 12.130 -28.264 13.777 625 HD1 HIS 75 HD1 HIS 75 10.880 -25.855 14.110 626 HD2 HIS 75 HD2 HIS 75 13.406 -26.227 10.830 627 HE1 HIS 75 HE1 HIS 75 10.254 -23.985 12.562 628 HE2 HIS 75 HE2 HIS 75 11.617 -24.393 10.495 629 H HIS 76 H HIS 76 13.565 -28.240 16.983 630 HA HIS 76 HA HIS 76 15.985 -29.702 17.221 631 HB2 HIS 76 HB2 HIS 76 13.463 -29.970 18.914 632 HB3 HIS 76 HB3 HIS 76 15.085 -30.479 19.381 633 HD1 HIS 76 HD1 HIS 76 12.820 -27.590 19.420 634 HD2 HIS 76 HD2 HIS 76 16.913 -28.230 19.797 635 HE1 HIS 76 HE1 HIS 76 13.746 -25.468 20.383 636 HE2 HIS 76 HE2 HIS 76 16.201 -25.910 20.694 637 H HIS 77 H HIS 77 12.734 -30.733 16.270 638 HA HIS 77 HA HIS 77 13.156 -33.556 16.406 639 HB2 HIS 77 HB2 HIS 77 11.069 -33.701 15.024 640 HB3 HIS 77 HB3 HIS 77 10.895 -32.673 16.438 641 HD1 HIS 77 HD1 HIS 77 10.178 -30.290 16.058 642 HD2 HIS 77 HD2 HIS 77 11.149 -32.234 12.515 643 HE1 HIS 77 HE1 HIS 77 9.453 -28.742 14.222 644 HE2 HIS 77 HE2 HIS 77 9.974 -29.969 12.089 645 H1 MET 1 H MET 1 -0.836 -20.990 -4.971 646 HA MET 1 HA MET 1 0.852 -19.993 -6.148 647 HB2 MET 1 HB2 MET 1 -1.365 -19.899 -8.233 648 HB3 MET 1 HB3 MET 1 0.326 -19.575 -8.588 649 HG2 MET 1 HG2 MET 1 -0.714 -22.210 -7.517 650 HG3 MET 1 HG3 MET 1 -0.422 -21.859 -9.218 651 HE1 MET 1 HE1 MET 1 1.062 -23.627 -6.247 652 HE2 MET 1 HE2 MET 1 1.390 -22.002 -5.644 653 HE3 MET 1 HE3 MET 1 2.724 -23.056 -6.114 654 H LYS 2 H LYS 2 -2.194 -18.148 -6.536 655 HA LYS 2 HA LYS 2 -0.824 -15.628 -6.949 656 HB2 LYS 2 HB2 LYS 2 -3.787 -16.137 -6.471 657 HB3 LYS 2 HB3 LYS 2 -3.069 -14.629 -7.036 658 HG2 LYS 2 HG2 LYS 2 -2.214 -15.937 -9.059 659 HG3 LYS 2 HG3 LYS 2 -3.230 -17.274 -8.517 660 HD2 LYS 2 HD2 LYS 2 -4.434 -16.046 -10.223 661 HD3 LYS 2 HD3 LYS 2 -5.226 -15.744 -8.675 662 HE2 LYS 2 HE2 LYS 2 -5.041 -13.672 -9.994 663 HE3 LYS 2 HE3 LYS 2 -4.088 -13.556 -8.516 664 HZ1 LYS 2 HZ1 LYS 2 -3.021 -14.156 -11.224 665 HZ2 LYS 2 HZ2 LYS 2 -2.102 -14.053 -9.811 666 HZ3 LYS 2 HZ3 LYS 2 -2.884 -12.682 -10.410 667 H MET 3 H MET 3 -0.759 -13.830 -5.509 668 HA MET 3 HA MET 3 -1.091 -14.479 -2.641 669 HB2 MET 3 HB2 MET 3 1.330 -14.870 -3.865 670 HB3 MET 3 HB3 MET 3 1.521 -13.187 -3.399 671 HG2 MET 3 HG2 MET 3 2.468 -14.723 -1.730 672 HG3 MET 3 HG3 MET 3 1.126 -13.792 -1.045 673 HE1 MET 3 HE1 MET 3 1.386 -15.866 0.915 674 HE2 MET 3 HE2 MET 3 2.487 -16.791 -0.109 675 HE3 MET 3 HE3 MET 3 1.022 -17.545 0.520 676 H LEU 4 H LEU 4 -0.496 -12.575 -1.206 677 HA LEU 4 HA LEU 4 -2.070 -10.303 -1.710 678 HB2 LEU 4 HB2 LEU 4 0.174 -10.698 0.304 679 HB3 LEU 4 HB3 LEU 4 -0.947 -9.344 0.333 680 HG LEU 4 HG LEU 4 -1.723 -12.268 0.704 681 HD11 LEU 4 HD11 LEU 4 -0.445 -11.458 2.607 682 HD12 LEU 4 HD12 LEU 4 -2.135 -11.677 3.048 683 HD13 LEU 4 HD13 LEU 4 -1.504 -10.052 2.761 684 HD21 LEU 4 HD21 LEU 4 -3.542 -10.994 -0.324 685 HD22 LEU 4 HD22 LEU 4 -3.434 -9.768 0.942 686 HD23 LEU 4 HD23 LEU 4 -3.941 -11.413 1.342 687 H LYS 5 H LYS 5 1.467 -10.704 -1.917 688 HA LYS 5 HA LYS 5 2.064 -8.020 -2.664 689 HB2 LYS 5 HB2 LYS 5 3.652 -10.580 -3.060 690 HB3 LYS 5 HB3 LYS 5 4.278 -8.974 -3.416 691 HG2 LYS 5 HG2 LYS 5 3.884 -8.383 -0.981 692 HG3 LYS 5 HG3 LYS 5 3.471 -10.073 -0.698 693 HD2 LYS 5 HD2 LYS 5 5.777 -9.713 -0.038 694 HD3 LYS 5 HD3 LYS 5 5.767 -10.719 -1.490 695 HE2 LYS 5 HE2 LYS 5 6.339 -8.762 -2.867 696 HE3 LYS 5 HE3 LYS 5 6.267 -7.719 -1.446 697 HZ1 LYS 5 HZ1 LYS 5 8.534 -8.332 -2.053 698 HZ2 LYS 5 HZ2 LYS 5 8.172 -9.963 -1.803 699 HZ3 LYS 5 HZ3 LYS 5 8.130 -8.880 -0.508 700 H GLU 6 H GLU 6 1.367 -10.940 -4.550 701 HA GLU 6 HA GLU 6 2.153 -9.924 -7.068 702 HB2 GLU 6 HB2 GLU 6 1.939 -12.352 -6.604 703 HB3 GLU 6 HB3 GLU 6 0.191 -12.171 -6.455 704 HG2 GLU 6 HG2 GLU 6 0.131 -11.390 -8.853 705 HG3 GLU 6 HG3 GLU 6 1.857 -11.740 -8.958 706 H LYS 7 H LYS 7 -1.061 -10.087 -5.468 707 HA LYS 7 HA LYS 7 -2.593 -9.033 -7.611 708 HB2 LYS 7 HB2 LYS 7 -4.390 -8.680 -6.020 709 HB3 LYS 7 HB3 LYS 7 -3.601 -10.205 -5.633 710 HG2 LYS 7 HG2 LYS 7 -2.462 -9.212 -3.739 711 HG3 LYS 7 HG3 LYS 7 -3.010 -7.604 -4.194 712 HD2 LYS 7 HD2 LYS 7 -4.394 -8.180 -2.398 713 HD3 LYS 7 HD3 LYS 7 -5.399 -8.475 -3.814 714 HE2 LYS 7 HE2 LYS 7 -3.876 -10.630 -2.307 715 HE3 LYS 7 HE3 LYS 7 -5.570 -10.240 -2.035 716 HZ1 LYS 7 HZ1 LYS 7 -5.401 -12.131 -3.442 717 HZ2 LYS 7 HZ2 LYS 7 -4.378 -11.331 -4.519 718 HZ3 LYS 7 HZ3 LYS 7 -5.989 -10.846 -4.371 719 H ALA 8 H ALA 8 -0.924 -7.444 -4.901 720 HA ALA 8 HA ALA 8 -1.672 -4.761 -5.374 721 HB1 ALA 8 HB1 ALA 8 0.301 -4.169 -4.003 722 HB2 ALA 8 HB2 ALA 8 0.909 -5.823 -4.159 723 HB3 ALA 8 HB3 ALA 8 -0.593 -5.510 -3.287 724 H GLY 9 H GLY 9 0.865 -6.783 -6.742 725 HA2 GLY 9 HA2 GLY 9 2.211 -4.790 -8.308 726 HA3 GLY 9 HA3 GLY 9 2.335 -6.531 -8.502 727 H ALA 10 H ALA 10 -0.437 -7.045 -8.978 728 HA ALA 10 HA ALA 10 -0.667 -6.648 -11.780 729 HB1 ALA 10 HB1 ALA 10 -1.655 -8.587 -10.621 730 HB2 ALA 10 HB2 ALA 10 -2.882 -7.715 -11.543 731 HB3 ALA 10 HB3 ALA 10 -2.792 -7.527 -9.789 732 H LEU 11 H LEU 11 -2.325 -5.132 -9.016 733 HA LEU 11 HA LEU 11 -3.946 -3.280 -10.469 734 HB2 LEU 11 HB2 LEU 11 -2.933 -3.127 -7.602 735 HB3 LEU 11 HB3 LEU 11 -4.264 -2.183 -8.263 736 HG LEU 11 HG LEU 11 -4.263 -5.217 -7.994 737 HD11 LEU 11 HD11 LEU 11 -5.612 -3.175 -6.221 738 HD12 LEU 11 HD12 LEU 11 -4.228 -4.184 -5.798 739 HD13 LEU 11 HD13 LEU 11 -5.792 -4.928 -6.117 740 HD21 LEU 11 HD21 LEU 11 -6.534 -3.335 -8.722 741 HD22 LEU 11 HD22 LEU 11 -6.663 -5.082 -8.488 742 HD23 LEU 11 HD23 LEU 11 -5.702 -4.445 -9.818 743 H ALA 12 H ALA 12 -0.702 -3.194 -9.124 744 HA ALA 12 HA ALA 12 -0.024 -0.497 -9.224 745 HB1 ALA 12 HB1 ALA 12 2.319 -1.256 -9.274 746 HB2 ALA 12 HB2 ALA 12 1.790 -2.886 -9.711 747 HB3 ALA 12 HB3 ALA 12 1.360 -2.209 -8.140 748 H GLY 13 H GLY 13 0.547 -2.975 -11.731 749 HA2 GLY 13 HA2 GLY 13 1.804 -1.446 -13.675 750 HA3 GLY 13 HA3 GLY 13 0.819 -2.864 -14.002 751 H GLN 14 H GLN 14 -1.684 -1.882 -13.156 752 HA GLN 14 HA GLN 14 -2.604 -0.551 -15.496 753 HB2 GLN 14 HB2 GLN 14 -4.135 -0.766 -12.870 754 HB3 GLN 14 HB3 GLN 14 -4.804 -0.601 -14.493 755 HG2 GLN 14 HG2 GLN 14 -3.892 -2.868 -15.038 756 HG3 GLN 14 HG3 GLN 14 -3.363 -3.024 -13.364 757 HE21 GLN 14 HE21 GLN 14 -4.987 -3.181 -11.721 758 HE22 GLN 14 HE22 GLN 14 -6.585 -3.695 -12.103 759 H ILE 15 H ILE 15 -2.175 0.567 -12.135 760 HA ILE 15 HA ILE 15 -3.125 3.216 -12.442 761 HB ILE 15 HB ILE 15 -1.202 2.059 -10.377 762 HG12 ILE 15 HG12 ILE 15 -4.218 2.533 -10.261 763 HG13 ILE 15 HG13 ILE 15 -3.426 0.967 -10.397 764 HG21 ILE 15 HG21 ILE 15 -2.689 4.711 -10.249 765 HG22 ILE 15 HG22 ILE 15 -0.945 4.503 -10.401 766 HG23 ILE 15 HG23 ILE 15 -1.765 3.992 -8.928 767 HD11 ILE 15 HD11 ILE 15 -3.303 2.841 -8.037 768 HD12 ILE 15 HD12 ILE 15 -2.436 1.309 -8.165 769 HD13 ILE 15 HD13 ILE 15 -4.198 1.326 -8.150 770 H TRP 16 H TRP 16 0.162 1.877 -12.652 771 HA TRP 16 HA TRP 16 1.564 4.316 -12.989 772 HB2 TRP 16 HB2 TRP 16 2.611 2.133 -12.289 773 HB3 TRP 16 HB3 TRP 16 2.411 1.538 -13.935 774 HD1 TRP 16 HD1 TRP 16 4.543 3.951 -11.856 775 HE1 TRP 16 HE1 TRP 16 6.586 4.673 -13.239 776 HE3 TRP 16 HE3 TRP 16 3.241 1.908 -16.347 777 HZ2 TRP 16 HZ2 TRP 16 7.523 4.425 -15.882 778 HZ3 TRP 16 HZ3 TRP 16 4.739 2.205 -18.263 779 HH2 TRP 16 HH2 TRP 16 6.850 3.439 -18.042 780 H GLU 17 H GLU 17 0.272 1.964 -15.361 781 HA GLU 17 HA GLU 17 1.136 3.214 -17.737 782 HB2 GLU 17 HB2 GLU 17 -1.194 1.381 -17.120 783 HB3 GLU 17 HB3 GLU 17 -0.901 1.969 -18.750 784 HG2 GLU 17 HG2 GLU 17 1.165 0.436 -17.155 785 HG3 GLU 17 HG3 GLU 17 -0.015 -0.347 -18.201 786 H ALA 18 H ALA 18 -1.749 3.809 -15.748 787 HA ALA 18 HA ALA 18 -3.065 5.687 -17.419 788 HB1 ALA 18 HB1 ALA 18 -4.241 6.397 -15.370 789 HB2 ALA 18 HB2 ALA 18 -3.066 5.517 -14.384 790 HB3 ALA 18 HB3 ALA 18 -4.144 4.638 -15.470 791 H LEU 19 H LEU 19 -0.473 6.039 -15.039 792 HA LEU 19 HA LEU 19 -0.330 8.934 -15.134 793 HB2 LEU 19 HB2 LEU 19 1.516 6.837 -13.931 794 HB3 LEU 19 HB3 LEU 19 1.736 8.571 -13.727 795 HG LEU 19 HG LEU 19 -0.683 7.004 -12.734 796 HD11 LEU 19 HD11 LEU 19 1.321 6.360 -11.490 797 HD12 LEU 19 HD12 LEU 19 0.243 7.316 -10.477 798 HD13 LEU 19 HD13 LEU 19 1.695 8.055 -11.160 799 HD21 LEU 19 HD21 LEU 19 -1.230 9.078 -11.504 800 HD22 LEU 19 HD22 LEU 19 -1.243 9.320 -13.246 801 HD23 LEU 19 HD23 LEU 19 0.122 9.899 -12.288 802 H ASN 20 H ASN 20 1.099 6.303 -16.915 803 HA ASN 20 HA ASN 20 3.556 7.515 -17.685 804 HB2 ASN 20 HB2 ASN 20 3.116 5.039 -17.667 805 HB3 ASN 20 HB3 ASN 20 2.073 5.241 -19.070 806 HD21 ASN 20 HD21 ASN 20 3.405 3.859 -20.306 807 HD22 ASN 20 HD22 ASN 20 4.960 4.351 -20.880 808 H GLY 21 H GLY 21 4.088 8.800 -19.386 809 HA2 GLY 21 HA2 GLY 21 3.918 10.070 -21.308 810 HA3 GLY 21 HA3 GLY 21 2.417 9.256 -21.705 811 H THR 22 H THR 22 2.341 10.529 -18.550 812 HA THR 22 HA THR 22 0.809 12.928 -19.406 813 HB THR 22 HB THR 22 -0.059 11.133 -17.088 814 HG1 THR 22 HG1 THR 22 -0.305 9.818 -18.851 815 HG21 THR 22 HG21 THR 22 -2.246 12.248 -17.388 816 HG22 THR 22 HG22 THR 22 -1.587 13.198 -18.719 817 HG23 THR 22 HG23 THR 22 -0.978 13.440 -17.081 818 H GLU 23 H GLU 23 0.608 14.605 -17.728 819 HA GLU 23 HA GLU 23 3.002 15.108 -16.225 820 HB2 GLU 23 HB2 GLU 23 0.338 16.584 -16.229 821 HB3 GLU 23 HB3 GLU 23 1.845 17.206 -15.556 822 HG2 GLU 23 HG2 GLU 23 2.859 17.200 -17.795 823 HG3 GLU 23 HG3 GLU 23 1.373 16.539 -18.480 824 H GLY 24 H GLY 24 0.231 13.322 -15.449 825 HA2 GLY 24 HA2 GLY 24 0.402 12.094 -13.278 826 HA3 GLY 24 HA3 GLY 24 0.546 13.669 -12.510 827 H LEU 25 H LEU 25 -1.454 11.612 -12.015 828 HA LEU 25 HA LEU 25 -3.954 13.079 -12.684 829 HB2 LEU 25 HB2 LEU 25 -3.583 10.049 -12.612 830 HB3 LEU 25 HB3 LEU 25 -5.148 10.834 -12.615 831 HG LEU 25 HG LEU 25 -4.470 11.837 -14.904 832 HD11 LEU 25 HD11 LEU 25 -2.368 9.660 -14.782 833 HD12 LEU 25 HD12 LEU 25 -2.075 11.398 -14.847 834 HD13 LEU 25 HD13 LEU 25 -2.821 10.586 -16.216 835 HD21 LEU 25 HD21 LEU 25 -4.896 8.836 -14.685 836 HD22 LEU 25 HD22 LEU 25 -5.183 9.816 -16.128 837 HD23 LEU 25 HD23 LEU 25 -6.158 10.071 -14.682 838 H THR 26 H THR 26 -5.646 12.916 -11.074 839 HA THR 26 HA THR 26 -4.787 12.541 -8.320 840 HB THR 26 HB THR 26 -7.029 13.224 -7.654 841 HG1 THR 26 HG1 THR 26 -8.563 13.699 -9.471 842 HG21 THR 26 HG21 THR 26 -5.569 15.087 -8.365 843 HG22 THR 26 HG22 THR 26 -7.258 15.427 -8.750 844 HG23 THR 26 HG23 THR 26 -6.151 14.917 -10.025 845 H GLN 27 H GLN 27 -6.314 11.201 -6.835 846 HA GLN 27 HA GLN 27 -6.297 8.469 -7.465 847 HB2 GLN 27 HB2 GLN 27 -6.387 9.289 -5.148 848 HB3 GLN 27 HB3 GLN 27 -7.987 9.971 -5.414 849 HG2 GLN 27 HG2 GLN 27 -8.926 7.721 -5.687 850 HG3 GLN 27 HG3 GLN 27 -7.324 7.011 -5.504 851 HE21 GLN 27 HE21 GLN 27 -9.690 6.502 -3.924 852 HE22 GLN 27 HE22 GLN 27 -9.294 6.908 -2.297 853 H LYS 28 H LYS 28 -9.009 10.786 -7.512 854 HA LYS 28 HA LYS 28 -11.113 9.177 -8.382 855 HB2 LYS 28 HB2 LYS 28 -11.448 11.463 -7.551 856 HB3 LYS 28 HB3 LYS 28 -10.584 12.128 -8.930 857 HG2 LYS 28 HG2 LYS 28 -12.971 12.469 -9.212 858 HG3 LYS 28 HG3 LYS 28 -12.387 11.341 -10.438 859 HD2 LYS 28 HD2 LYS 28 -13.246 9.442 -9.035 860 HD3 LYS 28 HD3 LYS 28 -13.892 10.619 -7.886 861 HE2 LYS 28 HE2 LYS 28 -14.723 10.312 -10.795 862 HE3 LYS 28 HE3 LYS 28 -15.656 9.806 -9.384 863 HZ1 LYS 28 HZ1 LYS 28 -16.469 11.896 -10.199 864 HZ2 LYS 28 HZ2 LYS 28 -14.935 12.592 -10.112 865 HZ3 LYS 28 HZ3 LYS 28 -15.738 12.150 -8.694 866 H GLN 29 H GLN 29 -8.798 11.051 -10.360 867 HA GLN 29 HA GLN 29 -9.838 10.403 -12.923 868 HB2 GLN 29 HB2 GLN 29 -7.032 11.255 -12.096 869 HB3 GLN 29 HB3 GLN 29 -7.568 11.132 -13.773 870 HG2 GLN 29 HG2 GLN 29 -9.273 12.874 -13.343 871 HG3 GLN 29 HG3 GLN 29 -8.705 12.994 -11.674 872 HE21 GLN 29 HE21 GLN 29 -7.900 13.656 -15.019 873 HE22 GLN 29 HE22 GLN 29 -6.602 14.740 -14.685 874 H ILE 30 H ILE 30 -7.342 8.827 -10.930 875 HA ILE 30 HA ILE 30 -6.534 6.921 -12.910 876 HB ILE 30 HB ILE 30 -6.083 7.055 -9.910 877 HG12 ILE 30 HG12 ILE 30 -4.220 7.469 -12.287 878 HG13 ILE 30 HG13 ILE 30 -4.925 8.747 -11.305 879 HG21 ILE 30 HG21 ILE 30 -6.066 4.668 -10.483 880 HG22 ILE 30 HG22 ILE 30 -4.436 5.226 -10.110 881 HG23 ILE 30 HG23 ILE 30 -4.917 4.971 -11.792 882 HD11 ILE 30 HD11 ILE 30 -2.621 8.402 -10.731 883 HD12 ILE 30 HD12 ILE 30 -2.911 6.697 -10.396 884 HD13 ILE 30 HD13 ILE 30 -3.643 7.936 -9.373 885 H LYS 31 H LYS 31 -8.811 6.719 -10.150 886 HA LYS 31 HA LYS 31 -9.532 4.014 -10.279 887 HB2 LYS 31 HB2 LYS 31 -11.240 6.428 -9.542 888 HB3 LYS 31 HB3 LYS 31 -11.756 4.765 -9.282 889 HG2 LYS 31 HG2 LYS 31 -9.288 6.002 -8.041 890 HG3 LYS 31 HG3 LYS 31 -10.863 5.937 -7.254 891 HD2 LYS 31 HD2 LYS 31 -9.135 3.570 -8.067 892 HD3 LYS 31 HD3 LYS 31 -9.403 4.163 -6.424 893 HE2 LYS 31 HE2 LYS 31 -11.466 2.905 -8.258 894 HE3 LYS 31 HE3 LYS 31 -10.773 2.200 -6.802 895 HZ1 LYS 31 HZ1 LYS 31 -12.982 3.066 -6.393 896 HZ2 LYS 31 HZ2 LYS 31 -12.508 4.610 -6.897 897 HZ3 LYS 31 HZ3 LYS 31 -11.839 3.936 -5.501 898 H LYS 32 H LYS 32 -10.778 6.774 -12.085 899 HA LYS 32 HA LYS 32 -12.737 5.386 -13.619 900 HB2 LYS 32 HB2 LYS 32 -12.522 7.930 -13.081 901 HB3 LYS 32 HB3 LYS 32 -11.419 7.995 -14.445 902 HG2 LYS 32 HG2 LYS 32 -14.242 6.923 -14.705 903 HG3 LYS 32 HG3 LYS 32 -13.895 8.645 -14.829 904 HD2 LYS 32 HD2 LYS 32 -12.697 6.494 -16.629 905 HD3 LYS 32 HD3 LYS 32 -14.103 7.479 -17.039 906 HE2 LYS 32 HE2 LYS 32 -12.712 9.519 -16.926 907 HE3 LYS 32 HE3 LYS 32 -11.306 8.541 -16.500 908 HZ1 LYS 32 HZ1 LYS 32 -11.448 7.443 -18.624 909 HZ2 LYS 32 HZ2 LYS 32 -11.366 9.116 -18.852 910 HZ3 LYS 32 HZ3 LYS 32 -12.844 8.310 -19.030 911 H ALA 33 H ALA 33 -9.389 6.434 -14.350 912 HA ALA 33 HA ALA 33 -9.253 5.657 -17.060 913 HB1 ALA 33 HB1 ALA 33 -6.814 5.899 -16.828 914 HB2 ALA 33 HB2 ALA 33 -6.961 5.879 -15.067 915 HB3 ALA 33 HB3 ALA 33 -7.649 7.211 -15.995 916 H THR 34 H THR 34 -8.301 3.923 -14.144 917 HA THR 34 HA THR 34 -7.325 1.563 -15.552 918 HB THR 34 HB THR 34 -6.514 0.817 -13.358 919 HG1 THR 34 HG1 THR 34 -7.164 3.038 -11.905 920 HG21 THR 34 HG21 THR 34 -4.979 2.660 -12.792 921 HG22 THR 34 HG22 THR 34 -5.962 3.790 -13.725 922 HG23 THR 34 HG23 THR 34 -5.102 2.480 -14.542 923 H LYS 35 H LYS 35 -10.214 2.632 -14.089 924 HA LYS 35 HA LYS 35 -12.272 1.737 -13.848 925 HB2 LYS 35 HB2 LYS 35 -11.061 -0.583 -15.392 926 HB3 LYS 35 HB3 LYS 35 -12.750 -0.551 -14.912 927 HG2 LYS 35 HG2 LYS 35 -11.792 1.838 -16.435 928 HG3 LYS 35 HG3 LYS 35 -11.831 0.321 -17.326 929 HD2 LYS 35 HD2 LYS 35 -13.917 1.495 -17.690 930 HD3 LYS 35 HD3 LYS 35 -14.242 0.054 -16.730 931 HE2 LYS 35 HE2 LYS 35 -15.545 1.930 -15.880 932 HE3 LYS 35 HE3 LYS 35 -14.328 1.478 -14.687 933 HZ1 LYS 35 HZ1 LYS 35 -14.506 3.878 -14.964 934 HZ2 LYS 35 HZ2 LYS 35 -14.099 3.738 -16.597 935 HZ3 LYS 35 HZ3 LYS 35 -12.970 3.328 -15.412 936 H LEU 36 H LEU 36 -10.366 1.519 -11.705 937 HA LEU 36 HA LEU 36 -10.835 -1.035 -10.360 938 HB2 LEU 36 HB2 LEU 36 -9.610 1.561 -9.323 939 HB3 LEU 36 HB3 LEU 36 -9.648 0.044 -8.434 940 HG LEU 36 HG LEU 36 -8.144 0.532 -11.033 941 HD11 LEU 36 HD11 LEU 36 -7.117 1.726 -9.175 942 HD12 LEU 36 HD12 LEU 36 -6.098 0.389 -9.697 943 HD13 LEU 36 HD13 LEU 36 -7.054 0.242 -8.219 944 HD21 LEU 36 HD21 LEU 36 -8.179 -1.956 -9.293 945 HD22 LEU 36 HD22 LEU 36 -7.138 -1.690 -10.696 946 HD23 LEU 36 HD23 LEU 36 -8.884 -1.792 -10.904 947 H LYS 37 H LYS 37 -12.369 -1.398 -8.728 948 HA LYS 37 HA LYS 37 -14.614 0.466 -8.644 949 HB2 LYS 37 HB2 LYS 37 -15.022 -1.939 -8.990 950 HB3 LYS 37 HB3 LYS 37 -14.291 -2.308 -7.431 951 HG2 LYS 37 HG2 LYS 37 -16.099 -1.247 -6.240 952 HG3 LYS 37 HG3 LYS 37 -16.760 -0.566 -7.732 953 HD2 LYS 37 HD2 LYS 37 -17.298 -2.844 -8.535 954 HD3 LYS 37 HD3 LYS 37 -16.616 -3.533 -7.059 955 HE2 LYS 37 HE2 LYS 37 -19.002 -1.647 -7.140 956 HE3 LYS 37 HE3 LYS 37 -19.112 -3.406 -7.033 957 HZ1 LYS 37 HZ1 LYS 37 -17.802 -1.637 -5.036 958 HZ2 LYS 37 HZ2 LYS 37 -17.917 -3.320 -4.936 959 HZ3 LYS 37 HZ3 LYS 37 -19.315 -2.374 -4.865 960 H ALA 38 H ALA 38 -12.478 -1.115 -6.260 961 HA ALA 38 HA ALA 38 -13.439 0.646 -4.091 962 HB1 ALA 38 HB1 ALA 38 -12.273 -0.887 -2.558 963 HB2 ALA 38 HB2 ALA 38 -11.632 -1.795 -3.934 964 HB3 ALA 38 HB3 ALA 38 -13.367 -1.774 -3.622 965 H ASP 39 H ASP 39 -12.166 2.148 -3.105 966 HA ASP 39 HA ASP 39 -9.786 3.208 -4.158 967 HB2 ASP 39 HB2 ASP 39 -9.597 4.350 -1.880 968 HB3 ASP 39 HB3 ASP 39 -11.127 4.583 -2.717 969 H LYS 40 H LYS 40 -10.309 0.629 -1.878 970 HA LYS 40 HA LYS 40 -7.851 0.058 -0.770 971 HB2 LYS 40 HB2 LYS 40 -9.931 -1.855 -1.899 972 HB3 LYS 40 HB3 LYS 40 -8.628 -2.342 -0.821 973 HG2 LYS 40 HG2 LYS 40 -10.507 -0.163 0.083 974 HG3 LYS 40 HG3 LYS 40 -11.071 -1.842 0.092 975 HD2 LYS 40 HD2 LYS 40 -9.009 -2.406 1.486 976 HD3 LYS 40 HD3 LYS 40 -8.709 -0.669 1.611 977 HE2 LYS 40 HE2 LYS 40 -10.801 -0.341 2.800 978 HE3 LYS 40 HE3 LYS 40 -11.281 -2.016 2.517 979 HZ1 LYS 40 HZ1 LYS 40 -9.000 -1.109 4.176 980 HZ2 LYS 40 HZ2 LYS 40 -9.408 -2.724 3.877 981 HZ3 LYS 40 HZ3 LYS 40 -10.468 -1.732 4.740 982 H ASP 41 H ASP 41 -8.992 -0.773 -4.060 983 HA ASP 41 HA ASP 41 -6.771 -2.320 -4.923 984 HB2 ASP 41 HB2 ASP 41 -8.635 -0.610 -6.630 985 HB3 ASP 41 HB3 ASP 41 -7.599 -1.906 -7.220 986 H PHE 42 H PHE 42 -7.480 1.128 -4.969 987 HA PHE 42 HA PHE 42 -5.313 2.001 -6.572 988 HB2 PHE 42 HB2 PHE 42 -7.298 3.417 -6.222 989 HB3 PHE 42 HB3 PHE 42 -6.933 3.550 -4.505 990 HD1 PHE 42 HD2 PHE 42 -5.603 4.360 -7.892 991 HD2 PHE 42 HD1 PHE 42 -5.478 5.300 -3.722 992 HE1 PHE 42 HE2 PHE 42 -4.225 6.324 -8.367 993 HE2 PHE 42 HE1 PHE 42 -4.087 7.272 -4.219 994 HZ PHE 42 HZ PHE 42 -3.468 7.782 -6.553 995 H PHE 43 H PHE 43 -5.678 1.742 -3.002 996 HA PHE 43 HA PHE 43 -3.188 3.020 -2.397 997 HB2 PHE 43 HB2 PHE 43 -4.861 1.213 -0.607 998 HB3 PHE 43 HB3 PHE 43 -3.573 2.287 -0.067 999 HD1 PHE 43 HD1 PHE 43 -4.037 4.813 -1.388 1000 HD2 PHE 43 HD2 PHE 43 -6.911 2.042 0.147 1001 HE1 PHE 43 HE1 PHE 43 -5.665 6.634 -1.121 1002 HE2 PHE 43 HE2 PHE 43 -8.532 3.863 0.402 1003 HZ PHE 43 HZ PHE 43 -7.911 6.165 -0.230 1004 H LEU 44 H LEU 44 -4.093 -0.392 -2.766 1005 HA LEU 44 HA LEU 44 -1.559 -1.478 -1.944 1006 HB2 LEU 44 HB2 LEU 44 -4.016 -2.589 -3.301 1007 HB3 LEU 44 HB3 LEU 44 -2.546 -3.545 -3.309 1008 HG LEU 44 HG LEU 44 -2.519 -3.648 -0.869 1009 HD11 LEU 44 HD11 LEU 44 -5.029 -1.955 -0.860 1010 HD12 LEU 44 HD12 LEU 44 -3.433 -1.470 -0.287 1011 HD13 LEU 44 HD13 LEU 44 -4.310 -2.752 0.542 1012 HD21 LEU 44 HD21 LEU 44 -4.508 -5.032 -0.490 1013 HD22 LEU 44 HD22 LEU 44 -3.787 -5.370 -2.062 1014 HD23 LEU 44 HD23 LEU 44 -5.253 -4.390 -1.957 1015 H GLY 45 H GLY 45 -3.004 -0.677 -5.111 1016 HA2 GLY 45 HA2 GLY 45 -0.857 -1.538 -6.771 1017 HA3 GLY 45 HA3 GLY 45 -2.086 -0.353 -7.197 1018 H LEU 46 H LEU 46 -1.729 1.778 -5.761 1019 HA LEU 46 HA LEU 46 0.535 3.157 -6.642 1020 HB2 LEU 46 HB2 LEU 46 -1.569 4.263 -5.931 1021 HB3 LEU 46 HB3 LEU 46 -1.257 3.802 -4.267 1022 HG LEU 46 HG LEU 46 0.823 5.234 -4.312 1023 HD11 LEU 46 HD11 LEU 46 -0.222 6.155 -6.997 1024 HD12 LEU 46 HD12 LEU 46 1.249 5.220 -6.703 1025 HD13 LEU 46 HD13 LEU 46 1.120 6.869 -6.098 1026 HD21 LEU 46 HD21 LEU 46 -1.758 6.724 -4.887 1027 HD22 LEU 46 HD22 LEU 46 -0.333 7.382 -4.080 1028 HD23 LEU 46 HD23 LEU 46 -1.256 6.088 -3.319 1029 H GLY 47 H GLY 47 -0.033 1.450 -3.614 1030 HA2 GLY 47 HA2 GLY 47 2.243 2.272 -2.124 1031 HA3 GLY 47 HA3 GLY 47 1.326 0.790 -1.874 1032 H TRP 48 H TRP 48 1.723 -0.266 -4.508 1033 HA TRP 48 HA TRP 48 4.334 -1.436 -4.304 1034 HB2 TRP 48 HB2 TRP 48 2.189 -2.568 -5.197 1035 HB3 TRP 48 HB3 TRP 48 2.462 -1.678 -6.692 1036 HD1 TRP 48 HD1 TRP 48 4.569 -2.482 -8.216 1037 HE1 TRP 48 HE1 TRP 48 5.981 -4.625 -8.207 1038 HE3 TRP 48 HE3 TRP 48 3.126 -4.374 -3.700 1039 HZ2 TRP 48 HZ2 TRP 48 6.391 -6.864 -6.534 1040 HZ3 TRP 48 HZ3 TRP 48 4.072 -6.520 -2.963 1041 HH2 TRP 48 HH2 TRP 48 5.672 -7.740 -4.355 1042 H LEU 49 H LEU 49 2.861 1.096 -6.362 1043 HA LEU 49 HA LEU 49 5.054 1.615 -8.076 1044 HB2 LEU 49 HB2 LEU 49 2.743 3.274 -7.084 1045 HB3 LEU 49 HB3 LEU 49 4.033 4.087 -7.937 1046 HG LEU 49 HG LEU 49 3.585 2.900 -9.978 1047 HD11 LEU 49 HD11 LEU 49 1.602 1.245 -8.430 1048 HD12 LEU 49 HD12 LEU 49 3.149 0.702 -9.097 1049 HD13 LEU 49 HD13 LEU 49 1.855 1.203 -10.180 1050 HD21 LEU 49 HD21 LEU 49 2.102 4.821 -9.506 1051 HD22 LEU 49 HD22 LEU 49 0.937 3.737 -8.742 1052 HD23 LEU 49 HD23 LEU 49 1.285 3.591 -10.468 1053 H LEU 50 H LEU 50 4.427 2.642 -4.759 1054 HA LEU 50 HA LEU 50 6.612 4.451 -4.465 1055 HB2 LEU 50 HB2 LEU 50 5.062 2.878 -2.374 1056 HB3 LEU 50 HB3 LEU 50 6.235 4.130 -1.990 1057 HG LEU 50 HG LEU 50 3.622 4.558 -3.503 1058 HD11 LEU 50 HD11 LEU 50 3.226 4.075 -1.141 1059 HD12 LEU 50 HD12 LEU 50 2.855 5.756 -1.508 1060 HD13 LEU 50 HD13 LEU 50 4.353 5.350 -0.663 1061 HD21 LEU 50 HD21 LEU 50 4.112 6.968 -3.334 1062 HD22 LEU 50 HD22 LEU 50 5.333 6.126 -4.282 1063 HD23 LEU 50 HD23 LEU 50 5.688 6.610 -2.620 1064 H ARG 51 H ARG 51 6.312 0.901 -3.872 1065 HA ARG 51 HA ARG 51 9.001 0.668 -2.831 1066 HB2 ARG 51 HB2 ARG 51 8.676 -1.714 -2.739 1067 HB3 ARG 51 HB3 ARG 51 7.209 -0.942 -2.189 1068 HG2 ARG 51 HG2 ARG 51 6.069 -2.315 -3.552 1069 HG3 ARG 51 HG3 ARG 51 6.732 -1.419 -4.904 1070 HD2 ARG 51 HD2 ARG 51 8.049 -3.859 -3.683 1071 HD3 ARG 51 HD3 ARG 51 6.989 -3.900 -5.089 1072 HE ARG 51 HE ARG 51 9.483 -2.347 -5.090 1073 HH11 ARG 51 HH11 ARG 51 7.498 -4.693 -6.643 1074 HH12 ARG 51 HH12 ARG 51 8.593 -4.888 -7.964 1075 HH21 ARG 51 HH21 ARG 51 10.815 -2.554 -6.784 1076 HH22 ARG 51 HH22 ARG 51 10.454 -3.694 -8.030 1077 H GLU 52 H GLU 52 7.580 0.584 -6.016 1078 HA GLU 52 HA GLU 52 9.974 -0.313 -7.398 1079 HB2 GLU 52 HB2 GLU 52 7.478 1.093 -8.438 1080 HB3 GLU 52 HB3 GLU 52 8.751 0.425 -9.459 1081 HG2 GLU 52 HG2 GLU 52 8.246 -1.829 -8.660 1082 HG3 GLU 52 HG3 GLU 52 7.014 -1.192 -7.572 1083 H ASP 53 H ASP 53 8.802 2.604 -6.053 1084 HA ASP 53 HA ASP 53 9.586 4.677 -5.757 1085 HB2 ASP 53 HB2 ASP 53 11.812 3.136 -5.661 1086 HB3 ASP 53 HB3 ASP 53 12.243 4.097 -7.065 1087 H LYS 54 H LYS 54 8.405 3.758 -8.373 1088 HA LYS 54 HA LYS 54 9.554 5.469 -10.431 1089 HB2 LYS 54 HB2 LYS 54 7.307 3.429 -10.458 1090 HB3 LYS 54 HB3 LYS 54 7.601 4.485 -11.839 1091 HG2 LYS 54 HG2 LYS 54 9.978 3.600 -11.868 1092 HG3 LYS 54 HG3 LYS 54 9.472 2.400 -10.680 1093 HD2 LYS 54 HD2 LYS 54 8.079 2.695 -13.373 1094 HD3 LYS 54 HD3 LYS 54 9.527 1.708 -13.171 1095 HE2 LYS 54 HE2 LYS 54 7.737 0.184 -13.018 1096 HE3 LYS 54 HE3 LYS 54 8.228 0.447 -11.351 1097 HZ1 LYS 54 HZ1 LYS 54 5.870 0.444 -11.503 1098 HZ2 LYS 54 HZ2 LYS 54 5.878 1.615 -12.722 1099 HZ3 LYS 54 HZ3 LYS 54 6.362 2.023 -11.154 1100 H VAL 55 H VAL 55 7.344 6.068 -7.964 1101 HA VAL 55 HA VAL 55 6.186 8.351 -9.457 1102 HB VAL 55 HB VAL 55 3.978 8.108 -8.483 1103 HG11 VAL 55 HG11 VAL 55 4.345 7.004 -10.632 1104 HG12 VAL 55 HG12 VAL 55 3.165 6.114 -9.671 1105 HG13 VAL 55 HG13 VAL 55 4.819 5.514 -9.811 1106 HG21 VAL 55 HG21 VAL 55 4.547 7.091 -6.327 1107 HG22 VAL 55 HG22 VAL 55 4.991 5.579 -7.122 1108 HG23 VAL 55 HG23 VAL 55 3.312 6.122 -7.135 1109 H VAL 56 H VAL 56 5.292 10.026 -8.117 1110 HA VAL 56 HA VAL 56 6.121 10.157 -5.328 1111 HB VAL 56 HB VAL 56 7.848 11.395 -6.520 1112 HG11 VAL 56 HG11 VAL 56 5.642 13.042 -7.805 1113 HG12 VAL 56 HG12 VAL 56 6.667 11.858 -8.617 1114 HG13 VAL 56 HG13 VAL 56 7.376 13.339 -7.969 1115 HG21 VAL 56 HG21 VAL 56 7.149 12.338 -4.350 1116 HG22 VAL 56 HG22 VAL 56 5.948 13.348 -5.157 1117 HG23 VAL 56 HG23 VAL 56 7.668 13.620 -5.448 1118 H THR 57 H THR 57 4.648 11.094 -3.976 1119 HA THR 57 HA THR 57 1.971 11.624 -5.127 1120 HB THR 57 HB THR 57 1.071 10.918 -2.905 1121 HG1 THR 57 HG1 THR 57 2.866 11.416 -1.595 1122 HG21 THR 57 HG21 THR 57 1.582 8.498 -3.064 1123 HG22 THR 57 HG22 THR 57 2.936 8.851 -4.140 1124 HG23 THR 57 HG23 THR 57 1.284 9.193 -4.660 1125 H SER 58 H SER 58 0.985 13.537 -4.708 1126 HA SER 58 HA SER 58 2.120 15.429 -2.730 1127 HB2 SER 58 HB2 SER 58 1.765 17.294 -4.277 1128 HB3 SER 58 HB3 SER 58 2.759 16.080 -5.083 1129 HG SER 58 HG SER 58 0.974 15.427 -6.253 1130 H GLU 59 H GLU 59 0.595 17.066 -1.995 1131 HA GLU 59 HA GLU 59 -2.136 15.998 -1.684 1132 HB2 GLU 59 HB2 GLU 59 -0.911 16.429 0.394 1133 HB3 GLU 59 HB3 GLU 59 -0.585 18.085 -0.093 1134 HG2 GLU 59 HG2 GLU 59 -2.350 18.060 1.568 1135 HG3 GLU 59 HG3 GLU 59 -3.003 18.598 0.024 1136 H VAL 60 H VAL 60 -3.366 16.740 -3.422 1137 HA VAL 60 HA VAL 60 -3.605 19.680 -3.753 1138 HB VAL 60 HB VAL 60 -4.204 17.426 -5.724 1139 HG11 VAL 60 HG11 VAL 60 -6.006 19.103 -5.941 1140 HG12 VAL 60 HG12 VAL 60 -4.943 19.152 -7.347 1141 HG13 VAL 60 HG13 VAL 60 -4.810 20.391 -6.097 1142 HG21 VAL 60 HG21 VAL 60 -2.266 19.768 -5.870 1143 HG22 VAL 60 HG22 VAL 60 -2.505 18.555 -7.132 1144 HG23 VAL 60 HG23 VAL 60 -1.831 18.081 -5.571 1145 H GLU 61 H GLU 61 -5.162 20.353 -2.447 1146 HA GLU 61 HA GLU 61 -7.215 20.903 -1.691 1147 HB2 GLU 61 HB2 GLU 61 -8.184 19.446 -4.181 1148 HB3 GLU 61 HB3 GLU 61 -9.086 20.656 -3.271 1149 HG2 GLU 61 HG2 GLU 61 -7.333 22.341 -3.871 1150 HG3 GLU 61 HG3 GLU 61 -6.527 21.115 -4.834 1151 H GLY 62 H GLY 62 -6.182 18.495 -0.527 1152 HA2 GLY 62 HA2 GLY 62 -6.951 17.029 1.100 1153 HA3 GLY 62 HA3 GLY 62 -8.600 17.380 0.621 1154 H GLU 63 H GLU 63 -6.642 16.503 -2.021 1155 HA GLU 63 HA GLU 63 -7.504 13.663 -1.979 1156 HB2 GLU 63 HB2 GLU 63 -7.479 15.545 -4.390 1157 HB3 GLU 63 HB3 GLU 63 -7.881 13.830 -4.429 1158 HG2 GLU 63 HG2 GLU 63 -9.816 14.299 -2.916 1159 HG3 GLU 63 HG3 GLU 63 -9.446 16.019 -3.034 1160 H ILE 64 H ILE 64 -6.163 12.177 -3.139 1161 HA ILE 64 HA ILE 64 -3.327 12.747 -3.064 1162 HB ILE 64 HB ILE 64 -4.789 10.243 -4.017 1163 HG12 ILE 64 HG12 ILE 64 -3.505 10.840 -1.313 1164 HG13 ILE 64 HG13 ILE 64 -5.232 10.727 -1.630 1165 HG21 ILE 64 HG21 ILE 64 -2.619 9.069 -3.767 1166 HG22 ILE 64 HG22 ILE 64 -1.838 10.601 -3.373 1167 HG23 ILE 64 HG23 ILE 64 -2.528 10.352 -4.977 1168 HD11 ILE 64 HD11 ILE 64 -4.967 8.345 -2.169 1169 HD12 ILE 64 HD12 ILE 64 -4.418 8.730 -0.541 1170 HD13 ILE 64 HD13 ILE 64 -3.238 8.463 -1.822 1171 H PHE 65 H PHE 65 -2.417 13.872 -4.701 1172 HA PHE 65 HA PHE 65 -3.086 13.195 -7.523 1173 HB2 PHE 65 HB2 PHE 65 -3.428 15.596 -6.996 1174 HB3 PHE 65 HB3 PHE 65 -1.780 15.721 -6.395 1175 HD1 PHE 65 HD2 PHE 65 -3.825 15.201 -9.464 1176 HD2 PHE 65 HD1 PHE 65 0.067 16.088 -7.928 1177 HE1 PHE 65 HE2 PHE 65 -3.058 15.773 -11.726 1178 HE2 PHE 65 HE1 PHE 65 0.828 16.657 -10.198 1179 HZ PHE 65 HZ PHE 65 -0.732 16.496 -12.098 1180 H VAL 66 H VAL 66 -1.663 11.739 -8.265 1181 HA VAL 66 HA VAL 66 1.155 11.812 -7.331 1182 HB VAL 66 HB VAL 66 0.008 9.838 -6.451 1183 HG11 VAL 66 HG11 VAL 66 -0.943 8.081 -7.895 1184 HG12 VAL 66 HG12 VAL 66 -0.640 9.077 -9.320 1185 HG13 VAL 66 HG13 VAL 66 -1.799 9.612 -8.101 1186 HG21 VAL 66 HG21 VAL 66 2.385 9.612 -7.066 1187 HG22 VAL 66 HG22 VAL 66 1.925 9.067 -8.679 1188 HG23 VAL 66 HG23 VAL 66 1.531 8.085 -7.272 1189 H LYS 67 H LYS 67 2.794 11.360 -8.823 1190 HA LYS 67 HA LYS 67 2.186 11.138 -11.696 1191 HB2 LYS 67 HB2 LYS 67 3.686 13.095 -12.209 1192 HB3 LYS 67 HB3 LYS 67 2.205 13.549 -11.374 1193 HG2 LYS 67 HG2 LYS 67 3.483 13.667 -9.230 1194 HG3 LYS 67 HG3 LYS 67 4.967 13.317 -10.123 1195 HD2 LYS 67 HD2 LYS 67 3.167 15.743 -10.521 1196 HD3 LYS 67 HD3 LYS 67 4.718 15.738 -9.676 1197 HE2 LYS 67 HE2 LYS 67 5.856 15.115 -11.786 1198 HE3 LYS 67 HE3 LYS 67 4.300 15.113 -12.621 1199 HZ1 LYS 67 HZ1 LYS 67 5.388 17.168 -13.023 1200 HZ2 LYS 67 HZ2 LYS 67 5.652 17.435 -11.379 1201 HZ3 LYS 67 HZ3 LYS 67 4.085 17.474 -11.997 1202 H LEU 68 H LEU 68 4.317 10.826 -12.952 1203 HA LEU 68 HA LEU 68 5.886 8.817 -11.587 1204 HB2 LEU 68 HB2 LEU 68 6.320 10.004 -14.352 1205 HB3 LEU 68 HB3 LEU 68 7.050 8.532 -13.728 1206 HG LEU 68 HG LEU 68 4.132 8.976 -14.467 1207 HD11 LEU 68 HD11 LEU 68 4.520 7.187 -16.097 1208 HD12 LEU 68 HD12 LEU 68 6.207 7.070 -15.594 1209 HD13 LEU 68 HD13 LEU 68 5.614 8.545 -16.364 1210 HD21 LEU 68 HD21 LEU 68 5.352 6.550 -13.111 1211 HD22 LEU 68 HD22 LEU 68 3.725 6.632 -13.796 1212 HD23 LEU 68 HD23 LEU 68 4.154 7.656 -12.429 1213 H VAL 69 H VAL 69 8.211 8.843 -11.307 1214 HA VAL 69 HA VAL 69 9.362 11.457 -10.708 1215 HB VAL 69 HB VAL 69 10.744 8.752 -10.412 1216 HG11 VAL 69 HG11 VAL 69 12.326 10.642 -10.417 1217 HG12 VAL 69 HG12 VAL 69 12.224 9.946 -8.800 1218 HG13 VAL 69 HG13 VAL 69 11.393 11.459 -9.162 1219 HG21 VAL 69 HG21 VAL 69 10.115 8.833 -8.017 1220 HG22 VAL 69 HG22 VAL 69 8.696 8.752 -9.061 1221 HG23 VAL 69 HG23 VAL 69 9.156 10.286 -8.321 1222 H LEU 70 H LEU 70 9.019 11.876 -13.102 1223 HA LEU 70 HA LEU 70 11.653 11.595 -14.447 1224 HB2 LEU 70 HB2 LEU 70 8.883 12.209 -15.540 1225 HB3 LEU 70 HB3 LEU 70 10.326 12.651 -16.436 1226 HG LEU 70 HG LEU 70 11.001 10.205 -16.393 1227 HD11 LEU 70 HD11 LEU 70 9.320 8.485 -16.016 1228 HD12 LEU 70 HD12 LEU 70 8.177 9.706 -15.453 1229 HD13 LEU 70 HD13 LEU 70 9.655 9.392 -14.542 1230 HD21 LEU 70 HD21 LEU 70 10.054 11.244 -18.401 1231 HD22 LEU 70 HD22 LEU 70 8.422 10.858 -17.848 1232 HD23 LEU 70 HD23 LEU 70 9.547 9.561 -18.258 1233 H GLU 71 H GLU 71 9.640 13.676 -12.638 1234 HA GLU 71 HA GLU 71 10.592 16.201 -13.583 1235 HB2 GLU 71 HB2 GLU 71 8.413 15.990 -12.441 1236 HB3 GLU 71 HB3 GLU 71 9.214 15.492 -10.956 1237 HG2 GLU 71 HG2 GLU 71 8.481 17.852 -10.891 1238 HG3 GLU 71 HG3 GLU 71 10.223 17.685 -10.696 1239 H HIS 72 H HIS 72 12.792 16.322 -13.572 1240 HA HIS 72 HA HIS 72 14.125 16.560 -10.928 1241 HB2 HIS 72 HB2 HIS 72 15.423 15.489 -13.479 1242 HB3 HIS 72 HB3 HIS 72 16.226 15.708 -11.924 1243 HD1 HIS 72 HD1 HIS 72 13.820 13.468 -13.728 1244 HD2 HIS 72 HD2 HIS 72 15.695 13.667 -10.023 1245 HE1 HIS 72 HE1 HIS 72 13.407 11.242 -12.644 1246 HE2 HIS 72 HE2 HIS 72 14.665 11.338 -10.477 1247 H HIS 73 H HIS 73 12.891 18.310 -13.297 1248 HA HIS 73 HA HIS 73 15.103 20.074 -14.029 1249 HB2 HIS 73 HB2 HIS 73 12.127 20.505 -14.553 1250 HB3 HIS 73 HB3 HIS 73 13.478 21.251 -15.400 1251 HD1 HIS 73 HD1 HIS 73 14.316 20.065 -17.457 1252 HD2 HIS 73 HD2 HIS 73 11.793 17.675 -15.172 1253 HE1 HIS 73 HE1 HIS 73 13.842 18.042 -18.862 1254 HE2 HIS 73 HE2 HIS 73 12.154 16.728 -17.550 1255 H HIS 74 H HIS 74 12.269 20.067 -11.927 1256 HA HIS 74 HA HIS 74 12.763 22.748 -10.855 1257 HB2 HIS 74 HB2 HIS 74 10.618 20.656 -10.276 1258 HB3 HIS 74 HB3 HIS 74 10.697 22.218 -9.466 1259 HD1 HIS 74 HD1 HIS 74 8.787 23.510 -10.399 1260 HD2 HIS 74 HD2 HIS 74 10.864 21.506 -13.385 1261 HE1 HIS 74 HE1 HIS 74 7.710 24.214 -12.555 1262 HE2 HIS 74 HE2 HIS 74 9.097 23.136 -14.346 1263 H HIS 75 H HIS 75 14.981 21.553 -10.338 1264 HA HIS 75 HA HIS 75 14.975 20.130 -7.740 1265 HB2 HIS 75 HB2 HIS 75 15.965 18.976 -9.722 1266 HB3 HIS 75 HB3 HIS 75 17.102 20.300 -9.934 1267 HD1 HIS 75 HD1 HIS 75 19.345 19.701 -9.098 1268 HD2 HIS 75 HD2 HIS 75 16.375 17.802 -6.904 1269 HE1 HIS 75 HE1 HIS 75 20.556 18.337 -7.382 1270 HE2 HIS 75 HE2 HIS 75 18.738 17.399 -5.933 1271 H HIS 76 H HIS 76 14.798 23.145 -8.177 1272 HA HIS 76 HA HIS 76 17.129 24.491 -7.390 1273 HB2 HIS 76 HB2 HIS 76 15.079 25.636 -8.199 1274 HB3 HIS 76 HB3 HIS 76 14.234 25.192 -6.722 1275 HD1 HIS 76 HD1 HIS 76 16.966 27.491 -7.979 1276 HD2 HIS 76 HD2 HIS 76 14.666 26.906 -4.564 1277 HE1 HIS 76 HE1 HIS 76 17.430 29.471 -6.509 1278 HE2 HIS 76 HE2 HIS 76 15.932 29.160 -4.514 1279 H HIS 77 H HIS 77 14.721 22.804 -5.406 1280 HA HIS 77 HA HIS 77 15.761 23.498 -2.826 1281 HB2 HIS 77 HB2 HIS 77 13.446 22.775 -3.052 1282 HB3 HIS 77 HB3 HIS 77 13.931 21.260 -3.798 1283 HD1 HIS 77 HD1 HIS 77 13.833 22.995 -0.441 1284 HD2 HIS 77 HD2 HIS 77 14.442 19.195 -2.018 1285 HE1 HIS 77 HE1 HIS 77 13.824 21.438 1.529 1286 HE2 HIS 77 HE2 HIS 77 14.319 19.171 0.565 Start of MODEL 4 1 H1 MET 1 H1 MET 1 7.849 18.868 5.940 2 H2 MET 1 H2 MET 1 8.785 20.160 6.491 3 H3 MET 1 H3 MET 1 9.059 18.605 7.091 4 HA MET 1 HA MET 1 9.487 19.507 4.307 5 HB2 MET 1 HB2 MET 1 11.471 18.800 6.506 6 HB3 MET 1 HB3 MET 1 11.926 19.038 4.821 7 HG2 MET 1 HG2 MET 1 12.426 21.055 6.012 8 HG3 MET 1 HG3 MET 1 11.035 21.378 4.979 9 HE1 MET 1 HE1 MET 1 12.377 21.058 8.643 10 HE2 MET 1 HE2 MET 1 11.357 19.619 8.576 11 HE3 MET 1 HE3 MET 1 10.893 20.984 9.591 12 H LYS 2 H LYS 2 8.991 16.823 6.459 13 HA LYS 2 HA LYS 2 10.016 14.772 4.683 14 HB2 LYS 2 HB2 LYS 2 8.312 14.614 7.204 15 HB3 LYS 2 HB3 LYS 2 8.864 13.198 6.310 16 HG2 LYS 2 HG2 LYS 2 11.203 13.816 6.741 17 HG3 LYS 2 HG3 LYS 2 10.675 15.256 7.621 18 HD2 LYS 2 HD2 LYS 2 9.637 13.883 9.348 19 HD3 LYS 2 HD3 LYS 2 9.948 12.407 8.426 20 HE2 LYS 2 HE2 LYS 2 12.084 14.228 9.602 21 HE3 LYS 2 HE3 LYS 2 11.558 12.688 10.285 22 HZ1 LYS 2 HZ1 LYS 2 12.909 13.097 7.669 23 HZ2 LYS 2 HZ2 LYS 2 12.294 11.617 8.205 24 HZ3 LYS 2 HZ3 LYS 2 13.560 12.355 9.046 25 H MET 3 H MET 3 8.964 13.793 3.060 26 HA MET 3 HA MET 3 6.268 14.438 2.281 27 HB2 MET 3 HB2 MET 3 8.248 12.370 1.234 28 HB3 MET 3 HB3 MET 3 6.691 12.700 0.480 29 HG2 MET 3 HG2 MET 3 8.906 14.740 0.820 30 HG3 MET 3 HG3 MET 3 8.579 13.832 -0.657 31 HE1 MET 3 HE1 MET 3 5.366 13.788 -0.772 32 HE2 MET 3 HE2 MET 3 6.369 14.185 -2.169 33 HE3 MET 3 HE3 MET 3 5.044 15.250 -1.702 34 H LEU 4 H LEU 4 4.617 12.782 1.835 35 HA LEU 4 HA LEU 4 3.872 11.132 3.971 36 HB2 LEU 4 HB2 LEU 4 2.270 10.071 2.168 37 HB3 LEU 4 HB3 LEU 4 2.056 11.729 2.688 38 HG LEU 4 HG LEU 4 3.067 12.573 0.613 39 HD11 LEU 4 HD11 LEU 4 3.436 9.690 -0.237 40 HD12 LEU 4 HD12 LEU 4 4.717 10.840 0.152 41 HD13 LEU 4 HD13 LEU 4 3.692 11.113 -1.253 42 HD21 LEU 4 HD21 LEU 4 0.651 12.153 0.618 43 HD22 LEU 4 HD22 LEU 4 0.916 10.502 0.051 44 HD23 LEU 4 HD23 LEU 4 1.327 11.871 -0.987 45 H LYS 5 H LYS 5 6.065 10.367 1.370 46 HA LYS 5 HA LYS 5 5.952 7.489 1.611 47 HB2 LYS 5 HB2 LYS 5 6.792 8.789 -0.450 48 HB3 LYS 5 HB3 LYS 5 8.264 9.113 0.466 49 HG2 LYS 5 HG2 LYS 5 8.481 6.556 0.721 50 HG3 LYS 5 HG3 LYS 5 7.206 6.433 -0.490 51 HD2 LYS 5 HD2 LYS 5 9.338 6.166 -1.592 52 HD3 LYS 5 HD3 LYS 5 8.660 7.721 -2.081 53 HE2 LYS 5 HE2 LYS 5 10.132 8.876 -0.480 54 HE3 LYS 5 HE3 LYS 5 10.774 7.329 0.067 55 HZ1 LYS 5 HZ1 LYS 5 11.012 8.363 -2.701 56 HZ2 LYS 5 HZ2 LYS 5 11.734 6.968 -2.080 57 HZ3 LYS 5 HZ3 LYS 5 12.215 8.491 -1.518 58 H GLU 6 H GLU 6 7.995 10.086 2.923 59 HA GLU 6 HA GLU 6 9.858 8.551 4.403 60 HB2 GLU 6 HB2 GLU 6 8.796 11.317 5.143 61 HB3 GLU 6 HB3 GLU 6 10.335 10.617 5.635 62 HG2 GLU 6 HG2 GLU 6 9.544 11.458 2.827 63 HG3 GLU 6 HG3 GLU 6 10.636 12.323 3.906 64 H LYS 7 H LYS 7 6.750 9.989 5.238 65 HA LYS 7 HA LYS 7 6.351 9.111 7.865 66 HB2 LYS 7 HB2 LYS 7 4.908 10.762 6.801 67 HB3 LYS 7 HB3 LYS 7 4.400 9.597 5.583 68 HG2 LYS 7 HG2 LYS 7 3.361 8.252 7.510 69 HG3 LYS 7 HG3 LYS 7 3.641 9.673 8.523 70 HD2 LYS 7 HD2 LYS 7 1.979 9.566 5.977 71 HD3 LYS 7 HD3 LYS 7 1.341 9.636 7.627 72 HE2 LYS 7 HE2 LYS 7 2.481 11.866 7.909 73 HE3 LYS 7 HE3 LYS 7 2.951 11.795 6.208 74 HZ1 LYS 7 HZ1 LYS 7 0.578 11.689 5.649 75 HZ2 LYS 7 HZ2 LYS 7 0.996 13.110 6.458 76 HZ3 LYS 7 HZ3 LYS 7 0.193 11.875 7.284 77 H ALA 8 H ALA 8 5.409 7.539 4.802 78 HA ALA 8 HA ALA 8 4.193 5.204 5.788 79 HB1 ALA 8 HB1 ALA 8 4.526 4.291 3.527 80 HB2 ALA 8 HB2 ALA 8 5.719 5.551 3.177 81 HB3 ALA 8 HB3 ALA 8 4.024 5.983 3.448 82 H GLY 9 H GLY 9 7.567 5.956 5.173 83 HA2 GLY 9 HA2 GLY 9 8.704 3.369 5.670 84 HA3 GLY 9 HA3 GLY 9 9.553 4.906 5.669 85 H ALA 10 H ALA 10 7.980 6.166 7.719 86 HA ALA 10 HA ALA 10 9.242 5.246 10.113 87 HB1 ALA 10 HB1 ALA 10 8.706 7.628 9.752 88 HB2 ALA 10 HB2 ALA 10 7.953 7.033 11.235 89 HB3 ALA 10 HB3 ALA 10 6.980 7.255 9.776 90 H LEU 11 H LEU 11 5.865 5.100 8.927 91 HA LEU 11 HA LEU 11 4.641 3.819 11.127 92 HB2 LEU 11 HB2 LEU 11 3.869 3.733 8.180 93 HB3 LEU 11 HB3 LEU 11 2.828 3.208 9.495 94 HG LEU 11 HG LEU 11 3.793 6.065 9.040 95 HD11 LEU 11 HD11 LEU 11 1.484 6.584 8.423 96 HD12 LEU 11 HD12 LEU 11 1.036 4.883 8.587 97 HD13 LEU 11 HD13 LEU 11 2.182 5.381 7.338 98 HD21 LEU 11 HD21 LEU 11 2.229 6.711 10.828 99 HD22 LEU 11 HD22 LEU 11 3.478 5.624 11.428 100 HD23 LEU 11 HD23 LEU 11 1.850 5.011 11.126 101 H ALA 12 H ALA 12 6.425 2.553 8.389 102 HA ALA 12 HA ALA 12 5.849 -0.164 8.437 103 HB1 ALA 12 HB1 ALA 12 8.549 1.090 7.857 104 HB2 ALA 12 HB2 ALA 12 7.212 0.962 6.715 105 HB3 ALA 12 HB3 ALA 12 7.986 -0.506 7.323 106 H GLY 13 H GLY 13 8.278 1.575 10.380 107 HA2 GLY 13 HA2 GLY 13 9.708 -0.554 11.468 108 HA3 GLY 13 HA3 GLY 13 9.530 1.019 12.221 109 H GLN 14 H GLN 14 6.999 1.182 13.011 110 HA GLN 14 HA GLN 14 6.861 -0.455 15.328 111 HB2 GLN 14 HB2 GLN 14 4.708 0.707 15.773 112 HB3 GLN 14 HB3 GLN 14 6.007 1.825 15.370 113 HG2 GLN 14 HG2 GLN 14 5.117 2.053 13.084 114 HG3 GLN 14 HG3 GLN 14 3.826 0.913 13.463 115 HE21 GLN 14 HE21 GLN 14 3.622 3.685 12.581 116 HE22 GLN 14 HE22 GLN 14 2.724 4.513 13.797 117 H ILE 15 H ILE 15 5.116 -0.604 12.203 118 HA ILE 15 HA ILE 15 3.172 -2.553 12.949 119 HB ILE 15 HB ILE 15 4.216 -1.716 10.212 120 HG12 ILE 15 HG12 ILE 15 1.613 -1.105 11.696 121 HG13 ILE 15 HG13 ILE 15 2.947 0.016 11.447 122 HG21 ILE 15 HG21 ILE 15 3.389 -4.029 9.997 123 HG22 ILE 15 HG22 ILE 15 2.311 -2.905 9.173 124 HG23 ILE 15 HG23 ILE 15 1.861 -3.567 10.744 125 HD11 ILE 15 HD11 ILE 15 1.136 0.521 9.952 126 HD12 ILE 15 HD12 ILE 15 1.137 -1.123 9.321 127 HD13 ILE 15 HD13 ILE 15 2.514 -0.061 9.021 128 H TRP 16 H TRP 16 6.344 -2.866 11.381 129 HA TRP 16 HA TRP 16 6.461 -5.664 11.153 130 HB2 TRP 16 HB2 TRP 16 8.071 -4.093 10.054 131 HB3 TRP 16 HB3 TRP 16 8.779 -3.733 11.627 132 HD1 TRP 16 HD1 TRP 16 8.542 -6.562 9.031 133 HE1 TRP 16 HE1 TRP 16 10.428 -8.253 9.478 134 HE3 TRP 16 HE3 TRP 16 10.316 -4.666 13.445 135 HZ2 TRP 16 HZ2 TRP 16 12.393 -8.742 11.444 136 HZ3 TRP 16 HZ3 TRP 16 12.193 -5.813 14.556 137 HH2 TRP 16 HH2 TRP 16 13.204 -7.813 13.581 138 H GLU 17 H GLU 17 7.540 -3.525 13.830 139 HA GLU 17 HA GLU 17 8.472 -5.561 15.585 140 HB2 GLU 17 HB2 GLU 17 7.613 -2.684 16.082 141 HB3 GLU 17 HB3 GLU 17 8.225 -3.717 17.375 142 HG2 GLU 17 HG2 GLU 17 10.356 -3.971 16.234 143 HG3 GLU 17 HG3 GLU 17 9.758 -3.067 14.841 144 H ALA 18 H ALA 18 5.247 -4.301 15.011 145 HA ALA 18 HA ALA 18 3.903 -5.464 17.253 146 HB1 ALA 18 HB1 ALA 18 2.792 -4.800 14.496 147 HB2 ALA 18 HB2 ALA 18 2.866 -3.697 15.870 148 HB3 ALA 18 HB3 ALA 18 1.835 -5.125 15.948 149 H LEU 19 H LEU 19 4.682 -6.630 13.998 150 HA LEU 19 HA LEU 19 3.474 -9.249 14.270 151 HB2 LEU 19 HB2 LEU 19 5.464 -8.107 12.272 152 HB3 LEU 19 HB3 LEU 19 4.695 -9.681 12.108 153 HG LEU 19 HG LEU 19 3.151 -7.057 12.184 154 HD11 LEU 19 HD11 LEU 19 4.605 -7.076 10.218 155 HD12 LEU 19 HD12 LEU 19 2.918 -7.266 9.748 156 HD13 LEU 19 HD13 LEU 19 3.995 -8.667 9.750 157 HD21 LEU 19 HD21 LEU 19 2.303 -9.880 11.435 158 HD22 LEU 19 HD22 LEU 19 1.294 -8.439 11.297 159 HD23 LEU 19 HD23 LEU 19 1.827 -8.987 12.882 160 H ASN 20 H ASN 20 6.547 -7.864 15.131 161 HA ASN 20 HA ASN 20 8.191 -10.170 14.761 162 HB2 ASN 20 HB2 ASN 20 9.090 -7.853 14.675 163 HB3 ASN 20 HB3 ASN 20 8.758 -7.663 16.392 164 HD21 ASN 20 HD21 ASN 20 10.673 -9.428 14.047 165 HD22 ASN 20 HD22 ASN 20 11.937 -9.863 15.133 166 H GLY 21 H GLY 21 8.449 -11.884 16.030 167 HA2 GLY 21 HA2 GLY 21 8.737 -13.028 18.099 168 HA3 GLY 21 HA3 GLY 21 7.765 -11.817 18.913 169 H THR 22 H THR 22 6.070 -12.545 16.144 170 HA THR 22 HA THR 22 4.615 -14.855 17.340 171 HB THR 22 HB THR 22 2.463 -13.917 16.429 172 HG1 THR 22 HG1 THR 22 3.936 -11.496 16.093 173 HG21 THR 22 HG21 THR 22 2.961 -13.623 18.816 174 HG22 THR 22 HG22 THR 22 2.095 -12.219 18.186 175 HG23 THR 22 HG23 THR 22 3.836 -12.128 18.467 176 H GLU 23 H GLU 23 3.023 -15.798 15.642 177 HA GLU 23 HA GLU 23 4.476 -16.559 13.250 178 HB2 GLU 23 HB2 GLU 23 1.652 -17.305 14.121 179 HB3 GLU 23 HB3 GLU 23 2.586 -18.097 12.853 180 HG2 GLU 23 HG2 GLU 23 3.186 -18.110 15.831 181 HG3 GLU 23 HG3 GLU 23 2.561 -19.451 14.877 182 H GLY 24 H GLY 24 2.724 -13.850 13.882 183 HA2 GLY 24 HA2 GLY 24 2.276 -12.333 11.989 184 HA3 GLY 24 HA3 GLY 24 1.429 -13.667 11.217 185 H LEU 25 H LEU 25 0.346 -11.073 11.803 186 HA LEU 25 HA LEU 25 -1.845 -11.735 13.690 187 HB2 LEU 25 HB2 LEU 25 -0.414 -9.058 13.439 188 HB3 LEU 25 HB3 LEU 25 -1.877 -9.317 14.378 189 HG LEU 25 HG LEU 25 0.850 -10.551 14.960 190 HD11 LEU 25 HD11 LEU 25 -0.647 -8.351 16.422 191 HD12 LEU 25 HD12 LEU 25 0.801 -8.154 15.428 192 HD13 LEU 25 HD13 LEU 25 0.884 -9.082 16.922 193 HD21 LEU 25 HD21 LEU 25 -1.738 -10.780 16.543 194 HD22 LEU 25 HD22 LEU 25 -0.155 -11.370 17.063 195 HD23 LEU 25 HD23 LEU 25 -0.936 -12.077 15.651 196 H THR 26 H THR 26 -3.844 -10.592 13.285 197 HA THR 26 HA THR 26 -4.476 -9.958 10.514 198 HB THR 26 HB THR 26 -6.761 -9.491 11.396 199 HG1 THR 26 HG1 THR 26 -7.163 -9.708 13.623 200 HG21 THR 26 HG21 THR 26 -7.322 -11.745 12.223 201 HG22 THR 26 HG22 THR 26 -5.611 -12.081 12.488 202 HG23 THR 26 HG23 THR 26 -6.217 -11.831 10.848 203 H GLN 27 H GLN 27 -5.595 -7.853 9.957 204 HA GLN 27 HA GLN 27 -4.083 -5.574 10.632 205 HB2 GLN 27 HB2 GLN 27 -5.717 -4.256 9.356 206 HB3 GLN 27 HB3 GLN 27 -5.314 -5.742 8.506 207 HG2 GLN 27 HG2 GLN 27 -7.448 -6.742 9.226 208 HG3 GLN 27 HG3 GLN 27 -7.855 -5.270 10.104 209 HE21 GLN 27 HE21 GLN 27 -8.374 -3.384 8.887 210 HE22 GLN 27 HE22 GLN 27 -8.871 -3.490 7.242 211 H LYS 28 H LYS 28 -7.065 -6.823 12.060 212 HA LYS 28 HA LYS 28 -7.776 -4.813 13.865 213 HB2 LYS 28 HB2 LYS 28 -7.842 -7.845 14.094 214 HB3 LYS 28 HB3 LYS 28 -8.420 -6.835 15.414 215 HG2 LYS 28 HG2 LYS 28 -9.541 -6.785 12.590 216 HG3 LYS 28 HG3 LYS 28 -10.228 -7.695 13.942 217 HD2 LYS 28 HD2 LYS 28 -10.389 -5.433 15.181 218 HD3 LYS 28 HD3 LYS 28 -10.030 -4.675 13.625 219 HE2 LYS 28 HE2 LYS 28 -12.407 -6.470 14.238 220 HE3 LYS 28 HE3 LYS 28 -12.445 -4.718 14.042 221 HZ1 LYS 28 HZ1 LYS 28 -11.689 -6.664 11.932 222 HZ2 LYS 28 HZ2 LYS 28 -11.760 -4.988 11.754 223 HZ3 LYS 28 HZ3 LYS 28 -13.173 -5.864 12.050 224 H GLN 29 H GLN 29 -5.394 -7.437 14.376 225 HA GLN 29 HA GLN 29 -4.707 -6.659 17.057 226 HB2 GLN 29 HB2 GLN 29 -3.379 -8.630 15.158 227 HB3 GLN 29 HB3 GLN 29 -2.933 -8.440 16.851 228 HG2 GLN 29 HG2 GLN 29 -5.680 -9.292 15.892 229 HG3 GLN 29 HG3 GLN 29 -4.402 -10.407 16.367 230 HE21 GLN 29 HE21 GLN 29 -5.563 -11.297 18.060 231 HE22 GLN 29 HE22 GLN 29 -5.935 -10.442 19.508 232 H ILE 30 H ILE 30 -3.139 -6.281 13.911 233 HA ILE 30 HA ILE 30 -0.681 -5.173 14.754 234 HB ILE 30 HB ILE 30 -2.194 -4.788 12.129 235 HG12 ILE 30 HG12 ILE 30 0.120 -6.676 12.756 236 HG13 ILE 30 HG13 ILE 30 -1.570 -7.167 12.748 237 HG21 ILE 30 HG21 ILE 30 -0.538 -2.988 12.387 238 HG22 ILE 30 HG22 ILE 30 -0.024 -4.120 11.136 239 HG23 ILE 30 HG23 ILE 30 0.727 -4.175 12.732 240 HD11 ILE 30 HD11 ILE 30 -1.710 -6.629 10.362 241 HD12 ILE 30 HD12 ILE 30 -0.458 -7.822 10.707 242 HD13 ILE 30 HD13 ILE 30 -0.009 -6.149 10.374 243 H LYS 31 H LYS 31 -3.668 -3.568 13.583 244 HA LYS 31 HA LYS 31 -2.799 -0.891 13.810 245 HB2 LYS 31 HB2 LYS 31 -4.804 -1.783 12.508 246 HB3 LYS 31 HB3 LYS 31 -5.680 -1.849 14.031 247 HG2 LYS 31 HG2 LYS 31 -5.308 0.631 14.270 248 HG3 LYS 31 HG3 LYS 31 -4.575 0.623 12.669 249 HD2 LYS 31 HD2 LYS 31 -6.776 1.323 12.246 250 HD3 LYS 31 HD3 LYS 31 -6.823 -0.392 11.846 251 HE2 LYS 31 HE2 LYS 31 -7.789 0.852 14.450 252 HE3 LYS 31 HE3 LYS 31 -8.814 0.318 13.124 253 HZ1 LYS 31 HZ1 LYS 31 -7.152 -1.362 14.907 254 HZ2 LYS 31 HZ2 LYS 31 -7.894 -1.952 13.507 255 HZ3 LYS 31 HZ3 LYS 31 -8.837 -1.349 14.771 256 H LYS 32 H LYS 32 -4.398 -3.016 16.145 257 HA LYS 32 HA LYS 32 -4.836 -1.126 18.225 258 HB2 LYS 32 HB2 LYS 32 -6.025 -3.280 18.180 259 HB3 LYS 32 HB3 LYS 32 -4.509 -4.155 18.360 260 HG2 LYS 32 HG2 LYS 32 -5.720 -4.111 20.483 261 HG3 LYS 32 HG3 LYS 32 -4.209 -3.204 20.618 262 HD2 LYS 32 HD2 LYS 32 -5.614 -1.086 20.164 263 HD3 LYS 32 HD3 LYS 32 -7.041 -2.099 20.401 264 HE2 LYS 32 HE2 LYS 32 -4.842 -1.613 22.444 265 HE3 LYS 32 HE3 LYS 32 -6.438 -0.864 22.448 266 HZ1 LYS 32 HZ1 LYS 32 -5.910 -3.773 22.718 267 HZ2 LYS 32 HZ2 LYS 32 -7.430 -3.034 22.768 268 HZ3 LYS 32 HZ3 LYS 32 -6.296 -2.723 23.986 269 H ALA 33 H ALA 33 -2.165 -3.440 17.649 270 HA ALA 33 HA ALA 33 -0.657 -2.921 19.995 271 HB1 ALA 33 HB1 ALA 33 1.174 -4.104 18.839 272 HB2 ALA 33 HB2 ALA 33 0.313 -3.961 17.303 273 HB3 ALA 33 HB3 ALA 33 -0.363 -4.941 18.606 274 H THR 34 H THR 34 -0.496 -1.552 16.747 275 HA THR 34 HA THR 34 1.775 0.199 17.278 276 HB THR 34 HB THR 34 1.450 0.905 14.898 277 HG1 THR 34 HG1 THR 34 -0.353 -1.021 14.231 278 HG21 THR 34 HG21 THR 34 2.845 -1.080 15.365 279 HG22 THR 34 HG22 THR 34 1.970 -1.255 13.844 280 HG23 THR 34 HG23 THR 34 1.411 -2.114 15.282 281 H LYS 35 H LYS 35 -1.601 0.408 17.652 282 HA LYS 35 HA LYS 35 -2.949 2.006 18.525 283 HB2 LYS 35 HB2 LYS 35 -0.499 3.801 18.684 284 HB3 LYS 35 HB3 LYS 35 -2.025 4.060 19.523 285 HG2 LYS 35 HG2 LYS 35 -1.636 2.117 20.944 286 HG3 LYS 35 HG3 LYS 35 -0.192 1.678 20.025 287 HD2 LYS 35 HD2 LYS 35 -0.546 4.206 21.696 288 HD3 LYS 35 HD3 LYS 35 0.406 2.790 22.153 289 HE2 LYS 35 HE2 LYS 35 1.956 3.186 20.311 290 HE3 LYS 35 HE3 LYS 35 0.957 4.509 19.707 291 HZ1 LYS 35 HZ1 LYS 35 2.788 5.388 20.894 292 HZ2 LYS 35 HZ2 LYS 35 2.464 4.435 22.247 293 HZ3 LYS 35 HZ3 LYS 35 1.398 5.673 21.811 294 H LEU 36 H LEU 36 -2.287 1.816 15.599 295 HA LEU 36 HA LEU 36 -2.527 4.421 14.423 296 HB2 LEU 36 HB2 LEU 36 -3.189 1.717 13.203 297 HB3 LEU 36 HB3 LEU 36 -2.985 3.216 12.311 298 HG LEU 36 HG LEU 36 -0.808 1.745 13.841 299 HD11 LEU 36 HD11 LEU 36 0.157 1.215 11.662 300 HD12 LEU 36 HD12 LEU 36 -1.201 1.999 10.850 301 HD13 LEU 36 HD13 LEU 36 -1.468 0.549 11.821 302 HD21 LEU 36 HD21 LEU 36 -0.544 4.250 12.146 303 HD22 LEU 36 HD22 LEU 36 0.783 3.344 12.880 304 HD23 LEU 36 HD23 LEU 36 -0.395 4.157 13.904 305 H LYS 37 H LYS 37 -4.404 5.203 13.206 306 HA LYS 37 HA LYS 37 -6.768 4.967 14.953 307 HB2 LYS 37 HB2 LYS 37 -5.910 7.206 13.066 308 HB3 LYS 37 HB3 LYS 37 -7.390 7.226 14.013 309 HG2 LYS 37 HG2 LYS 37 -5.811 8.602 15.170 310 HG3 LYS 37 HG3 LYS 37 -5.967 7.113 16.108 311 HD2 LYS 37 HD2 LYS 37 -3.849 6.284 15.024 312 HD3 LYS 37 HD3 LYS 37 -3.688 7.845 14.220 313 HE2 LYS 37 HE2 LYS 37 -3.749 7.466 17.232 314 HE3 LYS 37 HE3 LYS 37 -2.276 7.597 16.273 315 HZ1 LYS 37 HZ1 LYS 37 -2.875 9.705 17.267 316 HZ2 LYS 37 HZ2 LYS 37 -4.379 9.683 16.496 317 HZ3 LYS 37 HZ3 LYS 37 -2.962 9.804 15.581 318 H ALA 38 H ALA 38 -5.801 4.575 11.623 319 HA ALA 38 HA ALA 38 -8.440 3.478 10.900 320 HB1 ALA 38 HB1 ALA 38 -6.995 5.558 9.207 321 HB2 ALA 38 HB2 ALA 38 -8.461 5.839 10.149 322 HB3 ALA 38 HB3 ALA 38 -8.497 4.728 8.779 323 H ASP 39 H ASP 39 -8.382 2.302 8.844 324 HA ASP 39 HA ASP 39 -6.302 0.426 8.501 325 HB2 ASP 39 HB2 ASP 39 -7.553 -0.283 6.505 326 HB3 ASP 39 HB3 ASP 39 -8.660 0.024 7.837 327 H LYS 40 H LYS 40 -6.892 3.555 7.063 328 HA LYS 40 HA LYS 40 -5.206 3.628 4.857 329 HB2 LYS 40 HB2 LYS 40 -5.804 5.855 6.842 330 HB3 LYS 40 HB3 LYS 40 -5.133 6.100 5.235 331 HG2 LYS 40 HG2 LYS 40 -7.846 4.820 5.708 332 HG3 LYS 40 HG3 LYS 40 -7.627 6.561 5.542 333 HD2 LYS 40 HD2 LYS 40 -8.167 6.046 3.351 334 HD3 LYS 40 HD3 LYS 40 -6.421 5.845 3.251 335 HE2 LYS 40 HE2 LYS 40 -7.514 3.991 2.124 336 HE3 LYS 40 HE3 LYS 40 -6.743 3.378 3.587 337 HZ1 LYS 40 HZ1 LYS 40 -8.954 2.465 3.336 338 HZ2 LYS 40 HZ2 LYS 40 -9.629 4.012 3.268 339 HZ3 LYS 40 HZ3 LYS 40 -8.907 3.467 4.695 340 H ASP 41 H ASP 41 -4.355 4.244 8.287 341 HA ASP 41 HA ASP 41 -1.629 5.004 7.912 342 HB2 ASP 41 HB2 ASP 41 -2.862 3.645 10.350 343 HB3 ASP 41 HB3 ASP 41 -1.363 4.568 10.322 344 H PHE 42 H PHE 42 -3.253 1.942 8.447 345 HA PHE 42 HA PHE 42 -1.038 0.247 8.855 346 HB2 PHE 42 HB2 PHE 42 -3.239 -0.468 9.544 347 HB3 PHE 42 HB3 PHE 42 -3.876 -0.299 7.913 348 HD1 PHE 42 HD1 PHE 42 -1.060 -2.154 9.610 349 HD2 PHE 42 HD2 PHE 42 -4.282 -2.316 6.796 350 HE1 PHE 42 HE1 PHE 42 -0.597 -4.529 9.202 351 HE2 PHE 42 HE2 PHE 42 -3.809 -4.698 6.406 352 HZ PHE 42 HZ PHE 42 -1.968 -5.803 7.609 353 H PHE 43 H PHE 43 -2.796 1.111 5.851 354 HA PHE 43 HA PHE 43 -1.517 -0.743 4.120 355 HB2 PHE 43 HB2 PHE 43 -2.794 1.926 3.399 356 HB3 PHE 43 HB3 PHE 43 -2.401 0.645 2.255 357 HD1 PHE 43 HD2 PHE 43 -3.370 -1.726 4.027 358 HD2 PHE 43 HD1 PHE 43 -5.141 2.034 2.987 359 HE1 PHE 43 HE2 PHE 43 -5.614 -2.681 4.336 360 HE2 PHE 43 HE1 PHE 43 -7.369 1.063 3.301 361 HZ PHE 43 HZ PHE 43 -7.610 -1.295 3.966 362 H LEU 44 H LEU 44 -0.696 2.632 4.913 363 HA LEU 44 HA LEU 44 1.428 3.021 3.086 364 HB2 LEU 44 HB2 LEU 44 0.590 4.353 5.656 365 HB3 LEU 44 HB3 LEU 44 2.181 4.726 5.025 366 HG LEU 44 HG LEU 44 1.178 5.554 2.916 367 HD11 LEU 44 HD11 LEU 44 -1.229 5.928 2.680 368 HD12 LEU 44 HD12 LEU 44 -1.525 5.076 4.196 369 HD13 LEU 44 HD13 LEU 44 -0.855 4.210 2.813 370 HD21 LEU 44 HD21 LEU 44 1.655 7.134 4.731 371 HD22 LEU 44 HD22 LEU 44 0.032 6.897 5.388 372 HD23 LEU 44 HD23 LEU 44 0.245 7.643 3.802 373 H GLY 45 H GLY 45 1.491 1.883 6.479 374 HA2 GLY 45 HA2 GLY 45 4.322 1.516 6.662 375 HA3 GLY 45 HA3 GLY 45 3.111 0.838 7.736 376 H LEU 46 H LEU 46 1.646 -0.784 6.095 377 HA LEU 46 HA LEU 46 3.129 -3.180 5.979 378 HB2 LEU 46 HB2 LEU 46 0.702 -3.202 6.265 379 HB3 LEU 46 HB3 LEU 46 0.466 -2.440 4.700 380 HG LEU 46 HG LEU 46 1.329 -4.483 3.569 381 HD11 LEU 46 HD11 LEU 46 2.851 -5.303 5.267 382 HD12 LEU 46 HD12 LEU 46 1.703 -6.557 4.820 383 HD13 LEU 46 HD13 LEU 46 1.502 -5.687 6.341 384 HD21 LEU 46 HD21 LEU 46 -1.091 -4.243 3.909 385 HD22 LEU 46 HD22 LEU 46 -0.972 -5.071 5.462 386 HD23 LEU 46 HD23 LEU 46 -0.605 -5.937 3.969 387 H GLY 47 H GLY 47 2.336 -0.836 3.490 388 HA2 GLY 47 HA2 GLY 47 3.099 -2.228 1.148 389 HA3 GLY 47 HA3 GLY 47 3.065 -0.477 1.332 390 H TRP 48 H TRP 48 4.944 -0.452 3.530 391 HA TRP 48 HA TRP 48 7.426 -0.438 2.076 392 HB2 TRP 48 HB2 TRP 48 6.594 1.201 3.972 393 HB3 TRP 48 HB3 TRP 48 7.253 -0.012 5.068 394 HD1 TRP 48 HD1 TRP 48 9.978 -0.372 4.982 395 HE1 TRP 48 HE1 TRP 48 11.848 1.130 4.059 396 HE3 TRP 48 HE3 TRP 48 7.129 2.890 2.296 397 HZ2 TRP 48 HZ2 TRP 48 12.080 3.381 2.400 398 HZ3 TRP 48 HZ3 TRP 48 8.243 4.698 1.067 399 HH2 TRP 48 HH2 TRP 48 10.668 4.952 1.124 400 H LEU 49 H LEU 49 5.996 -2.450 4.628 401 HA LEU 49 HA LEU 49 8.159 -4.194 5.142 402 HB2 LEU 49 HB2 LEU 49 5.157 -4.448 5.367 403 HB3 LEU 49 HB3 LEU 49 6.153 -5.860 5.645 404 HG LEU 49 HG LEU 49 7.185 -4.882 7.593 405 HD11 LEU 49 HD11 LEU 49 6.680 -2.650 8.421 406 HD12 LEU 49 HD12 LEU 49 5.736 -2.314 6.962 407 HD13 LEU 49 HD13 LEU 49 7.477 -2.602 6.849 408 HD21 LEU 49 HD21 LEU 49 4.204 -4.303 7.656 409 HD22 LEU 49 HD22 LEU 49 5.250 -4.555 9.062 410 HD23 LEU 49 HD23 LEU 49 4.959 -5.878 7.936 411 H LEU 50 H LEU 50 5.662 -4.248 2.647 412 HA LEU 50 HA LEU 50 6.296 -6.688 1.383 413 HB2 LEU 50 HB2 LEU 50 4.931 -4.183 0.355 414 HB3 LEU 50 HB3 LEU 50 5.100 -5.631 -0.628 415 HG LEU 50 HG LEU 50 3.604 -5.498 2.025 416 HD11 LEU 50 HD11 LEU 50 1.546 -5.708 0.707 417 HD12 LEU 50 HD12 LEU 50 2.475 -5.610 -0.792 418 HD13 LEU 50 HD13 LEU 50 2.417 -4.229 0.307 419 HD21 LEU 50 HD21 LEU 50 4.551 -7.715 1.650 420 HD22 LEU 50 HD22 LEU 50 3.864 -7.777 0.025 421 HD23 LEU 50 HD23 LEU 50 2.803 -7.769 1.434 422 H ARG 51 H ARG 51 7.424 -3.340 0.631 423 HA ARG 51 HA ARG 51 8.809 -4.069 -1.739 424 HB2 ARG 51 HB2 ARG 51 9.880 -1.867 -1.668 425 HB3 ARG 51 HB3 ARG 51 8.153 -1.766 -1.377 426 HG2 ARG 51 HG2 ARG 51 8.472 -1.257 0.935 427 HG3 ARG 51 HG3 ARG 51 10.177 -1.691 0.881 428 HD2 ARG 51 HD2 ARG 51 8.991 0.634 -0.667 429 HD3 ARG 51 HD3 ARG 51 9.718 0.776 0.938 430 HE ARG 51 HE ARG 51 11.591 -0.516 -0.605 431 HH11 ARG 51 HH11 ARG 51 10.085 2.599 -0.700 432 HH12 ARG 51 HH12 ARG 51 11.451 3.332 -1.456 433 HH21 ARG 51 HH21 ARG 51 13.302 0.459 -1.534 434 HH22 ARG 51 HH22 ARG 51 13.240 2.137 -1.925 435 H GLU 52 H GLU 52 9.920 -4.006 1.623 436 HA GLU 52 HA GLU 52 12.681 -4.594 0.782 437 HB2 GLU 52 HB2 GLU 52 11.451 -3.460 3.242 438 HB3 GLU 52 HB3 GLU 52 12.778 -4.566 3.555 439 HG2 GLU 52 HG2 GLU 52 13.623 -2.315 3.481 440 HG3 GLU 52 HG3 GLU 52 14.254 -3.222 2.111 441 H ASP 53 H ASP 53 10.014 -6.442 1.133 442 HA ASP 53 HA ASP 53 9.691 -8.671 1.116 443 HB2 ASP 53 HB2 ASP 53 12.737 -8.830 0.981 444 HB3 ASP 53 HB3 ASP 53 11.653 -10.190 0.711 445 H LYS 54 H LYS 54 9.761 -7.304 3.639 446 HA LYS 54 HA LYS 54 11.231 -8.932 5.588 447 HB2 LYS 54 HB2 LYS 54 9.432 -6.505 6.035 448 HB3 LYS 54 HB3 LYS 54 10.520 -7.230 7.220 449 HG2 LYS 54 HG2 LYS 54 12.456 -6.583 5.800 450 HG3 LYS 54 HG3 LYS 54 11.343 -5.830 4.655 451 HD2 LYS 54 HD2 LYS 54 12.313 -4.107 6.073 452 HD3 LYS 54 HD3 LYS 54 10.597 -4.259 6.460 453 HE2 LYS 54 HE2 LYS 54 11.991 -4.022 8.493 454 HE3 LYS 54 HE3 LYS 54 11.149 -5.569 8.461 455 HZ1 LYS 54 HZ1 LYS 54 13.981 -5.168 7.670 456 HZ2 LYS 54 HZ2 LYS 54 13.166 -6.648 7.757 457 HZ3 LYS 54 HZ3 LYS 54 13.471 -5.763 9.167 458 H VAL 55 H VAL 55 8.091 -8.830 4.216 459 HA VAL 55 HA VAL 55 7.026 -10.634 6.325 460 HB VAL 55 HB VAL 55 4.771 -9.641 6.067 461 HG11 VAL 55 HG11 VAL 55 6.169 -8.884 7.924 462 HG12 VAL 55 HG12 VAL 55 5.154 -7.564 7.344 463 HG13 VAL 55 HG13 VAL 55 6.865 -7.611 6.916 464 HG21 VAL 55 HG21 VAL 55 4.962 -8.739 3.782 465 HG22 VAL 55 HG22 VAL 55 6.110 -7.519 4.337 466 HG23 VAL 55 HG23 VAL 55 4.437 -7.474 4.897 467 H VAL 56 H VAL 56 5.103 -11.926 5.584 468 HA VAL 56 HA VAL 56 4.608 -11.918 2.682 469 HB VAL 56 HB VAL 56 5.744 -14.038 3.144 470 HG11 VAL 56 HG11 VAL 56 3.610 -14.613 5.232 471 HG12 VAL 56 HG12 VAL 56 5.311 -14.267 5.549 472 HG13 VAL 56 HG13 VAL 56 4.858 -15.745 4.698 473 HG21 VAL 56 HG21 VAL 56 4.053 -15.634 2.281 474 HG22 VAL 56 HG22 VAL 56 3.952 -14.082 1.448 475 HG23 VAL 56 HG23 VAL 56 2.765 -14.494 2.687 476 H THR 57 H THR 57 2.514 -11.592 2.113 477 HA THR 57 HA THR 57 0.606 -11.100 4.321 478 HB THR 57 HB THR 57 -0.631 -9.684 2.580 479 HG1 THR 57 HG1 THR 57 0.350 -9.250 0.677 480 HG21 THR 57 HG21 THR 57 0.886 -7.754 2.791 481 HG22 THR 57 HG22 THR 57 2.195 -8.826 3.293 482 HG23 THR 57 HG23 THR 57 0.768 -8.636 4.317 483 H SER 58 H SER 58 -1.488 -11.737 4.198 484 HA SER 58 HA SER 58 -2.484 -13.493 2.087 485 HB2 SER 58 HB2 SER 58 -1.323 -15.013 3.745 486 HB3 SER 58 HB3 SER 58 -2.396 -14.415 5.008 487 HG SER 58 HG SER 58 -3.006 -15.997 2.744 488 H GLU 59 H GLU 59 -4.862 -14.076 2.661 489 HA GLU 59 HA GLU 59 -6.176 -11.852 4.125 490 HB2 GLU 59 HB2 GLU 59 -6.293 -11.484 1.673 491 HB3 GLU 59 HB3 GLU 59 -7.063 -13.045 1.457 492 HG2 GLU 59 HG2 GLU 59 -8.434 -11.117 3.302 493 HG3 GLU 59 HG3 GLU 59 -8.421 -10.689 1.597 494 H VAL 60 H VAL 60 -7.402 -12.545 5.709 495 HA VAL 60 HA VAL 60 -8.526 -15.293 5.743 496 HB VAL 60 HB VAL 60 -7.472 -13.609 8.055 497 HG11 VAL 60 HG11 VAL 60 -9.052 -16.208 8.284 498 HG12 VAL 60 HG12 VAL 60 -9.570 -14.620 8.855 499 HG13 VAL 60 HG13 VAL 60 -8.191 -15.419 9.611 500 HG21 VAL 60 HG21 VAL 60 -5.772 -14.896 6.822 501 HG22 VAL 60 HG22 VAL 60 -6.703 -16.379 7.062 502 HG23 VAL 60 HG23 VAL 60 -5.986 -15.552 8.448 503 H GLU 61 H GLU 61 -10.572 -15.170 5.248 504 HA GLU 61 HA GLU 61 -12.796 -14.777 5.237 505 HB2 GLU 61 HB2 GLU 61 -12.290 -14.160 8.167 506 HB3 GLU 61 HB3 GLU 61 -13.808 -14.724 7.463 507 HG2 GLU 61 HG2 GLU 61 -12.650 -16.849 6.806 508 HG3 GLU 61 HG3 GLU 61 -11.197 -16.264 7.601 509 H GLY 62 H GLY 62 -11.583 -12.512 4.237 510 HA2 GLY 62 HA2 GLY 62 -12.668 -10.601 3.360 511 HA3 GLY 62 HA3 GLY 62 -13.610 -10.456 4.830 512 H GLU 63 H GLU 63 -10.580 -10.907 5.989 513 HA GLU 63 HA GLU 63 -9.779 -8.050 5.818 514 HB2 GLU 63 HB2 GLU 63 -9.871 -9.729 8.362 515 HB3 GLU 63 HB3 GLU 63 -9.078 -8.159 8.232 516 HG2 GLU 63 HG2 GLU 63 -11.356 -7.219 7.528 517 HG3 GLU 63 HG3 GLU 63 -12.041 -8.767 8.021 518 H ILE 64 H ILE 64 -7.512 -7.666 6.507 519 HA ILE 64 HA ILE 64 -5.770 -9.483 5.056 520 HB ILE 64 HB ILE 64 -5.121 -6.829 6.408 521 HG12 ILE 64 HG12 ILE 64 -5.802 -7.383 3.483 522 HG13 ILE 64 HG13 ILE 64 -6.868 -6.597 4.642 523 HG21 ILE 64 HG21 ILE 64 -3.091 -8.174 6.035 524 HG22 ILE 64 HG22 ILE 64 -3.112 -6.772 4.962 525 HG23 ILE 64 HG23 ILE 64 -3.518 -8.371 4.333 526 HD11 ILE 64 HD11 ILE 64 -4.232 -5.517 3.635 527 HD12 ILE 64 HD12 ILE 64 -5.283 -4.728 4.814 528 HD13 ILE 64 HD13 ILE 64 -5.844 -4.981 3.163 529 H PHE 65 H PHE 65 -4.396 -10.915 5.922 530 HA PHE 65 HA PHE 65 -3.597 -10.789 8.781 531 HB2 PHE 65 HB2 PHE 65 -5.087 -12.759 8.136 532 HB3 PHE 65 HB3 PHE 65 -3.818 -13.305 7.054 533 HD1 PHE 65 HD1 PHE 65 -1.538 -13.978 8.092 534 HD2 PHE 65 HD2 PHE 65 -5.041 -13.330 10.453 535 HE1 PHE 65 HE1 PHE 65 -0.529 -15.234 9.951 536 HE2 PHE 65 HE2 PHE 65 -4.019 -14.579 12.302 537 HZ PHE 65 HZ PHE 65 -1.764 -15.531 12.055 538 H VAL 66 H VAL 66 -1.525 -10.062 8.827 539 HA VAL 66 HA VAL 66 0.349 -10.691 6.619 540 HB VAL 66 HB VAL 66 0.689 -8.580 8.797 541 HG11 VAL 66 HG11 VAL 66 2.396 -7.622 7.275 542 HG12 VAL 66 HG12 VAL 66 2.138 -8.948 6.140 543 HG13 VAL 66 HG13 VAL 66 2.807 -9.275 7.741 544 HG21 VAL 66 HG21 VAL 66 -0.405 -8.182 5.984 545 HG22 VAL 66 HG22 VAL 66 -0.040 -6.897 7.138 546 HG23 VAL 66 HG23 VAL 66 -1.329 -8.052 7.485 547 H LYS 67 H LYS 67 2.234 -11.788 7.001 548 HA LYS 67 HA LYS 67 2.900 -12.697 9.763 549 HB2 LYS 67 HB2 LYS 67 3.448 -14.248 7.190 550 HB3 LYS 67 HB3 LYS 67 3.600 -14.833 8.845 551 HG2 LYS 67 HG2 LYS 67 1.168 -14.820 9.102 552 HG3 LYS 67 HG3 LYS 67 0.983 -14.102 7.495 553 HD2 LYS 67 HD2 LYS 67 2.050 -16.155 6.514 554 HD3 LYS 67 HD3 LYS 67 2.080 -16.873 8.130 555 HE2 LYS 67 HE2 LYS 67 -0.398 -16.706 8.226 556 HE3 LYS 67 HE3 LYS 67 -0.403 -16.025 6.596 557 HZ1 LYS 67 HZ1 LYS 67 -0.890 -18.369 6.567 558 HZ2 LYS 67 HZ2 LYS 67 0.562 -18.723 7.354 559 HZ3 LYS 67 HZ3 LYS 67 0.585 -18.078 5.790 560 H LEU 68 H LEU 68 5.321 -13.203 9.976 561 HA LEU 68 HA LEU 68 7.019 -11.482 8.301 562 HB2 LEU 68 HB2 LEU 68 7.687 -13.248 10.691 563 HB3 LEU 68 HB3 LEU 68 8.869 -12.274 9.826 564 HG LEU 68 HG LEU 68 6.548 -11.277 11.530 565 HD11 LEU 68 HD11 LEU 68 9.543 -10.874 11.817 566 HD12 LEU 68 HD12 LEU 68 8.533 -11.947 12.792 567 HD13 LEU 68 HD13 LEU 68 8.293 -10.205 12.871 568 HD21 LEU 68 HD21 LEU 68 8.395 -9.601 9.792 569 HD22 LEU 68 HD22 LEU 68 7.242 -8.973 10.976 570 HD23 LEU 68 HD23 LEU 68 6.661 -9.839 9.558 571 H VAL 69 H VAL 69 9.336 -12.751 7.859 572 HA VAL 69 HA VAL 69 8.665 -14.775 5.853 573 HB VAL 69 HB VAL 69 11.428 -13.618 6.474 574 HG11 VAL 69 HG11 VAL 69 10.368 -14.861 3.895 575 HG12 VAL 69 HG12 VAL 69 11.517 -15.612 5.003 576 HG13 VAL 69 HG13 VAL 69 11.976 -14.160 4.114 577 HG21 VAL 69 HG21 VAL 69 9.354 -12.525 4.542 578 HG22 VAL 69 HG22 VAL 69 11.010 -11.936 4.718 579 HG23 VAL 69 HG23 VAL 69 9.869 -11.770 6.053 580 H LEU 70 H LEU 70 8.315 -15.628 8.565 581 HA LEU 70 HA LEU 70 8.532 -17.422 9.921 582 HB2 LEU 70 HB2 LEU 70 9.691 -18.707 7.424 583 HB3 LEU 70 HB3 LEU 70 9.031 -19.574 8.804 584 HG LEU 70 HG LEU 70 7.438 -17.772 6.930 585 HD11 LEU 70 HD11 LEU 70 7.475 -20.803 7.110 586 HD12 LEU 70 HD12 LEU 70 8.145 -19.816 5.805 587 HD13 LEU 70 HD13 LEU 70 6.408 -19.830 6.090 588 HD21 LEU 70 HD21 LEU 70 6.498 -17.742 9.190 589 HD22 LEU 70 HD22 LEU 70 6.458 -19.506 9.227 590 HD23 LEU 70 HD23 LEU 70 5.436 -18.621 8.090 591 H GLU 71 H GLU 71 10.803 -15.571 9.947 592 HA GLU 71 HA GLU 71 13.320 -16.793 9.878 593 HB2 GLU 71 HB2 GLU 71 12.505 -14.198 10.176 594 HB3 GLU 71 HB3 GLU 71 12.963 -14.532 11.834 595 HG2 GLU 71 HG2 GLU 71 14.740 -14.674 9.375 596 HG3 GLU 71 HG3 GLU 71 14.818 -13.490 10.676 597 H HIS 72 H HIS 72 14.596 -17.814 11.400 598 HA HIS 72 HA HIS 72 12.947 -19.432 13.193 599 HB2 HIS 72 HB2 HIS 72 15.806 -19.916 12.271 600 HB3 HIS 72 HB3 HIS 72 14.707 -21.096 12.984 601 HD1 HIS 72 HD1 HIS 72 15.559 -19.425 9.770 602 HD2 HIS 72 HD2 HIS 72 12.660 -22.027 11.213 603 HE1 HIS 72 HE1 HIS 72 14.392 -20.319 7.743 604 HE2 HIS 72 HE2 HIS 72 12.500 -21.688 8.656 605 H HIS 73 H HIS 73 14.953 -16.765 13.741 606 HA HIS 73 HA HIS 73 16.387 -17.641 16.079 607 HB2 HIS 73 HB2 HIS 73 17.079 -15.697 14.636 608 HB3 HIS 73 HB3 HIS 73 15.714 -14.784 15.265 609 HD1 HIS 73 HD1 HIS 73 16.400 -13.232 17.068 610 HD2 HIS 73 HD2 HIS 73 18.794 -16.628 16.979 611 HE1 HIS 73 HE1 HIS 73 18.126 -12.886 18.856 612 HE2 HIS 73 HE2 HIS 73 19.694 -14.833 18.604 613 H HIS 74 H HIS 74 15.269 -18.361 17.801 614 HA HIS 74 HA HIS 74 13.868 -18.589 19.542 615 HB2 HIS 74 HB2 HIS 74 13.791 -15.555 19.346 616 HB3 HIS 74 HB3 HIS 74 12.948 -16.427 20.623 617 HD1 HIS 74 HD1 HIS 74 14.325 -17.363 22.529 618 HD2 HIS 74 HD2 HIS 74 16.654 -15.690 19.526 619 HE1 HIS 74 HE1 HIS 74 16.645 -17.262 23.463 620 HE2 HIS 74 HE2 HIS 74 18.036 -16.218 21.647 621 H HIS 75 H HIS 75 12.799 -18.708 16.791 622 HA HIS 75 HA HIS 75 10.055 -17.820 16.815 623 HB2 HIS 75 HB2 HIS 75 11.477 -18.160 14.750 624 HB3 HIS 75 HB3 HIS 75 11.410 -19.892 15.023 625 HD1 HIS 75 HD1 HIS 75 9.791 -17.252 13.222 626 HD2 HIS 75 HD2 HIS 75 8.579 -20.874 14.850 627 HE1 HIS 75 HE1 HIS 75 7.657 -17.835 12.040 628 HE2 HIS 75 HE2 HIS 75 6.848 -19.913 13.196 629 H HIS 76 H HIS 76 8.643 -18.735 18.224 630 HA HIS 76 HA HIS 76 8.939 -21.213 19.529 631 HB2 HIS 76 HB2 HIS 76 6.540 -20.852 20.276 632 HB3 HIS 76 HB3 HIS 76 7.632 -19.514 20.602 633 HD1 HIS 76 HD1 HIS 76 6.983 -17.276 19.721 634 HD2 HIS 76 HD2 HIS 76 4.721 -20.316 18.028 635 HE1 HIS 76 HE1 HIS 76 5.213 -16.127 18.387 636 HE2 HIS 76 HE2 HIS 76 4.041 -17.971 17.183 637 H HIS 77 H HIS 77 7.564 -23.110 19.473 638 HA HIS 77 HA HIS 77 7.529 -24.389 16.974 639 HB2 HIS 77 HB2 HIS 77 7.748 -25.491 19.234 640 HB3 HIS 77 HB3 HIS 77 6.030 -25.223 19.500 641 HD1 HIS 77 HD1 HIS 77 8.435 -27.326 17.529 642 HD2 HIS 77 HD2 HIS 77 4.335 -27.053 18.175 643 HE1 HIS 77 HE1 HIS 77 7.456 -29.410 16.529 644 HE2 HIS 77 HE2 HIS 77 4.965 -29.138 16.776 645 H1 MET 1 H MET 1 4.814 -17.220 -6.395 646 HA MET 1 HA MET 1 3.590 -18.685 -7.912 647 HB2 MET 1 HB2 MET 1 3.968 -20.741 -6.645 648 HB3 MET 1 HB3 MET 1 2.972 -20.156 -5.318 649 HG2 MET 1 HG2 MET 1 1.809 -21.845 -6.669 650 HG3 MET 1 HG3 MET 1 0.978 -20.287 -6.716 651 HE1 MET 1 HE1 MET 1 0.266 -21.695 -10.301 652 HE2 MET 1 HE2 MET 1 -0.445 -21.046 -8.823 653 HE3 MET 1 HE3 MET 1 0.347 -22.624 -8.806 654 H LYS 2 H LYS 2 2.559 -16.717 -8.268 655 HA LYS 2 HA LYS 2 0.838 -15.265 -8.453 656 HB2 LYS 2 HB2 LYS 2 -0.307 -17.516 -8.873 657 HB3 LYS 2 HB3 LYS 2 -0.906 -17.443 -7.219 658 HG2 LYS 2 HG2 LYS 2 -2.093 -15.305 -7.791 659 HG3 LYS 2 HG3 LYS 2 -1.549 -15.478 -9.461 660 HD2 LYS 2 HD2 LYS 2 -3.375 -17.405 -7.959 661 HD3 LYS 2 HD3 LYS 2 -3.879 -16.243 -9.189 662 HE2 LYS 2 HE2 LYS 2 -2.491 -17.439 -10.867 663 HE3 LYS 2 HE3 LYS 2 -2.029 -18.615 -9.634 664 HZ1 LYS 2 HZ1 LYS 2 -3.813 -19.440 -10.999 665 HZ2 LYS 2 HZ2 LYS 2 -4.784 -18.113 -10.609 666 HZ3 LYS 2 HZ3 LYS 2 -4.353 -19.229 -9.412 667 H MET 3 H MET 3 2.393 -14.866 -6.202 668 HA MET 3 HA MET 3 0.986 -14.550 -3.756 669 HB2 MET 3 HB2 MET 3 3.577 -13.306 -4.773 670 HB3 MET 3 HB3 MET 3 2.976 -13.065 -3.134 671 HG2 MET 3 HG2 MET 3 3.712 -15.739 -4.352 672 HG3 MET 3 HG3 MET 3 4.696 -14.801 -3.220 673 HE1 MET 3 HE1 MET 3 4.891 -16.798 -1.499 674 HE2 MET 3 HE2 MET 3 4.001 -17.825 -2.625 675 HE3 MET 3 HE3 MET 3 3.513 -17.740 -0.932 676 H LEU 4 H LEU 4 0.510 -12.581 -2.614 677 HA LEU 4 HA LEU 4 -0.905 -10.553 -3.990 678 HB2 LEU 4 HB2 LEU 4 0.164 -10.660 -1.147 679 HB3 LEU 4 HB3 LEU 4 -0.775 -9.307 -1.743 680 HG LEU 4 HG LEU 4 -2.258 -10.689 -0.474 681 HD11 LEU 4 HD11 LEU 4 -2.821 -11.201 -3.403 682 HD12 LEU 4 HD12 LEU 4 -3.247 -9.754 -2.486 683 HD13 LEU 4 HD13 LEU 4 -3.991 -11.299 -2.081 684 HD21 LEU 4 HD21 LEU 4 -2.666 -13.074 -0.897 685 HD22 LEU 4 HD22 LEU 4 -0.993 -12.775 -0.435 686 HD23 LEU 4 HD23 LEU 4 -1.396 -13.084 -2.126 687 H LYS 5 H LYS 5 2.471 -10.893 -3.206 688 HA LYS 5 HA LYS 5 3.326 -8.216 -3.770 689 HB2 LYS 5 HB2 LYS 5 4.773 -9.715 -2.518 690 HB3 LYS 5 HB3 LYS 5 4.771 -10.886 -3.834 691 HG2 LYS 5 HG2 LYS 5 6.216 -9.607 -5.175 692 HG3 LYS 5 HG3 LYS 5 5.885 -8.115 -4.297 693 HD2 LYS 5 HD2 LYS 5 7.434 -10.486 -3.176 694 HD3 LYS 5 HD3 LYS 5 8.165 -9.024 -3.854 695 HE2 LYS 5 HE2 LYS 5 7.004 -7.670 -2.111 696 HE3 LYS 5 HE3 LYS 5 6.358 -9.159 -1.414 697 HZ1 LYS 5 HZ1 LYS 5 8.594 -9.886 -0.969 698 HZ2 LYS 5 HZ2 LYS 5 8.312 -8.374 -0.262 699 HZ3 LYS 5 HZ3 LYS 5 9.226 -8.487 -1.681 700 H GLU 6 H GLU 6 3.013 -11.175 -5.727 701 HA GLU 6 HA GLU 6 4.284 -10.205 -8.062 702 HB2 GLU 6 HB2 GLU 6 2.371 -12.533 -7.651 703 HB3 GLU 6 HB3 GLU 6 3.199 -12.212 -9.178 704 HG2 GLU 6 HG2 GLU 6 5.377 -12.498 -8.077 705 HG3 GLU 6 HG3 GLU 6 4.571 -12.770 -6.529 706 H LYS 7 H LYS 7 0.820 -10.433 -7.158 707 HA LYS 7 HA LYS 7 -0.119 -9.195 -9.574 708 HB2 LYS 7 HB2 LYS 7 -2.333 -9.115 -8.489 709 HB3 LYS 7 HB3 LYS 7 -1.589 -10.692 -8.321 710 HG2 LYS 7 HG2 LYS 7 -2.463 -10.440 -6.199 711 HG3 LYS 7 HG3 LYS 7 -0.855 -9.776 -5.948 712 HD2 LYS 7 HD2 LYS 7 -2.303 -8.265 -4.848 713 HD3 LYS 7 HD3 LYS 7 -1.901 -7.457 -6.358 714 HE2 LYS 7 HE2 LYS 7 -4.481 -8.985 -5.842 715 HE3 LYS 7 HE3 LYS 7 -4.306 -7.239 -5.715 716 HZ1 LYS 7 HZ1 LYS 7 -3.610 -7.313 -8.119 717 HZ2 LYS 7 HZ2 LYS 7 -5.233 -7.654 -7.803 718 HZ3 LYS 7 HZ3 LYS 7 -4.157 -8.911 -8.153 719 H ALA 8 H ALA 8 0.999 -7.917 -6.479 720 HA ALA 8 HA ALA 8 0.075 -5.238 -6.699 721 HB1 ALA 8 HB1 ALA 8 2.633 -6.222 -5.369 722 HB2 ALA 8 HB2 ALA 8 1.038 -6.150 -4.613 723 HB3 ALA 8 HB3 ALA 8 1.849 -4.659 -5.093 724 H GLY 9 H GLY 9 3.221 -6.666 -7.653 725 HA2 GLY 9 HA2 GLY 9 4.305 -4.404 -8.975 726 HA3 GLY 9 HA3 GLY 9 4.828 -6.067 -9.163 727 H ALA 10 H ALA 10 2.302 -7.087 -10.139 728 HA ALA 10 HA ALA 10 2.414 -6.580 -12.918 729 HB1 ALA 10 HB1 ALA 10 1.523 -8.682 -11.982 730 HB2 ALA 10 HB2 ALA 10 0.353 -7.927 -13.067 731 HB3 ALA 10 HB3 ALA 10 0.141 -7.812 -11.316 732 H LEU 11 H LEU 11 0.036 -5.528 -10.449 733 HA LEU 11 HA LEU 11 -1.545 -3.839 -12.078 734 HB2 LEU 11 HB2 LEU 11 -1.054 -3.826 -9.078 735 HB3 LEU 11 HB3 LEU 11 -2.224 -2.770 -9.856 736 HG LEU 11 HG LEU 11 -2.343 -5.811 -9.932 737 HD11 LEU 11 HD11 LEU 11 -4.188 -5.646 -8.339 738 HD12 LEU 11 HD12 LEU 11 -3.951 -3.899 -8.218 739 HD13 LEU 11 HD13 LEU 11 -2.693 -5.005 -7.659 740 HD21 LEU 11 HD21 LEU 11 -4.614 -5.508 -10.821 741 HD22 LEU 11 HD22 LEU 11 -3.410 -4.789 -11.887 742 HD23 LEU 11 HD23 LEU 11 -4.388 -3.755 -10.839 743 H ALA 12 H ALA 12 1.449 -3.251 -10.283 744 HA ALA 12 HA ALA 12 1.566 -0.468 -10.246 745 HB1 ALA 12 HB1 ALA 12 3.165 -1.947 -9.079 746 HB2 ALA 12 HB2 ALA 12 3.990 -0.702 -10.024 747 HB3 ALA 12 HB3 ALA 12 3.906 -2.366 -10.624 748 H GLY 13 H GLY 13 2.279 -2.663 -12.923 749 HA2 GLY 13 HA2 GLY 13 3.353 -0.881 -14.806 750 HA3 GLY 13 HA3 GLY 13 2.423 -2.320 -15.185 751 H GLN 14 H GLN 14 -0.109 -1.795 -14.360 752 HA GLN 14 HA GLN 14 -1.019 0.003 -16.423 753 HB2 GLN 14 HB2 GLN 14 -3.308 -0.724 -15.814 754 HB3 GLN 14 HB3 GLN 14 -2.225 -2.086 -16.073 755 HG2 GLN 14 HG2 GLN 14 -1.994 -2.332 -13.606 756 HG3 GLN 14 HG3 GLN 14 -3.136 -1.009 -13.387 757 HE21 GLN 14 HE21 GLN 14 -2.768 -4.328 -14.413 758 HE22 GLN 14 HE22 GLN 14 -4.441 -4.740 -14.351 759 H ILE 15 H ILE 15 -0.821 0.236 -12.883 760 HA ILE 15 HA ILE 15 -2.405 2.590 -12.504 761 HB ILE 15 HB ILE 15 -0.024 1.683 -10.799 762 HG12 ILE 15 HG12 ILE 15 -1.706 -0.127 -10.948 763 HG13 ILE 15 HG13 ILE 15 -1.645 0.533 -9.324 764 HG21 ILE 15 HG21 ILE 15 -0.650 4.007 -10.317 765 HG22 ILE 15 HG22 ILE 15 -1.083 2.971 -8.957 766 HG23 ILE 15 HG23 ILE 15 -2.333 3.532 -10.070 767 HD11 ILE 15 HD11 ILE 15 -3.903 0.049 -9.984 768 HD12 ILE 15 HD12 ILE 15 -3.756 1.079 -11.407 769 HD13 ILE 15 HD13 ILE 15 -3.705 1.790 -9.791 770 H TRP 16 H TRP 16 1.097 2.096 -13.012 771 HA TRP 16 HA TRP 16 1.897 4.791 -13.198 772 HB2 TRP 16 HB2 TRP 16 3.463 2.820 -12.988 773 HB3 TRP 16 HB3 TRP 16 3.134 2.417 -14.671 774 HD1 TRP 16 HD1 TRP 16 5.070 4.897 -12.506 775 HE1 TRP 16 HE1 TRP 16 6.685 6.247 -13.980 776 HE3 TRP 16 HE3 TRP 16 3.496 3.321 -17.107 777 HZ2 TRP 16 HZ2 TRP 16 7.218 6.617 -16.715 778 HZ3 TRP 16 HZ3 TRP 16 4.605 4.229 -19.102 779 HH2 TRP 16 HH2 TRP 16 6.417 5.844 -18.915 780 H GLU 17 H GLU 17 0.802 2.520 -15.766 781 HA GLU 17 HA GLU 17 1.096 4.271 -17.966 782 HB2 GLU 17 HB2 GLU 17 -0.627 1.802 -17.584 783 HB3 GLU 17 HB3 GLU 17 -0.609 2.691 -19.104 784 HG2 GLU 17 HG2 GLU 17 1.784 1.358 -17.799 785 HG3 GLU 17 HG3 GLU 17 0.872 0.727 -19.169 786 H ALA 18 H ALA 18 -1.542 3.913 -15.662 787 HA ALA 18 HA ALA 18 -3.483 5.537 -16.958 788 HB1 ALA 18 HB1 ALA 18 -4.510 5.741 -14.723 789 HB2 ALA 18 HB2 ALA 18 -3.047 5.081 -13.984 790 HB3 ALA 18 HB3 ALA 18 -4.028 4.074 -15.051 791 H LEU 19 H LEU 19 -0.833 6.289 -14.701 792 HA LEU 19 HA LEU 19 -1.246 9.159 -14.723 793 HB2 LEU 19 HB2 LEU 19 0.991 7.395 -13.675 794 HB3 LEU 19 HB3 LEU 19 1.002 9.146 -13.512 795 HG LEU 19 HG LEU 19 -1.096 7.300 -12.315 796 HD11 LEU 19 HD11 LEU 19 1.050 6.985 -11.201 797 HD12 LEU 19 HD12 LEU 19 -0.067 7.837 -10.140 798 HD13 LEU 19 HD13 LEU 19 1.219 8.728 -10.959 799 HD21 LEU 19 HD21 LEU 19 -1.868 9.313 -11.112 800 HD22 LEU 19 HD22 LEU 19 -2.025 9.492 -12.855 801 HD23 LEU 19 HD23 LEU 19 -0.702 10.299 -12.003 802 H ASN 20 H ASN 20 0.307 6.969 -16.862 803 HA ASN 20 HA ASN 20 2.462 8.612 -17.774 804 HB2 ASN 20 HB2 ASN 20 2.493 6.154 -18.030 805 HB3 ASN 20 HB3 ASN 20 1.111 6.230 -19.113 806 HD21 ASN 20 HD21 ASN 20 2.208 5.300 -20.826 807 HD22 ASN 20 HD22 ASN 20 3.479 6.098 -21.677 808 H GLY 21 H GLY 21 2.402 10.281 -19.150 809 HA2 GLY 21 HA2 GLY 21 1.701 11.629 -20.934 810 HA3 GLY 21 HA3 GLY 21 0.217 10.701 -21.067 811 H THR 22 H THR 22 0.513 11.388 -17.829 812 HA THR 22 HA THR 22 -0.907 14.002 -18.012 813 HB THR 22 HB THR 22 -2.356 13.456 -16.173 814 HG1 THR 22 HG1 THR 22 -0.885 11.035 -15.871 815 HG21 THR 22 HG21 THR 22 -3.625 11.489 -16.943 816 HG22 THR 22 HG22 THR 22 -2.259 10.995 -17.949 817 HG23 THR 22 HG23 THR 22 -3.123 12.492 -18.308 818 H GLU 23 H GLU 23 -0.735 15.340 -16.053 819 HA GLU 23 HA GLU 23 1.873 15.046 -14.669 820 HB2 GLU 23 HB2 GLU 23 1.766 17.460 -14.250 821 HB3 GLU 23 HB3 GLU 23 1.609 17.124 -15.971 822 HG2 GLU 23 HG2 GLU 23 -0.792 17.532 -15.877 823 HG3 GLU 23 HG3 GLU 23 -0.719 17.736 -14.126 824 H GLY 24 H GLY 24 -1.103 14.037 -14.053 825 HA2 GLY 24 HA2 GLY 24 -0.925 13.461 -11.430 826 HA3 GLY 24 HA3 GLY 24 -1.530 15.107 -11.371 827 H LEU 25 H LEU 25 -2.525 12.051 -11.052 828 HA LEU 25 HA LEU 25 -5.323 12.781 -11.638 829 HB2 LEU 25 HB2 LEU 25 -4.055 10.028 -11.975 830 HB3 LEU 25 HB3 LEU 25 -5.784 10.328 -12.030 831 HG LEU 25 HG LEU 25 -3.743 11.379 -14.036 832 HD11 LEU 25 HD11 LEU 25 -4.051 8.971 -14.257 833 HD12 LEU 25 HD12 LEU 25 -4.779 9.812 -15.622 834 HD13 LEU 25 HD13 LEU 25 -5.806 9.170 -14.334 835 HD21 LEU 25 HD21 LEU 25 -6.771 11.640 -14.054 836 HD22 LEU 25 HD22 LEU 25 -5.684 12.131 -15.358 837 HD23 LEU 25 HD23 LEU 25 -5.609 12.946 -13.799 838 H THR 26 H THR 26 -6.853 11.853 -10.082 839 HA THR 26 HA THR 26 -5.786 11.056 -7.476 840 HB THR 26 HB THR 26 -8.060 10.939 -6.668 841 HG1 THR 26 HG1 THR 26 -9.831 11.236 -8.267 842 HG21 THR 26 HG21 THR 26 -7.241 13.250 -7.012 843 HG22 THR 26 HG22 THR 26 -8.986 13.151 -7.259 844 HG23 THR 26 HG23 THR 26 -7.905 13.246 -8.651 845 H GLN 27 H GLN 27 -6.716 9.033 -6.418 846 HA GLN 27 HA GLN 27 -6.048 6.659 -7.723 847 HB2 GLN 27 HB2 GLN 27 -7.185 5.498 -5.845 848 HB3 GLN 27 HB3 GLN 27 -6.147 6.807 -5.300 849 HG2 GLN 27 HG2 GLN 27 -8.154 8.243 -4.987 850 HG3 GLN 27 HG3 GLN 27 -9.178 6.892 -5.472 851 HE21 GLN 27 HE21 GLN 27 -9.352 5.086 -4.055 852 HE22 GLN 27 HE22 GLN 27 -8.917 5.207 -2.390 853 H LYS 28 H LYS 28 -9.153 8.285 -7.516 854 HA LYS 28 HA LYS 28 -10.841 6.256 -8.567 855 HB2 LYS 28 HB2 LYS 28 -11.217 9.281 -8.491 856 HB3 LYS 28 HB3 LYS 28 -12.502 8.109 -8.806 857 HG2 LYS 28 HG2 LYS 28 -12.376 7.226 -6.579 858 HG3 LYS 28 HG3 LYS 28 -10.868 8.087 -6.248 859 HD2 LYS 28 HD2 LYS 28 -12.103 10.250 -6.408 860 HD3 LYS 28 HD3 LYS 28 -13.608 9.356 -6.660 861 HE2 LYS 28 HE2 LYS 28 -13.464 8.386 -4.432 862 HE3 LYS 28 HE3 LYS 28 -11.854 9.069 -4.187 863 HZ1 LYS 28 HZ1 LYS 28 -12.801 11.270 -4.249 864 HZ2 LYS 28 HZ2 LYS 28 -13.582 10.341 -3.071 865 HZ3 LYS 28 HZ3 LYS 28 -14.343 10.645 -4.545 866 H GLN 29 H GLN 29 -9.299 9.094 -10.160 867 HA GLN 29 HA GLN 29 -10.255 8.611 -12.787 868 HB2 GLN 29 HB2 GLN 29 -7.928 10.213 -11.709 869 HB3 GLN 29 HB3 GLN 29 -8.064 9.967 -13.443 870 HG2 GLN 29 HG2 GLN 29 -9.036 12.090 -12.934 871 HG3 GLN 29 HG3 GLN 29 -10.334 10.990 -13.386 872 HE21 GLN 29 HE21 GLN 29 -8.971 12.905 -10.853 873 HE22 GLN 29 HE22 GLN 29 -10.252 12.709 -9.726 874 H ILE 30 H ILE 30 -7.370 7.410 -11.124 875 HA ILE 30 HA ILE 30 -6.223 5.990 -13.300 876 HB ILE 30 HB ILE 30 -5.986 5.647 -10.291 877 HG12 ILE 30 HG12 ILE 30 -4.163 6.832 -12.430 878 HG13 ILE 30 HG13 ILE 30 -4.980 7.695 -11.130 879 HG21 ILE 30 HG21 ILE 30 -5.580 3.420 -11.260 880 HG22 ILE 30 HG22 ILE 30 -4.090 4.110 -10.620 881 HG23 ILE 30 HG23 ILE 30 -4.381 4.103 -12.363 882 HD11 ILE 30 HD11 ILE 30 -2.643 7.480 -10.667 883 HD12 ILE 30 HD12 ILE 30 -2.716 5.730 -10.842 884 HD13 ILE 30 HD13 ILE 30 -3.555 6.525 -9.505 885 H LYS 31 H LYS 31 -8.541 4.950 -10.763 886 HA LYS 31 HA LYS 31 -8.821 2.251 -11.527 887 HB2 LYS 31 HB2 LYS 31 -10.787 4.131 -10.172 888 HB3 LYS 31 HB3 LYS 31 -11.122 2.417 -10.413 889 HG2 LYS 31 HG2 LYS 31 -9.194 1.819 -9.011 890 HG3 LYS 31 HG3 LYS 31 -8.800 3.528 -8.801 891 HD2 LYS 31 HD2 LYS 31 -9.992 2.679 -6.829 892 HD3 LYS 31 HD3 LYS 31 -10.964 3.896 -7.660 893 HE2 LYS 31 HE2 LYS 31 -12.237 2.020 -8.770 894 HE3 LYS 31 HE3 LYS 31 -11.336 0.875 -7.775 895 HZ1 LYS 31 HZ1 LYS 31 -12.242 2.030 -5.815 896 HZ2 LYS 31 HZ2 LYS 31 -13.429 1.307 -6.778 897 HZ3 LYS 31 HZ3 LYS 31 -13.194 2.983 -6.836 898 H LYS 32 H LYS 32 -10.258 5.150 -12.935 899 HA LYS 32 HA LYS 32 -12.165 3.830 -14.616 900 HB2 LYS 32 HB2 LYS 32 -10.835 6.540 -15.030 901 HB3 LYS 32 HB3 LYS 32 -12.290 5.966 -15.840 902 HG2 LYS 32 HG2 LYS 32 -11.969 6.672 -12.909 903 HG3 LYS 32 HG3 LYS 32 -12.913 7.535 -14.121 904 HD2 LYS 32 HD2 LYS 32 -13.500 4.773 -12.979 905 HD3 LYS 32 HD3 LYS 32 -14.389 6.261 -12.651 906 HE2 LYS 32 HE2 LYS 32 -14.249 4.779 -15.299 907 HE3 LYS 32 HE3 LYS 32 -15.642 4.896 -14.224 908 HZ1 LYS 32 HZ1 LYS 32 -15.834 6.405 -16.089 909 HZ2 LYS 32 HZ2 LYS 32 -14.384 7.163 -15.677 910 HZ3 LYS 32 HZ3 LYS 32 -15.716 7.273 -14.647 911 H ALA 33 H ALA 33 -8.826 4.998 -15.175 912 HA ALA 33 HA ALA 33 -8.672 4.237 -17.934 913 HB1 ALA 33 HB1 ALA 33 -6.432 4.840 -15.970 914 HB2 ALA 33 HB2 ALA 33 -7.276 6.021 -16.972 915 HB3 ALA 33 HB3 ALA 33 -6.277 4.781 -17.731 916 H THR 34 H THR 34 -7.956 2.563 -14.944 917 HA THR 34 HA THR 34 -6.623 0.286 -16.245 918 HB THR 34 HB THR 34 -6.220 -0.522 -13.927 919 HG1 THR 34 HG1 THR 34 -6.961 1.702 -12.572 920 HG21 THR 34 HG21 THR 34 -4.709 1.268 -13.160 921 HG22 THR 34 HG22 THR 34 -5.477 2.410 -14.265 922 HG23 THR 34 HG23 THR 34 -4.566 1.037 -14.905 923 H LYS 35 H LYS 35 -9.721 1.178 -14.994 924 HA LYS 35 HA LYS 35 -11.725 0.206 -14.749 925 HB2 LYS 35 HB2 LYS 35 -10.555 -2.036 -16.448 926 HB3 LYS 35 HB3 LYS 35 -12.254 -1.933 -15.989 927 HG2 LYS 35 HG2 LYS 35 -10.748 0.103 -17.673 928 HG3 LYS 35 HG3 LYS 35 -11.877 -1.112 -18.284 929 HD2 LYS 35 HD2 LYS 35 -13.725 -0.050 -17.038 930 HD3 LYS 35 HD3 LYS 35 -12.606 1.134 -16.351 931 HE2 LYS 35 HE2 LYS 35 -13.862 2.122 -18.200 932 HE3 LYS 35 HE3 LYS 35 -12.154 2.008 -18.626 933 HZ1 LYS 35 HZ1 LYS 35 -12.667 -0.002 -19.891 934 HZ2 LYS 35 HZ2 LYS 35 -13.545 1.327 -20.457 935 HZ3 LYS 35 HZ3 LYS 35 -14.307 0.155 -19.504 936 H LEU 36 H LEU 36 -9.578 -0.210 -12.795 937 HA LEU 36 HA LEU 36 -10.086 -2.709 -11.446 938 HB2 LEU 36 HB2 LEU 36 -8.867 -0.115 -10.418 939 HB3 LEU 36 HB3 LEU 36 -9.019 -1.567 -9.437 940 HG LEU 36 HG LEU 36 -7.324 -1.270 -11.951 941 HD11 LEU 36 HD11 LEU 36 -5.409 -1.539 -10.446 942 HD12 LEU 36 HD12 LEU 36 -6.490 -1.591 -9.051 943 HD13 LEU 36 HD13 LEU 36 -6.368 -0.122 -10.024 944 HD21 LEU 36 HD21 LEU 36 -6.502 -3.552 -11.498 945 HD22 LEU 36 HD22 LEU 36 -8.227 -3.543 -11.845 946 HD23 LEU 36 HD23 LEU 36 -7.667 -3.721 -10.180 947 H LYS 37 H LYS 37 -11.719 -3.217 -10.121 948 HA LYS 37 HA LYS 37 -13.984 -1.426 -9.806 949 HB2 LYS 37 HB2 LYS 37 -13.645 -4.237 -8.661 950 HB3 LYS 37 HB3 LYS 37 -15.157 -3.383 -8.960 951 HG2 LYS 37 HG2 LYS 37 -13.229 -4.397 -11.082 952 HG3 LYS 37 HG3 LYS 37 -14.754 -5.156 -10.618 953 HD2 LYS 37 HD2 LYS 37 -15.997 -3.172 -11.432 954 HD3 LYS 37 HD3 LYS 37 -14.473 -2.391 -11.876 955 HE2 LYS 37 HE2 LYS 37 -15.598 -3.402 -13.837 956 HE3 LYS 37 HE3 LYS 37 -14.031 -4.154 -13.532 957 HZ1 LYS 37 HZ1 LYS 37 -16.655 -5.275 -12.695 958 HZ2 LYS 37 HZ2 LYS 37 -15.148 -6.007 -12.485 959 HZ3 LYS 37 HZ3 LYS 37 -15.766 -5.780 -14.040 960 H ALA 38 H ALA 38 -11.641 -3.063 -7.706 961 HA ALA 38 HA ALA 38 -12.611 -1.688 -5.286 962 HB1 ALA 38 HB1 ALA 38 -10.583 -3.939 -5.574 963 HB2 ALA 38 HB2 ALA 38 -12.289 -4.131 -5.165 964 HB3 ALA 38 HB3 ALA 38 -11.208 -3.290 -4.052 965 H ASP 39 H ASP 39 -11.431 -0.229 -4.161 966 HA ASP 39 HA ASP 39 -9.094 1.082 -5.162 967 HB2 ASP 39 HB2 ASP 39 -10.294 1.147 -2.356 968 HB3 ASP 39 HB3 ASP 39 -9.132 2.305 -3.008 969 H LYS 40 H LYS 40 -9.646 -1.624 -3.086 970 HA LYS 40 HA LYS 40 -7.323 -2.004 -1.643 971 HB2 LYS 40 HB2 LYS 40 -9.059 -4.088 -3.038 972 HB3 LYS 40 HB3 LYS 40 -7.902 -4.452 -1.759 973 HG2 LYS 40 HG2 LYS 40 -10.227 -2.543 -1.367 974 HG3 LYS 40 HG3 LYS 40 -10.364 -4.281 -1.079 975 HD2 LYS 40 HD2 LYS 40 -8.372 -2.438 0.310 976 HD3 LYS 40 HD3 LYS 40 -9.920 -2.940 0.997 977 HE2 LYS 40 HE2 LYS 40 -7.609 -4.783 0.266 978 HE3 LYS 40 HE3 LYS 40 -8.079 -4.300 1.898 979 HZ1 LYS 40 HZ1 LYS 40 -10.226 -5.390 1.540 980 HZ2 LYS 40 HZ2 LYS 40 -8.942 -6.476 1.399 981 HZ3 LYS 40 HZ3 LYS 40 -9.720 -5.909 0.009 982 H ASP 41 H ASP 41 -7.922 -2.891 -5.046 983 HA ASP 41 HA ASP 41 -5.400 -4.161 -5.543 984 HB2 ASP 41 HB2 ASP 41 -7.481 -2.973 -7.425 985 HB3 ASP 41 HB3 ASP 41 -6.065 -3.864 -7.978 986 H PHE 42 H PHE 42 -6.627 -0.857 -5.920 987 HA PHE 42 HA PHE 42 -4.487 0.291 -7.338 988 HB2 PHE 42 HB2 PHE 42 -6.583 1.523 -7.121 989 HB3 PHE 42 HB3 PHE 42 -6.419 1.592 -5.367 990 HD1 PHE 42 HD2 PHE 42 -4.864 2.751 -8.546 991 HD2 PHE 42 HD1 PHE 42 -5.178 3.391 -4.327 992 HE1 PHE 42 HE2 PHE 42 -3.587 4.821 -8.755 993 HE2 PHE 42 HE1 PHE 42 -3.878 5.470 -4.559 994 HZ PHE 42 HZ PHE 42 -3.086 6.184 -6.786 995 H PHE 43 H PHE 43 -4.998 0.039 -3.791 996 HA PHE 43 HA PHE 43 -2.830 1.625 -2.950 997 HB2 PHE 43 HB2 PHE 43 -4.175 -0.684 -1.484 998 HB3 PHE 43 HB3 PHE 43 -3.093 0.485 -0.728 999 HD1 PHE 43 HD1 PHE 43 -3.944 3.071 -1.756 1000 HD2 PHE 43 HD2 PHE 43 -6.353 -0.291 -0.654 1001 HE1 PHE 43 HE1 PHE 43 -5.832 4.574 -1.288 1002 HE2 PHE 43 HE2 PHE 43 -8.239 1.216 -0.188 1003 HZ PHE 43 HZ PHE 43 -7.982 3.649 -0.504 1004 H LEU 44 H LEU 44 -2.921 -1.829 -3.731 1005 HA LEU 44 HA LEU 44 -0.231 -2.429 -2.910 1006 HB2 LEU 44 HB2 LEU 44 -2.335 -3.901 -4.498 1007 HB3 LEU 44 HB3 LEU 44 -0.689 -4.502 -4.507 1008 HG LEU 44 HG LEU 44 -0.758 -4.721 -2.023 1009 HD11 LEU 44 HD11 LEU 44 -3.690 -3.988 -2.220 1010 HD12 LEU 44 HD12 LEU 44 -2.421 -3.031 -1.456 1011 HD13 LEU 44 HD13 LEU 44 -2.864 -4.596 -0.782 1012 HD21 LEU 44 HD21 LEU 44 -2.160 -6.725 -1.936 1013 HD22 LEU 44 HD22 LEU 44 -1.245 -6.663 -3.441 1014 HD23 LEU 44 HD23 LEU 44 -2.962 -6.253 -3.438 1015 H GLY 45 H GLY 45 -1.719 -1.483 -6.004 1016 HA2 GLY 45 HA2 GLY 45 0.571 -1.741 -7.682 1017 HA3 GLY 45 HA3 GLY 45 -0.823 -0.716 -7.987 1018 H LEU 46 H LEU 46 -0.829 1.177 -6.162 1019 HA LEU 46 HA LEU 46 1.125 3.058 -6.878 1020 HB2 LEU 46 HB2 LEU 46 -1.093 3.728 -6.078 1021 HB3 LEU 46 HB3 LEU 46 -0.777 3.019 -4.504 1022 HG LEU 46 HG LEU 46 1.046 4.728 -4.147 1023 HD11 LEU 46 HD11 LEU 46 1.593 5.243 -6.462 1024 HD12 LEU 46 HD12 LEU 46 1.171 6.707 -5.582 1025 HD13 LEU 46 HD13 LEU 46 0.009 5.989 -6.700 1026 HD21 LEU 46 HD21 LEU 46 -0.447 6.595 -3.614 1027 HD22 LEU 46 HD22 LEU 46 -1.188 5.057 -3.176 1028 HD23 LEU 46 HD23 LEU 46 -1.711 5.903 -4.634 1029 H GLY 47 H GLY 47 0.950 0.878 -4.105 1030 HA2 GLY 47 HA2 GLY 47 3.006 1.930 -2.468 1031 HA3 GLY 47 HA3 GLY 47 2.467 0.255 -2.481 1032 H TRP 48 H TRP 48 3.085 -0.245 -5.226 1033 HA TRP 48 HA TRP 48 5.895 -0.842 -5.064 1034 HB2 TRP 48 HB2 TRP 48 3.961 -2.262 -6.154 1035 HB3 TRP 48 HB3 TRP 48 4.234 -1.249 -7.569 1036 HD1 TRP 48 HD1 TRP 48 6.682 -1.508 -8.789 1037 HE1 TRP 48 HE1 TRP 48 8.401 -3.418 -8.723 1038 HE3 TRP 48 HE3 TRP 48 4.879 -4.061 -4.757 1039 HZ2 TRP 48 HZ2 TRP 48 8.908 -5.734 -7.172 1040 HZ3 TRP 48 HZ3 TRP 48 6.024 -6.119 -4.040 1041 HH2 TRP 48 HH2 TRP 48 7.996 -6.938 -5.226 1042 H LEU 49 H LEU 49 3.900 1.497 -6.825 1043 HA LEU 49 HA LEU 49 5.872 2.657 -8.477 1044 HB2 LEU 49 HB2 LEU 49 3.271 3.621 -7.302 1045 HB3 LEU 49 HB3 LEU 49 4.312 4.794 -8.071 1046 HG LEU 49 HG LEU 49 4.108 3.717 -10.226 1047 HD11 LEU 49 HD11 LEU 49 2.531 1.542 -8.861 1048 HD12 LEU 49 HD12 LEU 49 4.149 1.396 -9.557 1049 HD13 LEU 49 HD13 LEU 49 2.773 1.721 -10.603 1050 HD21 LEU 49 HD21 LEU 49 1.377 3.870 -8.908 1051 HD22 LEU 49 HD22 LEU 49 1.703 3.949 -10.644 1052 HD23 LEU 49 HD23 LEU 49 2.275 5.233 -9.584 1053 H LEU 50 H LEU 50 5.030 3.304 -5.091 1054 HA LEU 50 HA LEU 50 6.886 5.430 -4.646 1055 HB2 LEU 50 HB2 LEU 50 5.485 3.541 -2.718 1056 HB3 LEU 50 HB3 LEU 50 6.472 4.898 -2.189 1057 HG LEU 50 HG LEU 50 3.922 5.117 -3.847 1058 HD11 LEU 50 HD11 LEU 50 4.369 5.790 -0.919 1059 HD12 LEU 50 HD12 LEU 50 3.425 4.439 -1.555 1060 HD13 LEU 50 HD13 LEU 50 2.893 6.092 -1.845 1061 HD21 LEU 50 HD21 LEU 50 4.117 7.548 -3.489 1062 HD22 LEU 50 HD22 LEU 50 5.480 6.913 -4.402 1063 HD23 LEU 50 HD23 LEU 50 5.678 7.315 -2.692 1064 H ARG 51 H ARG 51 7.171 1.878 -4.342 1065 HA ARG 51 HA ARG 51 9.600 1.917 -2.854 1066 HB2 ARG 51 HB2 ARG 51 9.646 -0.426 -2.988 1067 HB3 ARG 51 HB3 ARG 51 7.951 -0.009 -2.968 1068 HG2 ARG 51 HG2 ARG 51 7.933 -1.699 -4.529 1069 HG3 ARG 51 HG3 ARG 51 8.158 -0.319 -5.593 1070 HD2 ARG 51 HD2 ARG 51 9.627 -2.221 -6.193 1071 HD3 ARG 51 HD3 ARG 51 10.550 -0.778 -5.770 1072 HE ARG 51 HE ARG 51 10.201 -3.160 -4.041 1073 HH11 ARG 51 HH11 ARG 51 12.059 -0.369 -4.911 1074 HH12 ARG 51 HH12 ARG 51 13.387 -0.817 -3.911 1075 HH21 ARG 51 HH21 ARG 51 11.929 -3.678 -2.743 1076 HH22 ARG 51 HH22 ARG 51 13.309 -2.646 -2.700 1077 H GLU 52 H GLU 52 8.972 1.805 -6.329 1078 HA GLU 52 HA GLU 52 11.819 1.653 -7.009 1079 HB2 GLU 52 HB2 GLU 52 9.299 1.917 -8.683 1080 HB3 GLU 52 HB3 GLU 52 10.905 1.951 -9.395 1081 HG2 GLU 52 HG2 GLU 52 11.289 -0.351 -8.472 1082 HG3 GLU 52 HG3 GLU 52 9.615 -0.364 -7.914 1083 H ASP 53 H ASP 53 9.556 4.116 -6.230 1084 HA ASP 53 HA ASP 53 9.271 6.300 -6.548 1085 HB2 ASP 53 HB2 ASP 53 12.291 6.220 -6.830 1086 HB3 ASP 53 HB3 ASP 53 11.395 7.736 -6.902 1087 H LYS 54 H LYS 54 8.451 4.896 -8.541 1088 HA LYS 54 HA LYS 54 9.141 5.910 -11.156 1089 HB2 LYS 54 HB2 LYS 54 6.550 4.567 -10.236 1090 HB3 LYS 54 HB3 LYS 54 7.149 4.680 -11.892 1091 HG2 LYS 54 HG2 LYS 54 8.923 3.124 -11.436 1092 HG3 LYS 54 HG3 LYS 54 8.600 3.186 -9.704 1093 HD2 LYS 54 HD2 LYS 54 7.723 1.105 -10.516 1094 HD3 LYS 54 HD3 LYS 54 6.345 2.141 -10.144 1095 HE2 LYS 54 HE2 LYS 54 6.006 0.927 -12.247 1096 HE3 LYS 54 HE3 LYS 54 6.100 2.663 -12.540 1097 HZ1 LYS 54 HZ1 LYS 54 8.340 2.415 -13.293 1098 HZ2 LYS 54 HZ2 LYS 54 7.369 1.324 -14.137 1099 HZ3 LYS 54 HZ3 LYS 54 8.360 0.778 -12.883 1100 H VAL 55 H VAL 55 7.098 6.811 -8.479 1101 HA VAL 55 HA VAL 55 5.977 9.109 -9.949 1102 HB VAL 55 HB VAL 55 3.772 8.835 -9.011 1103 HG11 VAL 55 HG11 VAL 55 4.152 7.664 -11.115 1104 HG12 VAL 55 HG12 VAL 55 2.979 6.793 -10.128 1105 HG13 VAL 55 HG13 VAL 55 4.639 6.208 -10.243 1106 HG21 VAL 55 HG21 VAL 55 3.099 6.885 -7.607 1107 HG22 VAL 55 HG22 VAL 55 4.292 7.915 -6.814 1108 HG23 VAL 55 HG23 VAL 55 4.792 6.384 -7.533 1109 H VAL 56 H VAL 56 5.131 10.744 -8.551 1110 HA VAL 56 HA VAL 56 5.915 10.733 -5.736 1111 HB VAL 56 HB VAL 56 7.425 12.254 -6.927 1112 HG11 VAL 56 HG11 VAL 56 6.664 14.279 -8.112 1113 HG12 VAL 56 HG12 VAL 56 4.988 13.765 -7.903 1114 HG13 VAL 56 HG13 VAL 56 6.086 12.802 -8.894 1115 HG21 VAL 56 HG21 VAL 56 6.808 12.880 -4.630 1116 HG22 VAL 56 HG22 VAL 56 5.429 13.801 -5.235 1117 HG23 VAL 56 HG23 VAL 56 7.071 14.325 -5.610 1118 H THR 57 H THR 57 4.323 11.402 -4.312 1119 HA THR 57 HA THR 57 1.737 12.233 -5.487 1120 HB THR 57 HB THR 57 1.329 9.935 -5.150 1121 HG1 THR 57 HG1 THR 57 -0.257 9.970 -3.469 1122 HG21 THR 57 HG21 THR 57 1.748 8.684 -3.090 1123 HG22 THR 57 HG22 THR 57 2.474 10.112 -2.358 1124 HG23 THR 57 HG23 THR 57 3.252 9.344 -3.740 1125 H SER 58 H SER 58 0.318 13.256 -4.044 1126 HA SER 58 HA SER 58 1.686 14.859 -1.972 1127 HB2 SER 58 HB2 SER 58 -0.271 15.796 -4.118 1128 HB3 SER 58 HB3 SER 58 0.297 16.798 -2.779 1129 HG SER 58 HG SER 58 2.084 17.134 -3.813 1130 H GLU 59 H GLU 59 0.562 15.248 -0.145 1131 HA GLU 59 HA GLU 59 -2.034 13.906 0.249 1132 HB2 GLU 59 HB2 GLU 59 -0.072 13.455 1.783 1133 HB3 GLU 59 HB3 GLU 59 -0.130 15.135 2.299 1134 HG2 GLU 59 HG2 GLU 59 -2.312 14.806 3.297 1135 HG3 GLU 59 HG3 GLU 59 -2.413 13.170 2.643 1136 H VAL 60 H VAL 60 -3.661 15.207 -0.326 1137 HA VAL 60 HA VAL 60 -3.560 18.134 0.210 1138 HB VAL 60 HB VAL 60 -4.501 16.779 -2.367 1139 HG11 VAL 60 HG11 VAL 60 -4.712 19.733 -1.628 1140 HG12 VAL 60 HG12 VAL 60 -6.063 18.614 -1.827 1141 HG13 VAL 60 HG13 VAL 60 -5.067 19.046 -3.218 1142 HG21 VAL 60 HG21 VAL 60 -2.260 18.778 -1.885 1143 HG22 VAL 60 HG22 VAL 60 -2.732 18.127 -3.459 1144 HG23 VAL 60 HG23 VAL 60 -2.054 17.056 -2.228 1145 H GLU 61 H GLU 61 -5.027 18.468 1.695 1146 HA GLU 61 HA GLU 61 -6.932 18.564 2.929 1147 HB2 GLU 61 HB2 GLU 61 -8.354 18.175 0.268 1148 HB3 GLU 61 HB3 GLU 61 -8.954 19.046 1.680 1149 HG2 GLU 61 HG2 GLU 61 -7.078 20.710 1.344 1150 HG3 GLU 61 HG3 GLU 61 -6.656 19.854 -0.126 1151 H GLY 62 H GLY 62 -5.813 15.904 2.750 1152 HA2 GLY 62 HA2 GLY 62 -6.446 13.885 3.771 1153 HA3 GLY 62 HA3 GLY 62 -8.130 14.244 3.460 1154 H GLU 63 H GLU 63 -7.254 14.809 0.512 1155 HA GLU 63 HA GLU 63 -7.755 12.111 -0.462 1156 HB2 GLU 63 HB2 GLU 63 -7.449 14.714 -2.035 1157 HB3 GLU 63 HB3 GLU 63 -8.108 13.197 -2.637 1158 HG2 GLU 63 HG2 GLU 63 -9.353 14.945 -0.486 1159 HG3 GLU 63 HG3 GLU 63 -9.861 14.863 -2.172 1160 H ILE 64 H ILE 64 -6.386 10.872 -1.696 1161 HA ILE 64 HA ILE 64 -3.535 11.490 -1.753 1162 HB ILE 64 HB ILE 64 -4.984 9.017 -2.809 1163 HG12 ILE 64 HG12 ILE 64 -3.680 9.415 -0.073 1164 HG13 ILE 64 HG13 ILE 64 -5.414 9.373 -0.369 1165 HG21 ILE 64 HG21 ILE 64 -2.783 7.892 -2.639 1166 HG22 ILE 64 HG22 ILE 64 -2.041 9.407 -2.123 1167 HG23 ILE 64 HG23 ILE 64 -2.717 9.266 -3.746 1168 HD11 ILE 64 HD11 ILE 64 -4.620 7.272 0.550 1169 HD12 ILE 64 HD12 ILE 64 -3.493 7.077 -0.792 1170 HD13 ILE 64 HD13 ILE 64 -5.233 7.033 -1.086 1171 H PHE 65 H PHE 65 -2.919 12.893 -3.334 1172 HA PHE 65 HA PHE 65 -3.994 12.637 -6.092 1173 HB2 PHE 65 HB2 PHE 65 -4.302 14.863 -5.039 1174 HB3 PHE 65 HB3 PHE 65 -2.566 14.995 -4.779 1175 HD1 PHE 65 HD2 PHE 65 -5.105 14.576 -7.515 1176 HD2 PHE 65 HD1 PHE 65 -1.218 16.032 -6.451 1177 HE1 PHE 65 HE2 PHE 65 -4.865 15.586 -9.745 1178 HE2 PHE 65 HE1 PHE 65 -0.990 17.033 -8.686 1179 HZ PHE 65 HZ PHE 65 -2.810 16.812 -10.331 1180 H VAL 66 H VAL 66 -2.723 11.262 -7.194 1181 HA VAL 66 HA VAL 66 0.191 11.116 -6.709 1182 HB VAL 66 HB VAL 66 0.055 8.881 -7.788 1183 HG11 VAL 66 HG11 VAL 66 -1.305 7.728 -6.058 1184 HG12 VAL 66 HG12 VAL 66 -2.019 9.274 -5.592 1185 HG13 VAL 66 HG13 VAL 66 -0.293 8.992 -5.365 1186 HG21 VAL 66 HG21 VAL 66 -2.151 7.891 -8.364 1187 HG22 VAL 66 HG22 VAL 66 -1.769 9.282 -9.377 1188 HG23 VAL 66 HG23 VAL 66 -2.923 9.451 -8.054 1189 H LYS 67 H LYS 67 1.737 11.139 -8.421 1190 HA LYS 67 HA LYS 67 0.925 11.461 -11.220 1191 HB2 LYS 67 HB2 LYS 67 2.228 13.657 -11.437 1192 HB3 LYS 67 HB3 LYS 67 0.693 13.776 -10.588 1193 HG2 LYS 67 HG2 LYS 67 1.903 13.699 -8.424 1194 HG3 LYS 67 HG3 LYS 67 3.435 13.690 -9.303 1195 HD2 LYS 67 HD2 LYS 67 3.026 15.917 -10.165 1196 HD3 LYS 67 HD3 LYS 67 1.367 15.913 -9.547 1197 HE2 LYS 67 HE2 LYS 67 3.875 15.809 -7.826 1198 HE3 LYS 67 HE3 LYS 67 2.900 17.251 -8.122 1199 HZ1 LYS 67 HZ1 LYS 67 1.023 16.154 -7.073 1200 HZ2 LYS 67 HZ2 LYS 67 2.337 16.223 -6.017 1201 HZ3 LYS 67 HZ3 LYS 67 1.952 14.770 -6.789 1202 H LEU 68 H LEU 68 2.888 11.375 -12.676 1203 HA LEU 68 HA LEU 68 4.928 9.623 -11.728 1204 HB2 LEU 68 HB2 LEU 68 5.004 11.374 -14.219 1205 HB3 LEU 68 HB3 LEU 68 6.056 10.003 -13.893 1206 HG LEU 68 HG LEU 68 3.080 9.945 -14.525 1207 HD11 LEU 68 HD11 LEU 68 3.738 8.607 -16.450 1208 HD12 LEU 68 HD12 LEU 68 5.434 8.686 -15.967 1209 HD13 LEU 68 HD13 LEU 68 4.585 10.154 -16.464 1210 HD21 LEU 68 HD21 LEU 68 3.176 7.492 -14.283 1211 HD22 LEU 68 HD22 LEU 68 3.452 8.322 -12.756 1212 HD23 LEU 68 HD23 LEU 68 4.814 7.621 -13.634 1213 H VAL 69 H VAL 69 7.289 10.063 -11.557 1214 HA VAL 69 HA VAL 69 8.033 12.525 -10.302 1215 HB VAL 69 HB VAL 69 9.866 10.416 -11.548 1216 HG11 VAL 69 HG11 VAL 69 11.068 12.551 -11.272 1217 HG12 VAL 69 HG12 VAL 69 11.664 11.359 -10.118 1218 HG13 VAL 69 HG13 VAL 69 10.571 12.637 -9.580 1219 HG21 VAL 69 HG21 VAL 69 10.151 9.562 -9.234 1220 HG22 VAL 69 HG22 VAL 69 8.473 9.456 -9.766 1221 HG23 VAL 69 HG23 VAL 69 8.963 10.736 -8.656 1222 H LEU 70 H LEU 70 7.341 14.159 -11.666 1223 HA LEU 70 HA LEU 70 8.825 14.586 -14.197 1224 HB2 LEU 70 HB2 LEU 70 6.051 15.601 -13.437 1225 HB3 LEU 70 HB3 LEU 70 6.896 15.980 -14.932 1226 HG LEU 70 HG LEU 70 5.900 13.220 -14.102 1227 HD11 LEU 70 HD11 LEU 70 4.058 14.697 -14.703 1228 HD12 LEU 70 HD12 LEU 70 4.274 13.448 -15.925 1229 HD13 LEU 70 HD13 LEU 70 4.836 15.094 -16.239 1230 HD21 LEU 70 HD21 LEU 70 6.555 12.471 -16.360 1231 HD22 LEU 70 HD22 LEU 70 7.946 13.010 -15.428 1232 HD23 LEU 70 HD23 LEU 70 7.276 14.052 -16.687 1233 H GLU 71 H GLU 71 10.557 15.671 -13.267 1234 HA GLU 71 HA GLU 71 10.394 17.773 -11.358 1235 HB2 GLU 71 HB2 GLU 71 12.621 17.086 -13.322 1236 HB3 GLU 71 HB3 GLU 71 12.784 18.211 -11.974 1237 HG2 GLU 71 HG2 GLU 71 12.303 16.355 -10.395 1238 HG3 GLU 71 HG3 GLU 71 12.198 15.240 -11.758 1239 H HIS 72 H HIS 72 9.970 17.754 -14.821 1240 HA HIS 72 HA HIS 72 10.350 20.471 -15.473 1241 HB2 HIS 72 HB2 HIS 72 8.337 18.484 -16.618 1242 HB3 HIS 72 HB3 HIS 72 8.706 20.049 -17.341 1243 HD1 HIS 72 HD1 HIS 72 9.120 17.388 -18.838 1244 HD2 HIS 72 HD2 HIS 72 12.125 19.416 -16.811 1245 HE1 HIS 72 HE1 HIS 72 11.261 16.648 -19.913 1246 HE2 HIS 72 HE2 HIS 72 13.065 17.893 -18.685 1247 H HIS 73 H HIS 73 7.860 18.954 -13.603 1248 HA HIS 73 HA HIS 73 6.319 21.481 -13.366 1249 HB2 HIS 73 HB2 HIS 73 5.538 18.655 -12.509 1250 HB3 HIS 73 HB3 HIS 73 4.512 20.083 -12.409 1251 HD1 HIS 73 HD1 HIS 73 3.310 20.816 -14.544 1252 HD2 HIS 73 HD2 HIS 73 5.906 17.630 -15.145 1253 HE1 HIS 73 HE1 HIS 73 2.822 19.976 -16.854 1254 HE2 HIS 73 HE2 HIS 73 4.457 18.108 -17.226 1255 H HIS 74 H HIS 74 6.233 22.510 -11.394 1256 HA HIS 74 HA HIS 74 6.351 23.015 -9.202 1257 HB2 HIS 74 HB2 HIS 74 5.248 20.761 -8.905 1258 HB3 HIS 74 HB3 HIS 74 6.839 20.052 -8.669 1259 HD1 HIS 74 HD1 HIS 74 7.861 20.223 -6.356 1260 HD2 HIS 74 HD2 HIS 74 4.400 22.490 -6.741 1261 HE1 HIS 74 HE1 HIS 74 7.317 21.012 -4.039 1262 HE2 HIS 74 HE2 HIS 74 5.127 22.220 -4.277 1263 H HIS 75 H HIS 75 9.006 22.391 -10.938 1264 HA HIS 75 HA HIS 75 11.040 22.088 -8.940 1265 HB2 HIS 75 HB2 HIS 75 12.658 22.705 -10.711 1266 HB3 HIS 75 HB3 HIS 75 11.540 21.469 -11.251 1267 HD1 HIS 75 HD1 HIS 75 10.092 21.983 -13.271 1268 HD2 HIS 75 HD2 HIS 75 12.332 25.250 -12.015 1269 HE1 HIS 75 HE1 HIS 75 9.890 23.683 -15.106 1270 HE2 HIS 75 HE2 HIS 75 11.384 25.571 -14.398 1271 H HIS 76 H HIS 76 12.104 23.566 -7.718 1272 HA HIS 76 HA HIS 76 11.024 26.238 -7.444 1273 HB2 HIS 76 HB2 HIS 76 11.666 24.732 -5.506 1274 HB3 HIS 76 HB3 HIS 76 13.351 24.945 -5.951 1275 HD1 HIS 76 HD1 HIS 76 14.178 27.589 -5.846 1276 HD2 HIS 76 HD2 HIS 76 10.746 26.567 -3.726 1277 HE1 HIS 76 HE1 HIS 76 13.852 29.421 -4.161 1278 HE2 HIS 76 HE2 HIS 76 11.674 28.881 -3.037 1279 H HIS 77 H HIS 77 11.709 26.911 -9.661 1280 HA HIS 77 HA HIS 77 13.995 28.612 -9.609 1281 HB2 HIS 77 HB2 HIS 77 15.096 26.353 -10.094 1282 HB3 HIS 77 HB3 HIS 77 14.213 26.312 -11.614 1283 HD1 HIS 77 HD1 HIS 77 15.691 26.976 -13.478 1284 HD2 HIS 77 HD2 HIS 77 16.657 29.017 -9.998 1285 HE1 HIS 77 HE1 HIS 77 17.601 28.469 -14.096 1286 HE2 HIS 77 HE2 HIS 77 18.014 29.848 -12.039 Start of MODEL 5 1 H1 MET 1 H1 MET 1 6.623 19.806 2.493 2 H2 MET 1 H2 MET 1 7.746 19.057 1.475 3 H3 MET 1 H3 MET 1 8.017 20.634 2.011 4 HA MET 1 HA MET 1 9.404 19.089 3.193 5 HB2 MET 1 HB2 MET 1 7.191 20.283 4.910 6 HB3 MET 1 HB3 MET 1 8.732 19.711 5.533 7 HG2 MET 1 HG2 MET 1 9.902 21.421 4.216 8 HG3 MET 1 HG3 MET 1 8.352 21.995 3.587 9 HE1 MET 1 HE1 MET 1 10.492 23.894 5.033 10 HE2 MET 1 HE2 MET 1 9.428 24.859 6.056 11 HE3 MET 1 HE3 MET 1 8.946 24.471 4.404 12 H LYS 2 H LYS 2 6.197 18.503 4.772 13 HA LYS 2 HA LYS 2 7.009 15.815 5.396 14 HB2 LYS 2 HB2 LYS 2 5.124 15.601 6.786 15 HB3 LYS 2 HB3 LYS 2 5.546 17.294 6.917 16 HG2 LYS 2 HG2 LYS 2 3.265 16.163 5.271 17 HG3 LYS 2 HG3 LYS 2 3.110 16.888 6.872 18 HD2 LYS 2 HD2 LYS 2 3.877 19.057 5.949 19 HD3 LYS 2 HD3 LYS 2 4.037 18.320 4.348 20 HE2 LYS 2 HE2 LYS 2 1.475 18.720 5.938 21 HE3 LYS 2 HE3 LYS 2 1.930 19.524 4.436 22 HZ1 LYS 2 HZ1 LYS 2 1.248 16.655 4.803 23 HZ2 LYS 2 HZ2 LYS 2 1.881 17.284 3.370 24 HZ3 LYS 2 HZ3 LYS 2 0.378 17.813 3.934 25 H MET 3 H MET 3 6.635 14.005 4.361 26 HA MET 3 HA MET 3 5.180 14.095 1.764 27 HB2 MET 3 HB2 MET 3 7.629 14.083 1.571 28 HB3 MET 3 HB3 MET 3 7.734 12.655 2.586 29 HG2 MET 3 HG2 MET 3 8.110 12.149 0.233 30 HG3 MET 3 HG3 MET 3 6.691 11.315 0.862 31 HE1 MET 3 HE1 MET 3 5.695 11.924 -2.851 32 HE2 MET 3 HE2 MET 3 5.859 10.736 -1.557 33 HE3 MET 3 HE3 MET 3 7.294 11.518 -2.224 34 H LEU 4 H LEU 4 4.024 12.268 1.090 35 HA LEU 4 HA LEU 4 2.866 10.573 3.081 36 HB2 LEU 4 HB2 LEU 4 2.729 10.321 0.055 37 HB3 LEU 4 HB3 LEU 4 1.747 9.405 1.179 38 HG LEU 4 HG LEU 4 0.339 11.101 0.304 39 HD11 LEU 4 HD11 LEU 4 1.203 12.047 3.042 40 HD12 LEU 4 HD12 LEU 4 0.026 10.782 2.681 41 HD13 LEU 4 HD13 LEU 4 -0.315 12.451 2.230 42 HD21 LEU 4 HD21 LEU 4 0.832 13.500 0.271 43 HD22 LEU 4 HD22 LEU 4 2.009 12.585 -0.669 44 HD23 LEU 4 HD23 LEU 4 2.443 13.191 0.932 45 H LYS 5 H LYS 5 5.660 10.228 1.076 46 HA LYS 5 HA LYS 5 6.054 7.412 1.162 47 HB2 LYS 5 HB2 LYS 5 7.189 8.841 -0.494 48 HB3 LYS 5 HB3 LYS 5 8.039 9.684 0.797 49 HG2 LYS 5 HG2 LYS 5 9.313 7.692 1.340 50 HG3 LYS 5 HG3 LYS 5 8.401 6.741 0.170 51 HD2 LYS 5 HD2 LYS 5 10.187 9.102 -0.551 52 HD3 LYS 5 HD3 LYS 5 10.699 7.414 -0.606 53 HE2 LYS 5 HE2 LYS 5 8.887 6.971 -2.291 54 HE3 LYS 5 HE3 LYS 5 8.509 8.697 -2.284 55 HZ1 LYS 5 HZ1 LYS 5 9.957 8.096 -4.114 56 HZ2 LYS 5 HZ2 LYS 5 11.117 7.499 -3.041 57 HZ3 LYS 5 HZ3 LYS 5 10.749 9.149 -3.057 58 H GLU 6 H GLU 6 7.583 10.068 3.057 59 HA GLU 6 HA GLU 6 8.966 8.381 4.878 60 HB2 GLU 6 HB2 GLU 6 9.456 10.403 6.173 61 HB3 GLU 6 HB3 GLU 6 9.626 10.756 4.457 62 HG2 GLU 6 HG2 GLU 6 7.386 11.822 4.468 63 HG3 GLU 6 HG3 GLU 6 7.242 11.492 6.190 64 H LYS 7 H LYS 7 5.737 9.721 4.848 65 HA LYS 7 HA LYS 7 4.920 9.209 7.522 66 HB2 LYS 7 HB2 LYS 7 3.839 10.742 5.737 67 HB3 LYS 7 HB3 LYS 7 3.122 9.295 5.049 68 HG2 LYS 7 HG2 LYS 7 2.646 10.126 7.930 69 HG3 LYS 7 HG3 LYS 7 1.675 10.756 6.599 70 HD2 LYS 7 HD2 LYS 7 0.883 8.514 6.047 71 HD3 LYS 7 HD3 LYS 7 1.965 7.794 7.240 72 HE2 LYS 7 HE2 LYS 7 -0.297 7.856 8.123 73 HE3 LYS 7 HE3 LYS 7 0.717 8.969 9.044 74 HZ1 LYS 7 HZ1 LYS 7 -1.401 9.948 8.547 75 HZ2 LYS 7 HZ2 LYS 7 -1.192 9.701 6.892 76 HZ3 LYS 7 HZ3 LYS 7 -0.193 10.790 7.721 77 H ALA 8 H ALA 8 4.589 7.355 4.488 78 HA ALA 8 HA ALA 8 3.377 5.000 5.471 79 HB1 ALA 8 HB1 ALA 8 3.546 5.549 3.064 80 HB2 ALA 8 HB2 ALA 8 4.169 3.932 3.397 81 HB3 ALA 8 HB3 ALA 8 5.289 5.271 3.117 82 H GLY 9 H GLY 9 6.807 5.921 5.237 83 HA2 GLY 9 HA2 GLY 9 7.968 3.493 6.163 84 HA3 GLY 9 HA3 GLY 9 8.732 5.073 6.147 85 H ALA 10 H ALA 10 6.825 6.385 7.891 86 HA ALA 10 HA ALA 10 7.796 5.724 10.484 87 HB1 ALA 10 HB1 ALA 10 7.056 7.999 9.884 88 HB2 ALA 10 HB2 ALA 10 6.179 7.404 11.298 89 HB3 ALA 10 HB3 ALA 10 5.397 7.423 9.713 90 H LEU 11 H LEU 11 4.686 5.144 8.860 91 HA LEU 11 HA LEU 11 3.358 3.658 10.876 92 HB2 LEU 11 HB2 LEU 11 3.076 3.556 7.849 93 HB3 LEU 11 HB3 LEU 11 1.932 2.841 8.980 94 HG LEU 11 HG LEU 11 2.545 5.820 8.831 95 HD11 LEU 11 HD11 LEU 11 0.343 6.034 7.727 96 HD12 LEU 11 HD12 LEU 11 0.239 4.277 7.619 97 HD13 LEU 11 HD13 LEU 11 1.513 5.144 6.757 98 HD21 LEU 11 HD21 LEU 11 0.522 6.080 10.219 99 HD22 LEU 11 HD22 LEU 11 1.745 5.115 11.044 100 HD23 LEU 11 HD23 LEU 11 0.346 4.325 10.308 101 H ALA 12 H ALA 12 5.539 2.699 8.250 102 HA ALA 12 HA ALA 12 5.290 -0.084 8.300 103 HB1 ALA 12 HB1 ALA 12 7.784 1.537 7.692 104 HB2 ALA 12 HB2 ALA 12 6.496 1.149 6.551 105 HB3 ALA 12 HB3 ALA 12 7.494 -0.147 7.218 106 H GLY 13 H GLY 13 7.319 2.026 10.306 107 HA2 GLY 13 HA2 GLY 13 8.731 0.110 11.809 108 HA3 GLY 13 HA3 GLY 13 8.307 1.726 12.351 109 H GLN 14 H GLN 14 5.470 1.473 12.299 110 HA GLN 14 HA GLN 14 4.965 0.309 14.865 111 HB2 GLN 14 HB2 GLN 14 2.979 1.294 12.774 112 HB3 GLN 14 HB3 GLN 14 2.611 0.976 14.468 113 HG2 GLN 14 HG2 GLN 14 4.067 2.819 15.156 114 HG3 GLN 14 HG3 GLN 14 4.517 3.115 13.471 115 HE21 GLN 14 HE21 GLN 14 3.682 5.250 13.584 116 HE22 GLN 14 HE22 GLN 14 1.985 5.562 13.594 117 H ILE 15 H ILE 15 3.788 -0.568 11.582 118 HA ILE 15 HA ILE 15 2.236 -2.813 12.340 119 HB ILE 15 HB ILE 15 3.349 -1.991 9.618 120 HG12 ILE 15 HG12 ILE 15 0.892 -1.688 9.040 121 HG13 ILE 15 HG13 ILE 15 0.489 -2.065 10.708 122 HG21 ILE 15 HG21 ILE 15 3.267 -4.442 9.557 123 HG22 ILE 15 HG22 ILE 15 1.996 -3.770 8.536 124 HG23 ILE 15 HG23 ILE 15 1.596 -4.425 10.129 125 HD11 ILE 15 HD11 ILE 15 0.382 0.295 10.257 126 HD12 ILE 15 HD12 ILE 15 2.071 0.305 9.752 127 HD13 ILE 15 HD13 ILE 15 1.652 -0.052 11.430 128 H TRP 16 H TRP 16 5.590 -2.598 11.128 129 HA TRP 16 HA TRP 16 6.119 -5.379 11.118 130 HB2 TRP 16 HB2 TRP 16 7.479 -3.763 9.833 131 HB3 TRP 16 HB3 TRP 16 8.100 -3.074 11.333 132 HD1 TRP 16 HD1 TRP 16 8.234 -6.364 9.298 133 HE1 TRP 16 HE1 TRP 16 10.400 -7.609 9.921 134 HE3 TRP 16 HE3 TRP 16 9.861 -3.311 13.046 135 HZ2 TRP 16 HZ2 TRP 16 12.504 -7.350 11.779 136 HZ3 TRP 16 HZ3 TRP 16 11.936 -3.879 14.220 137 HH2 TRP 16 HH2 TRP 16 13.240 -5.863 13.594 138 H GLU 17 H GLU 17 6.681 -2.893 13.686 139 HA GLU 17 HA GLU 17 7.940 -4.671 15.525 140 HB2 GLU 17 HB2 GLU 17 6.607 -1.987 15.810 141 HB3 GLU 17 HB3 GLU 17 7.004 -2.884 17.266 142 HG2 GLU 17 HG2 GLU 17 9.027 -2.135 15.130 143 HG3 GLU 17 HG3 GLU 17 8.706 -1.178 16.576 144 H ALA 18 H ALA 18 4.533 -4.131 14.794 145 HA ALA 18 HA ALA 18 3.430 -5.665 16.952 146 HB1 ALA 18 HB1 ALA 18 2.294 -5.104 14.189 147 HB2 ALA 18 HB2 ALA 18 2.070 -4.102 15.622 148 HB3 ALA 18 HB3 ALA 18 1.379 -5.726 15.568 149 H LEU 19 H LEU 19 4.758 -6.489 13.792 150 HA LEU 19 HA LEU 19 4.101 -9.327 13.917 151 HB2 LEU 19 HB2 LEU 19 5.823 -7.708 12.002 152 HB3 LEU 19 HB3 LEU 19 5.456 -9.417 11.793 153 HG LEU 19 HG LEU 19 3.369 -7.192 11.799 154 HD11 LEU 19 HD11 LEU 19 4.817 -6.993 9.835 155 HD12 LEU 19 HD12 LEU 19 3.205 -7.533 9.376 156 HD13 LEU 19 HD13 LEU 19 4.539 -8.691 9.431 157 HD21 LEU 19 HD21 LEU 19 3.105 -10.143 11.122 158 HD22 LEU 19 HD22 LEU 19 1.834 -8.928 10.953 159 HD23 LEU 19 HD23 LEU 19 2.453 -9.334 12.551 160 H ASN 20 H ASN 20 6.760 -7.293 14.901 161 HA ASN 20 HA ASN 20 8.870 -9.209 14.633 162 HB2 ASN 20 HB2 ASN 20 9.210 -6.717 14.571 163 HB3 ASN 20 HB3 ASN 20 8.865 -6.653 16.298 164 HD21 ASN 20 HD21 ASN 20 10.940 -5.850 16.765 165 HD22 ASN 20 HD22 ASN 20 12.356 -6.823 16.665 166 H GLY 21 H GLY 21 9.502 -10.773 16.002 167 HA2 GLY 21 HA2 GLY 21 9.786 -12.010 17.939 168 HA3 GLY 21 HA3 GLY 21 8.946 -10.771 18.855 169 H THR 22 H THR 22 7.149 -11.783 16.131 170 HA THR 22 HA THR 22 5.652 -13.859 17.659 171 HB THR 22 HB THR 22 3.539 -13.100 16.783 172 HG1 THR 22 HG1 THR 22 4.551 -10.917 15.357 173 HG21 THR 22 HG21 THR 22 4.294 -11.734 18.698 174 HG22 THR 22 HG22 THR 22 3.317 -10.773 17.585 175 HG23 THR 22 HG23 THR 22 5.074 -10.597 17.592 176 H GLU 23 H GLU 23 4.355 -15.316 16.175 177 HA GLU 23 HA GLU 23 5.877 -16.302 13.919 178 HB2 GLU 23 HB2 GLU 23 3.100 -17.088 14.916 179 HB3 GLU 23 HB3 GLU 23 3.974 -17.924 13.640 180 HG2 GLU 23 HG2 GLU 23 4.177 -19.206 15.648 181 HG3 GLU 23 HG3 GLU 23 5.750 -18.508 15.271 182 H GLY 24 H GLY 24 3.707 -13.787 14.232 183 HA2 GLY 24 HA2 GLY 24 3.213 -12.632 12.003 184 HA3 GLY 24 HA3 GLY 24 2.342 -14.120 11.637 185 H LEU 25 H LEU 25 1.095 -11.559 11.726 186 HA LEU 25 HA LEU 25 -0.888 -11.974 13.841 187 HB2 LEU 25 HB2 LEU 25 1.063 -10.365 14.579 188 HB3 LEU 25 HB3 LEU 25 0.321 -9.206 13.492 189 HG LEU 25 HG LEU 25 -1.798 -9.362 14.835 190 HD11 LEU 25 HD11 LEU 25 -0.152 -11.061 16.736 191 HD12 LEU 25 HD12 LEU 25 -1.522 -11.608 15.766 192 HD13 LEU 25 HD13 LEU 25 -1.770 -10.426 17.047 193 HD21 LEU 25 HD21 LEU 25 -1.004 -8.052 16.765 194 HD22 LEU 25 HD22 LEU 25 -0.225 -7.534 15.272 195 HD23 LEU 25 HD23 LEU 25 0.661 -8.539 16.423 196 H THR 26 H THR 26 -2.941 -11.006 13.361 197 HA THR 26 HA THR 26 -3.461 -10.659 10.502 198 HB THR 26 HB THR 26 -5.836 -10.774 11.039 199 HG1 THR 26 HG1 THR 26 -6.598 -10.717 13.138 200 HG21 THR 26 HG21 THR 26 -6.010 -12.960 12.119 201 HG22 THR 26 HG22 THR 26 -4.377 -12.802 12.773 202 HG23 THR 26 HG23 THR 26 -4.622 -12.947 11.028 203 H GLN 27 H GLN 27 -4.992 -8.943 9.785 204 HA GLN 27 HA GLN 27 -3.974 -6.387 10.060 205 HB2 GLN 27 HB2 GLN 27 -5.315 -7.041 8.137 206 HB3 GLN 27 HB3 GLN 27 -6.736 -7.283 9.148 207 HG2 GLN 27 HG2 GLN 27 -6.798 -4.850 9.626 208 HG3 GLN 27 HG3 GLN 27 -5.397 -4.614 8.585 209 HE21 GLN 27 HE21 GLN 27 -5.685 -4.748 6.341 210 HE22 GLN 27 HE22 GLN 27 -7.245 -4.718 5.609 211 H LYS 28 H LYS 28 -6.984 -7.620 11.542 212 HA LYS 28 HA LYS 28 -7.804 -5.387 12.987 213 HB2 LYS 28 HB2 LYS 28 -9.187 -7.403 12.669 214 HB3 LYS 28 HB3 LYS 28 -8.113 -8.329 13.713 215 HG2 LYS 28 HG2 LYS 28 -8.763 -6.868 15.631 216 HG3 LYS 28 HG3 LYS 28 -9.880 -6.005 14.570 217 HD2 LYS 28 HD2 LYS 28 -10.037 -8.970 15.269 218 HD3 LYS 28 HD3 LYS 28 -11.031 -7.697 15.982 219 HE2 LYS 28 HE2 LYS 28 -12.005 -7.222 13.746 220 HE3 LYS 28 HE3 LYS 28 -11.021 -8.513 13.053 221 HZ1 LYS 28 HZ1 LYS 28 -12.158 -10.086 14.497 222 HZ2 LYS 28 HZ2 LYS 28 -13.248 -9.270 13.498 223 HZ3 LYS 28 HZ3 LYS 28 -13.110 -8.843 15.126 224 H GLN 29 H GLN 29 -5.646 -8.007 14.060 225 HA GLN 29 HA GLN 29 -5.337 -7.045 16.750 226 HB2 GLN 29 HB2 GLN 29 -3.803 -9.178 15.220 227 HB3 GLN 29 HB3 GLN 29 -3.654 -8.883 16.952 228 HG2 GLN 29 HG2 GLN 29 -6.049 -9.455 17.243 229 HG3 GLN 29 HG3 GLN 29 -6.176 -9.786 15.517 230 HE21 GLN 29 HE21 GLN 29 -5.184 -11.680 14.692 231 HE22 GLN 29 HE22 GLN 29 -4.685 -12.967 15.724 232 H ILE 30 H ILE 30 -3.509 -6.557 13.768 233 HA ILE 30 HA ILE 30 -1.205 -5.336 14.982 234 HB ILE 30 HB ILE 30 -2.269 -5.161 12.126 235 HG12 ILE 30 HG12 ILE 30 0.094 -6.714 13.279 236 HG13 ILE 30 HG13 ILE 30 -1.464 -7.417 12.867 237 HG21 ILE 30 HG21 ILE 30 -0.937 -3.138 12.591 238 HG22 ILE 30 HG22 ILE 30 -0.077 -4.203 11.481 239 HG23 ILE 30 HG23 ILE 30 0.400 -4.133 13.180 240 HD11 ILE 30 HD11 ILE 30 0.501 -6.186 10.940 241 HD12 ILE 30 HD12 ILE 30 -1.074 -6.859 10.508 242 HD13 ILE 30 HD13 ILE 30 0.181 -7.903 11.177 243 H LYS 31 H LYS 31 -4.155 -4.011 13.412 244 HA LYS 31 HA LYS 31 -3.658 -1.266 13.877 245 HB2 LYS 31 HB2 LYS 31 -6.322 -2.712 13.560 246 HB3 LYS 31 HB3 LYS 31 -6.124 -0.959 13.504 247 HG2 LYS 31 HG2 LYS 31 -4.750 -1.127 11.499 248 HG3 LYS 31 HG3 LYS 31 -4.762 -2.886 11.594 249 HD2 LYS 31 HD2 LYS 31 -6.332 -2.388 9.907 250 HD3 LYS 31 HD3 LYS 31 -7.321 -2.734 11.321 251 HE2 LYS 31 HE2 LYS 31 -6.611 0.062 10.353 252 HE3 LYS 31 HE3 LYS 31 -8.107 -0.778 9.968 253 HZ1 LYS 31 HZ1 LYS 31 -7.210 0.059 12.667 254 HZ2 LYS 31 HZ2 LYS 31 -8.620 -0.814 12.342 255 HZ3 LYS 31 HZ3 LYS 31 -8.445 0.757 11.747 256 H LYS 32 H LYS 32 -4.959 -3.739 16.000 257 HA LYS 32 HA LYS 32 -5.749 -2.131 18.212 258 HB2 LYS 32 HB2 LYS 32 -6.412 -4.458 18.096 259 HB3 LYS 32 HB3 LYS 32 -4.748 -4.994 17.974 260 HG2 LYS 32 HG2 LYS 32 -5.619 -5.522 20.171 261 HG3 LYS 32 HG3 LYS 32 -4.345 -4.310 20.316 262 HD2 LYS 32 HD2 LYS 32 -6.082 -2.541 20.552 263 HD3 LYS 32 HD3 LYS 32 -7.344 -3.772 20.429 264 HE2 LYS 32 HE2 LYS 32 -6.529 -4.824 22.505 265 HE3 LYS 32 HE3 LYS 32 -5.228 -3.635 22.609 266 HZ1 LYS 32 HZ1 LYS 32 -6.909 -1.896 22.816 267 HZ2 LYS 32 HZ2 LYS 32 -7.038 -3.041 24.052 268 HZ3 LYS 32 HZ3 LYS 32 -8.138 -3.061 22.768 269 H ALA 33 H ALA 33 -2.662 -3.810 17.501 270 HA ALA 33 HA ALA 33 -1.283 -2.967 19.859 271 HB1 ALA 33 HB1 ALA 33 0.690 -4.004 18.807 272 HB2 ALA 33 HB2 ALA 33 -0.174 -4.099 17.267 273 HB3 ALA 33 HB3 ALA 33 -0.734 -5.037 18.653 274 H THR 34 H THR 34 -1.641 -1.538 16.708 275 HA THR 34 HA THR 34 0.509 0.451 17.076 276 HB THR 34 HB THR 34 0.062 1.045 14.701 277 HG1 THR 34 HG1 THR 34 -1.539 -1.040 14.048 278 HG21 THR 34 HG21 THR 34 0.786 -1.061 13.640 279 HG22 THR 34 HG22 THR 34 0.337 -1.968 15.085 280 HG23 THR 34 HG23 THR 34 1.665 -0.803 15.149 281 H LYS 35 H LYS 35 -2.933 0.142 17.321 282 HA LYS 35 HA LYS 35 -4.615 1.493 17.959 283 HB2 LYS 35 HB2 LYS 35 -2.369 3.426 18.615 284 HB3 LYS 35 HB3 LYS 35 -4.056 3.864 18.850 285 HG2 LYS 35 HG2 LYS 35 -2.658 1.515 20.174 286 HG3 LYS 35 HG3 LYS 35 -2.970 3.081 20.934 287 HD2 LYS 35 HD2 LYS 35 -5.098 1.143 19.918 288 HD3 LYS 35 HD3 LYS 35 -4.635 1.357 21.607 289 HE2 LYS 35 HE2 LYS 35 -5.456 3.680 21.554 290 HE3 LYS 35 HE3 LYS 35 -5.866 3.510 19.845 291 HZ1 LYS 35 HZ1 LYS 35 -7.778 3.241 21.315 292 HZ2 LYS 35 HZ2 LYS 35 -7.041 1.899 22.036 293 HZ3 LYS 35 HZ3 LYS 35 -7.478 1.848 20.403 294 H LEU 36 H LEU 36 -3.629 1.375 15.194 295 HA LEU 36 HA LEU 36 -4.239 3.903 13.941 296 HB2 LEU 36 HB2 LEU 36 -3.997 1.108 12.755 297 HB3 LEU 36 HB3 LEU 36 -4.213 2.574 11.804 298 HG LEU 36 HG LEU 36 -1.816 1.939 13.570 299 HD11 LEU 36 HD11 LEU 36 -0.543 1.777 11.487 300 HD12 LEU 36 HD12 LEU 36 -2.020 2.013 10.549 301 HD13 LEU 36 HD13 LEU 36 -1.830 0.576 11.557 302 HD21 LEU 36 HD21 LEU 36 -2.228 4.342 13.579 303 HD22 LEU 36 HD22 LEU 36 -2.288 4.372 11.816 304 HD23 LEU 36 HD23 LEU 36 -0.779 3.977 12.643 305 H LYS 37 H LYS 37 -6.227 4.637 14.371 306 HA LYS 37 HA LYS 37 -8.676 3.250 14.489 307 HB2 LYS 37 HB2 LYS 37 -8.413 5.505 15.402 308 HB3 LYS 37 HB3 LYS 37 -8.042 6.157 13.809 309 HG2 LYS 37 HG2 LYS 37 -10.375 5.636 13.087 310 HG3 LYS 37 HG3 LYS 37 -10.726 5.054 14.721 311 HD2 LYS 37 HD2 LYS 37 -10.287 7.295 15.638 312 HD3 LYS 37 HD3 LYS 37 -9.831 7.888 14.038 313 HE2 LYS 37 HE2 LYS 37 -12.140 7.507 13.240 314 HE3 LYS 37 HE3 LYS 37 -12.591 6.888 14.830 315 HZ1 LYS 37 HZ1 LYS 37 -11.613 9.642 14.292 316 HZ2 LYS 37 HZ2 LYS 37 -12.145 9.042 15.783 317 HZ3 LYS 37 HZ3 LYS 37 -13.237 9.207 14.498 318 H ALA 38 H ALA 38 -7.050 4.896 11.770 319 HA ALA 38 HA ALA 38 -9.118 4.240 9.838 320 HB1 ALA 38 HB1 ALA 38 -6.390 5.511 9.424 321 HB2 ALA 38 HB2 ALA 38 -7.899 6.379 9.712 322 HB3 ALA 38 HB3 ALA 38 -7.697 5.435 8.235 323 H ASP 39 H ASP 39 -9.006 2.783 8.198 324 HA ASP 39 HA ASP 39 -7.336 0.485 8.226 325 HB2 ASP 39 HB2 ASP 39 -8.430 -0.008 6.004 326 HB3 ASP 39 HB3 ASP 39 -9.570 0.343 7.299 327 H LYS 40 H LYS 40 -7.183 3.512 6.538 328 HA LYS 40 HA LYS 40 -5.591 3.032 4.322 329 HB2 LYS 40 HB2 LYS 40 -5.581 5.542 6.046 330 HB3 LYS 40 HB3 LYS 40 -5.162 5.445 4.333 331 HG2 LYS 40 HG2 LYS 40 -7.914 4.702 5.375 332 HG3 LYS 40 HG3 LYS 40 -7.482 6.368 4.940 333 HD2 LYS 40 HD2 LYS 40 -6.944 5.571 2.631 334 HD3 LYS 40 HD3 LYS 40 -7.451 3.943 3.097 335 HE2 LYS 40 HE2 LYS 40 -9.738 4.713 3.455 336 HE3 LYS 40 HE3 LYS 40 -9.257 6.390 3.173 337 HZ1 LYS 40 HZ1 LYS 40 -9.204 4.191 1.192 338 HZ2 LYS 40 HZ2 LYS 40 -8.655 5.763 0.907 339 HZ3 LYS 40 HZ3 LYS 40 -10.289 5.484 1.233 340 H ASP 41 H ASP 41 -4.576 3.992 7.570 341 HA ASP 41 HA ASP 41 -1.821 4.371 7.055 342 HB2 ASP 41 HB2 ASP 41 -3.349 3.896 9.642 343 HB3 ASP 41 HB3 ASP 41 -1.649 4.370 9.580 344 H PHE 42 H PHE 42 -3.680 1.530 8.001 345 HA PHE 42 HA PHE 42 -1.526 -0.204 8.640 346 HB2 PHE 42 HB2 PHE 42 -3.835 -0.803 9.232 347 HB3 PHE 42 HB3 PHE 42 -4.293 -0.859 7.532 348 HD1 PHE 42 HD1 PHE 42 -2.102 -2.492 10.079 349 HD2 PHE 42 HD2 PHE 42 -4.021 -2.894 6.275 350 HE1 PHE 42 HE1 PHE 42 -1.447 -4.853 9.984 351 HE2 PHE 42 HE2 PHE 42 -3.364 -5.263 6.202 352 HZ PHE 42 HZ PHE 42 -2.070 -6.240 8.060 353 H PHE 43 H PHE 43 -3.194 0.498 5.556 354 HA PHE 43 HA PHE 43 -1.857 -1.477 3.984 355 HB2 PHE 43 HB2 PHE 43 -3.209 1.068 2.989 356 HB3 PHE 43 HB3 PHE 43 -2.857 -0.371 2.034 357 HD1 PHE 43 HD2 PHE 43 -3.757 -2.599 3.651 358 HD2 PHE 43 HD1 PHE 43 -5.539 1.262 3.188 359 HE1 PHE 43 HE2 PHE 43 -5.942 -3.541 4.252 360 HE2 PHE 43 HE1 PHE 43 -7.727 0.337 3.789 361 HZ PHE 43 HZ PHE 43 -7.940 -2.073 4.312 362 H LEU 44 H LEU 44 -1.165 1.949 4.596 363 HA LEU 44 HA LEU 44 1.008 2.206 2.747 364 HB2 LEU 44 HB2 LEU 44 -0.009 3.854 5.062 365 HB3 LEU 44 HB3 LEU 44 1.573 4.221 4.402 366 HG LEU 44 HG LEU 44 0.552 4.644 2.169 367 HD11 LEU 44 HD11 LEU 44 -1.865 4.849 1.875 368 HD12 LEU 44 HD12 LEU 44 -2.135 4.263 3.517 369 HD13 LEU 44 HD13 LEU 44 -1.422 3.197 2.305 370 HD21 LEU 44 HD21 LEU 44 -0.690 6.301 4.389 371 HD22 LEU 44 HD22 LEU 44 -0.492 6.795 2.704 372 HD23 LEU 44 HD23 LEU 44 0.928 6.519 3.711 373 H GLY 45 H GLY 45 0.847 1.444 6.238 374 HA2 GLY 45 HA2 GLY 45 3.631 1.248 6.762 375 HA3 GLY 45 HA3 GLY 45 2.351 0.477 7.684 376 H LEU 46 H LEU 46 1.259 -1.319 6.115 377 HA LEU 46 HA LEU 46 3.019 -3.533 6.046 378 HB2 LEU 46 HB2 LEU 46 0.566 -3.684 6.401 379 HB3 LEU 46 HB3 LEU 46 0.289 -3.157 4.750 380 HG LEU 46 HG LEU 46 1.397 -5.249 3.924 381 HD11 LEU 46 HD11 LEU 46 1.837 -7.096 5.476 382 HD12 LEU 46 HD12 LEU 46 1.460 -6.049 6.845 383 HD13 LEU 46 HD13 LEU 46 2.858 -5.701 5.822 384 HD21 LEU 46 HD21 LEU 46 -0.452 -6.777 4.426 385 HD22 LEU 46 HD22 LEU 46 -1.068 -5.149 4.136 386 HD23 LEU 46 HD23 LEU 46 -0.950 -5.767 5.786 387 H GLY 47 H GLY 47 1.982 -1.274 3.569 388 HA2 GLY 47 HA2 GLY 47 2.824 -2.715 1.247 389 HA3 GLY 47 HA3 GLY 47 2.435 -1.003 1.336 390 H TRP 48 H TRP 48 4.389 -0.414 3.407 391 HA TRP 48 HA TRP 48 6.729 0.004 1.797 392 HB2 TRP 48 HB2 TRP 48 5.823 1.588 3.612 393 HB3 TRP 48 HB3 TRP 48 6.511 0.482 4.800 394 HD1 TRP 48 HD1 TRP 48 9.193 0.528 5.096 395 HE1 TRP 48 HE1 TRP 48 11.034 2.036 4.124 396 HE3 TRP 48 HE3 TRP 48 6.436 3.030 1.593 397 HZ2 TRP 48 HZ2 TRP 48 11.287 4.000 2.136 398 HZ3 TRP 48 HZ3 TRP 48 7.555 4.720 0.194 399 HH2 TRP 48 HH2 TRP 48 9.939 5.200 0.473 400 H LEU 49 H LEU 49 5.806 -2.312 4.272 401 HA LEU 49 HA LEU 49 8.298 -3.562 4.794 402 HB2 LEU 49 HB2 LEU 49 5.416 -4.387 5.036 403 HB3 LEU 49 HB3 LEU 49 6.637 -5.626 5.201 404 HG LEU 49 HG LEU 49 7.522 -4.682 7.202 405 HD11 LEU 49 HD11 LEU 49 6.848 -2.536 8.141 406 HD12 LEU 49 HD12 LEU 49 5.909 -2.197 6.678 407 HD13 LEU 49 HD13 LEU 49 7.666 -2.379 6.588 408 HD21 LEU 49 HD21 LEU 49 4.503 -4.351 7.337 409 HD22 LEU 49 HD22 LEU 49 5.587 -4.569 8.715 410 HD23 LEU 49 HD23 LEU 49 5.388 -5.865 7.541 411 H LEU 50 H LEU 50 6.052 -3.916 2.098 412 HA LEU 50 HA LEU 50 7.195 -6.162 0.809 413 HB2 LEU 50 HB2 LEU 50 5.713 -3.801 -0.398 414 HB3 LEU 50 HB3 LEU 50 6.126 -5.263 -1.284 415 HG LEU 50 HG LEU 50 4.217 -5.078 1.086 416 HD11 LEU 50 HD11 LEU 50 2.470 -5.694 -0.525 417 HD12 LEU 50 HD12 LEU 50 3.649 -5.659 -1.840 418 HD13 LEU 50 HD13 LEU 50 3.252 -4.177 -0.966 419 HD21 LEU 50 HD21 LEU 50 5.403 -7.205 1.198 420 HD22 LEU 50 HD22 LEU 50 5.057 -7.536 -0.501 421 HD23 LEU 50 HD23 LEU 50 3.741 -7.482 0.677 422 H ARG 51 H ARG 51 8.145 -2.714 0.727 423 HA ARG 51 HA ARG 51 10.116 -2.795 -1.299 424 HB2 ARG 51 HB2 ARG 51 10.083 -1.161 1.278 425 HB3 ARG 51 HB3 ARG 51 11.296 -0.945 0.019 426 HG2 ARG 51 HG2 ARG 51 9.229 -0.527 -1.535 427 HG3 ARG 51 HG3 ARG 51 8.366 -0.249 -0.021 428 HD2 ARG 51 HD2 ARG 51 9.252 1.829 -1.099 429 HD3 ARG 51 HD3 ARG 51 9.818 1.578 0.550 430 HE ARG 51 HE ARG 51 11.887 0.592 -0.644 431 HH11 ARG 51 HH11 ARG 51 10.111 3.312 -1.817 432 HH12 ARG 51 HH12 ARG 51 11.491 4.019 -2.576 433 HH21 ARG 51 HH21 ARG 51 13.643 1.539 -1.589 434 HH22 ARG 51 HH22 ARG 51 13.456 3.032 -2.448 435 H GLU 52 H GLU 52 10.240 -3.756 2.076 436 HA GLU 52 HA GLU 52 13.110 -4.221 2.078 437 HB2 GLU 52 HB2 GLU 52 11.062 -4.808 4.249 438 HB3 GLU 52 HB3 GLU 52 12.811 -4.681 4.453 439 HG2 GLU 52 HG2 GLU 52 10.912 -2.411 3.724 440 HG3 GLU 52 HG3 GLU 52 11.640 -2.690 5.301 441 H ASP 53 H ASP 53 10.156 -6.035 1.676 442 HA ASP 53 HA ASP 53 9.566 -8.192 1.424 443 HB2 ASP 53 HB2 ASP 53 12.477 -8.583 0.607 444 HB3 ASP 53 HB3 ASP 53 11.174 -9.732 0.308 445 H LYS 54 H LYS 54 10.518 -7.239 4.003 446 HA LYS 54 HA LYS 54 11.758 -9.510 5.352 447 HB2 LYS 54 HB2 LYS 54 11.647 -8.074 7.379 448 HB3 LYS 54 HB3 LYS 54 12.446 -7.285 6.028 449 HG2 LYS 54 HG2 LYS 54 10.313 -6.014 5.595 450 HG3 LYS 54 HG3 LYS 54 9.656 -6.710 7.086 451 HD2 LYS 54 HD2 LYS 54 11.479 -5.681 8.394 452 HD3 LYS 54 HD3 LYS 54 12.213 -5.048 6.919 453 HE2 LYS 54 HE2 LYS 54 10.200 -3.618 6.570 454 HE3 LYS 54 HE3 LYS 54 9.524 -4.235 8.082 455 HZ1 LYS 54 HZ1 LYS 54 11.461 -3.329 9.245 456 HZ2 LYS 54 HZ2 LYS 54 10.584 -2.128 8.443 457 HZ3 LYS 54 HZ3 LYS 54 12.039 -2.681 7.791 458 H VAL 55 H VAL 55 8.692 -8.869 4.323 459 HA VAL 55 HA VAL 55 7.487 -10.712 6.295 460 HB VAL 55 HB VAL 55 5.351 -9.534 6.267 461 HG11 VAL 55 HG11 VAL 55 6.910 -8.861 8.032 462 HG12 VAL 55 HG12 VAL 55 5.919 -7.492 7.532 463 HG13 VAL 55 HG13 VAL 55 7.592 -7.611 6.984 464 HG21 VAL 55 HG21 VAL 55 5.391 -8.589 3.999 465 HG22 VAL 55 HG22 VAL 55 6.666 -7.458 4.461 466 HG23 VAL 55 HG23 VAL 55 5.056 -7.311 5.173 467 H VAL 56 H VAL 56 5.573 -11.806 5.466 468 HA VAL 56 HA VAL 56 5.082 -11.788 2.597 469 HB VAL 56 HB VAL 56 6.688 -13.608 2.833 470 HG11 VAL 56 HG11 VAL 56 4.876 -14.820 4.949 471 HG12 VAL 56 HG12 VAL 56 6.456 -14.084 5.228 472 HG13 VAL 56 HG13 VAL 56 6.332 -15.570 4.283 473 HG21 VAL 56 HG21 VAL 56 5.405 -15.504 1.913 474 HG22 VAL 56 HG22 VAL 56 4.854 -13.979 1.216 475 HG23 VAL 56 HG23 VAL 56 3.896 -14.770 2.470 476 H THR 57 H THR 57 2.941 -12.253 2.028 477 HA THR 57 HA THR 57 1.054 -11.941 4.296 478 HB THR 57 HB THR 57 -0.486 -10.876 2.615 479 HG1 THR 57 HG1 THR 57 0.527 -10.250 0.581 480 HG21 THR 57 HG21 THR 57 0.757 -8.741 2.373 481 HG22 THR 57 HG22 THR 57 2.257 -9.562 2.807 482 HG23 THR 57 HG23 THR 57 0.956 -9.418 3.992 483 H SER 58 H SER 58 -0.700 -13.222 4.493 484 HA SER 58 HA SER 58 -1.249 -15.370 2.526 485 HB2 SER 58 HB2 SER 58 -1.383 -15.589 5.574 486 HB3 SER 58 HB3 SER 58 -1.817 -16.867 4.435 487 HG SER 58 HG SER 58 0.643 -16.019 3.851 488 H GLU 59 H GLU 59 -3.398 -15.829 2.142 489 HA GLU 59 HA GLU 59 -5.428 -13.927 3.151 490 HB2 GLU 59 HB2 GLU 59 -5.188 -14.213 0.678 491 HB3 GLU 59 HB3 GLU 59 -5.565 -15.923 0.845 492 HG2 GLU 59 HG2 GLU 59 -7.817 -15.268 1.758 493 HG3 GLU 59 HG3 GLU 59 -7.420 -13.586 1.400 494 H VAL 60 H VAL 60 -6.275 -14.682 5.046 495 HA VAL 60 HA VAL 60 -7.015 -17.559 5.297 496 HB VAL 60 HB VAL 60 -6.364 -15.574 7.532 497 HG11 VAL 60 HG11 VAL 60 -7.100 -18.524 7.745 498 HG12 VAL 60 HG12 VAL 60 -8.093 -17.166 8.280 499 HG13 VAL 60 HG13 VAL 60 -6.559 -17.507 9.083 500 HG21 VAL 60 HG21 VAL 60 -4.337 -16.314 6.341 501 HG22 VAL 60 HG22 VAL 60 -4.807 -18.003 6.574 502 HG23 VAL 60 HG23 VAL 60 -4.391 -17.004 7.968 503 H GLU 61 H GLU 61 -9.113 -17.728 4.802 504 HA GLU 61 HA GLU 61 -11.384 -17.602 4.906 505 HB2 GLU 61 HB2 GLU 61 -10.820 -16.658 7.746 506 HB3 GLU 61 HB3 GLU 61 -12.278 -17.478 7.188 507 HG2 GLU 61 HG2 GLU 61 -9.484 -18.661 7.279 508 HG3 GLU 61 HG3 GLU 61 -10.770 -19.005 8.418 509 H GLY 62 H GLY 62 -10.189 -15.149 3.883 510 HA2 GLY 62 HA2 GLY 62 -11.318 -13.352 2.871 511 HA3 GLY 62 HA3 GLY 62 -12.520 -13.386 4.139 512 H GLU 63 H GLU 63 -9.596 -13.403 5.756 513 HA GLU 63 HA GLU 63 -9.491 -10.434 5.876 514 HB2 GLU 63 HB2 GLU 63 -8.856 -10.540 8.206 515 HB3 GLU 63 HB3 GLU 63 -10.324 -11.476 7.981 516 HG2 GLU 63 HG2 GLU 63 -8.992 -13.561 8.043 517 HG3 GLU 63 HG3 GLU 63 -7.531 -12.612 8.309 518 H ILE 64 H ILE 64 -7.472 -9.399 6.213 519 HA ILE 64 HA ILE 64 -5.242 -10.596 4.829 520 HB ILE 64 HB ILE 64 -5.442 -7.906 6.262 521 HG12 ILE 64 HG12 ILE 64 -5.672 -8.598 3.297 522 HG13 ILE 64 HG13 ILE 64 -6.982 -8.052 4.338 523 HG21 ILE 64 HG21 ILE 64 -3.089 -8.627 6.121 524 HG22 ILE 64 HG22 ILE 64 -3.379 -7.263 5.041 525 HG23 ILE 64 HG23 ILE 64 -3.260 -8.897 4.385 526 HD11 ILE 64 HD11 ILE 64 -6.235 -6.259 2.909 527 HD12 ILE 64 HD12 ILE 64 -4.576 -6.436 3.480 528 HD13 ILE 64 HD13 ILE 64 -5.835 -5.874 4.583 529 H PHE 65 H PHE 65 -4.130 -12.147 5.890 530 HA PHE 65 HA PHE 65 -3.007 -11.578 8.576 531 HB2 PHE 65 HB2 PHE 65 -4.060 -13.819 8.329 532 HB3 PHE 65 HB3 PHE 65 -3.015 -14.178 6.959 533 HD1 PHE 65 HD2 PHE 65 -3.013 -13.536 10.637 534 HD2 PHE 65 HD1 PHE 65 -0.797 -15.072 7.321 535 HE1 PHE 65 HE2 PHE 65 -1.335 -14.450 12.179 536 HE2 PHE 65 HE1 PHE 65 0.879 -15.981 8.872 537 HZ PHE 65 HZ PHE 65 0.615 -15.671 11.298 538 H VAL 66 H VAL 66 -0.790 -11.278 8.795 539 HA VAL 66 HA VAL 66 0.984 -11.843 6.512 540 HB VAL 66 HB VAL 66 0.488 -9.473 6.258 541 HG11 VAL 66 HG11 VAL 66 1.386 -9.073 9.130 542 HG12 VAL 66 HG12 VAL 66 -0.268 -8.939 8.530 543 HG13 VAL 66 HG13 VAL 66 0.960 -7.787 7.997 544 HG21 VAL 66 HG21 VAL 66 3.278 -9.817 7.422 545 HG22 VAL 66 HG22 VAL 66 2.762 -8.515 6.350 546 HG23 VAL 66 HG23 VAL 66 2.801 -10.177 5.761 547 H LYS 67 H LYS 67 3.197 -12.228 7.103 548 HA LYS 67 HA LYS 67 3.809 -12.592 9.964 549 HB2 LYS 67 HB2 LYS 67 4.470 -14.980 9.559 550 HB3 LYS 67 HB3 LYS 67 2.744 -14.696 9.362 551 HG2 LYS 67 HG2 LYS 67 3.099 -14.598 6.876 552 HG3 LYS 67 HG3 LYS 67 4.782 -15.052 7.139 553 HD2 LYS 67 HD2 LYS 67 2.393 -16.756 7.977 554 HD3 LYS 67 HD3 LYS 67 3.267 -16.956 6.460 555 HE2 LYS 67 HE2 LYS 67 4.131 -18.619 7.931 556 HE3 LYS 67 HE3 LYS 67 5.365 -17.365 7.870 557 HZ1 LYS 67 HZ1 LYS 67 4.685 -16.578 10.003 558 HZ2 LYS 67 HZ2 LYS 67 4.912 -18.248 10.110 559 HZ3 LYS 67 HZ3 LYS 67 3.348 -17.612 10.033 560 H LEU 68 H LEU 68 6.094 -12.820 10.397 561 HA LEU 68 HA LEU 68 7.842 -11.550 8.509 562 HB2 LEU 68 HB2 LEU 68 8.501 -13.042 11.078 563 HB3 LEU 68 HB3 LEU 68 9.670 -12.129 10.135 564 HG LEU 68 HG LEU 68 7.307 -11.029 11.708 565 HD11 LEU 68 HD11 LEU 68 10.299 -10.569 12.000 566 HD12 LEU 68 HD12 LEU 68 9.274 -11.533 13.069 567 HD13 LEU 68 HD13 LEU 68 9.031 -9.793 12.955 568 HD21 LEU 68 HD21 LEU 68 9.141 -9.518 9.817 569 HD22 LEU 68 HD22 LEU 68 8.000 -8.776 10.944 570 HD23 LEU 68 HD23 LEU 68 7.405 -9.782 9.628 571 H VAL 69 H VAL 69 9.450 -12.411 7.232 572 HA VAL 69 HA VAL 69 9.359 -15.195 6.454 573 HB VAL 69 HB VAL 69 11.490 -13.146 5.664 574 HG11 VAL 69 HG11 VAL 69 11.688 -14.467 3.574 575 HG12 VAL 69 HG12 VAL 69 10.472 -15.601 4.172 576 HG13 VAL 69 HG13 VAL 69 12.027 -15.464 4.994 577 HG21 VAL 69 HG21 VAL 69 10.093 -12.552 3.705 578 HG22 VAL 69 HG22 VAL 69 9.285 -12.146 5.220 579 HG23 VAL 69 HG23 VAL 69 8.792 -13.580 4.319 580 H LEU 70 H LEU 70 10.819 -13.553 9.011 581 HA LEU 70 HA LEU 70 13.175 -15.264 9.342 582 HB2 LEU 70 HB2 LEU 70 12.113 -12.993 11.075 583 HB3 LEU 70 HB3 LEU 70 13.686 -13.764 11.234 584 HG LEU 70 HG LEU 70 12.769 -12.066 8.872 585 HD11 LEU 70 HD11 LEU 70 14.797 -11.420 11.037 586 HD12 LEU 70 HD12 LEU 70 13.186 -10.715 10.870 587 HD13 LEU 70 HD13 LEU 70 14.406 -10.416 9.636 588 HD21 LEU 70 HD21 LEU 70 14.294 -13.804 8.100 589 HD22 LEU 70 HD22 LEU 70 15.461 -13.388 9.357 590 HD23 LEU 70 HD23 LEU 70 15.104 -12.237 8.066 591 H GLU 71 H GLU 71 10.538 -16.569 9.548 592 HA GLU 71 HA GLU 71 10.035 -17.102 12.365 593 HB2 GLU 71 HB2 GLU 71 8.143 -17.045 10.816 594 HB3 GLU 71 HB3 GLU 71 8.851 -18.326 9.838 595 HG2 GLU 71 HG2 GLU 71 8.575 -19.917 11.691 596 HG3 GLU 71 HG3 GLU 71 7.927 -18.632 12.713 597 H HIS 72 H HIS 72 11.550 -18.282 13.423 598 HA HIS 72 HA HIS 72 13.172 -20.305 12.073 599 HB2 HIS 72 HB2 HIS 72 13.358 -19.225 14.919 600 HB3 HIS 72 HB3 HIS 72 14.531 -20.291 14.151 601 HD1 HIS 72 HD1 HIS 72 13.450 -16.729 14.329 602 HD2 HIS 72 HD2 HIS 72 16.235 -19.010 12.260 603 HE1 HIS 72 HE1 HIS 72 15.024 -15.078 13.293 604 HE2 HIS 72 HE2 HIS 72 16.817 -16.491 12.243 605 H HIS 73 H HIS 73 10.966 -21.590 11.924 606 HA HIS 73 HA HIS 73 11.536 -23.963 13.365 607 HB2 HIS 73 HB2 HIS 73 9.333 -24.322 14.507 608 HB3 HIS 73 HB3 HIS 73 10.293 -23.043 15.227 609 HD1 HIS 73 HD1 HIS 73 9.175 -20.843 15.533 610 HD2 HIS 73 HD2 HIS 73 7.064 -23.297 12.927 611 HE1 HIS 73 HE1 HIS 73 6.991 -19.691 15.146 612 HE2 HIS 73 HE2 HIS 73 5.834 -21.070 13.404 613 H HIS 74 H HIS 74 10.322 -25.816 12.663 614 HA HIS 74 HA HIS 74 9.577 -25.707 9.900 615 HB2 HIS 74 HB2 HIS 74 9.023 -28.194 10.254 616 HB3 HIS 74 HB3 HIS 74 10.681 -27.697 10.533 617 HD1 HIS 74 HD1 HIS 74 7.555 -28.282 12.689 618 HD2 HIS 74 HD2 HIS 74 11.682 -28.753 12.823 619 HE1 HIS 74 HE1 HIS 74 8.034 -29.385 14.886 620 HE2 HIS 74 HE2 HIS 74 10.518 -29.715 14.924 621 H HIS 75 H HIS 75 7.796 -24.427 9.596 622 HA HIS 75 HA HIS 75 5.231 -25.130 10.923 623 HB2 HIS 75 HB2 HIS 75 5.869 -22.847 11.378 624 HB3 HIS 75 HB3 HIS 75 6.254 -22.543 9.691 625 HD1 HIS 75 HD1 HIS 75 3.139 -23.494 11.694 626 HD2 HIS 75 HD2 HIS 75 4.278 -21.130 8.471 627 HE1 HIS 75 HE1 HIS 75 1.044 -22.369 10.911 628 HE2 HIS 75 HE2 HIS 75 1.766 -20.885 9.015 629 H HIS 76 H HIS 76 4.085 -26.525 9.644 630 HA HIS 76 HA HIS 76 3.508 -25.651 6.865 631 HB2 HIS 76 HB2 HIS 76 2.918 -27.991 6.294 632 HB3 HIS 76 HB3 HIS 76 4.593 -27.854 6.795 633 HD1 HIS 76 HD1 HIS 76 5.345 -29.534 8.474 634 HD2 HIS 76 HD2 HIS 76 1.207 -29.166 8.430 635 HE1 HIS 76 HE1 HIS 76 4.492 -31.333 10.005 636 HE2 HIS 76 HE2 HIS 76 2.012 -30.964 10.108 637 H HIS 77 H HIS 77 1.380 -25.515 6.231 638 HA HIS 77 HA HIS 77 -0.824 -26.333 7.936 639 HB2 HIS 77 HB2 HIS 77 -0.140 -24.127 8.943 640 HB3 HIS 77 HB3 HIS 77 -0.422 -23.347 7.388 641 HD1 HIS 77 HD1 HIS 77 -2.849 -22.834 6.760 642 HD2 HIS 77 HD2 HIS 77 -2.506 -24.976 10.308 643 HE1 HIS 77 HE1 HIS 77 -5.138 -22.801 7.792 644 HE2 HIS 77 HE2 HIS 77 -4.893 -24.019 9.974 645 H1 MET 1 H MET 1 3.408 -20.565 -4.471 646 HA MET 1 HA MET 1 1.081 -20.705 -4.666 647 HB2 MET 1 HB2 MET 1 -0.409 -20.077 -2.796 648 HB3 MET 1 HB3 MET 1 0.824 -21.212 -2.264 649 HG2 MET 1 HG2 MET 1 2.085 -19.406 -1.211 650 HG3 MET 1 HG3 MET 1 0.924 -18.216 -1.807 651 HE1 MET 1 HE1 MET 1 0.203 -18.285 2.078 652 HE2 MET 1 HE2 MET 1 0.577 -17.253 0.698 653 HE3 MET 1 HE3 MET 1 1.770 -18.419 1.278 654 H LYS 2 H LYS 2 -0.810 -18.832 -4.433 655 HA LYS 2 HA LYS 2 -0.046 -16.578 -5.946 656 HB2 LYS 2 HB2 LYS 2 -2.371 -15.711 -5.405 657 HB3 LYS 2 HB3 LYS 2 -2.322 -17.326 -6.098 658 HG2 LYS 2 HG2 LYS 2 -2.661 -18.306 -3.863 659 HG3 LYS 2 HG3 LYS 2 -2.690 -16.696 -3.150 660 HD2 LYS 2 HD2 LYS 2 -4.701 -17.652 -5.234 661 HD3 LYS 2 HD3 LYS 2 -4.959 -17.798 -3.497 662 HE2 LYS 2 HE2 LYS 2 -6.148 -15.848 -4.163 663 HE3 LYS 2 HE3 LYS 2 -4.691 -15.250 -3.380 664 HZ1 LYS 2 HZ1 LYS 2 -5.060 -15.492 -6.317 665 HZ2 LYS 2 HZ2 LYS 2 -3.734 -14.804 -5.526 666 HZ3 LYS 2 HZ3 LYS 2 -5.248 -14.066 -5.430 667 H MET 3 H MET 3 1.669 -15.482 -4.968 668 HA MET 3 HA MET 3 1.472 -14.322 -2.316 669 HB2 MET 3 HB2 MET 3 3.516 -13.854 -4.535 670 HB3 MET 3 HB3 MET 3 3.639 -13.212 -2.902 671 HG2 MET 3 HG2 MET 3 3.737 -15.529 -2.027 672 HG3 MET 3 HG3 MET 3 3.687 -16.136 -3.684 673 HE1 MET 3 HE1 MET 3 5.642 -12.948 -2.258 674 HE2 MET 3 HE2 MET 3 7.208 -13.686 -1.916 675 HE3 MET 3 HE3 MET 3 5.787 -14.166 -0.988 676 H LEU 4 H LEU 4 0.285 -12.587 -1.911 677 HA LEU 4 HA LEU 4 -0.924 -10.893 -3.831 678 HB2 LEU 4 HB2 LEU 4 -0.566 -10.495 -0.843 679 HB3 LEU 4 HB3 LEU 4 -1.547 -9.443 -1.842 680 HG LEU 4 HG LEU 4 -3.087 -10.884 -0.767 681 HD11 LEU 4 HD11 LEU 4 -2.675 -12.044 -3.528 682 HD12 LEU 4 HD12 LEU 4 -3.583 -10.585 -3.122 683 HD13 LEU 4 HD13 LEU 4 -4.147 -12.155 -2.556 684 HD21 LEU 4 HD21 LEU 4 -2.958 -13.331 -0.679 685 HD22 LEU 4 HD22 LEU 4 -1.549 -12.593 0.082 686 HD23 LEU 4 HD23 LEU 4 -1.409 -13.298 -1.531 687 H LYS 5 H LYS 5 2.246 -10.774 -2.567 688 HA LYS 5 HA LYS 5 2.949 -8.045 -2.953 689 HB2 LYS 5 HB2 LYS 5 4.278 -9.787 -1.680 690 HB3 LYS 5 HB3 LYS 5 4.710 -10.524 -3.218 691 HG2 LYS 5 HG2 LYS 5 5.378 -7.624 -2.875 692 HG3 LYS 5 HG3 LYS 5 6.302 -8.762 -1.899 693 HD2 LYS 5 HD2 LYS 5 6.026 -8.974 -4.924 694 HD3 LYS 5 HD3 LYS 5 7.346 -8.117 -4.125 695 HE2 LYS 5 HE2 LYS 5 6.711 -11.068 -3.763 696 HE3 LYS 5 HE3 LYS 5 7.973 -10.409 -4.800 697 HZ1 LYS 5 HZ1 LYS 5 8.975 -9.391 -2.809 698 HZ2 LYS 5 HZ2 LYS 5 8.945 -11.075 -2.750 699 HZ3 LYS 5 HZ3 LYS 5 7.832 -10.186 -1.846 700 H GLU 6 H GLU 6 2.939 -10.880 -5.123 701 HA GLU 6 HA GLU 6 4.059 -9.574 -7.403 702 HB2 GLU 6 HB2 GLU 6 3.954 -12.093 -6.963 703 HB3 GLU 6 HB3 GLU 6 2.257 -12.038 -7.404 704 HG2 GLU 6 HG2 GLU 6 4.523 -11.250 -9.267 705 HG3 GLU 6 HG3 GLU 6 3.841 -12.870 -9.191 706 H LYS 7 H LYS 7 0.748 -10.218 -6.295 707 HA LYS 7 HA LYS 7 -0.724 -9.191 -8.467 708 HB2 LYS 7 HB2 LYS 7 -1.591 -10.650 -6.590 709 HB3 LYS 7 HB3 LYS 7 -1.564 -9.252 -5.529 710 HG2 LYS 7 HG2 LYS 7 -3.164 -9.116 -8.085 711 HG3 LYS 7 HG3 LYS 7 -3.804 -10.051 -6.735 712 HD2 LYS 7 HD2 LYS 7 -3.762 -8.046 -5.299 713 HD3 LYS 7 HD3 LYS 7 -3.041 -7.100 -6.605 714 HE2 LYS 7 HE2 LYS 7 -5.453 -6.653 -6.419 715 HE3 LYS 7 HE3 LYS 7 -5.073 -7.406 -7.966 716 HZ1 LYS 7 HZ1 LYS 7 -7.055 -8.350 -7.005 717 HZ2 LYS 7 HZ2 LYS 7 -6.224 -8.775 -5.595 718 HZ3 LYS 7 HZ3 LYS 7 -5.837 -9.523 -7.058 719 H ALA 8 H ALA 8 0.645 -7.565 -5.636 720 HA ALA 8 HA ALA 8 -0.262 -4.934 -5.991 721 HB1 ALA 8 HB1 ALA 8 1.744 -4.242 -4.745 722 HB2 ALA 8 HB2 ALA 8 2.480 -5.826 -5.022 723 HB3 ALA 8 HB3 ALA 8 1.029 -5.686 -4.025 724 H GLY 9 H GLY 9 2.586 -6.547 -7.448 725 HA2 GLY 9 HA2 GLY 9 3.507 -4.384 -9.043 726 HA3 GLY 9 HA3 GLY 9 3.901 -6.078 -9.266 727 H ALA 10 H ALA 10 1.164 -6.949 -9.693 728 HA ALA 10 HA ALA 10 0.850 -6.553 -12.485 729 HB1 ALA 10 HB1 ALA 10 0.114 -8.594 -11.327 730 HB2 ALA 10 HB2 ALA 10 -1.222 -7.856 -12.218 731 HB3 ALA 10 HB3 ALA 10 -1.117 -7.669 -10.466 732 H LEU 11 H LEU 11 -0.896 -5.216 -9.673 733 HA LEU 11 HA LEU 11 -2.698 -3.503 -11.053 734 HB2 LEU 11 HB2 LEU 11 -1.491 -3.297 -8.270 735 HB3 LEU 11 HB3 LEU 11 -2.805 -2.278 -8.844 736 HG LEU 11 HG LEU 11 -3.002 -5.312 -8.635 737 HD11 LEU 11 HD11 LEU 11 -4.311 -4.957 -6.591 738 HD12 LEU 11 HD12 LEU 11 -3.974 -3.228 -6.663 739 HD13 LEU 11 HD13 LEU 11 -2.657 -4.375 -6.408 740 HD21 LEU 11 HD21 LEU 11 -5.431 -4.926 -8.842 741 HD22 LEU 11 HD22 LEU 11 -4.567 -4.326 -10.256 742 HD23 LEU 11 HD23 LEU 11 -5.151 -3.193 -9.032 743 H ALA 12 H ALA 12 0.604 -3.081 -9.863 744 HA ALA 12 HA ALA 12 0.896 -0.300 -10.112 745 HB1 ALA 12 HB1 ALA 12 3.298 -0.706 -10.006 746 HB2 ALA 12 HB2 ALA 12 3.048 -2.418 -10.382 747 HB3 ALA 12 HB3 ALA 12 2.442 -1.746 -8.868 748 H GLY 13 H GLY 13 1.463 -2.871 -12.512 749 HA2 GLY 13 HA2 GLY 13 2.722 -1.410 -14.542 750 HA3 GLY 13 HA3 GLY 13 1.735 -2.840 -14.783 751 H GLN 14 H GLN 14 -0.769 -2.137 -14.229 752 HA GLN 14 HA GLN 14 -1.554 -0.546 -16.467 753 HB2 GLN 14 HB2 GLN 14 -3.878 -1.033 -15.746 754 HB3 GLN 14 HB3 GLN 14 -2.877 -2.476 -15.828 755 HG2 GLN 14 HG2 GLN 14 -2.602 -2.380 -13.350 756 HG3 GLN 14 HG3 GLN 14 -3.704 -1.004 -13.308 757 HE21 GLN 14 HE21 GLN 14 -3.978 -3.644 -12.060 758 HE22 GLN 14 HE22 GLN 14 -5.458 -4.296 -12.649 759 H ILE 15 H ILE 15 -1.307 0.143 -13.001 760 HA ILE 15 HA ILE 15 -2.720 2.628 -12.998 761 HB ILE 15 HB ILE 15 -0.665 1.469 -11.079 762 HG12 ILE 15 HG12 ILE 15 -3.673 1.947 -10.820 763 HG13 ILE 15 HG13 ILE 15 -2.911 0.391 -11.126 764 HG21 ILE 15 HG21 ILE 15 -2.147 4.101 -10.728 765 HG22 ILE 15 HG22 ILE 15 -0.408 3.907 -10.947 766 HG23 ILE 15 HG23 ILE 15 -1.183 3.298 -9.486 767 HD11 ILE 15 HD11 ILE 15 -2.631 2.040 -8.615 768 HD12 ILE 15 HD12 ILE 15 -1.864 0.478 -8.914 769 HD13 ILE 15 HD13 ILE 15 -3.621 0.595 -8.821 770 H TRP 16 H TRP 16 0.729 1.836 -13.327 771 HA TRP 16 HA TRP 16 1.832 4.397 -13.522 772 HB2 TRP 16 HB2 TRP 16 3.135 2.267 -13.262 773 HB3 TRP 16 HB3 TRP 16 2.769 1.850 -14.931 774 HD1 TRP 16 HD1 TRP 16 4.997 4.147 -12.834 775 HE1 TRP 16 HE1 TRP 16 6.799 5.190 -14.352 776 HE3 TRP 16 HE3 TRP 16 3.283 2.525 -17.373 777 HZ2 TRP 16 HZ2 TRP 16 7.422 5.305 -17.100 778 HZ3 TRP 16 HZ3 TRP 16 4.531 3.144 -19.401 779 HH2 TRP 16 HH2 TRP 16 6.558 4.508 -19.268 780 H GLU 17 H GLU 17 0.443 2.328 -16.068 781 HA GLU 17 HA GLU 17 0.996 3.914 -18.346 782 HB2 GLU 17 HB2 GLU 17 -1.319 1.988 -17.888 783 HB3 GLU 17 HB3 GLU 17 -0.835 2.630 -19.456 784 HG2 GLU 17 HG2 GLU 17 1.345 1.487 -19.235 785 HG3 GLU 17 HG3 GLU 17 0.828 0.818 -17.686 786 H ALA 18 H ALA 18 -1.705 4.056 -16.040 787 HA ALA 18 HA ALA 18 -3.397 5.866 -17.447 788 HB1 ALA 18 HB1 ALA 18 -4.181 4.488 -15.555 789 HB2 ALA 18 HB2 ALA 18 -4.517 6.199 -15.277 790 HB3 ALA 18 HB3 ALA 18 -3.165 5.415 -14.451 791 H LEU 19 H LEU 19 -0.654 6.346 -15.277 792 HA LEU 19 HA LEU 19 -0.869 9.246 -15.195 793 HB2 LEU 19 HB2 LEU 19 1.190 7.273 -14.167 794 HB3 LEU 19 HB3 LEU 19 1.471 9.003 -14.099 795 HG LEU 19 HG LEU 19 -0.489 9.280 -12.607 796 HD11 LEU 19 HD11 LEU 19 -1.885 7.403 -13.331 797 HD12 LEU 19 HD12 LEU 19 -1.613 7.360 -11.592 798 HD13 LEU 19 HD13 LEU 19 -0.725 6.261 -12.648 799 HD21 LEU 19 HD21 LEU 19 1.741 8.954 -11.636 800 HD22 LEU 19 HD22 LEU 19 1.487 7.206 -11.610 801 HD23 LEU 19 HD23 LEU 19 0.487 8.262 -10.609 802 H ASN 20 H ASN 20 0.655 6.899 -17.281 803 HA ASN 20 HA ASN 20 2.732 8.608 -18.329 804 HB2 ASN 20 HB2 ASN 20 2.864 6.088 -18.341 805 HB3 ASN 20 HB3 ASN 20 1.575 6.046 -19.536 806 HD21 ASN 20 HD21 ASN 20 3.629 4.771 -20.368 807 HD22 ASN 20 HD22 ASN 20 4.620 5.665 -21.459 808 H GLY 21 H GLY 21 2.552 10.094 -19.951 809 HA2 GLY 21 HA2 GLY 21 1.691 11.149 -21.868 810 HA3 GLY 21 HA3 GLY 21 0.254 10.145 -21.786 811 H THR 22 H THR 22 0.321 11.073 -18.745 812 HA THR 22 HA THR 22 -1.152 13.628 -19.159 813 HB THR 22 HB THR 22 -2.417 13.157 -17.103 814 HG1 THR 22 HG1 THR 22 -1.767 10.591 -16.615 815 HG21 THR 22 HG21 THR 22 -3.714 11.164 -17.772 816 HG22 THR 22 HG22 THR 22 -2.444 10.704 -18.909 817 HG23 THR 22 HG23 THR 22 -3.365 12.190 -19.167 818 H GLU 23 H GLU 23 -1.057 15.095 -17.137 819 HA GLU 23 HA GLU 23 1.653 15.492 -16.192 820 HB2 GLU 23 HB2 GLU 23 -0.918 16.859 -15.287 821 HB3 GLU 23 HB3 GLU 23 0.725 17.437 -15.007 822 HG2 GLU 23 HG2 GLU 23 1.015 17.769 -17.432 823 HG3 GLU 23 HG3 GLU 23 -0.624 17.181 -17.713 824 H GLY 24 H GLY 24 -0.501 13.222 -15.261 825 HA2 GLY 24 HA2 GLY 24 -0.211 11.866 -13.290 826 HA3 GLY 24 HA3 GLY 24 0.125 13.325 -12.367 827 H LEU 25 H LEU 25 -1.828 11.383 -11.671 828 HA LEU 25 HA LEU 25 -4.377 12.881 -11.920 829 HB2 LEU 25 HB2 LEU 25 -3.988 9.872 -12.235 830 HB3 LEU 25 HB3 LEU 25 -5.556 10.647 -12.077 831 HG LEU 25 HG LEU 25 -3.618 11.055 -14.395 832 HD11 LEU 25 HD11 LEU 25 -6.214 9.483 -14.292 833 HD12 LEU 25 HD12 LEU 25 -4.585 8.815 -14.435 834 HD13 LEU 25 HD13 LEU 25 -5.249 9.792 -15.740 835 HD21 LEU 25 HD21 LEU 25 -6.440 12.126 -14.017 836 HD22 LEU 25 HD22 LEU 25 -5.471 12.278 -15.487 837 HD23 LEU 25 HD23 LEU 25 -4.950 13.073 -14.004 838 H THR 26 H THR 26 -5.844 12.594 -10.090 839 HA THR 26 HA THR 26 -4.608 11.908 -7.536 840 HB THR 26 HB THR 26 -6.752 12.458 -6.484 841 HG1 THR 26 HG1 THR 26 -8.544 13.085 -7.936 842 HG21 THR 26 HG21 THR 26 -7.096 14.783 -7.236 843 HG22 THR 26 HG22 THR 26 -6.195 14.449 -8.716 844 HG23 THR 26 HG23 THR 26 -5.373 14.404 -7.153 845 H GLN 27 H GLN 27 -5.700 10.271 -6.056 846 HA GLN 27 HA GLN 27 -5.648 7.716 -7.113 847 HB2 GLN 27 HB2 GLN 27 -6.731 6.971 -4.952 848 HB3 GLN 27 HB3 GLN 27 -5.312 7.991 -4.770 849 HG2 GLN 27 HG2 GLN 27 -6.730 9.920 -4.290 850 HG3 GLN 27 HG3 GLN 27 -8.173 8.936 -4.515 851 HE21 GLN 27 HE21 GLN 27 -7.143 6.607 -3.083 852 HE22 GLN 27 HE22 GLN 27 -7.088 7.050 -1.420 853 H LYS 28 H LYS 28 -8.541 9.739 -6.599 854 HA LYS 28 HA LYS 28 -10.520 7.852 -7.350 855 HB2 LYS 28 HB2 LYS 28 -10.574 10.898 -7.494 856 HB3 LYS 28 HB3 LYS 28 -11.968 9.900 -7.876 857 HG2 LYS 28 HG2 LYS 28 -12.281 10.706 -5.649 858 HG3 LYS 28 HG3 LYS 28 -11.888 8.988 -5.522 859 HD2 LYS 28 HD2 LYS 28 -9.550 9.588 -4.953 860 HD3 LYS 28 HD3 LYS 28 -9.959 11.300 -5.065 861 HE2 LYS 28 HE2 LYS 28 -11.216 9.365 -3.083 862 HE3 LYS 28 HE3 LYS 28 -9.852 10.423 -2.720 863 HZ1 LYS 28 HZ1 LYS 28 -11.944 11.379 -1.993 864 HZ2 LYS 28 HZ2 LYS 28 -12.551 11.333 -3.567 865 HZ3 LYS 28 HZ3 LYS 28 -11.236 12.336 -3.194 866 H GLN 29 H GLN 29 -8.669 10.189 -9.312 867 HA GLN 29 HA GLN 29 -10.004 9.755 -11.805 868 HB2 GLN 29 HB2 GLN 29 -7.189 10.808 -11.299 869 HB3 GLN 29 HB3 GLN 29 -8.054 10.928 -12.828 870 HG2 GLN 29 HG2 GLN 29 -9.000 12.224 -10.257 871 HG3 GLN 29 HG3 GLN 29 -7.963 13.029 -11.429 872 HE21 GLN 29 HE21 GLN 29 -9.454 14.643 -11.838 873 HE22 GLN 29 HE22 GLN 29 -10.917 14.376 -12.712 874 H ILE 30 H ILE 30 -7.058 8.386 -10.373 875 HA ILE 30 HA ILE 30 -6.146 6.852 -12.569 876 HB ILE 30 HB ILE 30 -5.688 6.373 -9.585 877 HG12 ILE 30 HG12 ILE 30 -3.900 7.817 -11.590 878 HG13 ILE 30 HG13 ILE 30 -4.971 8.636 -10.465 879 HG21 ILE 30 HG21 ILE 30 -5.152 4.343 -10.870 880 HG22 ILE 30 HG22 ILE 30 -3.674 5.095 -10.273 881 HG23 ILE 30 HG23 ILE 30 -4.132 5.282 -11.967 882 HD11 ILE 30 HD11 ILE 30 -3.684 7.758 -8.588 883 HD12 ILE 30 HD12 ILE 30 -2.671 8.668 -9.708 884 HD13 ILE 30 HD13 ILE 30 -2.619 6.906 -9.711 885 H LYS 31 H LYS 31 -8.160 5.984 -9.753 886 HA LYS 31 HA LYS 31 -8.641 3.287 -10.150 887 HB2 LYS 31 HB2 LYS 31 -10.433 5.487 -9.087 888 HB3 LYS 31 HB3 LYS 31 -10.965 3.813 -9.108 889 HG2 LYS 31 HG2 LYS 31 -9.213 3.166 -7.573 890 HG3 LYS 31 HG3 LYS 31 -8.490 4.775 -7.650 891 HD2 LYS 31 HD2 LYS 31 -9.721 4.665 -5.596 892 HD3 LYS 31 HD3 LYS 31 -10.634 5.708 -6.682 893 HE2 LYS 31 HE2 LYS 31 -11.277 2.783 -6.144 894 HE3 LYS 31 HE3 LYS 31 -12.052 4.139 -5.339 895 HZ1 LYS 31 HZ1 LYS 31 -12.219 3.435 -8.217 896 HZ2 LYS 31 HZ2 LYS 31 -12.852 4.858 -7.556 897 HZ3 LYS 31 HZ3 LYS 31 -13.452 3.355 -7.063 898 H LYS 32 H LYS 32 -10.366 6.021 -11.642 899 HA LYS 32 HA LYS 32 -12.341 4.504 -13.019 900 HB2 LYS 32 HB2 LYS 32 -12.559 6.918 -12.450 901 HB3 LYS 32 HB3 LYS 32 -11.291 7.306 -13.602 902 HG2 LYS 32 HG2 LYS 32 -13.466 7.806 -14.556 903 HG3 LYS 32 HG3 LYS 32 -12.718 6.478 -15.448 904 HD2 LYS 32 HD2 LYS 32 -14.121 4.857 -14.195 905 HD3 LYS 32 HD3 LYS 32 -14.864 6.188 -13.301 906 HE2 LYS 32 HE2 LYS 32 -15.050 5.710 -16.296 907 HE3 LYS 32 HE3 LYS 32 -16.332 5.439 -15.113 908 HZ1 LYS 32 HZ1 LYS 32 -16.684 7.516 -16.225 909 HZ2 LYS 32 HZ2 LYS 32 -15.126 8.050 -15.857 910 HZ3 LYS 32 HZ3 LYS 32 -16.261 7.842 -14.621 911 H ALA 33 H ALA 33 -9.156 5.749 -13.977 912 HA ALA 33 HA ALA 33 -9.306 5.027 -16.751 913 HB1 ALA 33 HB1 ALA 33 -6.912 5.608 -16.804 914 HB2 ALA 33 HB2 ALA 33 -6.874 5.655 -15.037 915 HB3 ALA 33 HB3 ALA 33 -7.845 6.827 -15.931 916 H THR 34 H THR 34 -8.124 3.382 -13.856 917 HA THR 34 HA THR 34 -6.935 1.134 -15.357 918 HB THR 34 HB THR 34 -6.034 0.400 -13.160 919 HG1 THR 34 HG1 THR 34 -6.799 2.723 -11.838 920 HG21 THR 34 HG21 THR 34 -4.525 2.302 -12.730 921 HG22 THR 34 HG22 THR 34 -5.564 3.361 -13.685 922 HG23 THR 34 HG23 THR 34 -4.708 2.024 -14.463 923 H LYS 35 H LYS 35 -9.863 1.935 -13.904 924 HA LYS 35 HA LYS 35 -11.849 0.889 -13.752 925 HB2 LYS 35 HB2 LYS 35 -10.589 -1.718 -14.688 926 HB3 LYS 35 HB3 LYS 35 -12.300 -1.295 -14.705 927 HG2 LYS 35 HG2 LYS 35 -10.092 -0.161 -16.457 928 HG3 LYS 35 HG3 LYS 35 -11.474 -1.137 -16.962 929 HD2 LYS 35 HD2 LYS 35 -13.012 0.675 -16.537 930 HD3 LYS 35 HD3 LYS 35 -11.768 1.629 -15.727 931 HE2 LYS 35 HE2 LYS 35 -10.532 1.750 -17.921 932 HE3 LYS 35 HE3 LYS 35 -11.909 0.950 -18.681 933 HZ1 LYS 35 HZ1 LYS 35 -13.306 2.793 -17.996 934 HZ2 LYS 35 HZ2 LYS 35 -12.009 3.339 -18.934 935 HZ3 LYS 35 HZ3 LYS 35 -11.988 3.556 -17.258 936 H LEU 36 H LEU 36 -9.576 0.790 -11.730 937 HA LEU 36 HA LEU 36 -10.195 -1.272 -9.846 938 HB2 LEU 36 HB2 LEU 36 -8.609 1.277 -9.828 939 HB3 LEU 36 HB3 LEU 36 -9.111 0.655 -8.269 940 HG LEU 36 HG LEU 36 -7.851 -1.392 -8.589 941 HD11 LEU 36 HD11 LEU 36 -8.131 -1.777 -10.976 942 HD12 LEU 36 HD12 LEU 36 -6.434 -1.841 -10.516 943 HD13 LEU 36 HD13 LEU 36 -7.070 -0.414 -11.336 944 HD21 LEU 36 HD21 LEU 36 -6.667 0.540 -7.692 945 HD22 LEU 36 HD22 LEU 36 -6.180 1.020 -9.322 946 HD23 LEU 36 HD23 LEU 36 -5.578 -0.488 -8.624 947 H LYS 37 H LYS 37 -12.191 -1.449 -9.004 948 HA LYS 37 HA LYS 37 -14.060 0.703 -8.748 949 HB2 LYS 37 HB2 LYS 37 -15.630 -0.892 -7.948 950 HB3 LYS 37 HB3 LYS 37 -14.638 -1.769 -9.098 951 HG2 LYS 37 HG2 LYS 37 -14.392 -1.944 -6.070 952 HG3 LYS 37 HG3 LYS 37 -15.214 -3.112 -7.105 953 HD2 LYS 37 HD2 LYS 37 -13.079 -3.697 -8.184 954 HD3 LYS 37 HD3 LYS 37 -12.234 -2.473 -7.230 955 HE2 LYS 37 HE2 LYS 37 -12.813 -3.707 -5.158 956 HE3 LYS 37 HE3 LYS 37 -13.641 -4.931 -6.123 957 HZ1 LYS 37 HZ1 LYS 37 -10.748 -4.286 -6.226 958 HZ2 LYS 37 HZ2 LYS 37 -11.529 -5.445 -7.185 959 HZ3 LYS 37 HZ3 LYS 37 -11.448 -5.647 -5.512 960 H ALA 38 H ALA 38 -11.687 -0.707 -6.615 961 HA ALA 38 HA ALA 38 -12.537 1.001 -4.341 962 HB1 ALA 38 HB1 ALA 38 -11.332 -1.791 -4.189 963 HB2 ALA 38 HB2 ALA 38 -13.025 -1.384 -3.905 964 HB3 ALA 38 HB3 ALA 38 -11.781 -0.775 -2.811 965 H ASP 39 H ASP 39 -10.969 2.099 -3.248 966 HA ASP 39 HA ASP 39 -8.383 2.620 -4.281 967 HB2 ASP 39 HB2 ASP 39 -9.401 3.062 -1.443 968 HB3 ASP 39 HB3 ASP 39 -7.988 3.827 -2.167 969 H LYS 40 H LYS 40 -9.600 0.150 -2.175 970 HA LYS 40 HA LYS 40 -7.423 -0.711 -0.686 971 HB2 LYS 40 HB2 LYS 40 -9.496 -2.508 -2.013 972 HB3 LYS 40 HB3 LYS 40 -8.532 -2.899 -0.586 973 HG2 LYS 40 HG2 LYS 40 -10.582 -0.663 -0.737 974 HG3 LYS 40 HG3 LYS 40 -10.892 -2.270 -0.069 975 HD2 LYS 40 HD2 LYS 40 -9.193 -1.866 1.690 976 HD3 LYS 40 HD3 LYS 40 -8.842 -0.276 0.998 977 HE2 LYS 40 HE2 LYS 40 -11.078 0.510 1.543 978 HE3 LYS 40 HE3 LYS 40 -11.564 -1.104 2.063 979 HZ1 LYS 40 HZ1 LYS 40 -11.082 0.339 3.909 980 HZ2 LYS 40 HZ2 LYS 40 -9.500 0.576 3.364 981 HZ3 LYS 40 HZ3 LYS 40 -10.005 -0.963 3.871 982 H ASP 41 H ASP 41 -8.243 -1.610 -4.061 983 HA ASP 41 HA ASP 41 -5.990 -3.286 -4.576 984 HB2 ASP 41 HB2 ASP 41 -7.504 -1.585 -6.610 985 HB3 ASP 41 HB3 ASP 41 -6.587 -3.060 -6.927 986 H PHE 42 H PHE 42 -6.676 0.142 -5.192 987 HA PHE 42 HA PHE 42 -4.381 0.926 -6.533 988 HB2 PHE 42 HB2 PHE 42 -6.380 2.320 -6.436 989 HB3 PHE 42 HB3 PHE 42 -6.180 2.562 -4.704 990 HD1 PHE 42 HD2 PHE 42 -4.472 3.163 -7.982 991 HD2 PHE 42 HD1 PHE 42 -4.949 4.438 -3.921 992 HE1 PHE 42 HE2 PHE 42 -3.065 5.130 -8.419 993 HE2 PHE 42 HE1 PHE 42 -3.530 6.394 -4.376 994 HZ PHE 42 HZ PHE 42 -2.592 6.740 -6.623 995 H PHE 43 H PHE 43 -4.811 0.667 -2.989 996 HA PHE 43 HA PHE 43 -2.437 2.064 -2.251 997 HB2 PHE 43 HB2 PHE 43 -3.965 -0.054 -0.688 998 HB3 PHE 43 HB3 PHE 43 -2.723 1.000 -0.014 999 HD1 PHE 43 HD1 PHE 43 -3.423 3.626 -1.267 1000 HD2 PHE 43 HD2 PHE 43 -5.940 0.610 0.439 1001 HE1 PHE 43 HE1 PHE 43 -5.123 5.335 -0.760 1002 HE2 PHE 43 HE2 PHE 43 -7.637 2.318 0.936 1003 HZ PHE 43 HZ PHE 43 -7.227 4.677 0.341 1004 H LEU 44 H LEU 44 -3.020 -1.332 -3.060 1005 HA LEU 44 HA LEU 44 -0.358 -2.271 -2.494 1006 HB2 LEU 44 HB2 LEU 44 -2.687 -3.389 -4.076 1007 HB3 LEU 44 HB3 LEU 44 -1.122 -4.175 -4.146 1008 HG LEU 44 HG LEU 44 -1.201 -4.590 -1.702 1009 HD11 LEU 44 HD11 LEU 44 -3.982 -3.386 -1.757 1010 HD12 LEU 44 HD12 LEU 44 -2.564 -2.708 -0.954 1011 HD13 LEU 44 HD13 LEU 44 -3.243 -4.232 -0.392 1012 HD21 LEU 44 HD21 LEU 44 -2.921 -6.337 -1.714 1013 HD22 LEU 44 HD22 LEU 44 -2.042 -6.313 -3.241 1014 HD23 LEU 44 HD23 LEU 44 -3.664 -5.620 -3.147 1015 H GLY 45 H GLY 45 -2.036 -1.134 -5.438 1016 HA2 GLY 45 HA2 GLY 45 0.058 -1.557 -7.310 1017 HA3 GLY 45 HA3 GLY 45 -1.288 -0.449 -7.506 1018 H LEU 46 H LEU 46 -1.052 1.625 -6.074 1019 HA LEU 46 HA LEU 46 1.155 3.196 -6.617 1020 HB2 LEU 46 HB2 LEU 46 -0.943 4.162 -5.814 1021 HB3 LEU 46 HB3 LEU 46 -0.752 3.378 -4.254 1022 HG LEU 46 HG LEU 46 1.263 4.793 -3.801 1023 HD11 LEU 46 HD11 LEU 46 1.786 6.708 -5.228 1024 HD12 LEU 46 HD12 LEU 46 0.581 6.180 -6.401 1025 HD13 LEU 46 HD13 LEU 46 2.003 5.184 -6.083 1026 HD21 LEU 46 HD21 LEU 46 -0.929 5.530 -2.960 1027 HD22 LEU 46 HD22 LEU 46 -1.206 6.435 -4.450 1028 HD23 LEU 46 HD23 LEU 46 0.104 6.901 -3.364 1029 H GLY 47 H GLY 47 0.683 1.014 -3.867 1030 HA2 GLY 47 HA2 GLY 47 2.906 1.733 -2.274 1031 HA3 GLY 47 HA3 GLY 47 2.142 0.146 -2.306 1032 H TRP 48 H TRP 48 2.614 -0.406 -5.069 1033 HA TRP 48 HA TRP 48 5.354 -1.273 -5.076 1034 HB2 TRP 48 HB2 TRP 48 3.362 -2.525 -6.085 1035 HB3 TRP 48 HB3 TRP 48 3.435 -1.383 -7.424 1036 HD1 TRP 48 HD1 TRP 48 5.484 -1.696 -9.173 1037 HE1 TRP 48 HE1 TRP 48 7.185 -3.589 -9.513 1038 HE3 TRP 48 HE3 TRP 48 4.689 -4.236 -4.842 1039 HZ2 TRP 48 HZ2 TRP 48 8.075 -5.877 -8.107 1040 HZ3 TRP 48 HZ3 TRP 48 5.992 -6.263 -4.398 1041 HH2 TRP 48 HH2 TRP 48 7.647 -7.070 -5.997 1042 H LEU 49 H LEU 49 3.522 1.289 -6.717 1043 HA LEU 49 HA LEU 49 5.520 2.328 -8.398 1044 HB2 LEU 49 HB2 LEU 49 3.080 3.471 -7.079 1045 HB3 LEU 49 HB3 LEU 49 4.205 4.588 -7.800 1046 HG LEU 49 HG LEU 49 3.862 3.642 -10.017 1047 HD11 LEU 49 HD11 LEU 49 3.565 1.299 -9.451 1048 HD12 LEU 49 HD12 LEU 49 2.239 1.877 -10.454 1049 HD13 LEU 49 HD13 LEU 49 1.997 1.651 -8.714 1050 HD21 LEU 49 HD21 LEU 49 1.217 4.136 -8.610 1051 HD22 LEU 49 HD22 LEU 49 1.502 4.237 -10.352 1052 HD23 LEU 49 HD23 LEU 49 2.292 5.378 -9.265 1053 H LEU 50 H LEU 50 4.949 2.877 -4.947 1054 HA LEU 50 HA LEU 50 7.199 4.641 -4.558 1055 HB2 LEU 50 HB2 LEU 50 5.584 3.033 -2.542 1056 HB3 LEU 50 HB3 LEU 50 6.776 4.259 -2.127 1057 HG LEU 50 HG LEU 50 4.161 4.760 -3.616 1058 HD11 LEU 50 HD11 LEU 50 3.770 4.245 -1.265 1059 HD12 LEU 50 HD12 LEU 50 3.429 5.940 -1.598 1060 HD13 LEU 50 HD13 LEU 50 4.923 5.489 -0.770 1061 HD21 LEU 50 HD21 LEU 50 4.683 7.162 -3.410 1062 HD22 LEU 50 HD22 LEU 50 5.892 6.320 -4.375 1063 HD23 LEU 50 HD23 LEU 50 6.256 6.769 -2.707 1064 H ARG 51 H ARG 51 6.650 1.153 -4.394 1065 HA ARG 51 HA ARG 51 8.873 0.247 -2.962 1066 HB2 ARG 51 HB2 ARG 51 6.856 -1.074 -3.680 1067 HB3 ARG 51 HB3 ARG 51 7.525 -1.179 -5.295 1068 HG2 ARG 51 HG2 ARG 51 8.949 -2.336 -2.876 1069 HG3 ARG 51 HG3 ARG 51 7.709 -3.226 -3.748 1070 HD2 ARG 51 HD2 ARG 51 9.239 -2.727 -5.850 1071 HD3 ARG 51 HD3 ARG 51 10.498 -2.484 -4.640 1072 HE ARG 51 HE ARG 51 9.367 -4.965 -5.514 1073 HH11 ARG 51 HH11 ARG 51 11.027 -3.531 -2.823 1074 HH12 ARG 51 HH12 ARG 51 11.419 -5.072 -2.143 1075 HH21 ARG 51 HH21 ARG 51 9.899 -6.876 -4.605 1076 HH22 ARG 51 HH22 ARG 51 10.781 -6.914 -3.119 1077 H GLU 52 H GLU 52 8.629 0.756 -6.498 1078 HA GLU 52 HA GLU 52 11.536 0.327 -6.809 1079 HB2 GLU 52 HB2 GLU 52 9.335 0.723 -8.864 1080 HB3 GLU 52 HB3 GLU 52 11.026 0.485 -9.270 1081 HG2 GLU 52 HG2 GLU 52 10.918 -1.776 -8.236 1082 HG3 GLU 52 HG3 GLU 52 9.206 -1.516 -7.892 1083 H ASP 53 H ASP 53 9.679 2.930 -5.957 1084 HA ASP 53 HA ASP 53 9.705 5.177 -6.125 1085 HB2 ASP 53 HB2 ASP 53 12.630 4.699 -6.835 1086 HB3 ASP 53 HB3 ASP 53 11.955 6.279 -6.456 1087 H LYS 54 H LYS 54 8.590 3.935 -8.232 1088 HA LYS 54 HA LYS 54 9.421 4.793 -10.834 1089 HB2 LYS 54 HB2 LYS 54 6.592 3.954 -10.036 1090 HB3 LYS 54 HB3 LYS 54 7.352 3.802 -11.622 1091 HG2 LYS 54 HG2 LYS 54 8.846 2.059 -10.763 1092 HG3 LYS 54 HG3 LYS 54 8.197 2.277 -9.140 1093 HD2 LYS 54 HD2 LYS 54 7.099 0.345 -9.905 1094 HD3 LYS 54 HD3 LYS 54 5.901 1.614 -10.167 1095 HE2 LYS 54 HE2 LYS 54 5.948 0.160 -12.104 1096 HE3 LYS 54 HE3 LYS 54 6.634 1.716 -12.567 1097 HZ1 LYS 54 HZ1 LYS 54 8.237 -0.670 -11.809 1098 HZ2 LYS 54 HZ2 LYS 54 8.828 0.798 -12.409 1099 HZ3 LYS 54 HZ3 LYS 54 7.901 -0.206 -13.399 1100 H VAL 55 H VAL 55 7.341 6.137 -8.304 1101 HA VAL 55 HA VAL 55 6.711 8.499 -9.979 1102 HB VAL 55 HB VAL 55 4.398 8.577 -9.305 1103 HG11 VAL 55 HG11 VAL 55 4.820 7.230 -11.300 1104 HG12 VAL 55 HG12 VAL 55 3.437 6.596 -10.405 1105 HG13 VAL 55 HG13 VAL 55 4.999 5.779 -10.307 1106 HG21 VAL 55 HG21 VAL 55 3.321 6.804 -7.905 1107 HG22 VAL 55 HG22 VAL 55 4.543 7.722 -7.028 1108 HG23 VAL 55 HG23 VAL 55 4.915 6.099 -7.613 1109 H VAL 56 H VAL 56 5.537 10.169 -8.547 1110 HA VAL 56 HA VAL 56 6.437 10.239 -5.771 1111 HB VAL 56 HB VAL 56 7.950 11.710 -6.986 1112 HG11 VAL 56 HG11 VAL 56 5.511 13.154 -8.085 1113 HG12 VAL 56 HG12 VAL 56 6.600 12.111 -9.002 1114 HG13 VAL 56 HG13 VAL 56 7.194 13.633 -8.333 1115 HG21 VAL 56 HG21 VAL 56 5.919 13.390 -5.458 1116 HG22 VAL 56 HG22 VAL 56 7.576 13.872 -5.837 1117 HG23 VAL 56 HG23 VAL 56 7.280 12.511 -4.752 1118 H THR 57 H THR 57 4.950 10.971 -4.292 1119 HA THR 57 HA THR 57 2.192 11.429 -5.285 1120 HB THR 57 HB THR 57 1.387 10.604 -3.092 1121 HG1 THR 57 HG1 THR 57 2.908 9.690 -1.618 1122 HG21 THR 57 HG21 THR 57 3.362 8.683 -4.381 1123 HG22 THR 57 HG22 THR 57 1.694 8.946 -4.897 1124 HG23 THR 57 HG23 THR 57 2.026 8.228 -3.320 1125 H SER 58 H SER 58 0.874 12.939 -4.108 1126 HA SER 58 HA SER 58 2.241 15.034 -2.542 1127 HB2 SER 58 HB2 SER 58 0.600 15.566 -5.074 1128 HB3 SER 58 HB3 SER 58 1.189 16.817 -3.970 1129 HG SER 58 HG SER 58 3.161 15.115 -4.823 1130 H GLU 59 H GLU 59 0.936 16.047 -1.067 1131 HA GLU 59 HA GLU 59 -1.838 15.083 -0.742 1132 HB2 GLU 59 HB2 GLU 59 -0.334 14.973 1.253 1133 HB3 GLU 59 HB3 GLU 59 -0.088 16.714 1.164 1134 HG2 GLU 59 HG2 GLU 59 -2.620 16.953 1.494 1135 HG3 GLU 59 HG3 GLU 59 -2.642 15.228 1.863 1136 H VAL 60 H VAL 60 -3.141 16.295 -2.042 1137 HA VAL 60 HA VAL 60 -2.931 19.272 -1.927 1138 HB VAL 60 HB VAL 60 -4.336 17.541 -4.029 1139 HG11 VAL 60 HG11 VAL 60 -4.046 20.576 -3.902 1140 HG12 VAL 60 HG12 VAL 60 -5.549 19.668 -3.711 1141 HG13 VAL 60 HG13 VAL 60 -4.711 19.670 -5.263 1142 HG21 VAL 60 HG21 VAL 60 -1.795 19.208 -4.221 1143 HG22 VAL 60 HG22 VAL 60 -2.561 18.361 -5.569 1144 HG23 VAL 60 HG23 VAL 60 -1.880 17.443 -4.224 1145 H GLU 61 H GLU 61 -4.087 19.812 -0.214 1146 HA GLU 61 HA GLU 61 -5.695 20.001 1.368 1147 HB2 GLU 61 HB2 GLU 61 -7.577 20.075 -1.018 1148 HB3 GLU 61 HB3 GLU 61 -7.730 20.944 0.509 1149 HG2 GLU 61 HG2 GLU 61 -5.399 22.012 -0.268 1150 HG3 GLU 61 HG3 GLU 61 -5.959 21.510 -1.856 1151 H GLY 62 H GLY 62 -5.063 17.346 1.303 1152 HA2 GLY 62 HA2 GLY 62 -5.972 15.537 2.534 1153 HA3 GLY 62 HA3 GLY 62 -7.584 16.019 2.056 1154 H GLU 63 H GLU 63 -6.635 16.147 -0.856 1155 HA GLU 63 HA GLU 63 -7.218 13.404 -1.569 1156 HB2 GLU 63 HB2 GLU 63 -6.506 15.830 -3.274 1157 HB3 GLU 63 HB3 GLU 63 -7.004 14.272 -3.926 1158 HG2 GLU 63 HG2 GLU 63 -8.730 15.960 -2.088 1159 HG3 GLU 63 HG3 GLU 63 -8.793 16.046 -3.845 1160 H ILE 64 H ILE 64 -5.813 11.808 -2.236 1161 HA ILE 64 HA ILE 64 -2.932 12.256 -2.221 1162 HB ILE 64 HB ILE 64 -4.535 9.710 -2.808 1163 HG12 ILE 64 HG12 ILE 64 -3.075 10.555 -0.260 1164 HG13 ILE 64 HG13 ILE 64 -4.820 10.542 -0.476 1165 HG21 ILE 64 HG21 ILE 64 -2.425 8.457 -2.500 1166 HG22 ILE 64 HG22 ILE 64 -1.538 9.975 -2.330 1167 HG23 ILE 64 HG23 ILE 64 -2.312 9.574 -3.864 1168 HD11 ILE 64 HD11 ILE 64 -4.075 8.626 0.817 1169 HD12 ILE 64 HD12 ILE 64 -3.014 8.116 -0.495 1170 HD13 ILE 64 HD13 ILE 64 -4.767 8.096 -0.717 1171 H PHE 65 H PHE 65 -2.448 13.566 -3.974 1172 HA PHE 65 HA PHE 65 -3.223 12.844 -6.714 1173 HB2 PHE 65 HB2 PHE 65 -3.392 15.207 -6.088 1174 HB3 PHE 65 HB3 PHE 65 -1.711 15.239 -5.571 1175 HD1 PHE 65 HD2 PHE 65 -3.738 14.453 -8.652 1176 HD2 PHE 65 HD1 PHE 65 -0.146 16.164 -7.075 1177 HE1 PHE 65 HE2 PHE 65 -3.072 15.148 -10.912 1178 HE2 PHE 65 HE1 PHE 65 0.509 16.855 -9.345 1179 HZ PHE 65 HZ PHE 65 -0.949 16.349 -11.263 1180 H VAL 66 H VAL 66 -1.960 11.480 -7.846 1181 HA VAL 66 HA VAL 66 0.894 11.100 -7.105 1182 HB VAL 66 HB VAL 66 -0.951 9.104 -8.501 1183 HG11 VAL 66 HG11 VAL 66 1.768 8.691 -7.191 1184 HG12 VAL 66 HG12 VAL 66 1.463 8.737 -8.929 1185 HG13 VAL 66 HG13 VAL 66 0.781 7.439 -7.949 1186 HG21 VAL 66 HG21 VAL 66 -0.213 9.205 -5.546 1187 HG22 VAL 66 HG22 VAL 66 -1.129 7.917 -6.336 1188 HG23 VAL 66 HG23 VAL 66 -1.808 9.543 -6.227 1189 H LYS 67 H LYS 67 2.491 11.075 -8.748 1190 HA LYS 67 HA LYS 67 1.742 11.215 -11.583 1191 HB2 LYS 67 HB2 LYS 67 2.926 13.391 -11.965 1192 HB3 LYS 67 HB3 LYS 67 1.489 13.555 -10.960 1193 HG2 LYS 67 HG2 LYS 67 3.048 13.496 -8.937 1194 HG3 LYS 67 HG3 LYS 67 4.388 13.659 -10.080 1195 HD2 LYS 67 HD2 LYS 67 3.393 15.792 -10.898 1196 HD3 LYS 67 HD3 LYS 67 2.085 15.617 -9.723 1197 HE2 LYS 67 HE2 LYS 67 3.683 17.150 -8.794 1198 HE3 LYS 67 HE3 LYS 67 3.842 15.640 -7.897 1199 HZ1 LYS 67 HZ1 LYS 67 5.989 16.585 -8.479 1200 HZ2 LYS 67 HZ2 LYS 67 5.607 16.522 -10.120 1201 HZ3 LYS 67 HZ3 LYS 67 5.775 15.091 -9.240 1202 H LEU 68 H LEU 68 3.591 10.887 -13.024 1203 HA LEU 68 HA LEU 68 5.521 9.061 -12.047 1204 HB2 LEU 68 HB2 LEU 68 5.614 10.637 -14.655 1205 HB3 LEU 68 HB3 LEU 68 6.578 9.213 -14.289 1206 HG LEU 68 HG LEU 68 3.578 9.340 -14.799 1207 HD11 LEU 68 HD11 LEU 68 4.060 7.842 -16.662 1208 HD12 LEU 68 HD12 LEU 68 5.776 7.823 -16.244 1209 HD13 LEU 68 HD13 LEU 68 5.015 9.318 -16.801 1210 HD21 LEU 68 HD21 LEU 68 3.503 6.902 -14.421 1211 HD22 LEU 68 HD22 LEU 68 3.902 7.787 -12.952 1212 HD23 LEU 68 HD23 LEU 68 5.172 6.941 -13.841 1213 H VAL 69 H VAL 69 7.805 9.236 -11.694 1214 HA VAL 69 HA VAL 69 8.986 11.778 -11.048 1215 HB VAL 69 HB VAL 69 10.381 9.108 -11.627 1216 HG11 VAL 69 HG11 VAL 69 12.347 10.058 -10.429 1217 HG12 VAL 69 HG12 VAL 69 11.525 11.618 -10.327 1218 HG13 VAL 69 HG13 VAL 69 11.979 10.961 -11.902 1219 HG21 VAL 69 HG21 VAL 69 10.556 8.873 -9.166 1220 HG22 VAL 69 HG22 VAL 69 8.872 8.960 -9.681 1221 HG23 VAL 69 HG23 VAL 69 9.644 10.370 -8.954 1222 H LEU 70 H LEU 70 8.942 13.223 -12.672 1223 HA LEU 70 HA LEU 70 8.821 12.783 -15.398 1224 HB2 LEU 70 HB2 LEU 70 9.861 15.273 -13.989 1225 HB3 LEU 70 HB3 LEU 70 9.328 15.208 -15.663 1226 HG LEU 70 HG LEU 70 7.553 14.791 -13.213 1227 HD11 LEU 70 HD11 LEU 70 6.513 16.927 -13.830 1228 HD12 LEU 70 HD12 LEU 70 7.675 17.131 -15.144 1229 HD13 LEU 70 HD13 LEU 70 8.228 17.126 -13.468 1230 HD21 LEU 70 HD21 LEU 70 6.745 13.427 -15.078 1231 HD22 LEU 70 HD22 LEU 70 6.775 14.827 -16.153 1232 HD23 LEU 70 HD23 LEU 70 5.653 14.781 -14.790 1233 H GLU 71 H GLU 71 11.718 13.880 -13.580 1234 HA GLU 71 HA GLU 71 13.479 12.795 -15.693 1235 HB2 GLU 71 HB2 GLU 71 13.084 15.288 -15.965 1236 HB3 GLU 71 HB3 GLU 71 13.840 15.543 -14.401 1237 HG2 GLU 71 HG2 GLU 71 15.303 14.199 -16.696 1238 HG3 GLU 71 HG3 GLU 71 15.233 15.950 -16.541 1239 H HIS 72 H HIS 72 14.795 11.359 -14.782 1240 HA HIS 72 HA HIS 72 16.300 12.046 -12.362 1241 HB2 HIS 72 HB2 HIS 72 16.078 9.781 -11.394 1242 HB3 HIS 72 HB3 HIS 72 14.516 10.574 -11.504 1243 HD1 HIS 72 HD1 HIS 72 13.049 9.753 -13.722 1244 HD2 HIS 72 HD2 HIS 72 16.083 7.240 -12.390 1245 HE1 HIS 72 HE1 HIS 72 12.550 7.503 -14.713 1246 HE2 HIS 72 HE2 HIS 72 14.331 5.981 -13.807 1247 H HIS 73 H HIS 73 18.300 12.171 -13.088 1248 HA HIS 73 HA HIS 73 19.123 10.801 -15.532 1249 HB2 HIS 73 HB2 HIS 73 21.168 12.341 -15.313 1250 HB3 HIS 73 HB3 HIS 73 19.610 13.120 -15.555 1251 HD1 HIS 73 HD1 HIS 73 18.843 14.769 -13.814 1252 HD2 HIS 73 HD2 HIS 73 22.200 12.624 -12.600 1253 HE1 HIS 73 HE1 HIS 73 19.644 15.895 -11.717 1254 HE2 HIS 73 HE2 HIS 73 21.742 14.671 -11.077 1255 H HIS 74 H HIS 74 21.313 9.972 -15.764 1256 HA HIS 74 HA HIS 74 21.909 7.799 -14.114 1257 HB2 HIS 74 HB2 HIS 74 22.565 7.973 -16.496 1258 HB3 HIS 74 HB3 HIS 74 23.702 9.255 -16.103 1259 HD1 HIS 74 HD1 HIS 74 25.718 7.976 -16.976 1260 HD2 HIS 74 HD2 HIS 74 23.665 5.895 -14.018 1261 HE1 HIS 74 HE1 HIS 74 27.167 6.011 -16.417 1262 HE2 HIS 74 HE2 HIS 74 25.831 4.682 -14.761 1263 H HIS 75 H HIS 75 22.581 7.871 -12.063 1264 HA HIS 75 HA HIS 75 24.111 10.090 -10.959 1265 HB2 HIS 75 HB2 HIS 75 23.224 7.527 -9.564 1266 HB3 HIS 75 HB3 HIS 75 23.724 9.032 -8.796 1267 HD1 HIS 75 HD1 HIS 75 20.776 7.246 -9.951 1268 HD2 HIS 75 HD2 HIS 75 21.787 11.226 -9.303 1269 HE1 HIS 75 HE1 HIS 75 18.596 8.480 -9.846 1270 HE2 HIS 75 HE2 HIS 75 19.229 10.841 -9.260 1271 H HIS 76 H HIS 76 26.077 9.872 -12.131 1272 HA HIS 76 HA HIS 76 28.075 8.213 -10.884 1273 HB2 HIS 76 HB2 HIS 76 27.125 6.624 -12.580 1274 HB3 HIS 76 HB3 HIS 76 27.530 7.759 -13.860 1275 HD1 HIS 76 HD1 HIS 76 30.031 7.912 -14.556 1276 HD2 HIS 76 HD2 HIS 76 29.288 5.158 -11.529 1277 HE1 HIS 76 HE1 HIS 76 32.134 6.555 -14.352 1278 HE2 HIS 76 HE2 HIS 76 31.690 4.948 -12.468 1279 H HIS 77 H HIS 77 30.056 9.198 -10.989 1280 HA HIS 77 HA HIS 77 30.505 11.398 -12.939 1281 HB2 HIS 77 HB2 HIS 77 31.305 11.411 -9.993 1282 HB3 HIS 77 HB3 HIS 77 31.662 12.683 -11.160 1283 HD1 HIS 77 HD1 HIS 77 29.103 11.548 -8.796 1284 HD2 HIS 77 HD2 HIS 77 29.270 14.101 -12.070 1285 HE1 HIS 77 HE1 HIS 77 27.006 12.919 -8.685 1286 HE2 HIS 77 HE2 HIS 77 27.233 14.586 -10.554 Start of MODEL 6 1 H1 MET 1 H1 MET 1 6.564 19.812 2.384 2 H2 MET 1 H2 MET 1 7.114 18.842 1.114 3 H3 MET 1 H3 MET 1 7.653 20.440 1.244 4 HA MET 1 HA MET 1 9.358 18.922 1.951 5 HB2 MET 1 HB2 MET 1 9.137 21.155 3.038 6 HB3 MET 1 HB3 MET 1 8.143 20.437 4.302 7 HG2 MET 1 HG2 MET 1 10.469 20.797 5.025 8 HG3 MET 1 HG3 MET 1 10.036 19.084 5.055 9 HE1 MET 1 HE1 MET 1 13.094 19.958 5.187 10 HE2 MET 1 HE2 MET 1 13.814 18.870 4.000 11 HE3 MET 1 HE3 MET 1 12.578 18.272 5.107 12 H LYS 2 H LYS 2 6.341 18.532 3.819 13 HA LYS 2 HA LYS 2 7.200 16.097 5.109 14 HB2 LYS 2 HB2 LYS 2 4.544 17.559 4.966 15 HB3 LYS 2 HB3 LYS 2 4.666 15.967 5.705 16 HG2 LYS 2 HG2 LYS 2 6.249 18.408 6.597 17 HG3 LYS 2 HG3 LYS 2 4.755 17.832 7.352 18 HD2 LYS 2 HD2 LYS 2 5.847 15.700 7.939 19 HD3 LYS 2 HD3 LYS 2 7.333 16.216 7.135 20 HE2 LYS 2 HE2 LYS 2 6.093 17.559 9.563 21 HE3 LYS 2 HE3 LYS 2 7.470 16.457 9.592 22 HZ1 LYS 2 HZ1 LYS 2 7.365 19.105 8.256 23 HZ2 LYS 2 HZ2 LYS 2 8.675 18.039 8.174 24 HZ3 LYS 2 HZ3 LYS 2 8.226 18.715 9.658 25 H MET 3 H MET 3 7.833 14.721 3.443 26 HA MET 3 HA MET 3 6.127 13.866 1.314 27 HB2 MET 3 HB2 MET 3 8.678 12.711 2.497 28 HB3 MET 3 HB3 MET 3 7.827 11.919 1.175 29 HG2 MET 3 HG2 MET 3 8.992 14.714 1.102 30 HG3 MET 3 HG3 MET 3 9.678 13.271 0.342 31 HE1 MET 3 HE1 MET 3 9.178 15.884 -1.417 32 HE2 MET 3 HE2 MET 3 8.414 15.169 -2.836 33 HE3 MET 3 HE3 MET 3 9.773 14.355 -2.066 34 H LEU 4 H LEU 4 4.446 12.535 1.420 35 HA LEU 4 HA LEU 4 3.619 11.108 3.741 36 HB2 LEU 4 HB2 LEU 4 2.686 10.769 0.870 37 HB3 LEU 4 HB3 LEU 4 1.852 10.147 2.288 38 HG LEU 4 HG LEU 4 2.275 13.105 1.651 39 HD11 LEU 4 HD11 LEU 4 0.673 12.081 0.112 40 HD12 LEU 4 HD12 LEU 4 -0.139 13.190 1.214 41 HD13 LEU 4 HD13 LEU 4 -0.261 11.447 1.470 42 HD21 LEU 4 HD21 LEU 4 2.213 12.737 4.074 43 HD22 LEU 4 HD22 LEU 4 0.703 11.835 3.924 44 HD23 LEU 4 HD23 LEU 4 0.749 13.557 3.535 45 H LYS 5 H LYS 5 5.913 10.272 1.328 46 HA LYS 5 HA LYS 5 5.857 7.425 1.575 47 HB2 LYS 5 HB2 LYS 5 7.057 8.880 -0.235 48 HB3 LYS 5 HB3 LYS 5 8.351 9.054 0.946 49 HG2 LYS 5 HG2 LYS 5 8.293 6.434 1.021 50 HG3 LYS 5 HG3 LYS 5 7.424 6.567 -0.507 51 HD2 LYS 5 HD2 LYS 5 10.218 7.624 0.087 52 HD3 LYS 5 HD3 LYS 5 9.836 6.186 -0.861 53 HE2 LYS 5 HE2 LYS 5 8.742 7.587 -2.547 54 HE3 LYS 5 HE3 LYS 5 9.074 9.026 -1.586 55 HZ1 LYS 5 HZ1 LYS 5 10.709 8.873 -3.277 56 HZ2 LYS 5 HZ2 LYS 5 11.046 7.259 -2.911 57 HZ3 LYS 5 HZ3 LYS 5 11.474 8.475 -1.821 58 H GLU 6 H GLU 6 7.293 10.021 3.483 59 HA GLU 6 HA GLU 6 9.114 8.492 5.036 60 HB2 GLU 6 HB2 GLU 6 7.800 11.174 5.598 61 HB3 GLU 6 HB3 GLU 6 9.051 10.468 6.623 62 HG2 GLU 6 HG2 GLU 6 9.369 11.216 3.702 63 HG3 GLU 6 HG3 GLU 6 9.950 12.157 5.073 64 H LYS 7 H LYS 7 5.725 9.522 5.730 65 HA LYS 7 HA LYS 7 5.633 8.203 8.265 66 HB2 LYS 7 HB2 LYS 7 3.149 8.508 8.165 67 HB3 LYS 7 HB3 LYS 7 4.077 9.976 7.956 68 HG2 LYS 7 HG2 LYS 7 2.309 10.201 6.443 69 HG3 LYS 7 HG3 LYS 7 3.667 9.716 5.435 70 HD2 LYS 7 HD2 LYS 7 1.551 8.591 4.790 71 HD3 LYS 7 HD3 LYS 7 2.787 7.434 5.284 72 HE2 LYS 7 HE2 LYS 7 0.577 6.820 6.172 73 HE3 LYS 7 HE3 LYS 7 1.696 7.194 7.478 74 HZ1 LYS 7 HZ1 LYS 7 -0.508 8.140 7.828 75 HZ2 LYS 7 HZ2 LYS 7 -0.352 9.054 6.414 76 HZ3 LYS 7 HZ3 LYS 7 0.674 9.343 7.723 77 H ALA 8 H ALA 8 5.080 7.072 4.994 78 HA ALA 8 HA ALA 8 3.853 4.581 5.526 79 HB1 ALA 8 HB1 ALA 8 4.058 5.522 3.259 80 HB2 ALA 8 HB2 ALA 8 4.730 3.892 3.323 81 HB3 ALA 8 HB3 ALA 8 5.807 5.292 3.305 82 H GLY 9 H GLY 9 7.285 5.522 5.420 83 HA2 GLY 9 HA2 GLY 9 8.387 2.954 6.058 84 HA3 GLY 9 HA3 GLY 9 9.229 4.493 6.098 85 H ALA 10 H ALA 10 7.577 5.809 8.005 86 HA ALA 10 HA ALA 10 8.803 5.043 10.442 87 HB1 ALA 10 HB1 ALA 10 8.125 7.358 9.963 88 HB2 ALA 10 HB2 ALA 10 7.402 6.795 11.473 89 HB3 ALA 10 HB3 ALA 10 6.425 6.884 10.003 90 H LEU 11 H LEU 11 5.457 4.649 9.276 91 HA LEU 11 HA LEU 11 4.453 3.255 11.556 92 HB2 LEU 11 HB2 LEU 11 3.412 3.316 8.701 93 HB3 LEU 11 HB3 LEU 11 2.527 2.687 10.087 94 HG LEU 11 HG LEU 11 3.391 5.587 9.732 95 HD11 LEU 11 HD11 LEU 11 0.643 4.346 9.476 96 HD12 LEU 11 HD12 LEU 11 1.637 4.986 8.163 97 HD13 LEU 11 HD13 LEU 11 1.016 6.072 9.404 98 HD21 LEU 11 HD21 LEU 11 1.992 6.055 11.703 99 HD22 LEU 11 HD22 LEU 11 3.335 4.987 12.097 100 HD23 LEU 11 HD23 LEU 11 1.708 4.326 11.922 101 H ALA 12 H ALA 12 5.856 2.204 8.462 102 HA ALA 12 HA ALA 12 5.437 -0.568 8.628 103 HB1 ALA 12 HB1 ALA 12 7.839 0.850 7.434 104 HB2 ALA 12 HB2 ALA 12 6.298 0.574 6.621 105 HB3 ALA 12 HB3 ALA 12 7.307 -0.803 7.076 106 H GLY 13 H GLY 13 7.955 1.451 10.077 107 HA2 GLY 13 HA2 GLY 13 9.642 -0.487 11.164 108 HA3 GLY 13 HA3 GLY 13 9.368 1.109 11.844 109 H GLN 14 H GLN 14 6.886 1.135 12.791 110 HA GLN 14 HA GLN 14 7.095 -0.450 15.176 111 HB2 GLN 14 HB2 GLN 14 5.052 0.710 15.925 112 HB3 GLN 14 HB3 GLN 14 6.234 1.843 15.283 113 HG2 GLN 14 HG2 GLN 14 4.956 1.974 13.170 114 HG3 GLN 14 HG3 GLN 14 3.773 0.843 13.820 115 HE21 GLN 14 HE21 GLN 14 5.258 3.475 15.652 116 HE22 GLN 14 HE22 GLN 14 3.816 4.391 15.833 117 H ILE 15 H ILE 15 5.122 -0.737 12.252 118 HA ILE 15 HA ILE 15 3.324 -2.757 13.113 119 HB ILE 15 HB ILE 15 4.360 -2.063 10.326 120 HG12 ILE 15 HG12 ILE 15 1.627 -1.568 11.610 121 HG13 ILE 15 HG13 ILE 15 2.891 -0.357 11.440 122 HG21 ILE 15 HG21 ILE 15 2.545 -3.478 9.379 123 HG22 ILE 15 HG22 ILE 15 2.177 -4.072 10.999 124 HG23 ILE 15 HG23 ILE 15 3.738 -4.430 10.262 125 HD11 ILE 15 HD11 ILE 15 1.169 -0.067 9.763 126 HD12 ILE 15 HD12 ILE 15 1.415 -1.711 9.177 127 HD13 ILE 15 HD13 ILE 15 2.693 -0.505 8.993 128 H TRP 16 H TRP 16 6.473 -2.963 11.424 129 HA TRP 16 HA TRP 16 6.682 -5.778 11.354 130 HB2 TRP 16 HB2 TRP 16 8.041 -4.246 9.924 131 HB3 TRP 16 HB3 TRP 16 8.935 -3.714 11.346 132 HD1 TRP 16 HD1 TRP 16 8.528 -6.717 9.011 133 HE1 TRP 16 HE1 TRP 16 10.512 -8.327 9.347 134 HE3 TRP 16 HE3 TRP 16 10.727 -4.463 13.040 135 HZ2 TRP 16 HZ2 TRP 16 12.712 -8.614 11.106 136 HZ3 TRP 16 HZ3 TRP 16 12.759 -5.467 14.004 137 HH2 TRP 16 HH2 TRP 16 13.723 -7.505 13.063 138 H GLU 17 H GLU 17 7.828 -3.389 13.755 139 HA GLU 17 HA GLU 17 9.207 -5.188 15.474 140 HB2 GLU 17 HB2 GLU 17 7.991 -2.444 16.002 141 HB3 GLU 17 HB3 GLU 17 8.934 -3.324 17.206 142 HG2 GLU 17 HG2 GLU 17 10.895 -3.298 15.734 143 HG3 GLU 17 HG3 GLU 17 9.966 -2.487 14.476 144 H ALA 18 H ALA 18 5.815 -4.249 15.277 145 HA ALA 18 HA ALA 18 4.882 -5.585 17.631 146 HB1 ALA 18 HB1 ALA 18 3.373 -4.893 15.086 147 HB2 ALA 18 HB2 ALA 18 3.568 -3.838 16.486 148 HB3 ALA 18 HB3 ALA 18 2.644 -5.335 16.635 149 H LEU 19 H LEU 19 5.451 -6.601 14.298 150 HA LEU 19 HA LEU 19 4.371 -9.275 14.569 151 HB2 LEU 19 HB2 LEU 19 6.111 -7.990 12.427 152 HB3 LEU 19 HB3 LEU 19 5.411 -9.598 12.293 153 HG LEU 19 HG LEU 19 3.772 -7.037 12.538 154 HD11 LEU 19 HD11 LEU 19 5.006 -7.049 10.418 155 HD12 LEU 19 HD12 LEU 19 3.280 -7.277 10.148 156 HD13 LEU 19 HD13 LEU 19 4.377 -8.657 10.041 157 HD21 LEU 19 HD21 LEU 19 2.924 -9.884 11.890 158 HD22 LEU 19 HD22 LEU 19 1.872 -8.465 11.873 159 HD23 LEU 19 HD23 LEU 19 2.590 -9.007 13.387 160 H ASN 20 H ASN 20 7.477 -7.779 15.177 161 HA ASN 20 HA ASN 20 9.145 -10.049 14.816 162 HB2 ASN 20 HB2 ASN 20 9.988 -7.701 14.791 163 HB3 ASN 20 HB3 ASN 20 9.705 -7.589 16.521 164 HD21 ASN 20 HD21 ASN 20 11.622 -9.129 14.046 165 HD22 ASN 20 HD22 ASN 20 12.915 -9.626 15.073 166 H GLY 21 H GLY 21 9.448 -11.792 16.039 167 HA2 GLY 21 HA2 GLY 21 9.581 -13.082 18.027 168 HA3 GLY 21 HA3 GLY 21 8.624 -11.882 18.883 169 H THR 22 H THR 22 6.659 -11.771 16.634 170 HA THR 22 HA THR 22 4.945 -14.023 17.406 171 HB THR 22 HB THR 22 4.272 -11.694 15.535 172 HG1 THR 22 HG1 THR 22 4.012 -10.444 17.235 173 HG21 THR 22 HG21 THR 22 1.935 -12.107 16.226 174 HG22 THR 22 HG22 THR 22 2.459 -13.462 17.225 175 HG23 THR 22 HG23 THR 22 2.630 -13.547 15.470 176 H GLU 23 H GLU 23 3.887 -15.385 15.795 177 HA GLU 23 HA GLU 23 5.549 -16.111 13.503 178 HB2 GLU 23 HB2 GLU 23 3.025 -17.367 14.644 179 HB3 GLU 23 HB3 GLU 23 3.915 -18.018 13.266 180 HG2 GLU 23 HG2 GLU 23 5.914 -18.298 14.725 181 HG3 GLU 23 HG3 GLU 23 4.965 -17.708 16.095 182 H GLY 24 H GLY 24 3.001 -13.961 13.931 183 HA2 GLY 24 HA2 GLY 24 2.537 -12.941 11.565 184 HA3 GLY 24 HA3 GLY 24 1.688 -14.464 11.338 185 H LEU 25 H LEU 25 0.770 -11.598 11.437 186 HA LEU 25 HA LEU 25 -1.551 -11.992 13.226 187 HB2 LEU 25 HB2 LEU 25 0.063 -9.413 12.954 188 HB3 LEU 25 HB3 LEU 25 -1.519 -9.497 13.714 189 HG LEU 25 HG LEU 25 0.999 -10.882 14.736 190 HD11 LEU 25 HD11 LEU 25 -0.447 -8.440 15.814 191 HD12 LEU 25 HD12 LEU 25 1.132 -8.459 15.024 192 HD13 LEU 25 HD13 LEU 25 0.921 -9.254 16.581 193 HD21 LEU 25 HD21 LEU 25 -1.004 -12.178 15.303 194 HD22 LEU 25 HD22 LEU 25 -1.771 -10.740 15.981 195 HD23 LEU 25 HD23 LEU 25 -0.332 -11.419 16.746 196 H THR 26 H THR 26 -3.488 -10.837 12.505 197 HA THR 26 HA THR 26 -3.613 -10.288 9.625 198 HB THR 26 HB THR 26 -6.025 -10.049 9.903 199 HG1 THR 26 HG1 THR 26 -6.820 -10.368 12.200 200 HG21 THR 26 HG21 THR 26 -6.649 -12.232 10.883 201 HG22 THR 26 HG22 THR 26 -5.058 -12.365 11.635 202 HG23 THR 26 HG23 THR 26 -5.210 -12.391 9.876 203 H GLN 27 H GLN 27 -4.896 -8.263 8.957 204 HA GLN 27 HA GLN 27 -3.661 -5.859 9.539 205 HB2 GLN 27 HB2 GLN 27 -5.024 -6.149 7.561 206 HB3 GLN 27 HB3 GLN 27 -6.471 -6.429 8.521 207 HG2 GLN 27 HG2 GLN 27 -6.538 -4.103 9.209 208 HG3 GLN 27 HG3 GLN 27 -4.984 -3.782 8.437 209 HE21 GLN 27 HE21 GLN 27 -7.665 -2.594 7.975 210 HE22 GLN 27 HE22 GLN 27 -7.949 -2.773 6.288 211 H LYS 28 H LYS 28 -6.627 -7.156 11.005 212 HA LYS 28 HA LYS 28 -7.336 -4.965 12.638 213 HB2 LYS 28 HB2 LYS 28 -7.936 -7.917 13.073 214 HB3 LYS 28 HB3 LYS 28 -8.773 -6.575 13.856 215 HG2 LYS 28 HG2 LYS 28 -9.550 -5.815 11.596 216 HG3 LYS 28 HG3 LYS 28 -8.791 -7.244 10.897 217 HD2 LYS 28 HD2 LYS 28 -11.090 -7.807 11.111 218 HD3 LYS 28 HD3 LYS 28 -10.295 -8.641 12.444 219 HE2 LYS 28 HE2 LYS 28 -11.747 -5.981 12.711 220 HE3 LYS 28 HE3 LYS 28 -12.478 -7.545 13.053 221 HZ1 LYS 28 HZ1 LYS 28 -11.762 -6.525 15.073 222 HZ2 LYS 28 HZ2 LYS 28 -10.194 -6.305 14.491 223 HZ3 LYS 28 HZ3 LYS 28 -10.775 -7.867 14.785 224 H GLN 29 H GLN 29 -5.258 -7.767 13.312 225 HA GLN 29 HA GLN 29 -5.006 -7.320 16.133 226 HB2 GLN 29 HB2 GLN 29 -3.157 -8.915 14.321 227 HB3 GLN 29 HB3 GLN 29 -3.257 -9.034 16.074 228 HG2 GLN 29 HG2 GLN 29 -5.410 -9.838 14.095 229 HG3 GLN 29 HG3 GLN 29 -4.344 -10.926 14.974 230 HE21 GLN 29 HE21 GLN 29 -6.039 -12.044 15.937 231 HE22 GLN 29 HE22 GLN 29 -7.063 -11.357 17.145 232 H ILE 30 H ILE 30 -3.067 -6.434 13.325 233 HA ILE 30 HA ILE 30 -0.916 -5.174 14.700 234 HB ILE 30 HB ILE 30 -1.954 -4.811 11.860 235 HG12 ILE 30 HG12 ILE 30 0.410 -6.426 12.939 236 HG13 ILE 30 HG13 ILE 30 -1.136 -7.105 12.440 237 HG21 ILE 30 HG21 ILE 30 -0.670 -2.805 12.503 238 HG22 ILE 30 HG22 ILE 30 0.213 -3.755 11.309 239 HG23 ILE 30 HG23 ILE 30 0.685 -3.816 13.010 240 HD11 ILE 30 HD11 ILE 30 0.844 -5.701 10.651 241 HD12 ILE 30 HD12 ILE 30 -0.701 -6.391 10.145 242 HD13 ILE 30 HD13 ILE 30 0.573 -7.438 10.767 243 H LYS 31 H LYS 31 -3.997 -3.934 13.398 244 HA LYS 31 HA LYS 31 -3.749 -1.195 13.840 245 HB2 LYS 31 HB2 LYS 31 -6.164 -3.031 14.009 246 HB3 LYS 31 HB3 LYS 31 -6.325 -1.295 14.231 247 HG2 LYS 31 HG2 LYS 31 -5.109 -2.514 11.737 248 HG3 LYS 31 HG3 LYS 31 -6.839 -2.212 11.904 249 HD2 LYS 31 HD2 LYS 31 -4.640 -0.102 12.053 250 HD3 LYS 31 HD3 LYS 31 -5.707 -0.389 10.673 251 HE2 LYS 31 HE2 LYS 31 -6.541 0.598 13.430 252 HE3 LYS 31 HE3 LYS 31 -6.508 1.539 11.936 253 HZ1 LYS 31 HZ1 LYS 31 -8.745 0.789 12.491 254 HZ2 LYS 31 HZ2 LYS 31 -8.245 -0.826 12.434 255 HZ3 LYS 31 HZ3 LYS 31 -8.226 0.115 11.036 256 H LYS 32 H LYS 32 -4.658 -3.717 16.203 257 HA LYS 32 HA LYS 32 -5.086 -1.955 18.429 258 HB2 LYS 32 HB2 LYS 32 -4.390 -4.927 18.391 259 HB3 LYS 32 HB3 LYS 32 -4.969 -4.039 19.803 260 HG2 LYS 32 HG2 LYS 32 -6.519 -4.449 17.223 261 HG3 LYS 32 HG3 LYS 32 -6.748 -5.376 18.710 262 HD2 LYS 32 HD2 LYS 32 -7.479 -3.340 19.895 263 HD3 LYS 32 HD3 LYS 32 -7.163 -2.363 18.457 264 HE2 LYS 32 HE2 LYS 32 -9.560 -2.818 18.684 265 HE3 LYS 32 HE3 LYS 32 -8.925 -3.595 17.234 266 HZ1 LYS 32 HZ1 LYS 32 -9.461 -4.944 19.829 267 HZ2 LYS 32 HZ2 LYS 32 -8.857 -5.693 18.439 268 HZ3 LYS 32 HZ3 LYS 32 -10.421 -5.050 18.440 269 H ALA 33 H ALA 33 -2.291 -3.823 17.275 270 HA ALA 33 HA ALA 33 -0.615 -3.401 19.557 271 HB1 ALA 33 HB1 ALA 33 1.122 -4.520 18.227 272 HB2 ALA 33 HB2 ALA 33 0.130 -4.358 16.774 273 HB3 ALA 33 HB3 ALA 33 -0.414 -5.380 18.105 274 H THR 34 H THR 34 -1.145 -1.499 16.678 275 HA THR 34 HA THR 34 1.185 0.259 17.296 276 HB THR 34 HB THR 34 1.217 0.847 14.858 277 HG1 THR 34 HG1 THR 34 -0.339 -1.346 14.153 278 HG21 THR 34 HG21 THR 34 2.716 -0.960 15.645 279 HG22 THR 34 HG22 THR 34 2.144 -1.286 14.008 280 HG23 THR 34 HG23 THR 34 1.433 -2.145 15.375 281 H LYS 35 H LYS 35 -2.211 0.150 17.137 282 HA LYS 35 HA LYS 35 -3.917 1.573 17.201 283 HB2 LYS 35 HB2 LYS 35 -3.862 3.476 18.676 284 HB3 LYS 35 HB3 LYS 35 -2.892 2.193 19.374 285 HG2 LYS 35 HG2 LYS 35 -0.855 3.356 18.953 286 HG3 LYS 35 HG3 LYS 35 -1.634 4.488 17.849 287 HD2 LYS 35 HD2 LYS 35 -1.132 5.573 20.004 288 HD3 LYS 35 HD3 LYS 35 -2.874 5.509 19.734 289 HE2 LYS 35 HE2 LYS 35 -2.278 4.960 22.068 290 HE3 LYS 35 HE3 LYS 35 -3.055 3.598 21.263 291 HZ1 LYS 35 HZ1 LYS 35 -0.932 2.571 20.948 292 HZ2 LYS 35 HZ2 LYS 35 -1.113 2.959 22.583 293 HZ3 LYS 35 HZ3 LYS 35 -0.126 3.909 21.590 294 H LEU 36 H LEU 36 -2.765 1.537 14.745 295 HA LEU 36 HA LEU 36 -2.237 3.972 13.463 296 HB2 LEU 36 HB2 LEU 36 -3.650 1.520 12.338 297 HB3 LEU 36 HB3 LEU 36 -3.000 2.829 11.361 298 HG LEU 36 HG LEU 36 -1.329 1.035 13.157 299 HD11 LEU 36 HD11 LEU 36 -0.516 -0.051 11.126 300 HD12 LEU 36 HD12 LEU 36 -1.635 0.906 10.153 301 HD13 LEU 36 HD13 LEU 36 -2.256 -0.268 11.314 302 HD21 LEU 36 HD21 LEU 36 -0.299 3.233 12.853 303 HD22 LEU 36 HD22 LEU 36 -0.444 3.084 11.099 304 HD23 LEU 36 HD23 LEU 36 0.616 1.993 11.997 305 H LYS 37 H LYS 37 -3.478 5.653 12.823 306 HA LYS 37 HA LYS 37 -5.916 6.124 14.200 307 HB2 LYS 37 HB2 LYS 37 -4.568 7.768 12.005 308 HB3 LYS 37 HB3 LYS 37 -5.889 8.339 13.017 309 HG2 LYS 37 HG2 LYS 37 -3.997 9.286 14.016 310 HG3 LYS 37 HG3 LYS 37 -4.333 7.889 15.028 311 HD2 LYS 37 HD2 LYS 37 -1.991 7.839 14.779 312 HD3 LYS 37 HD3 LYS 37 -2.537 6.655 13.596 313 HE2 LYS 37 HE2 LYS 37 -1.690 9.517 13.015 314 HE3 LYS 37 HE3 LYS 37 -0.745 8.073 12.677 315 HZ1 LYS 37 HZ1 LYS 37 -3.309 8.853 11.410 316 HZ2 LYS 37 HZ2 LYS 37 -2.502 7.401 11.113 317 HZ3 LYS 37 HZ3 LYS 37 -1.780 8.866 10.693 318 H ALA 38 H ALA 38 -5.178 5.347 10.871 319 HA ALA 38 HA ALA 38 -7.924 4.373 10.486 320 HB1 ALA 38 HB1 ALA 38 -6.395 6.008 8.425 321 HB2 ALA 38 HB2 ALA 38 -7.808 6.555 9.330 322 HB3 ALA 38 HB3 ALA 38 -7.964 5.233 8.171 323 H ASP 39 H ASP 39 -8.035 2.668 8.847 324 HA ASP 39 HA ASP 39 -5.806 0.899 8.616 325 HB2 ASP 39 HB2 ASP 39 -8.324 0.993 6.907 326 HB3 ASP 39 HB3 ASP 39 -7.218 -0.375 7.059 327 H LYS 40 H LYS 40 -6.921 3.601 6.711 328 HA LYS 40 HA LYS 40 -5.526 3.451 4.325 329 HB2 LYS 40 HB2 LYS 40 -5.736 5.936 6.085 330 HB3 LYS 40 HB3 LYS 40 -5.498 5.914 4.339 331 HG2 LYS 40 HG2 LYS 40 -7.985 4.861 5.726 332 HG3 LYS 40 HG3 LYS 40 -7.821 6.511 5.114 333 HD2 LYS 40 HD2 LYS 40 -7.443 5.553 2.817 334 HD3 LYS 40 HD3 LYS 40 -7.754 3.945 3.477 335 HE2 LYS 40 HE2 LYS 40 -10.043 4.660 4.117 336 HE3 LYS 40 HE3 LYS 40 -9.725 6.267 3.458 337 HZ1 LYS 40 HZ1 LYS 40 -9.446 5.274 1.280 338 HZ2 LYS 40 HZ2 LYS 40 -10.960 4.884 1.918 339 HZ3 LYS 40 HZ3 LYS 40 -9.726 3.733 1.910 340 H ASP 41 H ASP 41 -4.283 4.322 7.541 341 HA ASP 41 HA ASP 41 -1.599 4.982 6.823 342 HB2 ASP 41 HB2 ASP 41 -2.787 4.027 9.465 343 HB3 ASP 41 HB3 ASP 41 -1.140 4.615 9.287 344 H PHE 42 H PHE 42 -3.213 1.960 7.740 345 HA PHE 42 HA PHE 42 -0.961 0.317 8.158 346 HB2 PHE 42 HB2 PHE 42 -3.190 -0.378 8.930 347 HB3 PHE 42 HB3 PHE 42 -3.778 -0.465 7.274 348 HD1 PHE 42 HD1 PHE 42 -1.291 -1.977 9.620 349 HD2 PHE 42 HD2 PHE 42 -3.560 -2.512 6.032 350 HE1 PHE 42 HE1 PHE 42 -0.551 -4.305 9.492 351 HE2 PHE 42 HE2 PHE 42 -2.817 -4.857 5.924 352 HZ PHE 42 HZ PHE 42 -1.307 -5.753 7.659 353 H PHE 43 H PHE 43 -2.831 0.971 5.197 354 HA PHE 43 HA PHE 43 -1.674 -1.074 3.596 355 HB2 PHE 43 HB2 PHE 43 -3.021 1.496 2.663 356 HB3 PHE 43 HB3 PHE 43 -2.755 0.054 1.683 357 HD1 PHE 43 HD2 PHE 43 -3.581 -2.186 3.265 358 HD2 PHE 43 HD1 PHE 43 -5.313 1.723 3.157 359 HE1 PHE 43 HE2 PHE 43 -5.718 -3.104 4.060 360 HE2 PHE 43 HE1 PHE 43 -7.445 0.797 3.947 361 HZ PHE 43 HZ PHE 43 -7.647 -1.619 4.405 362 H LEU 44 H LEU 44 -0.760 2.321 4.078 363 HA LEU 44 HA LEU 44 1.364 2.353 2.144 364 HB2 LEU 44 HB2 LEU 44 0.552 4.188 4.408 365 HB3 LEU 44 HB3 LEU 44 2.105 4.420 3.626 366 HG LEU 44 HG LEU 44 0.938 4.728 1.434 367 HD11 LEU 44 HD11 LEU 44 -1.476 5.116 1.327 368 HD12 LEU 44 HD12 LEU 44 -1.638 4.660 3.024 369 HD13 LEU 44 HD13 LEU 44 -1.116 3.466 1.834 370 HD21 LEU 44 HD21 LEU 44 0.025 6.657 3.592 371 HD22 LEU 44 HD22 LEU 44 0.101 6.993 1.860 372 HD23 LEU 44 HD23 LEU 44 1.584 6.692 2.762 373 H GLY 45 H GLY 45 1.209 1.679 5.646 374 HA2 GLY 45 HA2 GLY 45 3.990 1.348 6.152 375 HA3 GLY 45 HA3 GLY 45 2.680 0.650 7.096 376 H LEU 46 H LEU 46 1.486 -1.013 5.292 377 HA LEU 46 HA LEU 46 3.054 -3.368 5.314 378 HB2 LEU 46 HB2 LEU 46 0.615 -3.446 5.490 379 HB3 LEU 46 HB3 LEU 46 0.438 -2.706 3.910 380 HG LEU 46 HG LEU 46 1.414 -4.758 2.856 381 HD11 LEU 46 HD11 LEU 46 2.798 -5.570 4.695 382 HD12 LEU 46 HD12 LEU 46 1.683 -6.821 4.153 383 HD13 LEU 46 HD13 LEU 46 1.354 -5.939 5.646 384 HD21 LEU 46 HD21 LEU 46 -1.007 -5.313 4.604 385 HD22 LEU 46 HD22 LEU 46 -0.545 -6.208 3.153 386 HD23 LEU 46 HD23 LEU 46 -1.029 -4.518 3.027 387 H GLY 47 H GLY 47 2.446 -0.947 2.854 388 HA2 GLY 47 HA2 GLY 47 3.437 -2.300 0.554 389 HA3 GLY 47 HA3 GLY 47 3.329 -0.556 0.759 390 H TRP 48 H TRP 48 4.992 -0.419 3.091 391 HA TRP 48 HA TRP 48 7.632 -0.443 1.951 392 HB2 TRP 48 HB2 TRP 48 6.561 1.235 3.673 393 HB3 TRP 48 HB3 TRP 48 7.064 0.062 4.878 394 HD1 TRP 48 HD1 TRP 48 9.807 -0.303 5.134 395 HE1 TRP 48 HE1 TRP 48 11.750 1.291 4.545 396 HE3 TRP 48 HE3 TRP 48 7.263 2.958 2.186 397 HZ2 TRP 48 HZ2 TRP 48 12.130 3.647 2.989 398 HZ3 TRP 48 HZ3 TRP 48 8.445 4.839 1.190 399 HH2 TRP 48 HH2 TRP 48 10.821 5.219 1.562 400 H LEU 49 H LEU 49 5.890 -2.432 4.340 401 HA LEU 49 HA LEU 49 7.919 -4.181 5.161 402 HB2 LEU 49 HB2 LEU 49 4.938 -4.398 4.861 403 HB3 LEU 49 HB3 LEU 49 5.810 -5.893 5.075 404 HG LEU 49 HG LEU 49 6.611 -5.214 7.263 405 HD11 LEU 49 HD11 LEU 49 5.956 -3.118 8.319 406 HD12 LEU 49 HD12 LEU 49 5.229 -2.576 6.796 407 HD13 LEU 49 HD13 LEU 49 6.971 -2.857 6.902 408 HD21 LEU 49 HD21 LEU 49 3.638 -4.640 6.995 409 HD22 LEU 49 HD22 LEU 49 4.481 -5.098 8.479 410 HD23 LEU 49 HD23 LEU 49 4.368 -6.243 7.144 411 H LEU 50 H LEU 50 5.792 -4.382 2.322 412 HA LEU 50 HA LEU 50 6.956 -6.697 1.125 413 HB2 LEU 50 HB2 LEU 50 5.254 -4.490 -0.098 414 HB3 LEU 50 HB3 LEU 50 5.666 -5.997 -0.911 415 HG LEU 50 HG LEU 50 3.976 -5.752 1.618 416 HD11 LEU 50 HD11 LEU 50 3.116 -6.445 -1.210 417 HD12 LEU 50 HD12 LEU 50 2.776 -4.941 -0.353 418 HD13 LEU 50 HD13 LEU 50 2.083 -6.453 0.224 419 HD21 LEU 50 HD21 LEU 50 5.241 -7.843 1.645 420 HD22 LEU 50 HD22 LEU 50 4.686 -8.237 0.015 421 HD23 LEU 50 HD23 LEU 50 3.535 -8.165 1.351 422 H ARG 51 H ARG 51 7.573 -3.222 0.843 423 HA ARG 51 HA ARG 51 9.234 -3.055 -1.391 424 HB2 ARG 51 HB2 ARG 51 8.496 -1.045 -0.302 425 HB3 ARG 51 HB3 ARG 51 9.230 -1.503 1.226 426 HG2 ARG 51 HG2 ARG 51 11.446 -1.068 0.391 427 HG3 ARG 51 HG3 ARG 51 10.847 -0.866 -1.257 428 HD2 ARG 51 HD2 ARG 51 9.633 1.162 -0.551 429 HD3 ARG 51 HD3 ARG 51 10.237 0.948 1.096 430 HE ARG 51 HE ARG 51 12.534 1.075 -0.082 431 HH11 ARG 51 HH11 ARG 51 9.783 2.986 -0.969 432 HH12 ARG 51 HH12 ARG 51 10.763 4.268 -1.576 433 HH21 ARG 51 HH21 ARG 51 13.734 2.733 -0.835 434 HH22 ARG 51 HH22 ARG 51 12.961 4.124 -1.517 435 H GLU 52 H GLU 52 10.195 -3.692 1.981 436 HA GLU 52 HA GLU 52 12.969 -4.226 1.173 437 HB2 GLU 52 HB2 GLU 52 11.768 -4.075 3.967 438 HB3 GLU 52 HB3 GLU 52 13.483 -4.092 3.559 439 HG2 GLU 52 HG2 GLU 52 13.143 -1.906 2.360 440 HG3 GLU 52 HG3 GLU 52 11.486 -1.883 2.953 441 H ASP 53 H ASP 53 10.121 -5.959 1.573 442 HA ASP 53 HA ASP 53 9.502 -8.107 1.735 443 HB2 ASP 53 HB2 ASP 53 12.366 -8.615 0.847 444 HB3 ASP 53 HB3 ASP 53 11.119 -9.860 0.912 445 H LYS 54 H LYS 54 10.277 -6.819 4.087 446 HA LYS 54 HA LYS 54 11.749 -8.521 5.869 447 HB2 LYS 54 HB2 LYS 54 9.742 -6.306 6.471 448 HB3 LYS 54 HB3 LYS 54 10.841 -7.028 7.643 449 HG2 LYS 54 HG2 LYS 54 12.769 -6.137 6.385 450 HG3 LYS 54 HG3 LYS 54 11.667 -5.419 5.206 451 HD2 LYS 54 HD2 LYS 54 11.867 -4.689 8.164 452 HD3 LYS 54 HD3 LYS 54 12.470 -3.730 6.811 453 HE2 LYS 54 HE2 LYS 54 10.087 -3.542 5.984 454 HE3 LYS 54 HE3 LYS 54 9.564 -4.327 7.479 455 HZ1 LYS 54 HZ1 LYS 54 9.408 -1.946 7.673 456 HZ2 LYS 54 HZ2 LYS 54 11.030 -1.752 7.252 457 HZ3 LYS 54 HZ3 LYS 54 10.617 -2.505 8.712 458 H VAL 55 H VAL 55 8.571 -8.603 4.581 459 HA VAL 55 HA VAL 55 7.728 -10.687 6.497 460 HB VAL 55 HB VAL 55 5.409 -9.957 6.473 461 HG11 VAL 55 HG11 VAL 55 6.784 -8.966 8.235 462 HG12 VAL 55 HG12 VAL 55 5.526 -7.838 7.733 463 HG13 VAL 55 HG13 VAL 55 7.190 -7.603 7.189 464 HG21 VAL 55 HG21 VAL 55 6.254 -7.661 4.662 465 HG22 VAL 55 HG22 VAL 55 4.652 -7.851 5.380 466 HG23 VAL 55 HG23 VAL 55 5.239 -9.034 4.210 467 H VAL 56 H VAL 56 6.002 -12.041 5.580 468 HA VAL 56 HA VAL 56 5.661 -12.037 2.677 469 HB VAL 56 HB VAL 56 5.460 -14.596 2.741 470 HG11 VAL 56 HG11 VAL 56 8.221 -13.419 3.247 471 HG12 VAL 56 HG12 VAL 56 7.398 -13.511 1.690 472 HG13 VAL 56 HG13 VAL 56 7.897 -14.991 2.509 473 HG21 VAL 56 HG21 VAL 56 6.701 -15.788 4.552 474 HG22 VAL 56 HG22 VAL 56 5.282 -14.935 5.159 475 HG23 VAL 56 HG23 VAL 56 6.892 -14.253 5.406 476 H THR 57 H THR 57 3.585 -12.542 1.970 477 HA THR 57 HA THR 57 1.530 -12.138 4.074 478 HB THR 57 HB THR 57 0.202 -11.006 2.239 479 HG1 THR 57 HG1 THR 57 1.725 -10.268 0.448 480 HG21 THR 57 HG21 THR 57 1.475 -8.890 2.257 481 HG22 THR 57 HG22 THR 57 2.913 -9.743 2.825 482 HG23 THR 57 HG23 THR 57 1.481 -9.637 3.853 483 H SER 58 H SER 58 -0.109 -13.525 4.217 484 HA SER 58 HA SER 58 -0.606 -15.544 2.089 485 HB2 SER 58 HB2 SER 58 -1.113 -15.809 5.093 486 HB3 SER 58 HB3 SER 58 -1.429 -17.049 3.876 487 HG SER 58 HG SER 58 0.957 -16.724 3.412 488 H GLU 59 H GLU 59 -2.731 -15.818 1.396 489 HA GLU 59 HA GLU 59 -4.551 -13.594 2.100 490 HB2 GLU 59 HB2 GLU 59 -3.826 -13.998 -0.308 491 HB3 GLU 59 HB3 GLU 59 -4.768 -15.485 -0.288 492 HG2 GLU 59 HG2 GLU 59 -6.826 -14.207 0.089 493 HG3 GLU 59 HG3 GLU 59 -5.906 -12.707 0.209 494 H VAL 60 H VAL 60 -5.828 -14.116 3.720 495 HA VAL 60 HA VAL 60 -6.924 -16.864 3.989 496 HB VAL 60 HB VAL 60 -5.828 -15.048 6.195 497 HG11 VAL 60 HG11 VAL 60 -7.176 -17.763 6.494 498 HG12 VAL 60 HG12 VAL 60 -7.821 -16.213 7.042 499 HG13 VAL 60 HG13 VAL 60 -6.364 -16.871 7.786 500 HG21 VAL 60 HG21 VAL 60 -4.877 -17.770 5.225 501 HG22 VAL 60 HG22 VAL 60 -4.180 -16.855 6.566 502 HG23 VAL 60 HG23 VAL 60 -4.074 -16.225 4.920 503 H GLU 61 H GLU 61 -9.029 -16.790 3.714 504 HA GLU 61 HA GLU 61 -11.238 -16.300 3.789 505 HB2 GLU 61 HB2 GLU 61 -10.581 -14.671 6.280 506 HB3 GLU 61 HB3 GLU 61 -12.140 -15.389 5.878 507 HG2 GLU 61 HG2 GLU 61 -11.026 -17.661 6.057 508 HG3 GLU 61 HG3 GLU 61 -9.586 -16.844 6.627 509 H GLY 62 H GLY 62 -9.647 -14.545 2.121 510 HA2 GLY 62 HA2 GLY 62 -9.811 -12.616 0.889 511 HA3 GLY 62 HA3 GLY 62 -11.345 -12.300 1.676 512 H GLU 63 H GLU 63 -9.088 -12.619 4.084 513 HA GLU 63 HA GLU 63 -8.848 -9.703 4.452 514 HB2 GLU 63 HB2 GLU 63 -8.477 -12.008 6.426 515 HB3 GLU 63 HB3 GLU 63 -8.328 -10.299 6.832 516 HG2 GLU 63 HG2 GLU 63 -10.865 -11.648 5.843 517 HG3 GLU 63 HG3 GLU 63 -10.486 -11.308 7.529 518 H ILE 64 H ILE 64 -6.885 -8.770 5.089 519 HA ILE 64 HA ILE 64 -4.454 -9.831 4.015 520 HB ILE 64 HB ILE 64 -4.956 -7.373 5.756 521 HG12 ILE 64 HG12 ILE 64 -4.585 -7.667 2.735 522 HG13 ILE 64 HG13 ILE 64 -6.059 -7.189 3.570 523 HG21 ILE 64 HG21 ILE 64 -2.624 -8.076 6.037 524 HG22 ILE 64 HG22 ILE 64 -2.697 -6.591 5.092 525 HG23 ILE 64 HG23 ILE 64 -2.402 -8.133 4.286 526 HD11 ILE 64 HD11 ILE 64 -4.966 -5.098 4.269 527 HD12 ILE 64 HD12 ILE 64 -4.990 -5.289 2.517 528 HD13 ILE 64 HD13 ILE 64 -3.501 -5.585 3.411 529 H PHE 65 H PHE 65 -3.717 -11.636 5.037 530 HA PHE 65 HA PHE 65 -2.953 -11.420 7.895 531 HB2 PHE 65 HB2 PHE 65 -4.268 -13.460 7.394 532 HB3 PHE 65 HB3 PHE 65 -3.129 -13.913 6.131 533 HD1 PHE 65 HD2 PHE 65 -3.368 -13.291 9.818 534 HD2 PHE 65 HD1 PHE 65 -1.228 -15.255 6.681 535 HE1 PHE 65 HE2 PHE 65 -2.019 -14.495 11.484 536 HE2 PHE 65 HE1 PHE 65 0.118 -16.451 8.353 537 HZ PHE 65 HZ PHE 65 -0.274 -16.073 10.755 538 H VAL 66 H VAL 66 -0.832 -11.221 8.365 539 HA VAL 66 HA VAL 66 1.218 -11.611 6.248 540 HB VAL 66 HB VAL 66 2.443 -9.644 7.031 541 HG11 VAL 66 HG11 VAL 66 0.901 -7.826 6.367 542 HG12 VAL 66 HG12 VAL 66 -0.475 -8.914 6.557 543 HG13 VAL 66 HG13 VAL 66 0.730 -9.228 5.308 544 HG21 VAL 66 HG21 VAL 66 1.545 -8.111 8.772 545 HG22 VAL 66 HG22 VAL 66 1.894 -9.712 9.425 546 HG23 VAL 66 HG23 VAL 66 0.227 -9.246 9.080 547 H LYS 67 H LYS 67 3.350 -12.115 7.038 548 HA LYS 67 HA LYS 67 3.790 -12.701 9.873 549 HB2 LYS 67 HB2 LYS 67 4.619 -15.045 9.343 550 HB3 LYS 67 HB3 LYS 67 2.876 -14.842 9.234 551 HG2 LYS 67 HG2 LYS 67 2.942 -14.821 6.835 552 HG3 LYS 67 HG3 LYS 67 4.698 -14.736 6.825 553 HD2 LYS 67 HD2 LYS 67 3.993 -16.984 6.232 554 HD3 LYS 67 HD3 LYS 67 4.815 -17.021 7.789 555 HE2 LYS 67 HE2 LYS 67 1.799 -16.913 7.590 556 HE3 LYS 67 HE3 LYS 67 2.677 -18.435 7.512 557 HZ1 LYS 67 HZ1 LYS 67 2.602 -16.526 9.787 558 HZ2 LYS 67 HZ2 LYS 67 3.660 -17.839 9.709 559 HZ3 LYS 67 HZ3 LYS 67 1.992 -18.102 9.745 560 H LEU 68 H LEU 68 6.211 -13.402 10.172 561 HA LEU 68 HA LEU 68 7.815 -11.633 8.493 562 HB2 LEU 68 HB2 LEU 68 8.614 -13.283 10.916 563 HB3 LEU 68 HB3 LEU 68 9.689 -12.188 10.055 564 HG LEU 68 HG LEU 68 7.280 -11.471 11.764 565 HD11 LEU 68 HD11 LEU 68 10.198 -10.653 11.921 566 HD12 LEU 68 HD12 LEU 68 9.373 -11.811 12.969 567 HD13 LEU 68 HD13 LEU 68 8.909 -10.114 13.000 568 HD21 LEU 68 HD21 LEU 68 8.798 -9.598 9.914 569 HD22 LEU 68 HD22 LEU 68 7.629 -9.105 11.143 570 HD23 LEU 68 HD23 LEU 68 7.102 -10.077 9.774 571 H VAL 69 H VAL 69 9.924 -12.280 7.683 572 HA VAL 69 HA VAL 69 9.912 -14.861 6.303 573 HB VAL 69 HB VAL 69 11.934 -12.568 6.126 574 HG11 VAL 69 HG11 VAL 69 12.678 -13.613 4.011 575 HG12 VAL 69 HG12 VAL 69 11.554 -14.950 4.265 576 HG13 VAL 69 HG13 VAL 69 12.904 -14.709 5.375 577 HG21 VAL 69 HG21 VAL 69 9.710 -11.819 5.405 578 HG22 VAL 69 HG22 VAL 69 9.584 -13.185 4.296 579 HG23 VAL 69 HG23 VAL 69 10.799 -11.934 4.022 580 H LEU 70 H LEU 70 10.377 -16.414 7.873 581 HA LEU 70 HA LEU 70 13.176 -16.413 8.844 582 HB2 LEU 70 HB2 LEU 70 12.574 -17.563 10.905 583 HB3 LEU 70 HB3 LEU 70 11.778 -16.007 10.814 584 HG LEU 70 HG LEU 70 10.348 -18.639 10.231 585 HD11 LEU 70 HD11 LEU 70 9.388 -18.509 12.485 586 HD12 LEU 70 HD12 LEU 70 10.396 -17.108 12.853 587 HD13 LEU 70 HD13 LEU 70 11.142 -18.679 12.548 588 HD21 LEU 70 HD21 LEU 70 9.230 -15.878 10.838 589 HD22 LEU 70 HD22 LEU 70 8.286 -17.347 10.571 590 HD23 LEU 70 HD23 LEU 70 9.245 -16.669 9.258 591 H GLU 71 H GLU 71 14.230 -17.852 7.706 592 HA GLU 71 HA GLU 71 13.097 -20.094 6.352 593 HB2 GLU 71 HB2 GLU 71 15.472 -20.677 5.807 594 HB3 GLU 71 HB3 GLU 71 15.070 -19.001 5.447 595 HG2 GLU 71 HG2 GLU 71 16.180 -18.286 7.541 596 HG3 GLU 71 HG3 GLU 71 16.600 -19.959 7.890 597 H HIS 72 H HIS 72 14.672 -19.713 9.486 598 HA HIS 72 HA HIS 72 14.679 -22.568 10.055 599 HB2 HIS 72 HB2 HIS 72 15.582 -21.940 12.271 600 HB3 HIS 72 HB3 HIS 72 16.506 -21.212 10.972 601 HD1 HIS 72 HD1 HIS 72 16.389 -18.605 10.740 602 HD2 HIS 72 HD2 HIS 72 14.345 -20.130 14.022 603 HE1 HIS 72 HE1 HIS 72 15.928 -16.640 12.225 604 HE2 HIS 72 HE2 HIS 72 14.863 -17.612 14.275 605 H HIS 73 H HIS 73 12.859 -23.566 10.534 606 HA HIS 73 HA HIS 73 11.198 -22.764 12.730 607 HB2 HIS 73 HB2 HIS 73 9.014 -22.809 11.470 608 HB3 HIS 73 HB3 HIS 73 10.028 -21.434 11.069 609 HD1 HIS 73 HD1 HIS 73 8.421 -24.444 9.582 610 HD2 HIS 73 HD2 HIS 73 11.064 -21.461 8.390 611 HE1 HIS 73 HE1 HIS 73 8.512 -24.589 7.080 612 HE2 HIS 73 HE2 HIS 73 10.170 -22.835 6.389 613 H HIS 74 H HIS 74 11.654 -24.654 13.731 614 HA HIS 74 HA HIS 74 11.461 -27.230 12.348 615 HB2 HIS 74 HB2 HIS 74 12.335 -28.168 14.494 616 HB3 HIS 74 HB3 HIS 74 13.364 -26.918 13.821 617 HD1 HIS 74 HD1 HIS 74 13.985 -25.014 15.354 618 HD2 HIS 74 HD2 HIS 74 10.805 -27.248 16.836 619 HE1 HIS 74 HE1 HIS 74 13.607 -24.176 17.685 620 HE2 HIS 74 HE2 HIS 74 11.606 -25.449 18.510 621 H HIS 75 H HIS 75 9.025 -25.516 13.023 622 HA HIS 75 HA HIS 75 7.381 -27.627 14.304 623 HB2 HIS 75 HB2 HIS 75 7.526 -25.561 15.684 624 HB3 HIS 75 HB3 HIS 75 6.915 -24.608 14.341 625 HD1 HIS 75 HD1 HIS 75 4.407 -24.464 14.080 626 HD2 HIS 75 HD2 HIS 75 5.557 -27.336 16.855 627 HE1 HIS 75 HE1 HIS 75 2.291 -25.202 15.190 628 HE2 HIS 75 HE2 HIS 75 2.990 -27.003 16.796 629 H HIS 76 H HIS 76 6.019 -28.579 12.905 630 HA HIS 76 HA HIS 76 5.269 -27.370 10.348 631 HB2 HIS 76 HB2 HIS 76 4.656 -30.095 11.568 632 HB3 HIS 76 HB3 HIS 76 4.113 -29.597 9.970 633 HD1 HIS 76 HD1 HIS 76 5.755 -29.823 8.061 634 HD2 HIS 76 HD2 HIS 76 7.523 -30.462 11.765 635 HE1 HIS 76 HE1 HIS 76 8.046 -30.701 7.565 636 HE2 HIS 76 HE2 HIS 76 9.023 -31.251 9.817 637 H HIS 77 H HIS 77 3.088 -27.106 9.657 638 HA HIS 77 HA HIS 77 0.825 -27.380 11.395 639 HB2 HIS 77 HB2 HIS 77 1.799 -25.298 12.356 640 HB3 HIS 77 HB3 HIS 77 1.776 -24.546 10.765 641 HD1 HIS 77 HD1 HIS 77 -0.047 -22.887 10.685 642 HD2 HIS 77 HD2 HIS 77 -1.155 -26.220 12.905 643 HE1 HIS 77 HE1 HIS 77 -2.400 -22.451 11.412 644 HE2 HIS 77 HE2 HIS 77 -2.975 -24.375 12.920 645 H1 MET 1 H MET 1 -0.697 -21.797 -5.260 646 HA MET 1 HA MET 1 -0.140 -20.918 -3.104 647 HB2 MET 1 HB2 MET 1 1.369 -19.267 -5.186 648 HB3 MET 1 HB3 MET 1 1.895 -19.558 -3.530 649 HG2 MET 1 HG2 MET 1 3.146 -20.993 -5.010 650 HG3 MET 1 HG3 MET 1 2.053 -21.995 -4.054 651 HE1 MET 1 HE1 MET 1 3.520 -23.030 -6.754 652 HE2 MET 1 HE2 MET 1 2.191 -23.887 -7.534 653 HE3 MET 1 HE3 MET 1 2.439 -24.040 -5.794 654 H LYS 2 H LYS 2 -0.281 -18.096 -5.269 655 HA LYS 2 HA LYS 2 -1.245 -16.069 -5.213 656 HB2 LYS 2 HB2 LYS 2 -3.341 -17.523 -3.558 657 HB3 LYS 2 HB3 LYS 2 -3.561 -15.914 -4.234 658 HG2 LYS 2 HG2 LYS 2 -3.466 -16.792 -6.495 659 HG3 LYS 2 HG3 LYS 2 -3.048 -18.396 -5.899 660 HD2 LYS 2 HD2 LYS 2 -5.391 -18.397 -6.529 661 HD3 LYS 2 HD3 LYS 2 -5.287 -18.531 -4.775 662 HE2 LYS 2 HE2 LYS 2 -5.841 -15.921 -6.240 663 HE3 LYS 2 HE3 LYS 2 -7.103 -16.984 -5.625 664 HZ1 LYS 2 HZ1 LYS 2 -6.735 -15.267 -4.051 665 HZ2 LYS 2 HZ2 LYS 2 -5.069 -15.517 -4.050 666 HZ3 LYS 2 HZ3 LYS 2 -6.095 -16.686 -3.393 667 H MET 3 H MET 3 0.647 -15.254 -3.870 668 HA MET 3 HA MET 3 -0.194 -14.404 -1.163 669 HB2 MET 3 HB2 MET 3 2.066 -13.537 -0.848 670 HB3 MET 3 HB3 MET 3 2.118 -15.215 -1.363 671 HG2 MET 3 HG2 MET 3 2.683 -14.443 -3.658 672 HG3 MET 3 HG3 MET 3 2.743 -12.787 -3.052 673 HE1 MET 3 HE1 MET 3 4.493 -12.134 -0.924 674 HE2 MET 3 HE2 MET 3 5.744 -13.250 -0.377 675 HE3 MET 3 HE3 MET 3 4.048 -13.595 -0.038 676 H LEU 4 H LEU 4 -0.405 -12.278 -0.563 677 HA LEU 4 HA LEU 4 -1.787 -10.522 -2.218 678 HB2 LEU 4 HB2 LEU 4 -0.252 -9.911 0.323 679 HB3 LEU 4 HB3 LEU 4 -1.188 -8.685 -0.509 680 HG LEU 4 HG LEU 4 -3.258 -10.038 -0.138 681 HD11 LEU 4 HD11 LEU 4 -3.255 -11.865 1.497 682 HD12 LEU 4 HD12 LEU 4 -1.492 -11.817 1.562 683 HD13 LEU 4 HD13 LEU 4 -2.310 -12.278 0.067 684 HD21 LEU 4 HD21 LEU 4 -1.707 -9.335 2.372 685 HD22 LEU 4 HD22 LEU 4 -3.460 -9.522 2.255 686 HD23 LEU 4 HD23 LEU 4 -2.656 -8.217 1.388 687 H LYS 5 H LYS 5 1.679 -10.773 -1.820 688 HA LYS 5 HA LYS 5 2.444 -8.224 -2.762 689 HB2 LYS 5 HB2 LYS 5 3.868 -9.885 -1.457 690 HB3 LYS 5 HB3 LYS 5 4.086 -10.769 -2.966 691 HG2 LYS 5 HG2 LYS 5 5.196 -8.813 -3.970 692 HG3 LYS 5 HG3 LYS 5 4.920 -7.885 -2.496 693 HD2 LYS 5 HD2 LYS 5 7.226 -8.650 -2.527 694 HD3 LYS 5 HD3 LYS 5 6.359 -9.491 -1.240 695 HE2 LYS 5 HE2 LYS 5 6.146 -11.488 -2.682 696 HE3 LYS 5 HE3 LYS 5 6.987 -10.644 -3.985 697 HZ1 LYS 5 HZ1 LYS 5 8.122 -11.336 -1.332 698 HZ2 LYS 5 HZ2 LYS 5 8.928 -10.471 -2.539 699 HZ3 LYS 5 HZ3 LYS 5 8.487 -12.082 -2.804 700 H GLU 6 H GLU 6 1.843 -11.291 -4.480 701 HA GLU 6 HA GLU 6 2.893 -10.549 -7.023 702 HB2 GLU 6 HB2 GLU 6 0.788 -12.635 -6.300 703 HB3 GLU 6 HB3 GLU 6 1.542 -12.498 -7.888 704 HG2 GLU 6 HG2 GLU 6 3.729 -13.018 -6.918 705 HG3 GLU 6 HG3 GLU 6 3.018 -13.095 -5.309 706 H LYS 7 H LYS 7 -0.487 -10.618 -5.803 707 HA LYS 7 HA LYS 7 -1.570 -9.412 -8.174 708 HB2 LYS 7 HB2 LYS 7 -3.732 -9.391 -6.980 709 HB3 LYS 7 HB3 LYS 7 -2.947 -10.953 -6.931 710 HG2 LYS 7 HG2 LYS 7 -3.748 -10.831 -4.780 711 HG3 LYS 7 HG3 LYS 7 -2.130 -10.167 -4.541 712 HD2 LYS 7 HD2 LYS 7 -3.004 -7.899 -4.484 713 HD3 LYS 7 HD3 LYS 7 -4.609 -8.450 -4.981 714 HE2 LYS 7 HE2 LYS 7 -3.232 -9.125 -2.358 715 HE3 LYS 7 HE3 LYS 7 -4.540 -7.963 -2.568 716 HZ1 LYS 7 HZ1 LYS 7 -5.968 -9.799 -3.297 717 HZ2 LYS 7 HZ2 LYS 7 -5.382 -10.043 -1.734 718 HZ3 LYS 7 HZ3 LYS 7 -4.710 -10.901 -3.022 719 H ALA 8 H ALA 8 -0.311 -8.077 -5.186 720 HA ALA 8 HA ALA 8 -1.238 -5.403 -5.430 721 HB1 ALA 8 HB1 ALA 8 0.686 -4.786 -4.017 722 HB2 ALA 8 HB2 ALA 8 1.412 -6.374 -4.296 723 HB3 ALA 8 HB3 ALA 8 -0.106 -6.241 -3.407 724 H GLY 9 H GLY 9 1.600 -7.047 -6.821 725 HA2 GLY 9 HA2 GLY 9 2.678 -4.866 -8.287 726 HA3 GLY 9 HA3 GLY 9 2.970 -6.570 -8.597 727 H ALA 10 H ALA 10 0.180 -7.246 -9.075 728 HA ALA 10 HA ALA 10 -0.106 -6.632 -11.849 729 HB1 ALA 10 HB1 ALA 10 -0.943 -8.730 -10.880 730 HB2 ALA 10 HB2 ALA 10 -2.243 -7.854 -11.691 731 HB3 ALA 10 HB3 ALA 10 -2.129 -7.833 -9.928 732 H LEU 11 H LEU 11 -1.831 -5.485 -8.932 733 HA LEU 11 HA LEU 11 -3.544 -3.597 -10.195 734 HB2 LEU 11 HB2 LEU 11 -2.459 -3.592 -7.349 735 HB3 LEU 11 HB3 LEU 11 -3.797 -2.604 -7.922 736 HG LEU 11 HG LEU 11 -3.793 -5.645 -7.721 737 HD11 LEU 11 HD11 LEU 11 -5.445 -5.347 -5.924 738 HD12 LEU 11 HD12 LEU 11 -5.257 -3.595 -6.034 739 HD13 LEU 11 HD13 LEU 11 -3.900 -4.599 -5.521 740 HD21 LEU 11 HD21 LEU 11 -6.034 -3.791 -8.589 741 HD22 LEU 11 HD22 LEU 11 -6.183 -5.529 -8.309 742 HD23 LEU 11 HD23 LEU 11 -5.162 -4.934 -9.615 743 H ALA 12 H ALA 12 -0.245 -3.399 -8.954 744 HA ALA 12 HA ALA 12 0.208 -0.625 -9.047 745 HB1 ALA 12 HB1 ALA 12 2.591 -1.178 -9.038 746 HB2 ALA 12 HB2 ALA 12 2.225 -2.850 -9.494 747 HB3 ALA 12 HB3 ALA 12 1.710 -2.228 -7.925 748 H GLY 13 H GLY 13 0.743 -3.114 -11.524 749 HA2 GLY 13 HA2 GLY 13 2.184 -1.701 -13.426 750 HA3 GLY 13 HA3 GLY 13 1.107 -3.040 -13.791 751 H GLN 14 H GLN 14 -1.338 -2.139 -13.380 752 HA GLN 14 HA GLN 14 -1.913 -0.530 -15.640 753 HB2 GLN 14 HB2 GLN 14 -4.292 -0.704 -14.870 754 HB3 GLN 14 HB3 GLN 14 -3.453 -2.249 -14.957 755 HG2 GLN 14 HG2 GLN 14 -3.055 -1.984 -12.422 756 HG3 GLN 14 HG3 GLN 14 -4.248 -0.688 -12.492 757 HE21 GLN 14 HE21 GLN 14 -3.733 -4.126 -12.685 758 HE22 GLN 14 HE22 GLN 14 -5.393 -4.584 -12.609 759 H ILE 15 H ILE 15 -1.785 0.270 -12.171 760 HA ILE 15 HA ILE 15 -2.924 2.882 -12.300 761 HB ILE 15 HB ILE 15 -1.129 1.540 -10.232 762 HG12 ILE 15 HG12 ILE 15 -4.113 2.203 -10.192 763 HG13 ILE 15 HG13 ILE 15 -3.433 0.611 -10.505 764 HG21 ILE 15 HG21 ILE 15 -2.495 4.238 -9.905 765 HG22 ILE 15 HG22 ILE 15 -0.758 3.972 -10.033 766 HG23 ILE 15 HG23 ILE 15 -1.641 3.353 -8.639 767 HD11 ILE 15 HD11 ILE 15 -2.530 0.574 -8.214 768 HD12 ILE 15 HD12 ILE 15 -4.283 0.754 -8.256 769 HD13 ILE 15 HD13 ILE 15 -3.266 2.152 -7.914 770 H TRP 16 H TRP 16 0.456 1.773 -12.365 771 HA TRP 16 HA TRP 16 1.766 4.256 -12.500 772 HB2 TRP 16 HB2 TRP 16 2.878 2.060 -12.016 773 HB3 TRP 16 HB3 TRP 16 2.664 1.596 -13.700 774 HD1 TRP 16 HD1 TRP 16 4.752 3.928 -11.476 775 HE1 TRP 16 HE1 TRP 16 6.796 4.739 -12.807 776 HE3 TRP 16 HE3 TRP 16 3.537 2.032 -16.071 777 HZ2 TRP 16 HZ2 TRP 16 7.768 4.603 -15.451 778 HZ3 TRP 16 HZ3 TRP 16 5.077 2.420 -17.954 779 HH2 TRP 16 HH2 TRP 16 7.148 3.684 -17.649 780 H GLU 17 H GLU 17 0.570 2.128 -15.093 781 HA GLU 17 HA GLU 17 1.499 3.614 -17.322 782 HB2 GLU 17 HB2 GLU 17 -0.860 1.709 -17.142 783 HB3 GLU 17 HB3 GLU 17 -0.162 2.298 -18.651 784 HG2 GLU 17 HG2 GLU 17 1.939 1.176 -18.157 785 HG3 GLU 17 HG3 GLU 17 1.332 0.658 -16.585 786 H ALA 18 H ALA 18 -1.466 3.948 -15.399 787 HA ALA 18 HA ALA 18 -2.869 5.812 -17.016 788 HB1 ALA 18 HB1 ALA 18 -3.891 4.660 -15.081 789 HB2 ALA 18 HB2 ALA 18 -4.085 6.409 -14.958 790 HB3 ALA 18 HB3 ALA 18 -2.865 5.585 -13.981 791 H LEU 19 H LEU 19 -0.213 6.211 -14.737 792 HA LEU 19 HA LEU 19 -0.143 9.130 -14.889 793 HB2 LEU 19 HB2 LEU 19 1.706 7.116 -13.562 794 HB3 LEU 19 HB3 LEU 19 1.845 8.862 -13.391 795 HG LEU 19 HG LEU 19 -0.558 7.226 -12.472 796 HD11 LEU 19 HD11 LEU 19 1.412 6.664 -11.133 797 HD12 LEU 19 HD12 LEU 19 0.265 7.605 -10.186 798 HD13 LEU 19 HD13 LEU 19 1.720 8.376 -10.823 799 HD21 LEU 19 HD21 LEU 19 -1.216 9.304 -11.302 800 HD22 LEU 19 HD22 LEU 19 -1.164 9.524 -13.047 801 HD23 LEU 19 HD23 LEU 19 0.144 10.154 -12.042 802 H ASN 20 H ASN 20 1.318 6.448 -16.562 803 HA ASN 20 HA ASN 20 3.725 7.725 -17.422 804 HB2 ASN 20 HB2 ASN 20 3.496 5.262 -17.356 805 HB3 ASN 20 HB3 ASN 20 2.279 5.329 -18.624 806 HD21 ASN 20 HD21 ASN 20 5.667 5.921 -17.900 807 HD22 ASN 20 HD22 ASN 20 6.231 5.762 -19.520 808 H GLY 21 H GLY 21 4.079 9.149 -19.025 809 HA2 GLY 21 HA2 GLY 21 3.741 10.511 -20.866 810 HA3 GLY 21 HA3 GLY 21 2.341 9.551 -21.313 811 H THR 22 H THR 22 2.098 10.527 -18.100 812 HA THR 22 HA THR 22 0.356 12.857 -18.728 813 HB THR 22 HB THR 22 -0.148 10.720 -16.586 814 HG1 THR 22 HG1 THR 22 -0.875 9.628 -18.249 815 HG21 THR 22 HG21 THR 22 -1.949 12.981 -17.553 816 HG22 THR 22 HG22 THR 22 -1.140 12.910 -15.985 817 HG23 THR 22 HG23 THR 22 -2.394 11.736 -16.385 818 H GLU 23 H GLU 23 0.315 14.528 -17.108 819 HA GLU 23 HA GLU 23 2.831 14.955 -15.777 820 HB2 GLU 23 HB2 GLU 23 1.930 17.132 -15.131 821 HB3 GLU 23 HB3 GLU 23 1.574 16.810 -16.823 822 HG2 GLU 23 HG2 GLU 23 -0.745 16.222 -16.238 823 HG3 GLU 23 HG3 GLU 23 -0.398 16.503 -14.534 824 H GLY 24 H GLY 24 -0.152 13.544 -14.795 825 HA2 GLY 24 HA2 GLY 24 0.250 12.466 -12.438 826 HA3 GLY 24 HA3 GLY 24 0.136 14.148 -11.930 827 H LEU 25 H LEU 25 -1.626 11.846 -11.309 828 HA LEU 25 HA LEU 25 -4.220 13.039 -12.069 829 HB2 LEU 25 HB2 LEU 25 -3.515 10.085 -12.315 830 HB3 LEU 25 HB3 LEU 25 -5.167 10.682 -12.323 831 HG LEU 25 HG LEU 25 -3.051 11.300 -14.427 832 HD11 LEU 25 HD11 LEU 25 -3.816 8.983 -14.559 833 HD12 LEU 25 HD12 LEU 25 -4.436 9.909 -15.924 834 HD13 LEU 25 HD13 LEU 25 -5.503 9.511 -14.572 835 HD21 LEU 25 HD21 LEU 25 -5.977 12.123 -14.330 836 HD22 LEU 25 HD22 LEU 25 -4.887 12.368 -15.697 837 HD23 LEU 25 HD23 LEU 25 -4.583 13.197 -14.172 838 H THR 26 H THR 26 -5.977 12.481 -10.620 839 HA THR 26 HA THR 26 -5.214 11.970 -7.848 840 HB THR 26 HB THR 26 -7.532 12.394 -7.268 841 HG1 THR 26 HG1 THR 26 -9.046 12.793 -9.104 842 HG21 THR 26 HG21 THR 26 -6.231 14.433 -7.822 843 HG22 THR 26 HG22 THR 26 -7.936 14.630 -8.228 844 HG23 THR 26 HG23 THR 26 -6.760 14.314 -9.505 845 H GLN 27 H GLN 27 -6.529 10.303 -6.551 846 HA GLN 27 HA GLN 27 -6.312 7.696 -7.579 847 HB2 GLN 27 HB2 GLN 27 -7.382 6.893 -5.578 848 HB3 GLN 27 HB3 GLN 27 -6.366 8.256 -5.131 849 HG2 GLN 27 HG2 GLN 27 -8.335 9.701 -4.955 850 HG3 GLN 27 HG3 GLN 27 -9.378 8.387 -5.494 851 HE21 GLN 27 HE21 GLN 27 -9.822 6.673 -4.050 852 HE22 GLN 27 HE22 GLN 27 -9.514 6.806 -2.359 853 H LYS 28 H LYS 28 -9.041 9.916 -7.619 854 HA LYS 28 HA LYS 28 -11.104 8.187 -8.480 855 HB2 LYS 28 HB2 LYS 28 -10.729 11.157 -9.073 856 HB3 LYS 28 HB3 LYS 28 -12.234 10.265 -9.295 857 HG2 LYS 28 HG2 LYS 28 -10.826 10.702 -6.638 858 HG3 LYS 28 HG3 LYS 28 -12.221 11.616 -7.225 859 HD2 LYS 28 HD2 LYS 28 -13.573 9.528 -7.242 860 HD3 LYS 28 HD3 LYS 28 -12.174 8.620 -6.653 861 HE2 LYS 28 HE2 LYS 28 -13.542 10.887 -5.151 862 HE3 LYS 28 HE3 LYS 28 -13.793 9.165 -4.848 863 HZ1 LYS 28 HZ1 LYS 28 -11.429 8.978 -4.303 864 HZ2 LYS 28 HZ2 LYS 28 -12.223 10.066 -3.287 865 HZ3 LYS 28 HZ3 LYS 28 -11.232 10.638 -4.529 866 H GLN 29 H GLN 29 -8.861 10.223 -10.361 867 HA GLN 29 HA GLN 29 -9.841 9.643 -12.957 868 HB2 GLN 29 HB2 GLN 29 -7.017 10.478 -12.164 869 HB3 GLN 29 HB3 GLN 29 -7.709 10.601 -13.780 870 HG2 GLN 29 HG2 GLN 29 -8.655 12.127 -11.337 871 HG3 GLN 29 HG3 GLN 29 -7.619 12.768 -12.606 872 HE21 GLN 29 HE21 GLN 29 -10.239 13.686 -11.681 873 HE22 GLN 29 HE22 GLN 29 -11.251 13.691 -13.075 874 H ILE 30 H ILE 30 -7.138 8.270 -11.111 875 HA ILE 30 HA ILE 30 -6.189 6.475 -13.103 876 HB ILE 30 HB ILE 30 -5.786 6.469 -10.080 877 HG12 ILE 30 HG12 ILE 30 -3.964 7.488 -12.309 878 HG13 ILE 30 HG13 ILE 30 -4.956 8.508 -11.273 879 HG21 ILE 30 HG21 ILE 30 -5.324 4.222 -10.954 880 HG22 ILE 30 HG22 ILE 30 -3.827 5.013 -10.468 881 HG23 ILE 30 HG23 ILE 30 -4.245 4.896 -12.180 882 HD11 ILE 30 HD11 ILE 30 -2.664 8.544 -10.560 883 HD12 ILE 30 HD12 ILE 30 -2.637 6.789 -10.401 884 HD13 ILE 30 HD13 ILE 30 -3.650 7.761 -9.328 885 H LYS 31 H LYS 31 -8.249 5.938 -10.204 886 HA LYS 31 HA LYS 31 -8.431 3.133 -10.373 887 HB2 LYS 31 HB2 LYS 31 -9.142 4.741 -8.441 888 HB3 LYS 31 HB3 LYS 31 -10.682 4.854 -9.280 889 HG2 LYS 31 HG2 LYS 31 -10.791 2.300 -9.117 890 HG3 LYS 31 HG3 LYS 31 -9.409 2.406 -8.029 891 HD2 LYS 31 HD2 LYS 31 -11.422 2.262 -6.694 892 HD3 LYS 31 HD3 LYS 31 -10.765 3.892 -6.525 893 HE2 LYS 31 HE2 LYS 31 -12.433 4.769 -8.077 894 HE3 LYS 31 HE3 LYS 31 -13.023 3.143 -8.423 895 HZ1 LYS 31 HZ1 LYS 31 -13.169 4.513 -5.800 896 HZ2 LYS 31 HZ2 LYS 31 -13.736 2.957 -6.131 897 HZ3 LYS 31 HZ3 LYS 31 -14.450 4.294 -6.879 898 H LYS 32 H LYS 32 -10.442 5.668 -11.827 899 HA LYS 32 HA LYS 32 -12.334 4.002 -13.157 900 HB2 LYS 32 HB2 LYS 32 -12.749 6.382 -12.692 901 HB3 LYS 32 HB3 LYS 32 -11.414 6.851 -13.727 902 HG2 LYS 32 HG2 LYS 32 -13.768 5.346 -14.893 903 HG3 LYS 32 HG3 LYS 32 -13.901 7.074 -14.565 904 HD2 LYS 32 HD2 LYS 32 -11.889 7.456 -16.019 905 HD3 LYS 32 HD3 LYS 32 -11.880 5.735 -16.411 906 HE2 LYS 32 HE2 LYS 32 -14.120 5.961 -17.435 907 HE3 LYS 32 HE3 LYS 32 -14.131 7.683 -17.033 908 HZ1 LYS 32 HZ1 LYS 32 -12.207 6.330 -18.850 909 HZ2 LYS 32 HZ2 LYS 32 -12.188 7.974 -18.451 910 HZ3 LYS 32 HZ3 LYS 32 -13.482 7.333 -19.324 911 H ALA 33 H ALA 33 -9.268 5.513 -14.244 912 HA ALA 33 HA ALA 33 -9.310 4.702 -16.956 913 HB1 ALA 33 HB1 ALA 33 -7.812 6.469 -16.087 914 HB2 ALA 33 HB2 ALA 33 -6.911 5.244 -16.982 915 HB3 ALA 33 HB3 ALA 33 -6.877 5.252 -15.215 916 H THR 34 H THR 34 -8.266 3.035 -14.078 917 HA THR 34 HA THR 34 -7.013 0.789 -15.482 918 HB THR 34 HB THR 34 -6.410 0.019 -13.193 919 HG1 THR 34 HG1 THR 34 -7.125 2.274 -11.847 920 HG21 THR 34 HG21 THR 34 -4.898 1.863 -12.572 921 HG22 THR 34 HG22 THR 34 -5.793 2.968 -13.618 922 HG23 THR 34 HG23 THR 34 -4.891 1.621 -14.319 923 H LYS 35 H LYS 35 -10.083 1.644 -14.296 924 HA LYS 35 HA LYS 35 -12.093 0.631 -14.252 925 HB2 LYS 35 HB2 LYS 35 -11.206 -0.597 -16.297 926 HB3 LYS 35 HB3 LYS 35 -10.758 -1.923 -15.237 927 HG2 LYS 35 HG2 LYS 35 -13.158 -2.222 -14.636 928 HG3 LYS 35 HG3 LYS 35 -13.583 -0.914 -15.745 929 HD2 LYS 35 HD2 LYS 35 -12.256 -3.551 -16.518 930 HD3 LYS 35 HD3 LYS 35 -13.955 -3.138 -16.771 931 HE2 LYS 35 HE2 LYS 35 -13.321 -1.347 -18.318 932 HE3 LYS 35 HE3 LYS 35 -11.610 -1.651 -18.016 933 HZ1 LYS 35 HZ1 LYS 35 -11.823 -3.810 -19.011 934 HZ2 LYS 35 HZ2 LYS 35 -12.396 -2.637 -20.084 935 HZ3 LYS 35 HZ3 LYS 35 -13.487 -3.602 -19.227 936 H LEU 36 H LEU 36 -9.987 0.431 -12.079 937 HA LEU 36 HA LEU 36 -10.767 -1.786 -10.387 938 HB2 LEU 36 HB2 LEU 36 -9.219 0.766 -9.801 939 HB3 LEU 36 HB3 LEU 36 -9.477 -0.512 -8.619 940 HG LEU 36 HG LEU 36 -7.955 -0.859 -11.243 941 HD11 LEU 36 HD11 LEU 36 -5.914 -0.976 -9.860 942 HD12 LEU 36 HD12 LEU 36 -6.853 -0.544 -8.429 943 HD13 LEU 36 HD13 LEU 36 -6.690 0.604 -9.761 944 HD21 LEU 36 HD21 LEU 36 -8.265 -2.771 -8.899 945 HD22 LEU 36 HD22 LEU 36 -7.255 -3.028 -10.325 946 HD23 LEU 36 HD23 LEU 36 -9.005 -2.948 -10.493 947 H LYS 37 H LYS 37 -11.897 -1.464 -8.276 948 HA LYS 37 HA LYS 37 -14.145 0.465 -8.607 949 HB2 LYS 37 HB2 LYS 37 -15.599 -1.341 -7.610 950 HB3 LYS 37 HB3 LYS 37 -14.936 -1.704 -9.198 951 HG2 LYS 37 HG2 LYS 37 -13.114 -3.048 -8.006 952 HG3 LYS 37 HG3 LYS 37 -14.064 -2.861 -6.528 953 HD2 LYS 37 HD2 LYS 37 -15.066 -4.142 -9.102 954 HD3 LYS 37 HD3 LYS 37 -14.464 -5.033 -7.703 955 HE2 LYS 37 HE2 LYS 37 -16.305 -4.117 -6.333 956 HE3 LYS 37 HE3 LYS 37 -16.899 -3.215 -7.727 957 HZ1 LYS 37 HZ1 LYS 37 -18.100 -5.287 -7.356 958 HZ2 LYS 37 HZ2 LYS 37 -16.675 -6.165 -7.593 959 HZ3 LYS 37 HZ3 LYS 37 -17.331 -5.264 -8.861 960 H ALA 38 H ALA 38 -12.187 -1.297 -6.250 961 HA ALA 38 HA ALA 38 -13.313 0.199 -3.977 962 HB1 ALA 38 HB1 ALA 38 -12.042 -1.365 -2.560 963 HB2 ALA 38 HB2 ALA 38 -11.297 -2.085 -3.993 964 HB3 ALA 38 HB3 ALA 38 -13.034 -2.244 -3.727 965 H ASP 39 H ASP 39 -12.097 1.503 -2.657 966 HA ASP 39 HA ASP 39 -9.905 3.026 -3.512 967 HB2 ASP 39 HB2 ASP 39 -9.787 3.764 -1.142 968 HB3 ASP 39 HB3 ASP 39 -11.447 3.729 -1.723 969 H LYS 40 H LYS 40 -10.087 0.033 -1.744 970 HA LYS 40 HA LYS 40 -7.490 -0.281 -0.742 971 HB2 LYS 40 HB2 LYS 40 -9.381 -2.480 -1.677 972 HB3 LYS 40 HB3 LYS 40 -8.081 -2.647 -0.495 973 HG2 LYS 40 HG2 LYS 40 -10.560 -0.922 -0.140 974 HG3 LYS 40 HG3 LYS 40 -10.348 -2.550 0.527 975 HD2 LYS 40 HD2 LYS 40 -8.344 -1.655 1.801 976 HD3 LYS 40 HD3 LYS 40 -8.772 -0.040 1.219 977 HE2 LYS 40 HE2 LYS 40 -10.489 -1.835 2.965 978 HE3 LYS 40 HE3 LYS 40 -9.627 -0.387 3.484 979 HZ1 LYS 40 HZ1 LYS 40 -11.966 0.058 3.123 980 HZ2 LYS 40 HZ2 LYS 40 -11.856 -0.474 1.525 981 HZ3 LYS 40 HZ3 LYS 40 -11.033 0.916 2.009 982 H ASP 41 H ASP 41 -8.862 -1.088 -3.908 983 HA ASP 41 HA ASP 41 -6.758 -2.618 -5.012 984 HB2 ASP 41 HB2 ASP 41 -8.714 -0.764 -6.444 985 HB3 ASP 41 HB3 ASP 41 -7.754 -2.026 -7.211 986 H PHE 42 H PHE 42 -7.356 0.866 -4.882 987 HA PHE 42 HA PHE 42 -5.169 1.652 -6.538 988 HB2 PHE 42 HB2 PHE 42 -7.121 3.138 -6.206 989 HB3 PHE 42 HB3 PHE 42 -6.714 3.312 -4.500 990 HD1 PHE 42 HD2 PHE 42 -5.331 3.899 -7.934 991 HD2 PHE 42 HD1 PHE 42 -5.243 5.082 -3.821 992 HE1 PHE 42 HE2 PHE 42 -3.842 5.763 -8.495 993 HE2 PHE 42 HE1 PHE 42 -3.743 6.948 -4.402 994 HZ PHE 42 HZ PHE 42 -3.042 7.287 -6.744 995 H PHE 43 H PHE 43 -5.527 1.178 -3.023 996 HA PHE 43 HA PHE 43 -3.069 2.483 -2.291 997 HB2 PHE 43 HB2 PHE 43 -4.713 0.496 -0.669 998 HB3 PHE 43 HB3 PHE 43 -3.454 1.551 -0.033 999 HD1 PHE 43 HD1 PHE 43 -4.183 4.116 -1.505 1000 HD2 PHE 43 HD2 PHE 43 -6.589 1.240 0.551 1001 HE1 PHE 43 HE1 PHE 43 -5.859 5.849 -1.031 1002 HE2 PHE 43 HE2 PHE 43 -8.262 2.963 1.005 1003 HZ PHE 43 HZ PHE 43 -7.903 5.280 0.223 1004 H LEU 44 H LEU 44 -3.977 -0.953 -2.677 1005 HA LEU 44 HA LEU 44 -1.455 -2.057 -1.939 1006 HB2 LEU 44 HB2 LEU 44 -3.882 -3.142 -3.370 1007 HB3 LEU 44 HB3 LEU 44 -2.413 -4.098 -3.346 1008 HG LEU 44 HG LEU 44 -2.467 -4.147 -0.864 1009 HD11 LEU 44 HD11 LEU 44 -5.122 -2.700 -1.043 1010 HD12 LEU 44 HD12 LEU 44 -3.623 -2.041 -0.385 1011 HD13 LEU 44 HD13 LEU 44 -4.411 -3.399 0.415 1012 HD21 LEU 44 HD21 LEU 44 -3.508 -5.984 -2.107 1013 HD22 LEU 44 HD22 LEU 44 -5.048 -5.121 -2.128 1014 HD23 LEU 44 HD23 LEU 44 -4.369 -5.681 -0.599 1015 H GLY 45 H GLY 45 -2.773 -0.924 -5.015 1016 HA2 GLY 45 HA2 GLY 45 -0.573 -1.733 -6.677 1017 HA3 GLY 45 HA3 GLY 45 -1.796 -0.536 -7.068 1018 H LEU 46 H LEU 46 -1.459 1.391 -5.194 1019 HA LEU 46 HA LEU 46 0.696 2.928 -6.237 1020 HB2 LEU 46 HB2 LEU 46 -1.411 3.950 -5.427 1021 HB3 LEU 46 HB3 LEU 46 -1.045 3.435 -3.790 1022 HG LEU 46 HG LEU 46 1.004 4.935 -3.847 1023 HD11 LEU 46 HD11 LEU 46 1.157 6.684 -5.551 1024 HD12 LEU 46 HD12 LEU 46 -0.194 5.967 -6.432 1025 HD13 LEU 46 HD13 LEU 46 1.326 5.079 -6.263 1026 HD21 LEU 46 HD21 LEU 46 -1.656 6.349 -4.232 1027 HD22 LEU 46 HD22 LEU 46 -0.221 7.022 -3.457 1028 HD23 LEU 46 HD23 LEU 46 -1.060 5.660 -2.720 1029 H GLY 47 H GLY 47 0.340 1.011 -3.335 1030 HA2 GLY 47 HA2 GLY 47 2.530 1.850 -1.782 1031 HA3 GLY 47 HA3 GLY 47 1.805 0.249 -1.742 1032 H TRP 48 H TRP 48 2.348 -0.358 -4.522 1033 HA TRP 48 HA TRP 48 5.087 -1.232 -4.403 1034 HB2 TRP 48 HB2 TRP 48 3.085 -2.457 -5.500 1035 HB3 TRP 48 HB3 TRP 48 3.307 -1.364 -6.858 1036 HD1 TRP 48 HD1 TRP 48 5.913 -1.523 -8.024 1037 HE1 TRP 48 HE1 TRP 48 7.392 -3.597 -8.329 1038 HE3 TRP 48 HE3 TRP 48 3.595 -4.653 -4.739 1039 HZ2 TRP 48 HZ2 TRP 48 7.527 -6.239 -7.361 1040 HZ3 TRP 48 HZ3 TRP 48 4.438 -6.940 -4.498 1041 HH2 TRP 48 HH2 TRP 48 6.366 -7.728 -5.777 1042 H LEU 49 H LEU 49 3.326 1.314 -6.121 1043 HA LEU 49 HA LEU 49 5.471 2.247 -7.747 1044 HB2 LEU 49 HB2 LEU 49 2.916 3.501 -6.739 1045 HB3 LEU 49 HB3 LEU 49 4.071 4.461 -7.637 1046 HG LEU 49 HG LEU 49 3.764 3.131 -9.642 1047 HD11 LEU 49 HD11 LEU 49 1.954 1.317 -8.055 1048 HD12 LEU 49 HD12 LEU 49 3.561 0.921 -8.673 1049 HD13 LEU 49 HD13 LEU 49 2.243 1.245 -9.798 1050 HD21 LEU 49 HD21 LEU 49 1.074 3.755 -8.380 1051 HD22 LEU 49 HD22 LEU 49 1.381 3.545 -10.110 1052 HD23 LEU 49 HD23 LEU 49 2.106 4.900 -9.248 1053 H LEU 50 H LEU 50 4.565 2.872 -4.416 1054 HA LEU 50 HA LEU 50 6.589 4.833 -3.839 1055 HB2 LEU 50 HB2 LEU 50 4.952 3.054 -1.991 1056 HB3 LEU 50 HB3 LEU 50 5.994 4.361 -1.444 1057 HG LEU 50 HG LEU 50 3.500 4.698 -3.169 1058 HD11 LEU 50 HD11 LEU 50 3.907 5.370 -0.236 1059 HD12 LEU 50 HD12 LEU 50 2.922 4.054 -0.881 1060 HD13 LEU 50 HD13 LEU 50 2.467 5.726 -1.197 1061 HD21 LEU 50 HD21 LEU 50 5.318 6.826 -1.980 1062 HD22 LEU 50 HD22 LEU 50 3.793 7.119 -2.820 1063 HD23 LEU 50 HD23 LEU 50 5.153 6.424 -3.693 1064 H ARG 51 H ARG 51 6.360 1.269 -3.592 1065 HA ARG 51 HA ARG 51 8.707 0.861 -2.067 1066 HB2 ARG 51 HB2 ARG 51 8.411 -1.443 -2.316 1067 HB3 ARG 51 HB3 ARG 51 6.788 -0.842 -2.546 1068 HG2 ARG 51 HG2 ARG 51 6.804 -2.326 -4.272 1069 HG3 ARG 51 HG3 ARG 51 7.543 -0.987 -5.130 1070 HD2 ARG 51 HD2 ARG 51 8.838 -2.884 -5.688 1071 HD3 ARG 51 HD3 ARG 51 9.805 -1.992 -4.508 1072 HE ARG 51 HE ARG 51 8.179 -4.033 -3.318 1073 HH11 ARG 51 HH11 ARG 51 11.212 -3.489 -4.904 1074 HH12 ARG 51 HH12 ARG 51 11.919 -4.915 -4.234 1075 HH21 ARG 51 HH21 ARG 51 9.134 -5.831 -2.477 1076 HH22 ARG 51 HH22 ARG 51 10.770 -6.205 -2.866 1077 H GLU 52 H GLU 52 8.278 1.128 -5.578 1078 HA GLU 52 HA GLU 52 11.175 0.829 -6.042 1079 HB2 GLU 52 HB2 GLU 52 8.851 1.100 -7.989 1080 HB3 GLU 52 HB3 GLU 52 10.541 1.006 -8.485 1081 HG2 GLU 52 HG2 GLU 52 10.657 -1.239 -7.299 1082 HG3 GLU 52 HG3 GLU 52 8.908 -1.140 -7.095 1083 H ASP 53 H ASP 53 9.204 3.342 -5.140 1084 HA ASP 53 HA ASP 53 9.480 5.573 -4.928 1085 HB2 ASP 53 HB2 ASP 53 12.290 5.125 -6.022 1086 HB3 ASP 53 HB3 ASP 53 11.740 6.567 -5.180 1087 H LYS 54 H LYS 54 8.701 4.284 -7.607 1088 HA LYS 54 HA LYS 54 9.666 6.125 -9.669 1089 HB2 LYS 54 HB2 LYS 54 8.347 4.641 -11.214 1090 HB3 LYS 54 HB3 LYS 54 9.562 3.792 -10.266 1091 HG2 LYS 54 HG2 LYS 54 7.735 3.067 -8.683 1092 HG3 LYS 54 HG3 LYS 54 6.559 3.792 -9.789 1093 HD2 LYS 54 HD2 LYS 54 7.292 2.266 -11.585 1094 HD3 LYS 54 HD3 LYS 54 8.507 1.562 -10.512 1095 HE2 LYS 54 HE2 LYS 54 6.701 0.740 -9.029 1096 HE3 LYS 54 HE3 LYS 54 5.496 1.438 -10.116 1097 HZ1 LYS 54 HZ1 LYS 54 5.758 -0.898 -10.548 1098 HZ2 LYS 54 HZ2 LYS 54 7.422 -0.720 -10.779 1099 HZ3 LYS 54 HZ3 LYS 54 6.339 -0.019 -11.872 1100 H VAL 55 H VAL 55 7.327 6.450 -7.406 1101 HA VAL 55 HA VAL 55 6.189 8.660 -8.980 1102 HB VAL 55 HB VAL 55 3.972 8.486 -7.971 1103 HG11 VAL 55 HG11 VAL 55 4.251 7.334 -10.107 1104 HG12 VAL 55 HG12 VAL 55 3.084 6.481 -9.096 1105 HG13 VAL 55 HG13 VAL 55 4.724 5.850 -9.273 1106 HG21 VAL 55 HG21 VAL 55 4.526 7.485 -5.805 1107 HG22 VAL 55 HG22 VAL 55 4.932 5.954 -6.582 1108 HG23 VAL 55 HG23 VAL 55 3.266 6.532 -6.595 1109 H VAL 56 H VAL 56 5.185 10.292 -7.522 1110 HA VAL 56 HA VAL 56 5.947 10.271 -4.725 1111 HB VAL 56 HB VAL 56 7.792 11.524 -5.768 1112 HG11 VAL 56 HG11 VAL 56 5.687 13.384 -6.914 1113 HG12 VAL 56 HG12 VAL 56 6.695 12.263 -7.826 1114 HG13 VAL 56 HG13 VAL 56 7.433 13.635 -6.997 1115 HG21 VAL 56 HG21 VAL 56 7.098 12.279 -3.535 1116 HG22 VAL 56 HG22 VAL 56 5.922 13.386 -4.250 1117 HG23 VAL 56 HG23 VAL 56 7.649 13.653 -4.497 1118 H THR 57 H THR 57 4.547 11.562 -3.421 1119 HA THR 57 HA THR 57 1.854 11.642 -4.631 1120 HB THR 57 HB THR 57 1.032 11.349 -2.305 1121 HG1 THR 57 HG1 THR 57 2.374 11.397 -0.612 1122 HG21 THR 57 HG21 THR 57 1.564 9.287 -3.572 1123 HG22 THR 57 HG22 THR 57 1.890 9.078 -1.853 1124 HG23 THR 57 HG23 THR 57 3.225 9.346 -2.975 1125 H SER 58 H SER 58 0.379 13.278 -4.044 1126 HA SER 58 HA SER 58 1.269 15.656 -2.568 1127 HB2 SER 58 HB2 SER 58 1.784 16.197 -4.938 1128 HB3 SER 58 HB3 SER 58 0.131 15.802 -5.403 1129 HG SER 58 HG SER 58 -0.597 17.577 -4.242 1130 H GLU 59 H GLU 59 -0.512 17.026 -1.958 1131 HA GLU 59 HA GLU 59 -3.160 15.695 -1.866 1132 HB2 GLU 59 HB2 GLU 59 -2.208 16.075 0.341 1133 HB3 GLU 59 HB3 GLU 59 -1.827 17.745 -0.042 1134 HG2 GLU 59 HG2 GLU 59 -4.706 16.836 -0.037 1135 HG3 GLU 59 HG3 GLU 59 -3.889 17.150 1.492 1136 H VAL 60 H VAL 60 -4.493 16.496 -3.467 1137 HA VAL 60 HA VAL 60 -4.581 19.442 -3.878 1138 HB VAL 60 HB VAL 60 -5.329 17.138 -5.733 1139 HG11 VAL 60 HG11 VAL 60 -5.976 20.082 -6.183 1140 HG12 VAL 60 HG12 VAL 60 -7.149 18.787 -5.928 1141 HG13 VAL 60 HG13 VAL 60 -6.150 18.796 -7.380 1142 HG21 VAL 60 HG21 VAL 60 -2.955 17.824 -5.716 1143 HG22 VAL 60 HG22 VAL 60 -3.427 19.486 -6.084 1144 HG23 VAL 60 HG23 VAL 60 -3.713 18.203 -7.265 1145 H GLU 61 H GLU 61 -6.042 20.236 -2.513 1146 HA GLU 61 HA GLU 61 -7.983 20.758 -1.477 1147 HB2 GLU 61 HB2 GLU 61 -9.311 19.471 -3.898 1148 HB3 GLU 61 HB3 GLU 61 -9.988 20.737 -2.874 1149 HG2 GLU 61 HG2 GLU 61 -8.128 22.250 -3.638 1150 HG3 GLU 61 HG3 GLU 61 -7.600 20.985 -4.731 1151 H GLY 62 H GLY 62 -6.879 18.253 -0.653 1152 HA2 GLY 62 HA2 GLY 62 -7.506 16.768 1.029 1153 HA3 GLY 62 HA3 GLY 62 -9.191 17.030 0.634 1154 H GLU 63 H GLU 63 -7.254 16.318 -2.099 1155 HA GLU 63 HA GLU 63 -8.164 13.490 -2.129 1156 HB2 GLU 63 HB2 GLU 63 -9.203 15.081 -3.813 1157 HB3 GLU 63 HB3 GLU 63 -7.610 15.314 -4.522 1158 HG2 GLU 63 HG2 GLU 63 -8.834 13.742 -5.861 1159 HG3 GLU 63 HG3 GLU 63 -7.524 12.881 -5.054 1160 H ILE 64 H ILE 64 -6.747 11.864 -2.806 1161 HA ILE 64 HA ILE 64 -3.905 12.314 -2.637 1162 HB ILE 64 HB ILE 64 -5.440 9.801 -3.459 1163 HG12 ILE 64 HG12 ILE 64 -4.222 10.586 -0.765 1164 HG13 ILE 64 HG13 ILE 64 -5.943 10.528 -1.132 1165 HG21 ILE 64 HG21 ILE 64 -3.342 8.557 -3.001 1166 HG22 ILE 64 HG22 ILE 64 -2.502 10.083 -2.714 1167 HG23 ILE 64 HG23 ILE 64 -3.134 9.713 -4.319 1168 HD11 ILE 64 HD11 ILE 64 -4.055 8.169 -1.040 1169 HD12 ILE 64 HD12 ILE 64 -5.775 8.090 -1.436 1170 HD13 ILE 64 HD13 ILE 64 -5.261 8.607 0.168 1171 H PHE 65 H PHE 65 -2.879 13.314 -4.248 1172 HA PHE 65 HA PHE 65 -3.466 12.727 -7.106 1173 HB2 PHE 65 HB2 PHE 65 -4.006 15.062 -6.410 1174 HB3 PHE 65 HB3 PHE 65 -2.359 15.285 -5.844 1175 HD1 PHE 65 HD2 PHE 65 -4.485 14.894 -8.862 1176 HD2 PHE 65 HD1 PHE 65 -0.567 15.812 -7.413 1177 HE1 PHE 65 HE2 PHE 65 -3.856 15.733 -11.083 1178 HE2 PHE 65 HE1 PHE 65 0.051 16.652 -9.638 1179 HZ PHE 65 HZ PHE 65 -1.588 16.612 -11.476 1180 H VAL 66 H VAL 66 -1.934 11.247 -7.713 1181 HA VAL 66 HA VAL 66 0.876 11.558 -6.775 1182 HB VAL 66 HB VAL 66 1.152 9.132 -7.175 1183 HG11 VAL 66 HG11 VAL 66 -1.221 9.779 -5.377 1184 HG12 VAL 66 HG12 VAL 66 0.483 9.896 -4.932 1185 HG13 VAL 66 HG13 VAL 66 -0.228 8.323 -5.285 1186 HG21 VAL 66 HG21 VAL 66 -0.804 7.683 -7.652 1187 HG22 VAL 66 HG22 VAL 66 -0.505 8.810 -8.975 1188 HG23 VAL 66 HG23 VAL 66 -1.821 9.116 -7.841 1189 H LYS 67 H LYS 67 2.613 10.966 -8.276 1190 HA LYS 67 HA LYS 67 2.111 10.983 -11.141 1191 HB2 LYS 67 HB2 LYS 67 3.384 13.127 -11.560 1192 HB3 LYS 67 HB3 LYS 67 1.795 13.338 -10.853 1193 HG2 LYS 67 HG2 LYS 67 4.223 13.330 -9.061 1194 HG3 LYS 67 HG3 LYS 67 3.823 14.767 -10.008 1195 HD2 LYS 67 HD2 LYS 67 1.511 14.703 -8.953 1196 HD3 LYS 67 HD3 LYS 67 2.100 13.422 -7.889 1197 HE2 LYS 67 HE2 LYS 67 3.275 16.219 -8.067 1198 HE3 LYS 67 HE3 LYS 67 2.150 15.673 -6.827 1199 HZ1 LYS 67 HZ1 LYS 67 4.333 15.575 -5.952 1200 HZ2 LYS 67 HZ2 LYS 67 4.918 14.721 -7.288 1201 HZ3 LYS 67 HZ3 LYS 67 3.839 13.974 -6.215 1202 H LEU 68 H LEU 68 4.101 10.791 -12.446 1203 HA LEU 68 HA LEU 68 5.913 8.950 -11.205 1204 HB2 LEU 68 HB2 LEU 68 6.091 10.180 -13.978 1205 HB3 LEU 68 HB3 LEU 68 7.020 8.801 -13.412 1206 HG LEU 68 HG LEU 68 4.044 8.922 -14.009 1207 HD11 LEU 68 HD11 LEU 68 4.550 7.129 -15.602 1208 HD12 LEU 68 HD12 LEU 68 6.258 7.192 -15.160 1209 HD13 LEU 68 HD13 LEU 68 5.494 8.575 -15.950 1210 HD21 LEU 68 HD21 LEU 68 3.888 6.567 -13.275 1211 HD22 LEU 68 HD22 LEU 68 4.254 7.658 -11.945 1212 HD23 LEU 68 HD23 LEU 68 5.534 6.660 -12.639 1213 H VAL 69 H VAL 69 6.876 10.311 -9.548 1214 HA VAL 69 HA VAL 69 8.562 11.455 -8.559 1215 HB VAL 69 HB VAL 69 10.113 10.776 -11.107 1216 HG11 VAL 69 HG11 VAL 69 11.379 12.338 -9.646 1217 HG12 VAL 69 HG12 VAL 69 12.134 10.747 -9.694 1218 HG13 VAL 69 HG13 VAL 69 11.179 11.226 -8.288 1219 HG21 VAL 69 HG21 VAL 69 9.708 9.102 -8.611 1220 HG22 VAL 69 HG22 VAL 69 10.758 8.687 -9.969 1221 HG23 VAL 69 HG23 VAL 69 9.014 8.788 -10.204 1222 H LEU 70 H LEU 70 6.720 12.940 -10.539 1223 HA LEU 70 HA LEU 70 8.282 15.322 -11.255 1224 HB2 LEU 70 HB2 LEU 70 5.330 14.695 -11.694 1225 HB3 LEU 70 HB3 LEU 70 6.173 16.105 -12.320 1226 HG LEU 70 HG LEU 70 6.754 13.221 -13.120 1227 HD11 LEU 70 HD11 LEU 70 4.596 13.953 -13.992 1228 HD12 LEU 70 HD12 LEU 70 5.772 13.794 -15.293 1229 HD13 LEU 70 HD13 LEU 70 5.336 15.398 -14.692 1230 HD21 LEU 70 HD21 LEU 70 8.782 14.586 -13.253 1231 HD22 LEU 70 HD22 LEU 70 7.936 15.800 -14.216 1232 HD23 LEU 70 HD23 LEU 70 8.204 14.181 -14.866 1233 H GLU 71 H GLU 71 8.021 17.356 -10.278 1234 HA GLU 71 HA GLU 71 6.060 17.597 -8.062 1235 HB2 GLU 71 HB2 GLU 71 8.977 18.453 -7.967 1236 HB3 GLU 71 HB3 GLU 71 7.767 18.978 -6.800 1237 HG2 GLU 71 HG2 GLU 71 7.388 16.490 -6.294 1238 HG3 GLU 71 HG3 GLU 71 8.855 16.181 -7.227 1239 H HIS 72 H HIS 72 5.542 19.758 -7.425 1240 HA HIS 72 HA HIS 72 6.090 22.066 -9.011 1241 HB2 HIS 72 HB2 HIS 72 3.805 22.399 -9.949 1242 HB3 HIS 72 HB3 HIS 72 4.585 20.976 -10.627 1243 HD1 HIS 72 HD1 HIS 72 1.653 22.050 -8.616 1244 HD2 HIS 72 HD2 HIS 72 3.433 18.494 -9.817 1245 HE1 HIS 72 HE1 HIS 72 -0.042 20.262 -8.155 1246 HE2 HIS 72 HE2 HIS 72 0.949 18.189 -9.172 1247 H HIS 73 H HIS 73 4.780 23.959 -8.241 1248 HA HIS 73 HA HIS 73 4.974 24.046 -5.434 1249 HB2 HIS 73 HB2 HIS 73 4.134 26.403 -5.647 1250 HB3 HIS 73 HB3 HIS 73 5.495 26.017 -6.684 1251 HD1 HIS 73 HD1 HIS 73 5.153 26.185 -9.215 1252 HD2 HIS 73 HD2 HIS 73 1.690 26.930 -7.033 1253 HE1 HIS 73 HE1 HIS 73 3.518 27.156 -10.853 1254 HE2 HIS 73 HE2 HIS 73 1.436 27.601 -9.518 1255 H HIS 74 H HIS 74 3.642 23.343 -3.951 1256 HA HIS 74 HA HIS 74 0.941 24.277 -3.732 1257 HB2 HIS 74 HB2 HIS 74 0.536 22.216 -5.122 1258 HB3 HIS 74 HB3 HIS 74 1.316 21.241 -3.883 1259 HD1 HIS 74 HD1 HIS 74 -1.921 22.785 -4.780 1260 HD2 HIS 74 HD2 HIS 74 -0.231 21.021 -1.421 1261 HE1 HIS 74 HE1 HIS 74 -3.830 22.331 -3.225 1262 HE2 HIS 74 HE2 HIS 74 -2.810 21.054 -1.324 1263 H HIS 75 H HIS 75 1.638 25.236 -1.833 1264 HA HIS 75 HA HIS 75 2.997 23.674 0.232 1265 HB2 HIS 75 HB2 HIS 75 2.937 25.918 1.515 1266 HB3 HIS 75 HB3 HIS 75 3.926 25.819 0.071 1267 HD1 HIS 75 HD1 HIS 75 3.751 27.801 -1.356 1268 HD2 HIS 75 HD2 HIS 75 0.245 27.217 0.782 1269 HE1 HIS 75 HE1 HIS 75 2.287 29.745 -1.940 1270 HE2 HIS 75 HE2 HIS 75 0.268 29.477 -0.475 1271 H HIS 76 H HIS 76 1.651 22.216 1.143 1272 HA HIS 76 HA HIS 76 -0.089 23.062 3.231 1273 HB2 HIS 76 HB2 HIS 76 -1.670 23.311 1.264 1274 HB3 HIS 76 HB3 HIS 76 -1.519 21.585 0.962 1275 HD1 HIS 76 HD1 HIS 76 -2.979 20.037 2.349 1276 HD2 HIS 76 HD2 HIS 76 -3.065 23.958 3.719 1277 HE1 HIS 76 HE1 HIS 76 -4.798 20.106 4.070 1278 HE2 HIS 76 HE2 HIS 76 -4.853 22.485 4.872 1279 H HIS 77 H HIS 77 0.204 21.566 4.819 1280 HA HIS 77 HA HIS 77 1.437 19.013 4.293 1281 HB2 HIS 77 HB2 HIS 77 1.528 18.710 6.711 1282 HB3 HIS 77 HB3 HIS 77 2.044 20.338 6.307 1283 HD1 HIS 77 HD1 HIS 77 0.232 22.270 6.798 1284 HD2 HIS 77 HD2 HIS 77 -0.508 18.586 8.565 1285 HE1 HIS 77 HE1 HIS 77 -1.452 22.715 8.599 1286 HE2 HIS 77 HE2 HIS 77 -2.020 20.454 9.518 Start of MODEL 7 1 H1 MET 1 H1 MET 1 13.303 15.441 5.948 2 H2 MET 1 H2 MET 1 12.242 16.033 4.776 3 H3 MET 1 H3 MET 1 12.059 14.456 5.364 4 HA MET 1 HA MET 1 11.519 15.274 7.545 5 HB2 MET 1 HB2 MET 1 11.786 18.016 6.246 6 HB3 MET 1 HB3 MET 1 11.153 17.732 7.864 7 HG2 MET 1 HG2 MET 1 13.309 16.854 8.588 8 HG3 MET 1 HG3 MET 1 13.951 17.024 6.955 9 HE1 MET 1 HE1 MET 1 16.041 18.414 7.772 10 HE2 MET 1 HE2 MET 1 15.507 18.232 9.445 11 HE3 MET 1 HE3 MET 1 15.932 19.827 8.822 12 H LYS 2 H LYS 2 9.532 14.415 7.516 13 HA LYS 2 HA LYS 2 7.312 14.122 7.309 14 HB2 LYS 2 HB2 LYS 2 7.366 17.011 6.364 15 HB3 LYS 2 HB3 LYS 2 5.871 16.116 6.622 16 HG2 LYS 2 HG2 LYS 2 7.964 16.677 8.758 17 HG3 LYS 2 HG3 LYS 2 6.461 17.584 8.532 18 HD2 LYS 2 HD2 LYS 2 5.148 15.545 9.005 19 HD3 LYS 2 HD3 LYS 2 6.639 14.615 9.201 20 HE2 LYS 2 HE2 LYS 2 5.753 16.944 10.941 21 HE3 LYS 2 HE3 LYS 2 5.676 15.237 11.378 22 HZ1 LYS 2 HZ1 LYS 2 8.139 16.826 10.877 23 HZ2 LYS 2 HZ2 LYS 2 8.118 15.162 11.170 24 HZ3 LYS 2 HZ3 LYS 2 7.598 16.237 12.369 25 H MET 3 H MET 3 9.104 13.508 4.955 26 HA MET 3 HA MET 3 7.429 13.596 2.607 27 HB2 MET 3 HB2 MET 3 9.866 11.875 3.244 28 HB3 MET 3 HB3 MET 3 9.081 11.943 1.671 29 HG2 MET 3 HG2 MET 3 9.659 14.335 1.498 30 HG3 MET 3 HG3 MET 3 10.447 14.249 3.073 31 HE1 MET 3 HE1 MET 3 10.569 13.030 -0.688 32 HE2 MET 3 HE2 MET 3 10.544 11.497 0.184 33 HE3 MET 3 HE3 MET 3 12.002 11.999 -0.672 34 H LEU 4 H LEU 4 6.414 11.783 1.577 35 HA LEU 4 HA LEU 4 4.743 10.190 3.179 36 HB2 LEU 4 HB2 LEU 4 4.468 10.905 0.702 37 HB3 LEU 4 HB3 LEU 4 5.468 9.531 0.298 38 HG LEU 4 HG LEU 4 2.992 9.176 -0.022 39 HD11 LEU 4 HD11 LEU 4 4.227 7.245 1.948 40 HD12 LEU 4 HD12 LEU 4 4.429 7.223 0.196 41 HD13 LEU 4 HD13 LEU 4 2.840 6.929 0.899 42 HD21 LEU 4 HD21 LEU 4 2.841 9.264 3.002 43 HD22 LEU 4 HD22 LEU 4 1.530 8.821 1.903 44 HD23 LEU 4 HD23 LEU 4 2.175 10.461 1.887 45 H LYS 5 H LYS 5 7.787 9.372 1.512 46 HA LYS 5 HA LYS 5 7.940 6.633 2.109 47 HB2 LYS 5 HB2 LYS 5 10.137 8.682 1.664 48 HB3 LYS 5 HB3 LYS 5 10.460 6.961 1.862 49 HG2 LYS 5 HG2 LYS 5 8.905 6.582 -0.138 50 HG3 LYS 5 HG3 LYS 5 8.990 8.330 -0.404 51 HD2 LYS 5 HD2 LYS 5 11.425 8.206 -0.670 52 HD3 LYS 5 HD3 LYS 5 11.415 6.485 -0.268 53 HE2 LYS 5 HE2 LYS 5 11.634 6.734 -2.666 54 HE3 LYS 5 HE3 LYS 5 10.035 6.071 -2.321 55 HZ1 LYS 5 HZ1 LYS 5 10.024 7.846 -3.995 56 HZ2 LYS 5 HZ2 LYS 5 10.604 8.933 -2.845 57 HZ3 LYS 5 HZ3 LYS 5 9.078 8.231 -2.648 58 H GLU 6 H GLU 6 8.829 9.406 4.118 59 HA GLU 6 HA GLU 6 10.325 7.900 6.081 60 HB2 GLU 6 HB2 GLU 6 9.302 10.769 6.161 61 HB3 GLU 6 HB3 GLU 6 10.467 10.062 7.283 62 HG2 GLU 6 HG2 GLU 6 12.049 9.723 5.415 63 HG3 GLU 6 HG3 GLU 6 10.887 10.449 4.302 64 H LYS 7 H LYS 7 7.074 9.428 6.008 65 HA LYS 7 HA LYS 7 6.362 8.659 8.672 66 HB2 LYS 7 HB2 LYS 7 4.065 9.305 8.076 67 HB3 LYS 7 HB3 LYS 7 5.233 10.532 7.609 68 HG2 LYS 7 HG2 LYS 7 5.053 9.945 5.281 69 HG3 LYS 7 HG3 LYS 7 4.119 8.496 5.655 70 HD2 LYS 7 HD2 LYS 7 2.665 10.258 4.789 71 HD3 LYS 7 HD3 LYS 7 2.261 9.876 6.464 72 HE2 LYS 7 HE2 LYS 7 3.575 11.892 7.189 73 HE3 LYS 7 HE3 LYS 7 3.846 12.291 5.492 74 HZ1 LYS 7 HZ1 LYS 7 1.175 12.066 6.765 75 HZ2 LYS 7 HZ2 LYS 7 1.511 12.589 5.190 76 HZ3 LYS 7 HZ3 LYS 7 2.007 13.520 6.514 77 H ALA 8 H ALA 8 5.651 7.207 5.479 78 HA ALA 8 HA ALA 8 4.193 4.956 6.371 79 HB1 ALA 8 HB1 ALA 8 4.255 5.670 4.006 80 HB2 ALA 8 HB2 ALA 8 4.699 3.970 4.169 81 HB3 ALA 8 HB3 ALA 8 5.951 5.190 3.897 82 H GLY 9 H GLY 9 7.654 5.586 6.100 83 HA2 GLY 9 HA2 GLY 9 8.644 2.986 6.741 84 HA3 GLY 9 HA3 GLY 9 9.528 4.497 6.857 85 H ALA 10 H ALA 10 7.691 5.753 8.741 86 HA ALA 10 HA ALA 10 8.652 4.769 11.253 87 HB1 ALA 10 HB1 ALA 10 8.157 7.159 10.871 88 HB2 ALA 10 HB2 ALA 10 7.237 6.530 12.243 89 HB3 ALA 10 HB3 ALA 10 6.442 6.780 10.686 90 H LEU 11 H LEU 11 5.430 4.763 9.708 91 HA LEU 11 HA LEU 11 4.012 3.163 11.550 92 HB2 LEU 11 HB2 LEU 11 3.664 3.427 8.533 93 HB3 LEU 11 HB3 LEU 11 2.483 2.689 9.607 94 HG LEU 11 HG LEU 11 3.340 5.614 9.721 95 HD11 LEU 11 HD11 LEU 11 1.143 6.147 8.770 96 HD12 LEU 11 HD12 LEU 11 0.791 4.428 8.578 97 HD13 LEU 11 HD13 LEU 11 2.104 5.171 7.661 98 HD21 LEU 11 HD21 LEU 11 1.440 5.905 11.259 99 HD22 LEU 11 HD22 LEU 11 2.623 4.772 11.908 100 HD23 LEU 11 HD23 LEU 11 1.118 4.169 11.207 101 H ALA 12 H ALA 12 6.048 2.321 8.786 102 HA ALA 12 HA ALA 12 5.661 -0.446 8.664 103 HB1 ALA 12 HB1 ALA 12 8.193 1.097 8.019 104 HB2 ALA 12 HB2 ALA 12 6.827 0.845 6.931 105 HB3 ALA 12 HB3 ALA 12 7.791 -0.533 7.460 106 H GLY 13 H GLY 13 8.068 1.404 10.522 107 HA2 GLY 13 HA2 GLY 13 9.645 -0.624 11.569 108 HA3 GLY 13 HA3 GLY 13 9.348 0.910 12.364 109 H GLN 14 H GLN 14 6.698 0.738 13.028 110 HA GLN 14 HA GLN 14 6.791 -0.938 15.367 111 HB2 GLN 14 HB2 GLN 14 4.496 0.063 15.837 112 HB3 GLN 14 HB3 GLN 14 5.826 1.207 15.681 113 HG2 GLN 14 HG2 GLN 14 5.117 1.695 13.353 114 HG3 GLN 14 HG3 GLN 14 3.759 0.589 13.551 115 HE21 GLN 14 HE21 GLN 14 2.380 2.357 13.050 116 HE22 GLN 14 HE22 GLN 14 2.012 3.564 14.227 117 H ILE 15 H ILE 15 4.931 -1.097 12.307 118 HA ILE 15 HA ILE 15 3.215 -3.254 13.108 119 HB ILE 15 HB ILE 15 3.952 -2.273 10.313 120 HG12 ILE 15 HG12 ILE 15 1.435 -1.781 11.980 121 HG13 ILE 15 HG13 ILE 15 2.747 -0.622 11.790 122 HG21 ILE 15 HG21 ILE 15 1.730 -4.203 11.098 123 HG22 ILE 15 HG22 ILE 15 3.170 -4.605 10.162 124 HG23 ILE 15 HG23 ILE 15 1.960 -3.514 9.488 125 HD11 ILE 15 HD11 ILE 15 0.940 -1.641 9.600 126 HD12 ILE 15 HD12 ILE 15 2.269 -0.497 9.386 127 HD13 ILE 15 HD13 ILE 15 0.876 -0.058 10.373 128 H TRP 16 H TRP 16 6.235 -3.172 11.193 129 HA TRP 16 HA TRP 16 6.727 -5.896 10.823 130 HB2 TRP 16 HB2 TRP 16 8.115 -3.984 9.886 131 HB3 TRP 16 HB3 TRP 16 8.834 -3.768 11.476 132 HD1 TRP 16 HD1 TRP 16 9.137 -5.836 8.323 133 HE1 TRP 16 HE1 TRP 16 11.095 -7.489 8.532 134 HE3 TRP 16 HE3 TRP 16 10.215 -5.251 13.306 135 HZ2 TRP 16 HZ2 TRP 16 12.857 -8.425 10.515 136 HZ3 TRP 16 HZ3 TRP 16 12.052 -6.566 14.273 137 HH2 TRP 16 HH2 TRP 16 13.340 -8.121 12.911 138 H GLU 17 H GLU 17 7.494 -3.825 13.598 139 HA GLU 17 HA GLU 17 8.842 -5.736 15.204 140 HB2 GLU 17 HB2 GLU 17 8.436 -3.004 15.333 141 HB3 GLU 17 HB3 GLU 17 7.402 -3.541 16.641 142 HG2 GLU 17 HG2 GLU 17 10.380 -4.054 16.360 143 HG3 GLU 17 HG3 GLU 17 9.621 -2.893 17.440 144 H ALA 18 H ALA 18 5.411 -4.912 14.899 145 HA ALA 18 HA ALA 18 4.389 -6.479 17.056 146 HB1 ALA 18 HB1 ALA 18 3.008 -5.623 14.485 147 HB2 ALA 18 HB2 ALA 18 3.076 -4.688 15.979 148 HB3 ALA 18 HB3 ALA 18 2.201 -6.221 15.941 149 H LEU 19 H LEU 19 5.119 -7.185 13.668 150 HA LEU 19 HA LEU 19 4.264 -9.955 13.763 151 HB2 LEU 19 HB2 LEU 19 5.901 -8.475 11.674 152 HB3 LEU 19 HB3 LEU 19 5.164 -10.060 11.465 153 HG LEU 19 HG LEU 19 3.633 -7.454 11.868 154 HD11 LEU 19 HD11 LEU 19 4.024 -9.070 9.330 155 HD12 LEU 19 HD12 LEU 19 4.743 -7.496 9.690 156 HD13 LEU 19 HD13 LEU 19 2.997 -7.643 9.509 157 HD21 LEU 19 HD21 LEU 19 2.594 -10.244 11.256 158 HD22 LEU 19 HD22 LEU 19 1.620 -8.771 11.318 159 HD23 LEU 19 HD23 LEU 19 2.404 -9.367 12.778 160 H ASN 20 H ASN 20 7.192 -8.256 14.577 161 HA ASN 20 HA ASN 20 9.011 -10.457 14.392 162 HB2 ASN 20 HB2 ASN 20 9.817 -8.122 14.533 163 HB3 ASN 20 HB3 ASN 20 9.170 -7.976 16.160 164 HD21 ASN 20 HD21 ASN 20 11.177 -7.568 17.101 165 HD22 ASN 20 HD22 ASN 20 12.416 -8.763 17.224 166 H GLY 21 H GLY 21 9.402 -12.094 15.817 167 HA2 GLY 21 HA2 GLY 21 9.203 -13.434 17.713 168 HA3 GLY 21 HA3 GLY 21 8.149 -12.241 18.452 169 H THR 22 H THR 22 6.276 -12.067 16.233 170 HA THR 22 HA THR 22 4.627 -14.409 16.836 171 HB THR 22 HB THR 22 3.763 -12.062 15.090 172 HG1 THR 22 HG1 THR 22 4.097 -10.806 16.753 173 HG21 THR 22 HG21 THR 22 1.532 -12.521 16.047 174 HG22 THR 22 HG22 THR 22 2.210 -13.813 17.039 175 HG23 THR 22 HG23 THR 22 2.183 -13.973 15.279 176 H GLU 23 H GLU 23 3.661 -15.707 15.182 177 HA GLU 23 HA GLU 23 5.261 -15.969 12.707 178 HB2 GLU 23 HB2 GLU 23 4.255 -18.223 12.492 179 HB3 GLU 23 HB3 GLU 23 5.082 -18.016 14.030 180 HG2 GLU 23 HG2 GLU 23 2.090 -17.642 13.791 181 HG3 GLU 23 HG3 GLU 23 2.796 -19.242 13.995 182 H GLY 24 H GLY 24 2.562 -14.335 13.582 183 HA2 GLY 24 HA2 GLY 24 1.630 -13.448 11.235 184 HA3 GLY 24 HA3 GLY 24 0.787 -14.987 11.361 185 H LEU 25 H LEU 25 -0.100 -12.046 11.488 186 HA LEU 25 HA LEU 25 -1.974 -12.347 13.698 187 HB2 LEU 25 HB2 LEU 25 0.204 -11.226 14.560 188 HB3 LEU 25 HB3 LEU 25 -0.250 -9.838 13.587 189 HG LEU 25 HG LEU 25 -2.371 -9.641 14.927 190 HD11 LEU 25 HD11 LEU 25 -2.604 -10.898 17.028 191 HD12 LEU 25 HD12 LEU 25 -1.168 -11.845 16.630 192 HD13 LEU 25 HD13 LEU 25 -2.616 -11.971 15.628 193 HD21 LEU 25 HD21 LEU 25 -1.337 -8.723 16.960 194 HD22 LEU 25 HD22 LEU 25 -0.412 -8.276 15.528 195 HD23 LEU 25 HD23 LEU 25 0.174 -9.560 16.589 196 H THR 26 H THR 26 -3.840 -10.924 13.505 197 HA THR 26 HA THR 26 -4.367 -10.076 10.737 198 HB THR 26 HB THR 26 -6.738 -9.792 11.427 199 HG1 THR 26 HG1 THR 26 -7.350 -10.413 13.573 200 HG21 THR 26 HG21 THR 26 -7.287 -12.152 11.905 201 HG22 THR 26 HG22 THR 26 -5.602 -12.470 12.321 202 HG23 THR 26 HG23 THR 26 -6.035 -12.033 10.666 203 H GLN 27 H GLN 27 -5.433 -8.036 10.275 204 HA GLN 27 HA GLN 27 -3.897 -5.834 10.882 205 HB2 GLN 27 HB2 GLN 27 -5.620 -4.503 9.709 206 HB3 GLN 27 HB3 GLN 27 -5.286 -6.017 8.877 207 HG2 GLN 27 HG2 GLN 27 -7.343 -6.997 9.862 208 HG3 GLN 27 HG3 GLN 27 -7.697 -5.460 10.645 209 HE21 GLN 27 HE21 GLN 27 -8.295 -3.672 9.306 210 HE22 GLN 27 HE22 GLN 27 -8.914 -3.927 7.718 211 H LYS 28 H LYS 28 -6.970 -6.714 12.417 212 HA LYS 28 HA LYS 28 -7.348 -4.319 13.911 213 HB2 LYS 28 HB2 LYS 28 -9.134 -5.589 15.078 214 HB3 LYS 28 HB3 LYS 28 -9.223 -5.733 13.327 215 HG2 LYS 28 HG2 LYS 28 -8.142 -7.989 13.490 216 HG3 LYS 28 HG3 LYS 28 -8.168 -7.838 15.250 217 HD2 LYS 28 HD2 LYS 28 -10.057 -9.204 14.473 218 HD3 LYS 28 HD3 LYS 28 -10.642 -7.714 15.212 219 HE2 LYS 28 HE2 LYS 28 -10.990 -6.737 12.966 220 HE3 LYS 28 HE3 LYS 28 -10.373 -8.211 12.218 221 HZ1 LYS 28 HZ1 LYS 28 -12.239 -9.404 13.264 222 HZ2 LYS 28 HZ2 LYS 28 -12.736 -8.226 12.164 223 HZ3 LYS 28 HZ3 LYS 28 -12.852 -7.930 13.827 224 H GLN 29 H GLN 29 -5.791 -7.399 14.715 225 HA GLN 29 HA GLN 29 -5.343 -6.740 17.501 226 HB2 GLN 29 HB2 GLN 29 -4.126 -8.950 15.797 227 HB3 GLN 29 HB3 GLN 29 -4.057 -8.846 17.558 228 HG2 GLN 29 HG2 GLN 29 -6.555 -9.019 17.617 229 HG3 GLN 29 HG3 GLN 29 -6.553 -9.237 15.867 230 HE21 GLN 29 HE21 GLN 29 -5.688 -11.195 15.020 231 HE22 GLN 29 HE22 GLN 29 -5.541 -12.602 16.001 232 H ILE 30 H ILE 30 -3.536 -6.468 14.490 233 HA ILE 30 HA ILE 30 -1.007 -5.724 15.564 234 HB ILE 30 HB ILE 30 -2.240 -5.155 12.833 235 HG12 ILE 30 HG12 ILE 30 -0.158 -7.229 13.664 236 HG13 ILE 30 HG13 ILE 30 -1.865 -7.573 13.420 237 HG21 ILE 30 HG21 ILE 30 -0.479 -3.483 13.269 238 HG22 ILE 30 HG22 ILE 30 0.035 -4.620 12.022 239 HG23 ILE 30 HG23 ILE 30 0.667 -4.769 13.666 240 HD11 ILE 30 HD11 ILE 30 0.086 -6.657 11.314 241 HD12 ILE 30 HD12 ILE 30 -1.634 -6.968 11.056 242 HD13 ILE 30 HD13 ILE 30 -0.561 -8.284 11.530 243 H LYS 31 H LYS 31 -3.808 -3.753 14.441 244 HA LYS 31 HA LYS 31 -2.575 -1.228 14.877 245 HB2 LYS 31 HB2 LYS 31 -4.720 -0.212 14.497 246 HB3 LYS 31 HB3 LYS 31 -4.558 -1.573 13.394 247 HG2 LYS 31 HG2 LYS 31 -5.996 -2.924 14.946 248 HG3 LYS 31 HG3 LYS 31 -6.239 -1.471 15.921 249 HD2 LYS 31 HD2 LYS 31 -7.055 -1.840 13.005 250 HD3 LYS 31 HD3 LYS 31 -8.140 -1.856 14.397 251 HE2 LYS 31 HE2 LYS 31 -6.511 0.524 13.429 252 HE3 LYS 31 HE3 LYS 31 -8.249 0.297 13.221 253 HZ1 LYS 31 HZ1 LYS 31 -7.921 1.731 15.056 254 HZ2 LYS 31 HZ2 LYS 31 -6.777 0.711 15.763 255 HZ3 LYS 31 HZ3 LYS 31 -8.401 0.241 15.695 256 H LYS 32 H LYS 32 -4.252 -3.404 17.086 257 HA LYS 32 HA LYS 32 -4.475 -1.657 19.332 258 HB2 LYS 32 HB2 LYS 32 -4.209 -4.676 19.077 259 HB3 LYS 32 HB3 LYS 32 -4.371 -3.887 20.642 260 HG2 LYS 32 HG2 LYS 32 -6.410 -3.654 18.405 261 HG3 LYS 32 HG3 LYS 32 -6.497 -4.836 19.718 262 HD2 LYS 32 HD2 LYS 32 -6.529 -2.930 21.361 263 HD3 LYS 32 HD3 LYS 32 -6.568 -1.800 20.004 264 HE2 LYS 32 HE2 LYS 32 -8.743 -2.677 19.301 265 HE3 LYS 32 HE3 LYS 32 -8.684 -3.913 20.561 266 HZ1 LYS 32 HZ1 LYS 32 -8.782 -0.982 21.015 267 HZ2 LYS 32 HZ2 LYS 32 -8.723 -2.168 22.223 268 HZ3 LYS 32 HZ3 LYS 32 -10.066 -2.063 21.208 269 H ALA 33 H ALA 33 -1.960 -3.982 18.325 270 HA ALA 33 HA ALA 33 -0.165 -3.585 20.492 271 HB1 ALA 33 HB1 ALA 33 1.440 -4.872 19.135 272 HB2 ALA 33 HB2 ALA 33 0.407 -4.679 17.713 273 HB3 ALA 33 HB3 ALA 33 -0.162 -5.615 19.098 274 H THR 34 H THR 34 -0.471 -1.997 17.375 275 HA THR 34 HA THR 34 1.997 -0.418 17.678 276 HB THR 34 HB THR 34 1.554 0.304 15.331 277 HG1 THR 34 HG1 THR 34 -0.435 -1.530 14.850 278 HG21 THR 34 HG21 THR 34 2.857 -1.772 15.688 279 HG22 THR 34 HG22 THR 34 1.888 -1.862 14.217 280 HG23 THR 34 HG23 THR 34 1.361 -2.716 15.670 281 H LYS 35 H LYS 35 -1.296 -0.104 18.393 282 HA LYS 35 HA LYS 35 -2.582 1.522 19.266 283 HB2 LYS 35 HB2 LYS 35 0.018 3.099 19.414 284 HB3 LYS 35 HB3 LYS 35 -1.501 3.652 20.116 285 HG2 LYS 35 HG2 LYS 35 -0.054 1.094 20.886 286 HG3 LYS 35 HG3 LYS 35 0.028 2.612 21.782 287 HD2 LYS 35 HD2 LYS 35 -2.602 1.157 21.278 288 HD3 LYS 35 HD3 LYS 35 -1.577 0.788 22.663 289 HE2 LYS 35 HE2 LYS 35 -3.335 2.303 23.362 290 HE3 LYS 35 HE3 LYS 35 -1.803 3.166 23.414 291 HZ1 LYS 35 HZ1 LYS 35 -2.371 4.272 21.373 292 HZ2 LYS 35 HZ2 LYS 35 -3.621 4.479 22.489 293 HZ3 LYS 35 HZ3 LYS 35 -3.795 3.371 21.224 294 H LEU 36 H LEU 36 -2.307 1.263 16.409 295 HA LEU 36 HA LEU 36 -2.552 3.866 15.180 296 HB2 LEU 36 HB2 LEU 36 -3.264 1.094 14.141 297 HB3 LEU 36 HB3 LEU 36 -3.326 2.561 13.169 298 HG LEU 36 HG LEU 36 -0.831 1.322 14.389 299 HD11 LEU 36 HD11 LEU 36 -1.677 1.519 11.484 300 HD12 LEU 36 HD12 LEU 36 -1.669 0.055 12.474 301 HD13 LEU 36 HD13 LEU 36 -0.152 0.862 12.087 302 HD21 LEU 36 HD21 LEU 36 -1.092 3.835 12.714 303 HD22 LEU 36 HD22 LEU 36 0.429 3.049 13.138 304 HD23 LEU 36 HD23 LEU 36 -0.587 3.732 14.402 305 H LYS 37 H LYS 37 -4.331 5.090 15.055 306 HA LYS 37 HA LYS 37 -6.850 4.420 16.221 307 HB2 LYS 37 HB2 LYS 37 -6.058 6.712 14.364 308 HB3 LYS 37 HB3 LYS 37 -7.653 6.564 15.083 309 HG2 LYS 37 HG2 LYS 37 -6.487 8.163 16.374 310 HG3 LYS 37 HG3 LYS 37 -6.551 6.702 17.356 311 HD2 LYS 37 HD2 LYS 37 -4.226 6.228 16.960 312 HD3 LYS 37 HD3 LYS 37 -4.128 7.436 15.675 313 HE2 LYS 37 HE2 LYS 37 -3.065 8.198 17.796 314 HE3 LYS 37 HE3 LYS 37 -4.386 9.245 17.279 315 HZ1 LYS 37 HZ1 LYS 37 -4.421 8.774 19.669 316 HZ2 LYS 37 HZ2 LYS 37 -4.624 7.125 19.351 317 HZ3 LYS 37 HZ3 LYS 37 -5.820 8.225 18.900 318 H ALA 38 H ALA 38 -5.715 4.717 12.855 319 HA ALA 38 HA ALA 38 -8.197 3.416 11.866 320 HB1 ALA 38 HB1 ALA 38 -6.416 5.406 10.415 321 HB2 ALA 38 HB2 ALA 38 -7.994 5.755 11.124 322 HB3 ALA 38 HB3 ALA 38 -7.870 4.645 9.754 323 H ASP 39 H ASP 39 -8.064 1.828 10.348 324 HA ASP 39 HA ASP 39 -5.752 0.224 9.965 325 HB2 ASP 39 HB2 ASP 39 -8.371 0.302 8.423 326 HB3 ASP 39 HB3 ASP 39 -7.151 -0.966 8.265 327 H LYS 40 H LYS 40 -6.920 3.026 8.292 328 HA LYS 40 HA LYS 40 -5.571 2.922 5.856 329 HB2 LYS 40 HB2 LYS 40 -6.009 5.364 7.621 330 HB3 LYS 40 HB3 LYS 40 -5.665 5.391 5.888 331 HG2 LYS 40 HG2 LYS 40 -7.808 4.151 5.498 332 HG3 LYS 40 HG3 LYS 40 -8.146 4.258 7.226 333 HD2 LYS 40 HD2 LYS 40 -9.372 5.991 6.013 334 HD3 LYS 40 HD3 LYS 40 -8.169 6.726 7.072 335 HE2 LYS 40 HE2 LYS 40 -6.686 7.133 5.158 336 HE3 LYS 40 HE3 LYS 40 -7.795 6.283 4.079 337 HZ1 LYS 40 HZ1 LYS 40 -8.313 8.832 5.509 338 HZ2 LYS 40 HZ2 LYS 40 -9.465 7.990 4.598 339 HZ3 LYS 40 HZ3 LYS 40 -8.097 8.625 3.843 340 H ASP 41 H ASP 41 -4.304 3.826 9.052 341 HA ASP 41 HA ASP 41 -1.654 4.536 8.225 342 HB2 ASP 41 HB2 ASP 41 -2.646 3.515 10.919 343 HB3 ASP 41 HB3 ASP 41 -1.082 4.280 10.631 344 H PHE 42 H PHE 42 -3.214 1.507 9.170 345 HA PHE 42 HA PHE 42 -0.898 -0.151 9.127 346 HB2 PHE 42 HB2 PHE 42 -2.910 -0.901 10.287 347 HB3 PHE 42 HB3 PHE 42 -3.847 -0.842 8.800 348 HD1 PHE 42 HD1 PHE 42 -0.914 -2.575 10.370 349 HD2 PHE 42 HD2 PHE 42 -4.041 -2.806 7.454 350 HE1 PHE 42 HE1 PHE 42 -0.337 -4.918 9.923 351 HE2 PHE 42 HE2 PHE 42 -3.453 -5.155 7.023 352 HZ PHE 42 HZ PHE 42 -1.597 -6.210 8.257 353 H PHE 43 H PHE 43 -3.123 0.942 6.563 354 HA PHE 43 HA PHE 43 -2.201 -0.899 4.560 355 HB2 PHE 43 HB2 PHE 43 -3.676 1.749 4.213 356 HB3 PHE 43 HB3 PHE 43 -3.448 0.540 2.952 357 HD1 PHE 43 HD2 PHE 43 -3.980 -1.973 4.585 358 HD2 PHE 43 HD1 PHE 43 -6.060 1.760 4.419 359 HE1 PHE 43 HE2 PHE 43 -6.051 -3.091 5.279 360 HE2 PHE 43 HE1 PHE 43 -8.131 0.628 5.112 361 HZ PHE 43 HZ PHE 43 -8.131 -1.801 5.537 362 H LEU 44 H LEU 44 -1.313 2.473 5.357 363 HA LEU 44 HA LEU 44 0.650 2.776 3.285 364 HB2 LEU 44 HB2 LEU 44 -0.002 4.302 5.809 365 HB3 LEU 44 HB3 LEU 44 1.516 4.637 4.999 366 HG LEU 44 HG LEU 44 0.279 5.266 2.929 367 HD11 LEU 44 HD11 LEU 44 -2.140 5.623 2.936 368 HD12 LEU 44 HD12 LEU 44 -2.254 4.922 4.552 369 HD13 LEU 44 HD13 LEU 44 -1.745 3.922 3.190 370 HD21 LEU 44 HD21 LEU 44 0.930 7.011 4.529 371 HD22 LEU 44 HD22 LEU 44 -0.611 6.829 5.374 372 HD23 LEU 44 HD23 LEU 44 -0.578 7.423 3.711 373 H GLY 45 H GLY 45 0.830 1.722 6.682 374 HA2 GLY 45 HA2 GLY 45 3.652 1.440 6.896 375 HA3 GLY 45 HA3 GLY 45 2.454 0.643 7.904 376 H LEU 46 H LEU 46 1.165 -1.087 6.435 377 HA LEU 46 HA LEU 46 2.869 -3.274 5.928 378 HB2 LEU 46 HB2 LEU 46 0.509 -3.551 6.550 379 HB3 LEU 46 HB3 LEU 46 -0.004 -2.795 5.052 380 HG LEU 46 HG LEU 46 1.027 -4.736 3.792 381 HD11 LEU 46 HD11 LEU 46 1.331 -5.976 6.540 382 HD12 LEU 46 HD12 LEU 46 2.639 -5.496 5.452 383 HD13 LEU 46 HD13 LEU 46 1.552 -6.807 4.998 384 HD21 LEU 46 HD21 LEU 46 -1.392 -4.640 4.200 385 HD22 LEU 46 HD22 LEU 46 -1.181 -5.468 5.745 386 HD23 LEU 46 HD23 LEU 46 -0.808 -6.305 4.237 387 H GLY 47 H GLY 47 1.496 -0.852 3.740 388 HA2 GLY 47 HA2 GLY 47 2.188 -1.998 1.243 389 HA3 GLY 47 HA3 GLY 47 1.952 -0.280 1.554 390 H TRP 48 H TRP 48 3.994 0.010 3.526 391 HA TRP 48 HA TRP 48 6.376 0.225 1.960 392 HB2 TRP 48 HB2 TRP 48 5.720 1.759 3.903 393 HB3 TRP 48 HB3 TRP 48 6.198 0.462 4.997 394 HD1 TRP 48 HD1 TRP 48 8.811 0.208 5.461 395 HE1 TRP 48 HE1 TRP 48 10.894 1.472 4.668 396 HE3 TRP 48 HE3 TRP 48 6.664 3.082 1.828 397 HZ2 TRP 48 HZ2 TRP 48 11.550 3.426 2.750 398 HZ3 TRP 48 HZ3 TRP 48 8.090 4.628 0.550 399 HH2 TRP 48 HH2 TRP 48 10.486 4.797 1.010 400 H LEU 49 H LEU 49 5.291 -2.038 4.511 401 HA LEU 49 HA LEU 49 7.566 -3.653 4.765 402 HB2 LEU 49 HB2 LEU 49 4.622 -4.114 5.165 403 HB3 LEU 49 HB3 LEU 49 5.660 -5.515 5.181 404 HG LEU 49 HG LEU 49 6.840 -4.762 7.145 405 HD11 LEU 49 HD11 LEU 49 6.342 -2.648 8.260 406 HD12 LEU 49 HD12 LEU 49 5.278 -2.192 6.922 407 HD13 LEU 49 HD13 LEU 49 7.011 -2.405 6.647 408 HD21 LEU 49 HD21 LEU 49 3.866 -4.276 7.547 409 HD22 LEU 49 HD22 LEU 49 5.040 -4.671 8.807 410 HD23 LEU 49 HD23 LEU 49 4.662 -5.853 7.557 411 H LEU 50 H LEU 50 5.017 -3.783 2.308 412 HA LEU 50 HA LEU 50 5.837 -6.147 0.948 413 HB2 LEU 50 HB2 LEU 50 4.193 -3.766 0.010 414 HB3 LEU 50 HB3 LEU 50 4.424 -5.221 -0.951 415 HG LEU 50 HG LEU 50 3.030 -5.100 1.758 416 HD11 LEU 50 HD11 LEU 50 0.962 -5.564 0.523 417 HD12 LEU 50 HD12 LEU 50 1.835 -5.483 -1.009 418 HD13 LEU 50 HD13 LEU 50 1.687 -4.043 0.003 419 HD21 LEU 50 HD21 LEU 50 3.422 -7.452 -0.129 420 HD22 LEU 50 HD22 LEU 50 2.426 -7.457 1.327 421 HD23 LEU 50 HD23 LEU 50 4.167 -7.241 1.459 422 H ARG 51 H ARG 51 6.575 -2.684 0.379 423 HA ARG 51 HA ARG 51 8.233 -3.198 -1.910 424 HB2 ARG 51 HB2 ARG 51 8.662 -0.870 -1.976 425 HB3 ARG 51 HB3 ARG 51 7.004 -1.050 -1.481 426 HG2 ARG 51 HG2 ARG 51 7.433 0.466 0.125 427 HG3 ARG 51 HG3 ARG 51 8.357 -0.777 0.948 428 HD2 ARG 51 HD2 ARG 51 9.599 1.076 -1.105 429 HD3 ARG 51 HD3 ARG 51 9.508 1.479 0.605 430 HE ARG 51 HE ARG 51 10.803 -0.713 0.921 431 HH11 ARG 51 HH11 ARG 51 11.268 1.366 -1.814 432 HH12 ARG 51 HH12 ARG 51 12.900 0.864 -2.043 433 HH21 ARG 51 HH21 ARG 51 12.881 -1.303 0.625 434 HH22 ARG 51 HH22 ARG 51 13.806 -0.634 -0.671 435 H GLU 52 H GLU 52 8.793 -3.207 1.513 436 HA GLU 52 HA GLU 52 11.686 -3.147 1.464 437 HB2 GLU 52 HB2 GLU 52 9.639 -3.937 3.578 438 HB3 GLU 52 HB3 GLU 52 11.372 -4.054 3.862 439 HG2 GLU 52 HG2 GLU 52 9.971 -1.468 3.117 440 HG3 GLU 52 HG3 GLU 52 10.232 -1.991 4.782 441 H ASP 53 H ASP 53 9.250 -5.546 0.925 442 HA ASP 53 HA ASP 53 9.212 -7.754 0.478 443 HB2 ASP 53 HB2 ASP 53 11.072 -7.026 -1.094 444 HB3 ASP 53 HB3 ASP 53 12.230 -7.537 0.130 445 H LYS 54 H LYS 54 9.693 -6.719 3.236 446 HA LYS 54 HA LYS 54 11.176 -8.903 4.556 447 HB2 LYS 54 HB2 LYS 54 10.122 -6.271 5.656 448 HB3 LYS 54 HB3 LYS 54 10.917 -7.497 6.646 449 HG2 LYS 54 HG2 LYS 54 12.935 -7.278 5.136 450 HG3 LYS 54 HG3 LYS 54 12.138 -5.906 4.362 451 HD2 LYS 54 HD2 LYS 54 12.926 -6.090 7.304 452 HD3 LYS 54 HD3 LYS 54 13.800 -5.198 6.057 453 HE2 LYS 54 HE2 LYS 54 11.692 -3.809 5.731 454 HE3 LYS 54 HE3 LYS 54 11.038 -4.601 7.165 455 HZ1 LYS 54 HZ1 LYS 54 12.910 -3.723 8.429 456 HZ2 LYS 54 HZ2 LYS 54 12.013 -2.485 7.710 457 HZ3 LYS 54 HZ3 LYS 54 13.499 -2.947 7.045 458 H VAL 55 H VAL 55 8.044 -8.536 3.566 459 HA VAL 55 HA VAL 55 7.065 -10.377 5.665 460 HB VAL 55 HB VAL 55 4.847 -9.350 5.761 461 HG11 VAL 55 HG11 VAL 55 6.477 -8.637 7.432 462 HG12 VAL 55 HG12 VAL 55 5.376 -7.318 7.038 463 HG13 VAL 55 HG13 VAL 55 7.014 -7.325 6.379 464 HG21 VAL 55 HG21 VAL 55 4.719 -8.373 3.504 465 HG22 VAL 55 HG22 VAL 55 5.929 -7.163 3.940 466 HG23 VAL 55 HG23 VAL 55 4.348 -7.154 4.727 467 H VAL 56 H VAL 56 5.084 -11.497 5.105 468 HA VAL 56 HA VAL 56 4.241 -11.505 2.317 469 HB VAL 56 HB VAL 56 5.544 -13.541 2.579 470 HG11 VAL 56 HG11 VAL 56 3.801 -14.209 4.971 471 HG12 VAL 56 HG12 VAL 56 5.506 -13.753 5.010 472 HG13 VAL 56 HG13 VAL 56 5.017 -15.274 4.258 473 HG21 VAL 56 HG21 VAL 56 3.867 -15.278 2.003 474 HG22 VAL 56 HG22 VAL 56 3.537 -13.761 1.166 475 HG23 VAL 56 HG23 VAL 56 2.572 -14.218 2.572 476 H THR 57 H THR 57 2.057 -11.532 1.985 477 HA THR 57 HA THR 57 0.367 -11.025 4.358 478 HB THR 57 HB THR 57 -1.146 -9.818 2.795 479 HG1 THR 57 HG1 THR 57 -0.742 -9.716 0.664 480 HG21 THR 57 HG21 THR 57 0.293 -7.885 2.288 481 HG22 THR 57 HG22 THR 57 1.733 -8.869 2.543 482 HG23 THR 57 HG23 THR 57 0.655 -8.517 3.894 483 H SER 58 H SER 58 -1.803 -11.817 4.359 484 HA SER 58 HA SER 58 -2.681 -13.855 2.472 485 HB2 SER 58 HB2 SER 58 -1.273 -15.152 4.100 486 HB3 SER 58 HB3 SER 58 -2.277 -14.562 5.424 487 HG SER 58 HG SER 58 -3.458 -16.255 5.014 488 H GLU 59 H GLU 59 -4.931 -14.686 3.173 489 HA GLU 59 HA GLU 59 -6.472 -12.553 4.571 490 HB2 GLU 59 HB2 GLU 59 -6.927 -12.643 2.112 491 HB3 GLU 59 HB3 GLU 59 -7.430 -14.324 2.276 492 HG2 GLU 59 HG2 GLU 59 -9.198 -13.443 3.948 493 HG3 GLU 59 HG3 GLU 59 -8.796 -11.836 3.344 494 H VAL 60 H VAL 60 -7.394 -13.244 6.410 495 HA VAL 60 HA VAL 60 -8.413 -16.027 6.619 496 HB VAL 60 HB VAL 60 -7.594 -14.080 8.826 497 HG11 VAL 60 HG11 VAL 60 -9.130 -16.697 9.168 498 HG12 VAL 60 HG12 VAL 60 -9.732 -15.081 9.545 499 HG13 VAL 60 HG13 VAL 60 -8.405 -15.766 10.482 500 HG21 VAL 60 HG21 VAL 60 -6.703 -16.918 8.169 501 HG22 VAL 60 HG22 VAL 60 -6.097 -15.935 9.509 502 HG23 VAL 60 HG23 VAL 60 -5.783 -15.444 7.842 503 H GLU 61 H GLU 61 -10.389 -15.985 5.852 504 HA GLU 61 HA GLU 61 -12.587 -15.642 5.550 505 HB2 GLU 61 HB2 GLU 61 -12.520 -14.753 8.453 506 HB3 GLU 61 HB3 GLU 61 -13.909 -15.412 7.587 507 HG2 GLU 61 HG2 GLU 61 -12.551 -17.547 7.265 508 HG3 GLU 61 HG3 GLU 61 -11.352 -16.858 8.351 509 H GLY 62 H GLY 62 -11.372 -13.616 4.335 510 HA2 GLY 62 HA2 GLY 62 -12.064 -11.686 3.247 511 HA3 GLY 62 HA3 GLY 62 -13.306 -11.450 4.461 512 H GLU 63 H GLU 63 -10.499 -11.862 6.176 513 HA GLU 63 HA GLU 63 -10.009 -8.929 6.322 514 HB2 GLU 63 HB2 GLU 63 -9.789 -10.902 8.642 515 HB3 GLU 63 HB3 GLU 63 -9.701 -9.140 8.717 516 HG2 GLU 63 HG2 GLU 63 -12.132 -9.182 7.782 517 HG3 GLU 63 HG3 GLU 63 -12.122 -10.890 8.213 518 H ILE 64 H ILE 64 -7.864 -8.241 6.918 519 HA ILE 64 HA ILE 64 -5.875 -9.725 5.435 520 HB ILE 64 HB ILE 64 -5.655 -7.065 6.906 521 HG12 ILE 64 HG12 ILE 64 -6.138 -7.667 3.950 522 HG13 ILE 64 HG13 ILE 64 -7.327 -7.016 5.072 523 HG21 ILE 64 HG21 ILE 64 -3.431 -8.067 6.606 524 HG22 ILE 64 HG22 ILE 64 -3.621 -6.667 5.553 525 HG23 ILE 64 HG23 ILE 64 -3.745 -8.295 4.883 526 HD11 ILE 64 HD11 ILE 64 -4.808 -5.632 4.144 527 HD12 ILE 64 HD12 ILE 64 -5.978 -4.973 5.291 528 HD13 ILE 64 HD13 ILE 64 -6.457 -5.288 3.624 529 H PHE 65 H PHE 65 -4.651 -11.246 6.282 530 HA PHE 65 HA PHE 65 -3.640 -11.136 9.077 531 HB2 PHE 65 HB2 PHE 65 -5.161 -13.045 8.675 532 HB3 PHE 65 HB3 PHE 65 -4.231 -13.531 7.269 533 HD1 PHE 65 HD2 PHE 65 -4.357 -13.538 10.954 534 HD2 PHE 65 HD1 PHE 65 -2.071 -14.722 7.538 535 HE1 PHE 65 HE2 PHE 65 -3.026 -15.050 12.359 536 HE2 PHE 65 HE1 PHE 65 -0.751 -16.234 8.956 537 HZ PHE 65 HZ PHE 65 -1.226 -16.397 11.362 538 H VAL 66 H VAL 66 -1.501 -10.459 9.006 539 HA VAL 66 HA VAL 66 0.194 -11.323 6.711 540 HB VAL 66 HB VAL 66 1.412 -9.201 6.810 541 HG11 VAL 66 HG11 VAL 66 -0.539 -9.347 5.328 542 HG12 VAL 66 HG12 VAL 66 -0.352 -7.709 5.948 543 HG13 VAL 66 HG13 VAL 66 -1.590 -8.768 6.624 544 HG21 VAL 66 HG21 VAL 66 1.179 -8.661 9.205 545 HG22 VAL 66 HG22 VAL 66 -0.543 -8.356 8.989 546 HG23 VAL 66 HG23 VAL 66 0.642 -7.301 8.213 547 H LYS 67 H LYS 67 2.499 -11.452 7.086 548 HA LYS 67 HA LYS 67 3.514 -11.552 9.826 549 HB2 LYS 67 HB2 LYS 67 4.365 -13.927 9.592 550 HB3 LYS 67 HB3 LYS 67 2.632 -13.799 9.797 551 HG2 LYS 67 HG2 LYS 67 3.852 -14.135 7.047 552 HG3 LYS 67 HG3 LYS 67 3.548 -15.523 8.096 553 HD2 LYS 67 HD2 LYS 67 1.138 -14.955 8.167 554 HD3 LYS 67 HD3 LYS 67 1.436 -13.529 7.168 555 HE2 LYS 67 HE2 LYS 67 0.515 -15.360 5.820 556 HE3 LYS 67 HE3 LYS 67 2.156 -14.971 5.309 557 HZ1 LYS 67 HZ1 LYS 67 1.428 -17.229 7.096 558 HZ2 LYS 67 HZ2 LYS 67 2.969 -16.887 6.500 559 HZ3 LYS 67 HZ3 LYS 67 1.741 -17.364 5.444 560 H LEU 68 H LEU 68 5.926 -12.081 9.799 561 HA LEU 68 HA LEU 68 7.279 -10.737 7.652 562 HB2 LEU 68 HB2 LEU 68 8.458 -12.488 9.852 563 HB3 LEU 68 HB3 LEU 68 9.368 -11.402 8.807 564 HG LEU 68 HG LEU 68 7.383 -10.626 10.982 565 HD11 LEU 68 HD11 LEU 68 10.352 -10.070 10.718 566 HD12 LEU 68 HD12 LEU 68 9.601 -11.247 11.799 567 HD13 LEU 68 HD13 LEU 68 9.299 -9.527 12.029 568 HD21 LEU 68 HD21 LEU 68 7.032 -9.107 9.118 569 HD22 LEU 68 HD22 LEU 68 8.764 -8.797 8.991 570 HD23 LEU 68 HD23 LEU 68 7.873 -8.265 10.420 571 H VAL 69 H VAL 69 9.192 -11.832 6.472 572 HA VAL 69 HA VAL 69 8.377 -14.199 5.068 573 HB VAL 69 HB VAL 69 11.130 -12.876 5.153 574 HG11 VAL 69 HG11 VAL 69 11.345 -15.188 4.337 575 HG12 VAL 69 HG12 VAL 69 11.593 -14.050 3.011 576 HG13 VAL 69 HG13 VAL 69 10.059 -14.914 3.155 577 HG21 VAL 69 HG21 VAL 69 10.490 -11.808 3.021 578 HG22 VAL 69 HG22 VAL 69 9.384 -11.347 4.316 579 HG23 VAL 69 HG23 VAL 69 8.888 -12.547 3.120 580 H LEU 70 H LEU 70 8.053 -15.921 6.399 581 HA LEU 70 HA LEU 70 9.720 -16.550 8.658 582 HB2 LEU 70 HB2 LEU 70 7.574 -18.321 7.427 583 HB3 LEU 70 HB3 LEU 70 8.216 -18.412 9.060 584 HG LEU 70 HG LEU 70 6.428 -16.214 7.934 585 HD11 LEU 70 HD11 LEU 70 5.246 -18.317 8.400 586 HD12 LEU 70 HD12 LEU 70 4.740 -17.024 9.483 587 HD13 LEU 70 HD13 LEU 70 5.832 -18.285 10.068 588 HD21 LEU 70 HD21 LEU 70 6.372 -15.247 10.196 589 HD22 LEU 70 HD22 LEU 70 7.998 -15.212 9.520 590 HD23 LEU 70 HD23 LEU 70 7.578 -16.420 10.738 591 H GLU 71 H GLU 71 11.795 -17.000 7.899 592 HA GLU 71 HA GLU 71 12.183 -19.516 6.354 593 HB2 GLU 71 HB2 GLU 71 13.025 -17.464 5.208 594 HB3 GLU 71 HB3 GLU 71 14.058 -17.117 6.590 595 HG2 GLU 71 HG2 GLU 71 15.301 -19.228 6.166 596 HG3 GLU 71 HG3 GLU 71 14.268 -19.542 4.771 597 H HIS 72 H HIS 72 13.213 -17.595 9.138 598 HA HIS 72 HA HIS 72 15.080 -19.680 10.057 599 HB2 HIS 72 HB2 HIS 72 14.658 -16.807 10.996 600 HB3 HIS 72 HB3 HIS 72 15.846 -17.919 11.677 601 HD1 HIS 72 HD1 HIS 72 18.016 -18.271 10.373 602 HD2 HIS 72 HD2 HIS 72 15.257 -15.934 8.324 603 HE1 HIS 72 HE1 HIS 72 19.222 -17.422 8.343 604 HE2 HIS 72 HE2 HIS 72 17.469 -16.210 7.016 605 H HIS 73 H HIS 73 14.993 -20.589 12.077 606 HA HIS 73 HA HIS 73 12.474 -21.494 12.922 607 HB2 HIS 73 HB2 HIS 73 13.813 -22.605 14.807 608 HB3 HIS 73 HB3 HIS 73 14.312 -22.975 13.162 609 HD1 HIS 73 HD1 HIS 73 16.763 -23.286 13.236 610 HD2 HIS 73 HD2 HIS 73 15.593 -20.007 15.511 611 HE1 HIS 73 HE1 HIS 73 18.892 -22.281 14.115 612 HE2 HIS 73 HE2 HIS 73 18.141 -20.421 15.631 613 H HIS 74 H HIS 74 14.049 -18.617 13.918 614 HA HIS 74 HA HIS 74 13.174 -18.384 16.616 615 HB2 HIS 74 HB2 HIS 74 15.048 -17.067 15.632 616 HB3 HIS 74 HB3 HIS 74 13.900 -16.180 14.639 617 HD1 HIS 74 HD1 HIS 74 13.299 -13.976 15.592 618 HD2 HIS 74 HD2 HIS 74 14.387 -16.671 18.563 619 HE1 HIS 74 HE1 HIS 74 13.106 -12.708 17.749 620 HE2 HIS 74 HE2 HIS 74 13.844 -14.329 19.523 621 H HIS 75 H HIS 75 11.471 -17.932 13.618 622 HA HIS 75 HA HIS 75 9.118 -16.757 15.004 623 HB2 HIS 75 HB2 HIS 75 10.082 -16.675 12.137 624 HB3 HIS 75 HB3 HIS 75 8.362 -16.489 12.462 625 HD1 HIS 75 HD1 HIS 75 11.631 -14.878 13.599 626 HD2 HIS 75 HD2 HIS 75 7.661 -13.915 12.896 627 HE1 HIS 75 HE1 HIS 75 11.439 -12.426 14.085 628 HE2 HIS 75 HE2 HIS 75 9.088 -11.843 13.419 629 H HIS 76 H HIS 76 10.150 -19.721 14.698 630 HA HIS 76 HA HIS 76 7.677 -20.933 13.604 631 HB2 HIS 76 HB2 HIS 76 9.823 -21.696 12.592 632 HB3 HIS 76 HB3 HIS 76 10.378 -22.229 14.174 633 HD1 HIS 76 HD1 HIS 76 8.016 -23.142 11.405 634 HD2 HIS 76 HD2 HIS 76 9.291 -24.685 15.042 635 HE1 HIS 76 HE1 HIS 76 7.094 -25.474 11.504 636 HE2 HIS 76 HE2 HIS 76 8.051 -26.447 13.617 637 H HIS 77 H HIS 77 6.184 -21.295 15.151 638 HA HIS 77 HA HIS 77 6.993 -22.659 17.669 639 HB2 HIS 77 HB2 HIS 77 4.738 -20.609 17.438 640 HB3 HIS 77 HB3 HIS 77 5.247 -21.436 18.904 641 HD1 HIS 77 HD1 HIS 77 5.806 -18.405 16.985 642 HD2 HIS 77 HD2 HIS 77 7.976 -20.645 19.735 643 HE1 HIS 77 HE1 HIS 77 7.681 -16.917 17.734 644 HE2 HIS 77 HE2 HIS 77 8.854 -18.221 19.532 645 H1 MET 1 H MET 1 -0.974 -20.737 -10.218 646 HA MET 1 HA MET 1 -1.334 -19.021 -8.519 647 HB2 MET 1 HB2 MET 1 -0.160 -21.620 -7.469 648 HB3 MET 1 HB3 MET 1 -0.871 -20.417 -6.400 649 HG2 MET 1 HG2 MET 1 -2.448 -22.209 -6.890 650 HG3 MET 1 HG3 MET 1 -3.029 -20.667 -7.525 651 HE1 MET 1 HE1 MET 1 -4.257 -23.480 -8.367 652 HE2 MET 1 HE2 MET 1 -4.402 -23.302 -10.115 653 HE3 MET 1 HE3 MET 1 -4.837 -21.961 -9.050 654 H LYS 2 H LYS 2 -0.305 -17.200 -8.006 655 HA LYS 2 HA LYS 2 2.395 -17.290 -6.752 656 HB2 LYS 2 HB2 LYS 2 1.282 -15.110 -8.579 657 HB3 LYS 2 HB3 LYS 2 2.824 -15.030 -7.732 658 HG2 LYS 2 HG2 LYS 2 2.114 -17.065 -9.874 659 HG3 LYS 2 HG3 LYS 2 3.039 -15.584 -10.150 660 HD2 LYS 2 HD2 LYS 2 3.893 -17.816 -8.256 661 HD3 LYS 2 HD3 LYS 2 4.437 -17.678 -9.928 662 HE2 LYS 2 HE2 LYS 2 4.909 -15.577 -7.780 663 HE3 LYS 2 HE3 LYS 2 6.085 -16.790 -8.280 664 HZ1 LYS 2 HZ1 LYS 2 6.166 -15.843 -10.452 665 HZ2 LYS 2 HZ2 LYS 2 6.398 -14.596 -9.333 666 HZ3 LYS 2 HZ3 LYS 2 4.910 -14.770 -10.107 667 H MET 3 H MET 3 2.765 -15.266 -5.346 668 HA MET 3 HA MET 3 0.567 -15.095 -3.452 669 HB2 MET 3 HB2 MET 3 3.366 -13.900 -3.401 670 HB3 MET 3 HB3 MET 3 2.211 -13.757 -2.081 671 HG2 MET 3 HG2 MET 3 2.207 -16.224 -1.839 672 HG3 MET 3 HG3 MET 3 3.408 -16.341 -3.127 673 HE1 MET 3 HE1 MET 3 6.530 -14.590 -1.434 674 HE2 MET 3 HE2 MET 3 5.338 -13.802 -2.465 675 HE3 MET 3 HE3 MET 3 5.942 -15.407 -2.882 676 H LEU 4 H LEU 4 0.274 -12.868 -2.354 677 HA LEU 4 HA LEU 4 -1.062 -11.087 -4.104 678 HB2 LEU 4 HB2 LEU 4 -0.200 -10.613 -1.223 679 HB3 LEU 4 HB3 LEU 4 -1.323 -9.599 -2.103 680 HG LEU 4 HG LEU 4 -2.675 -10.916 -0.676 681 HD11 LEU 4 HD11 LEU 4 -4.055 -12.297 -2.130 682 HD12 LEU 4 HD12 LEU 4 -2.789 -12.291 -3.362 683 HD13 LEU 4 HD13 LEU 4 -3.595 -10.785 -2.912 684 HD21 LEU 4 HD21 LEU 4 -1.186 -13.418 -1.525 685 HD22 LEU 4 HD22 LEU 4 -2.554 -13.347 -0.408 686 HD23 LEU 4 HD23 LEU 4 -1.028 -12.579 0.021 687 H LYS 5 H LYS 5 2.259 -11.240 -3.293 688 HA LYS 5 HA LYS 5 3.194 -8.616 -3.802 689 HB2 LYS 5 HB2 LYS 5 4.570 -10.458 -2.843 690 HB3 LYS 5 HB3 LYS 5 4.483 -11.315 -4.380 691 HG2 LYS 5 HG2 LYS 5 5.770 -9.504 -5.465 692 HG3 LYS 5 HG3 LYS 5 5.873 -8.650 -3.921 693 HD2 LYS 5 HD2 LYS 5 7.015 -11.419 -4.495 694 HD3 LYS 5 HD3 LYS 5 7.954 -9.923 -4.445 695 HE2 LYS 5 HE2 LYS 5 7.465 -9.656 -2.064 696 HE3 LYS 5 HE3 LYS 5 6.392 -11.052 -2.096 697 HZ1 LYS 5 HZ1 LYS 5 9.294 -11.141 -2.668 698 HZ2 LYS 5 HZ2 LYS 5 8.256 -12.468 -2.541 699 HZ3 LYS 5 HZ3 LYS 5 8.601 -11.526 -1.177 700 H GLU 6 H GLU 6 2.527 -11.374 -5.928 701 HA GLU 6 HA GLU 6 3.418 -10.337 -8.388 702 HB2 GLU 6 HB2 GLU 6 2.936 -12.737 -7.962 703 HB3 GLU 6 HB3 GLU 6 1.220 -12.372 -7.851 704 HG2 GLU 6 HG2 GLU 6 1.658 -13.343 -10.007 705 HG3 GLU 6 HG3 GLU 6 1.248 -11.645 -10.235 706 H LYS 7 H LYS 7 0.197 -10.322 -6.854 707 HA LYS 7 HA LYS 7 -1.313 -8.907 -8.715 708 HB2 LYS 7 HB2 LYS 7 -2.390 -9.850 -6.767 709 HB3 LYS 7 HB3 LYS 7 -1.401 -8.880 -5.676 710 HG2 LYS 7 HG2 LYS 7 -2.512 -6.821 -6.630 711 HG3 LYS 7 HG3 LYS 7 -3.605 -7.887 -7.517 712 HD2 LYS 7 HD2 LYS 7 -3.283 -7.883 -4.496 713 HD3 LYS 7 HD3 LYS 7 -4.505 -6.938 -5.354 714 HE2 LYS 7 HE2 LYS 7 -5.416 -9.089 -6.303 715 HE3 LYS 7 HE3 LYS 7 -4.265 -9.970 -5.289 716 HZ1 LYS 7 HZ1 LYS 7 -6.360 -8.125 -4.290 717 HZ2 LYS 7 HZ2 LYS 7 -5.297 -9.041 -3.343 718 HZ3 LYS 7 HZ3 LYS 7 -6.463 -9.809 -4.289 719 H ALA 8 H ALA 8 0.547 -7.538 -5.974 720 HA ALA 8 HA ALA 8 0.085 -4.815 -6.397 721 HB1 ALA 8 HB1 ALA 8 2.045 -4.435 -4.960 722 HB2 ALA 8 HB2 ALA 8 2.563 -6.109 -5.206 723 HB3 ALA 8 HB3 ALA 8 1.064 -5.765 -4.340 724 H GLY 9 H GLY 9 2.499 -6.931 -7.858 725 HA2 GLY 9 HA2 GLY 9 4.010 -4.915 -9.258 726 HA3 GLY 9 HA3 GLY 9 4.061 -6.647 -9.540 727 H ALA 10 H ALA 10 1.366 -7.108 -10.198 728 HA ALA 10 HA ALA 10 1.245 -6.452 -12.961 729 HB1 ALA 10 HB1 ALA 10 -0.937 -7.544 -11.151 730 HB2 ALA 10 HB2 ALA 10 0.257 -8.505 -12.027 731 HB3 ALA 10 HB3 ALA 10 -0.949 -7.577 -12.921 732 H LEU 11 H LEU 11 -0.383 -5.126 -10.119 733 HA LEU 11 HA LEU 11 -2.073 -3.238 -11.442 734 HB2 LEU 11 HB2 LEU 11 -1.009 -3.301 -8.589 735 HB3 LEU 11 HB3 LEU 11 -2.288 -2.232 -9.155 736 HG LEU 11 HG LEU 11 -2.492 -5.273 -9.173 737 HD11 LEU 11 HD11 LEU 11 -3.595 -3.342 -7.121 738 HD12 LEU 11 HD12 LEU 11 -2.304 -4.519 -6.874 739 HD13 LEU 11 HD13 LEU 11 -3.943 -5.069 -7.208 740 HD21 LEU 11 HD21 LEU 11 -4.636 -3.154 -9.570 741 HD22 LEU 11 HD22 LEU 11 -4.900 -4.901 -9.525 742 HD23 LEU 11 HD23 LEU 11 -3.950 -4.190 -10.827 743 H ALA 12 H ALA 12 1.209 -3.134 -10.095 744 HA ALA 12 HA ALA 12 1.737 -0.387 -10.152 745 HB1 ALA 12 HB1 ALA 12 3.724 -2.630 -10.643 746 HB2 ALA 12 HB2 ALA 12 3.205 -2.047 -9.061 747 HB3 ALA 12 HB3 ALA 12 4.109 -0.976 -10.135 748 H GLY 13 H GLY 13 2.188 -2.806 -12.720 749 HA2 GLY 13 HA2 GLY 13 3.420 -1.212 -14.673 750 HA3 GLY 13 HA3 GLY 13 2.462 -2.643 -14.991 751 H GLN 14 H GLN 14 -0.064 -2.016 -14.407 752 HA GLN 14 HA GLN 14 -0.807 -0.434 -16.669 753 HB2 GLN 14 HB2 GLN 14 -3.165 -0.933 -15.989 754 HB3 GLN 14 HB3 GLN 14 -2.146 -2.361 -16.128 755 HG2 GLN 14 HG2 GLN 14 -1.906 -2.414 -13.657 756 HG3 GLN 14 HG3 GLN 14 -2.958 -1.002 -13.541 757 HE21 GLN 14 HE21 GLN 14 -4.415 -2.207 -12.255 758 HE22 GLN 14 HE22 GLN 14 -5.487 -3.360 -12.957 759 H ILE 15 H ILE 15 -0.875 0.233 -13.160 760 HA ILE 15 HA ILE 15 -2.377 2.644 -13.233 761 HB ILE 15 HB ILE 15 -0.395 1.576 -11.183 762 HG12 ILE 15 HG12 ILE 15 -3.439 1.868 -11.099 763 HG13 ILE 15 HG13 ILE 15 -2.576 0.367 -11.413 764 HG21 ILE 15 HG21 ILE 15 -2.056 4.108 -10.907 765 HG22 ILE 15 HG22 ILE 15 -0.297 4.020 -10.992 766 HG23 ILE 15 HG23 ILE 15 -1.145 3.343 -9.603 767 HD11 ILE 15 HD11 ILE 15 -2.535 1.937 -8.832 768 HD12 ILE 15 HD12 ILE 15 -1.650 0.439 -9.135 769 HD13 ILE 15 HD13 ILE 15 -3.413 0.439 -9.142 770 H TRP 16 H TRP 16 1.159 2.091 -13.302 771 HA TRP 16 HA TRP 16 1.990 4.778 -13.415 772 HB2 TRP 16 HB2 TRP 16 3.499 2.821 -12.952 773 HB3 TRP 16 HB3 TRP 16 3.384 2.355 -14.646 774 HD1 TRP 16 HD1 TRP 16 5.033 4.915 -12.346 775 HE1 TRP 16 HE1 TRP 16 6.828 6.215 -13.663 776 HE3 TRP 16 HE3 TRP 16 4.070 3.130 -17.049 777 HZ2 TRP 16 HZ2 TRP 16 7.717 6.457 -16.317 778 HZ3 TRP 16 HZ3 TRP 16 5.434 3.953 -18.925 779 HH2 TRP 16 HH2 TRP 16 7.213 5.586 -18.567 780 H GLU 17 H GLU 17 1.280 2.470 -16.054 781 HA GLU 17 HA GLU 17 1.907 4.132 -18.265 782 HB2 GLU 17 HB2 GLU 17 0.036 1.735 -18.086 783 HB3 GLU 17 HB3 GLU 17 0.539 2.483 -19.600 784 HG2 GLU 17 HG2 GLU 17 2.872 1.885 -19.145 785 HG3 GLU 17 HG3 GLU 17 2.407 1.179 -17.598 786 H ALA 18 H ALA 18 -1.019 3.896 -16.319 787 HA ALA 18 HA ALA 18 -2.808 5.331 -18.002 788 HB1 ALA 18 HB1 ALA 18 -4.178 5.638 -15.982 789 HB2 ALA 18 HB2 ALA 18 -2.822 5.120 -14.973 790 HB3 ALA 18 HB3 ALA 18 -3.574 3.982 -16.091 791 H LEU 19 H LEU 19 -0.388 6.390 -15.652 792 HA LEU 19 HA LEU 19 -1.077 9.228 -15.911 793 HB2 LEU 19 HB2 LEU 19 0.979 7.724 -14.267 794 HB3 LEU 19 HB3 LEU 19 0.999 9.475 -14.378 795 HG LEU 19 HG LEU 19 -1.285 9.553 -13.366 796 HD11 LEU 19 HD11 LEU 19 -2.229 7.580 -12.260 797 HD12 LEU 19 HD12 LEU 19 -0.963 6.569 -12.958 798 HD13 LEU 19 HD13 LEU 19 -2.142 7.360 -14.006 799 HD21 LEU 19 HD21 LEU 19 -0.577 9.024 -11.076 800 HD22 LEU 19 HD22 LEU 19 0.702 9.848 -11.966 801 HD23 LEU 19 HD23 LEU 19 0.796 8.104 -11.700 802 H ASN 20 H ASN 20 1.001 6.990 -17.521 803 HA ASN 20 HA ASN 20 3.191 8.665 -18.180 804 HB2 ASN 20 HB2 ASN 20 3.160 6.150 -18.396 805 HB3 ASN 20 HB3 ASN 20 2.140 6.316 -19.818 806 HD21 ASN 20 HD21 ASN 20 3.622 5.423 -21.250 807 HD22 ASN 20 HD22 ASN 20 5.119 6.178 -21.654 808 H GLY 21 H GLY 21 3.301 10.380 -19.516 809 HA2 GLY 21 HA2 GLY 21 2.827 11.588 -21.531 810 HA3 GLY 21 HA3 GLY 21 1.255 10.815 -21.626 811 H THR 22 H THR 22 0.487 11.302 -18.858 812 HA THR 22 HA THR 22 -0.395 14.086 -19.092 813 HB THR 22 HB THR 22 -1.894 13.653 -17.221 814 HG1 THR 22 HG1 THR 22 -0.113 11.602 -16.679 815 HG21 THR 22 HG21 THR 22 -1.836 11.209 -19.025 816 HG22 THR 22 HG22 THR 22 -2.675 12.728 -19.362 817 HG23 THR 22 HG23 THR 22 -3.195 11.704 -18.018 818 H GLU 23 H GLU 23 -0.457 15.437 -17.025 819 HA GLU 23 HA GLU 23 2.173 15.609 -15.752 820 HB2 GLU 23 HB2 GLU 23 -0.279 17.401 -15.476 821 HB3 GLU 23 HB3 GLU 23 1.308 17.731 -14.785 822 HG2 GLU 23 HG2 GLU 23 2.241 17.844 -17.098 823 HG3 GLU 23 HG3 GLU 23 0.612 17.619 -17.737 824 H GLY 24 H GLY 24 -0.362 13.686 -15.130 825 HA2 GLY 24 HA2 GLY 24 -0.166 12.382 -13.023 826 HA3 GLY 24 HA3 GLY 24 -0.233 13.913 -12.170 827 H LEU 25 H LEU 25 -1.960 11.708 -11.726 828 HA LEU 25 HA LEU 25 -4.608 12.848 -12.410 829 HB2 LEU 25 HB2 LEU 25 -3.864 9.893 -12.586 830 HB3 LEU 25 HB3 LEU 25 -5.503 10.517 -12.713 831 HG LEU 25 HG LEU 25 -3.254 11.098 -14.688 832 HD11 LEU 25 HD11 LEU 25 -5.640 9.243 -14.983 833 HD12 LEU 25 HD12 LEU 25 -3.950 8.758 -14.808 834 HD13 LEU 25 HD13 LEU 25 -4.466 9.634 -16.246 835 HD21 LEU 25 HD21 LEU 25 -6.202 11.831 -14.831 836 HD22 LEU 25 HD22 LEU 25 -5.012 12.084 -16.114 837 HD23 LEU 25 HD23 LEU 25 -4.857 12.949 -14.587 838 H THR 26 H THR 26 -6.301 12.332 -10.875 839 HA THR 26 HA THR 26 -5.417 11.769 -8.137 840 HB THR 26 HB THR 26 -7.743 12.228 -7.456 841 HG1 THR 26 HG1 THR 26 -9.340 12.683 -9.000 842 HG21 THR 26 HG21 THR 26 -6.280 14.199 -7.761 843 HG22 THR 26 HG22 THR 26 -7.957 14.583 -8.159 844 HG23 THR 26 HG23 THR 26 -6.785 14.317 -9.452 845 H GLN 27 H GLN 27 -6.572 10.138 -6.816 846 HA GLN 27 HA GLN 27 -6.311 7.542 -7.784 847 HB2 GLN 27 HB2 GLN 27 -6.211 8.143 -5.413 848 HB3 GLN 27 HB3 GLN 27 -7.921 8.553 -5.407 849 HG2 GLN 27 HG2 GLN 27 -8.535 6.228 -5.723 850 HG3 GLN 27 HG3 GLN 27 -6.845 5.768 -5.934 851 HE21 GLN 27 HE21 GLN 27 -8.764 4.795 -3.990 852 HE22 GLN 27 HE22 GLN 27 -8.077 5.101 -2.442 853 H LYS 28 H LYS 28 -9.281 9.499 -7.561 854 HA LYS 28 HA LYS 28 -11.231 7.687 -8.440 855 HB2 LYS 28 HB2 LYS 28 -10.934 10.683 -8.837 856 HB3 LYS 28 HB3 LYS 28 -12.368 9.816 -9.381 857 HG2 LYS 28 HG2 LYS 28 -11.403 9.850 -6.496 858 HG3 LYS 28 HG3 LYS 28 -12.608 10.967 -7.158 859 HD2 LYS 28 HD2 LYS 28 -14.061 9.032 -7.744 860 HD3 LYS 28 HD3 LYS 28 -12.862 7.929 -7.062 861 HE2 LYS 28 HE2 LYS 28 -14.318 10.080 -5.481 862 HE3 LYS 28 HE3 LYS 28 -14.794 8.382 -5.542 863 HZ1 LYS 28 HZ1 LYS 28 -12.606 7.812 -4.618 864 HZ2 LYS 28 HZ2 LYS 28 -13.511 8.792 -3.578 865 HZ3 LYS 28 HZ3 LYS 28 -12.242 9.460 -4.471 866 H GLN 29 H GLN 29 -9.196 9.843 -10.443 867 HA GLN 29 HA GLN 29 -10.231 9.052 -12.984 868 HB2 GLN 29 HB2 GLN 29 -7.663 10.494 -12.215 869 HB3 GLN 29 HB3 GLN 29 -8.200 10.281 -13.883 870 HG2 GLN 29 HG2 GLN 29 -10.198 11.610 -13.458 871 HG3 GLN 29 HG3 GLN 29 -9.793 11.742 -11.747 872 HE21 GLN 29 HE21 GLN 29 -8.195 13.198 -11.116 873 HE22 GLN 29 HE22 GLN 29 -7.539 14.384 -12.179 874 H ILE 30 H ILE 30 -7.490 7.949 -11.059 875 HA ILE 30 HA ILE 30 -6.213 6.355 -13.077 876 HB ILE 30 HB ILE 30 -5.938 6.240 -10.038 877 HG12 ILE 30 HG12 ILE 30 -4.198 7.719 -12.061 878 HG13 ILE 30 HG13 ILE 30 -5.453 8.486 -11.098 879 HG21 ILE 30 HG21 ILE 30 -5.058 4.185 -11.072 880 HG22 ILE 30 HG22 ILE 30 -3.739 5.174 -10.441 881 HG23 ILE 30 HG23 ILE 30 -4.063 5.144 -12.177 882 HD11 ILE 30 HD11 ILE 30 -3.263 8.901 -10.184 883 HD12 ILE 30 HD12 ILE 30 -2.963 7.170 -10.033 884 HD13 ILE 30 HD13 ILE 30 -4.224 7.938 -9.062 885 H LYS 31 H LYS 31 -8.371 5.588 -10.332 886 HA LYS 31 HA LYS 31 -8.432 2.790 -10.549 887 HB2 LYS 31 HB2 LYS 31 -9.243 3.965 -8.568 888 HB3 LYS 31 HB3 LYS 31 -10.544 4.705 -9.496 889 HG2 LYS 31 HG2 LYS 31 -11.610 2.537 -9.820 890 HG3 LYS 31 HG3 LYS 31 -10.259 1.719 -9.025 891 HD2 LYS 31 HD2 LYS 31 -10.811 2.797 -6.902 892 HD3 LYS 31 HD3 LYS 31 -12.089 3.741 -7.680 893 HE2 LYS 31 HE2 LYS 31 -12.045 0.710 -7.440 894 HE3 LYS 31 HE3 LYS 31 -12.976 1.806 -6.423 895 HZ1 LYS 31 HZ1 LYS 31 -13.298 1.489 -9.360 896 HZ2 LYS 31 HZ2 LYS 31 -14.194 2.536 -8.379 897 HZ3 LYS 31 HZ3 LYS 31 -14.337 0.862 -8.178 898 H LYS 32 H LYS 32 -10.580 5.233 -12.026 899 HA LYS 32 HA LYS 32 -12.266 3.420 -13.426 900 HB2 LYS 32 HB2 LYS 32 -12.943 5.740 -12.963 901 HB3 LYS 32 HB3 LYS 32 -11.654 6.347 -13.992 902 HG2 LYS 32 HG2 LYS 32 -13.839 6.472 -15.114 903 HG3 LYS 32 HG3 LYS 32 -12.732 5.400 -15.976 904 HD2 LYS 32 HD2 LYS 32 -13.861 3.431 -14.927 905 HD3 LYS 32 HD3 LYS 32 -14.990 4.521 -14.116 906 HE2 LYS 32 HE2 LYS 32 -15.844 5.267 -16.307 907 HE3 LYS 32 HE3 LYS 32 -14.683 4.218 -17.125 908 HZ1 LYS 32 HZ1 LYS 32 -16.851 3.208 -17.019 909 HZ2 LYS 32 HZ2 LYS 32 -16.872 3.320 -15.334 910 HZ3 LYS 32 HZ3 LYS 32 -15.752 2.309 -16.102 911 H ALA 33 H ALA 33 -9.301 5.164 -14.423 912 HA ALA 33 HA ALA 33 -9.338 4.501 -17.175 913 HB1 ALA 33 HB1 ALA 33 -6.982 5.202 -17.201 914 HB2 ALA 33 HB2 ALA 33 -6.929 5.139 -15.435 915 HB3 ALA 33 HB3 ALA 33 -7.960 6.319 -16.246 916 H THR 34 H THR 34 -7.615 2.937 -14.468 917 HA THR 34 HA THR 34 -6.567 0.775 -16.133 918 HB THR 34 HB THR 34 -5.432 0.002 -14.067 919 HG1 THR 34 HG1 THR 34 -6.249 2.226 -12.595 920 HG21 THR 34 HG21 THR 34 -4.001 1.968 -13.663 921 HG22 THR 34 HG22 THR 34 -5.178 3.006 -14.468 922 HG23 THR 34 HG23 THR 34 -4.320 1.764 -15.387 923 H LYS 35 H LYS 35 -9.410 1.331 -14.364 924 HA LYS 35 HA LYS 35 -11.277 0.133 -13.979 925 HB2 LYS 35 HB2 LYS 35 -9.951 -1.900 -15.803 926 HB3 LYS 35 HB3 LYS 35 -11.622 -2.002 -15.266 927 HG2 LYS 35 HG2 LYS 35 -12.230 -0.020 -16.481 928 HG3 LYS 35 HG3 LYS 35 -10.545 0.367 -16.823 929 HD2 LYS 35 HD2 LYS 35 -11.668 -0.521 -18.820 930 HD3 LYS 35 HD3 LYS 35 -10.372 -1.596 -18.305 931 HE2 LYS 35 HE2 LYS 35 -13.271 -2.092 -17.550 932 HE3 LYS 35 HE3 LYS 35 -12.588 -2.682 -19.061 933 HZ1 LYS 35 HZ1 LYS 35 -11.753 -3.424 -16.311 934 HZ2 LYS 35 HZ2 LYS 35 -10.904 -3.872 -17.700 935 HZ3 LYS 35 HZ3 LYS 35 -12.488 -4.415 -17.468 936 H LEU 36 H LEU 36 -9.960 0.171 -11.835 937 HA LEU 36 HA LEU 36 -9.193 -2.418 -10.742 938 HB2 LEU 36 HB2 LEU 36 -9.490 0.265 -9.333 939 HB3 LEU 36 HB3 LEU 36 -8.678 -1.160 -8.696 940 HG LEU 36 HG LEU 36 -7.763 0.513 -11.069 941 HD11 LEU 36 HD11 LEU 36 -6.559 0.279 -8.299 942 HD12 LEU 36 HD12 LEU 36 -7.421 1.674 -8.957 943 HD13 LEU 36 HD13 LEU 36 -5.881 1.183 -9.657 944 HD21 LEU 36 HD21 LEU 36 -6.407 -1.906 -9.834 945 HD22 LEU 36 HD22 LEU 36 -5.724 -0.864 -11.087 946 HD23 LEU 36 HD23 LEU 36 -7.158 -1.825 -11.430 947 H LYS 37 H LYS 37 -10.305 -3.532 -9.103 948 HA LYS 37 HA LYS 37 -13.200 -3.377 -9.180 949 HB2 LYS 37 HB2 LYS 37 -11.419 -5.203 -7.484 950 HB3 LYS 37 HB3 LYS 37 -13.152 -5.382 -7.709 951 HG2 LYS 37 HG2 LYS 37 -12.232 -7.012 -9.135 952 HG3 LYS 37 HG3 LYS 37 -12.644 -5.685 -10.219 953 HD2 LYS 37 HD2 LYS 37 -10.448 -6.611 -10.802 954 HD3 LYS 37 HD3 LYS 37 -10.272 -4.953 -10.226 955 HE2 LYS 37 HE2 LYS 37 -9.645 -5.887 -7.968 956 HE3 LYS 37 HE3 LYS 37 -9.663 -7.501 -8.683 957 HZ1 LYS 37 HZ1 LYS 37 -7.970 -5.274 -9.655 958 HZ2 LYS 37 HZ2 LYS 37 -7.874 -6.903 -10.099 959 HZ3 LYS 37 HZ3 LYS 37 -7.453 -6.423 -8.530 960 H ALA 38 H ALA 38 -10.639 -2.705 -6.887 961 HA ALA 38 HA ALA 38 -12.431 -1.109 -5.177 962 HB1 ALA 38 HB1 ALA 38 -12.233 -3.322 -4.087 963 HB2 ALA 38 HB2 ALA 38 -11.436 -2.071 -3.129 964 HB3 ALA 38 HB3 ALA 38 -10.474 -3.184 -4.108 965 H ASP 39 H ASP 39 -11.208 0.348 -3.750 966 HA ASP 39 HA ASP 39 -9.041 1.732 -4.981 967 HB2 ASP 39 HB2 ASP 39 -10.212 1.948 -2.184 968 HB3 ASP 39 HB3 ASP 39 -9.038 3.083 -2.860 969 H LYS 40 H LYS 40 -9.185 -0.850 -2.660 970 HA LYS 40 HA LYS 40 -6.624 -0.922 -1.573 971 HB2 LYS 40 HB2 LYS 40 -8.267 -3.309 -2.516 972 HB3 LYS 40 HB3 LYS 40 -6.951 -3.365 -1.340 973 HG2 LYS 40 HG2 LYS 40 -9.534 -1.823 -0.973 974 HG3 LYS 40 HG3 LYS 40 -9.237 -3.440 -0.331 975 HD2 LYS 40 HD2 LYS 40 -7.447 -2.577 1.111 976 HD3 LYS 40 HD3 LYS 40 -7.595 -0.970 0.386 977 HE2 LYS 40 HE2 LYS 40 -8.705 -1.127 2.612 978 HE3 LYS 40 HE3 LYS 40 -9.830 -0.703 1.324 979 HZ1 LYS 40 HZ1 LYS 40 -10.589 -2.993 1.272 980 HZ2 LYS 40 HZ2 LYS 40 -10.753 -2.361 2.832 981 HZ3 LYS 40 HZ3 LYS 40 -9.487 -3.419 2.478 982 H ASP 41 H ASP 41 -7.642 -1.850 -4.842 983 HA ASP 41 HA ASP 41 -5.241 -3.107 -5.714 984 HB2 ASP 41 HB2 ASP 41 -7.418 -1.676 -7.288 985 HB3 ASP 41 HB3 ASP 41 -6.106 -2.578 -8.040 986 H PHE 42 H PHE 42 -6.306 0.276 -5.625 987 HA PHE 42 HA PHE 42 -4.122 1.356 -7.115 988 HB2 PHE 42 HB2 PHE 42 -6.187 2.666 -6.816 989 HB3 PHE 42 HB3 PHE 42 -5.920 2.735 -5.075 990 HD1 PHE 42 HD2 PHE 42 -4.241 3.627 -8.311 991 HD2 PHE 42 HD1 PHE 42 -4.755 4.606 -4.177 992 HE1 PHE 42 HE2 PHE 42 -2.889 5.648 -8.612 993 HE2 PHE 42 HE1 PHE 42 -3.388 6.625 -4.493 994 HZ PHE 42 HZ PHE 42 -2.462 7.150 -6.717 995 H PHE 43 H PHE 43 -4.677 0.810 -3.629 996 HA PHE 43 HA PHE 43 -2.406 2.240 -2.685 997 HB2 PHE 43 HB2 PHE 43 -3.996 0.019 -1.331 998 HB3 PHE 43 HB3 PHE 43 -2.846 1.078 -0.516 999 HD1 PHE 43 HD1 PHE 43 -3.464 3.759 -1.492 1000 HD2 PHE 43 HD2 PHE 43 -6.160 0.563 -0.559 1001 HE1 PHE 43 HE1 PHE 43 -5.248 5.385 -1.025 1002 HE2 PHE 43 HE2 PHE 43 -7.932 2.198 -0.095 1003 HZ PHE 43 HZ PHE 43 -7.482 4.610 -0.329 1004 H LEU 44 H LEU 44 -2.881 -1.253 -3.338 1005 HA LEU 44 HA LEU 44 -0.273 -2.110 -2.556 1006 HB2 LEU 44 HB2 LEU 44 -2.507 -3.369 -4.146 1007 HB3 LEU 44 HB3 LEU 44 -0.931 -4.135 -4.174 1008 HG LEU 44 HG LEU 44 -0.996 -4.393 -1.703 1009 HD11 LEU 44 HD11 LEU 44 -3.812 -3.279 -1.825 1010 HD12 LEU 44 HD12 LEU 44 -2.411 -2.496 -1.091 1011 HD13 LEU 44 HD13 LEU 44 -3.033 -3.997 -0.411 1012 HD21 LEU 44 HD21 LEU 44 -2.667 -6.183 -1.596 1013 HD22 LEU 44 HD22 LEU 44 -1.785 -6.237 -3.120 1014 HD23 LEU 44 HD23 LEU 44 -3.426 -5.587 -3.076 1015 H GLY 45 H GLY 45 -1.633 -1.216 -5.743 1016 HA2 GLY 45 HA2 GLY 45 0.673 -1.678 -7.330 1017 HA3 GLY 45 HA3 GLY 45 -0.639 -0.576 -7.719 1018 H LEU 46 H LEU 46 -0.433 1.229 -5.609 1019 HA LEU 46 HA LEU 46 1.487 3.077 -6.604 1020 HB2 LEU 46 HB2 LEU 46 -0.703 3.707 -5.568 1021 HB3 LEU 46 HB3 LEU 46 -0.105 3.177 -4.007 1022 HG LEU 46 HG LEU 46 1.673 4.972 -4.142 1023 HD11 LEU 46 HD11 LEU 46 0.135 5.891 -6.585 1024 HD12 LEU 46 HD12 LEU 46 1.780 5.244 -6.560 1025 HD13 LEU 46 HD13 LEU 46 1.428 6.784 -5.779 1026 HD21 LEU 46 HD21 LEU 46 -1.184 6.002 -4.277 1027 HD22 LEU 46 HD22 LEU 46 0.197 6.847 -3.571 1028 HD23 LEU 46 HD23 LEU 46 -0.385 5.353 -2.841 1029 H GLY 47 H GLY 47 1.487 0.862 -3.882 1030 HA2 GLY 47 HA2 GLY 47 3.702 1.876 -2.408 1031 HA3 GLY 47 HA3 GLY 47 3.056 0.243 -2.316 1032 H TRP 48 H TRP 48 3.430 -0.352 -5.118 1033 HA TRP 48 HA TRP 48 6.201 -1.135 -5.154 1034 HB2 TRP 48 HB2 TRP 48 4.099 -2.407 -6.126 1035 HB3 TRP 48 HB3 TRP 48 4.348 -1.397 -7.547 1036 HD1 TRP 48 HD1 TRP 48 6.758 -1.766 -8.869 1037 HE1 TRP 48 HE1 TRP 48 8.321 -3.796 -8.956 1038 HE3 TRP 48 HE3 TRP 48 4.865 -4.425 -4.933 1039 HZ2 TRP 48 HZ2 TRP 48 8.709 -6.203 -7.561 1040 HZ3 TRP 48 HZ3 TRP 48 5.877 -6.600 -4.377 1041 HH2 TRP 48 HH2 TRP 48 7.757 -7.485 -5.667 1042 H LEU 49 H LEU 49 4.243 1.342 -6.768 1043 HA LEU 49 HA LEU 49 6.250 2.429 -8.464 1044 HB2 LEU 49 HB2 LEU 49 3.685 3.493 -7.284 1045 HB3 LEU 49 HB3 LEU 49 4.756 4.599 -8.112 1046 HG LEU 49 HG LEU 49 4.443 3.508 -10.231 1047 HD11 LEU 49 HD11 LEU 49 2.948 1.328 -8.787 1048 HD12 LEU 49 HD12 LEU 49 4.541 1.196 -9.540 1049 HD13 LEU 49 HD13 LEU 49 3.122 1.489 -10.540 1050 HD21 LEU 49 HD21 LEU 49 2.025 3.707 -10.583 1051 HD22 LEU 49 HD22 LEU 49 2.594 5.004 -9.538 1052 HD23 LEU 49 HD23 LEU 49 1.741 3.624 -8.841 1053 H LEU 50 H LEU 50 5.561 2.883 -5.038 1054 HA LEU 50 HA LEU 50 7.316 5.071 -4.528 1055 HB2 LEU 50 HB2 LEU 50 6.097 2.967 -2.718 1056 HB3 LEU 50 HB3 LEU 50 7.146 4.231 -2.093 1057 HG LEU 50 HG LEU 50 4.529 4.757 -3.567 1058 HD11 LEU 50 HD11 LEU 50 5.061 4.823 -0.576 1059 HD12 LEU 50 HD12 LEU 50 4.067 3.645 -1.439 1060 HD13 LEU 50 HD13 LEU 50 3.570 5.334 -1.377 1061 HD21 LEU 50 HD21 LEU 50 6.361 6.649 -2.037 1062 HD22 LEU 50 HD22 LEU 50 4.794 7.074 -2.738 1063 HD23 LEU 50 HD23 LEU 50 6.127 6.603 -3.789 1064 H ARG 51 H ARG 51 7.864 1.500 -4.400 1065 HA ARG 51 HA ARG 51 10.517 1.725 -3.329 1066 HB2 ARG 51 HB2 ARG 51 10.861 -0.615 -3.816 1067 HB3 ARG 51 HB3 ARG 51 9.243 -0.386 -3.195 1068 HG2 ARG 51 HG2 ARG 51 8.345 -0.592 -5.507 1069 HG3 ARG 51 HG3 ARG 51 9.977 -0.909 -6.089 1070 HD2 ARG 51 HD2 ARG 51 8.492 -2.600 -4.049 1071 HD3 ARG 51 HD3 ARG 51 8.625 -2.970 -5.770 1072 HE ARG 51 HE ARG 51 11.217 -2.730 -4.959 1073 HH11 ARG 51 HH11 ARG 51 8.590 -4.683 -3.816 1074 HH12 ARG 51 HH12 ARG 51 9.622 -5.989 -3.362 1075 HH21 ARG 51 HH21 ARG 51 12.513 -4.411 -4.329 1076 HH22 ARG 51 HH22 ARG 51 11.815 -5.830 -3.632 1077 H GLU 52 H GLU 52 9.257 1.933 -6.576 1078 HA GLU 52 HA GLU 52 11.921 1.928 -7.811 1079 HB2 GLU 52 HB2 GLU 52 9.142 2.277 -9.014 1080 HB3 GLU 52 HB3 GLU 52 10.644 2.151 -9.936 1081 HG2 GLU 52 HG2 GLU 52 10.974 -0.143 -9.079 1082 HG3 GLU 52 HG3 GLU 52 9.478 -0.017 -8.152 1083 H ASP 53 H ASP 53 9.578 4.151 -6.542 1084 HA ASP 53 HA ASP 53 9.579 6.370 -6.148 1085 HB2 ASP 53 HB2 ASP 53 11.867 6.052 -5.384 1086 HB3 ASP 53 HB3 ASP 53 12.477 6.093 -7.030 1087 H LYS 54 H LYS 54 8.806 5.211 -8.746 1088 HA LYS 54 HA LYS 54 9.442 7.112 -10.841 1089 HB2 LYS 54 HB2 LYS 54 7.375 4.877 -10.755 1090 HB3 LYS 54 HB3 LYS 54 7.779 5.820 -12.191 1091 HG2 LYS 54 HG2 LYS 54 10.099 4.948 -12.097 1092 HG3 LYS 54 HG3 LYS 54 9.670 3.991 -10.676 1093 HD2 LYS 54 HD2 LYS 54 8.552 3.676 -13.492 1094 HD3 LYS 54 HD3 LYS 54 9.648 2.573 -12.656 1095 HE2 LYS 54 HE2 LYS 54 7.788 2.278 -10.912 1096 HE3 LYS 54 HE3 LYS 54 6.731 3.118 -12.048 1097 HZ1 LYS 54 HZ1 LYS 54 7.265 1.383 -13.685 1098 HZ2 LYS 54 HZ2 LYS 54 6.515 0.771 -12.302 1099 HZ3 LYS 54 HZ3 LYS 54 8.179 0.573 -12.511 1100 H VAL 55 H VAL 55 7.254 7.168 -8.239 1101 HA VAL 55 HA VAL 55 5.721 9.369 -9.499 1102 HB VAL 55 HB VAL 55 3.624 8.728 -8.402 1103 HG11 VAL 55 HG11 VAL 55 3.978 7.930 -10.700 1104 HG12 VAL 55 HG12 VAL 55 2.992 6.791 -9.782 1105 HG13 VAL 55 HG13 VAL 55 4.695 6.437 -10.086 1106 HG21 VAL 55 HG21 VAL 55 3.350 6.501 -7.297 1107 HG22 VAL 55 HG22 VAL 55 4.472 7.549 -6.430 1108 HG23 VAL 55 HG23 VAL 55 5.091 6.236 -7.434 1109 H VAL 56 H VAL 56 4.677 10.786 -7.953 1110 HA VAL 56 HA VAL 56 5.693 10.763 -5.199 1111 HB VAL 56 HB VAL 56 7.139 12.339 -6.394 1112 HG11 VAL 56 HG11 VAL 56 4.625 13.801 -7.275 1113 HG12 VAL 56 HG12 VAL 56 5.710 12.872 -8.311 1114 HG13 VAL 56 HG13 VAL 56 6.283 14.352 -7.542 1115 HG21 VAL 56 HG21 VAL 56 6.552 12.943 -4.077 1116 HG22 VAL 56 HG22 VAL 56 5.156 13.857 -4.653 1117 HG23 VAL 56 HG23 VAL 56 6.789 14.392 -5.059 1118 H THR 57 H THR 57 4.257 11.647 -3.658 1119 HA THR 57 HA THR 57 1.440 11.582 -4.532 1120 HB THR 57 HB THR 57 0.915 11.052 -2.170 1121 HG1 THR 57 HG1 THR 57 2.404 11.185 -0.616 1122 HG21 THR 57 HG21 THR 57 3.193 9.319 -3.215 1123 HG22 THR 57 HG22 THR 57 1.486 9.133 -3.628 1124 HG23 THR 57 HG23 THR 57 2.032 8.850 -1.973 1125 H SER 58 H SER 58 0.004 13.177 -3.997 1126 HA SER 58 HA SER 58 0.806 15.541 -2.434 1127 HB2 SER 58 HB2 SER 58 -0.304 15.692 -5.284 1128 HB3 SER 58 HB3 SER 58 -0.060 17.080 -4.216 1129 HG SER 58 HG SER 58 2.191 15.555 -4.466 1130 H GLU 59 H GLU 59 -1.026 16.799 -1.694 1131 HA GLU 59 HA GLU 59 -3.517 15.206 -1.460 1132 HB2 GLU 59 HB2 GLU 59 -2.334 15.757 0.661 1133 HB3 GLU 59 HB3 GLU 59 -2.459 17.473 0.289 1134 HG2 GLU 59 HG2 GLU 59 -4.971 17.226 0.361 1135 HG3 GLU 59 HG3 GLU 59 -4.738 15.568 0.915 1136 H VAL 60 H VAL 60 -4.800 15.857 -3.180 1137 HA VAL 60 HA VAL 60 -5.467 18.737 -3.405 1138 HB VAL 60 HB VAL 60 -5.973 16.413 -5.324 1139 HG11 VAL 60 HG11 VAL 60 -7.991 17.855 -5.356 1140 HG12 VAL 60 HG12 VAL 60 -7.076 18.043 -6.853 1141 HG13 VAL 60 HG13 VAL 60 -6.981 19.284 -5.601 1142 HG21 VAL 60 HG21 VAL 60 -3.696 17.386 -5.371 1143 HG22 VAL 60 HG22 VAL 60 -4.385 18.993 -5.627 1144 HG23 VAL 60 HG23 VAL 60 -4.565 17.747 -6.867 1145 H GLU 61 H GLU 61 -6.958 19.248 -1.987 1146 HA GLU 61 HA GLU 61 -8.891 19.472 -0.868 1147 HB2 GLU 61 HB2 GLU 61 -10.101 17.869 -3.156 1148 HB3 GLU 61 HB3 GLU 61 -10.960 18.970 -2.075 1149 HG2 GLU 61 HG2 GLU 61 -9.473 20.833 -2.974 1150 HG3 GLU 61 HG3 GLU 61 -8.870 19.683 -4.157 1151 H GLY 62 H GLY 62 -7.279 17.416 0.088 1152 HA2 GLY 62 HA2 GLY 62 -7.529 16.002 1.921 1153 HA3 GLY 62 HA3 GLY 62 -9.214 15.754 1.515 1154 H GLU 63 H GLU 63 -8.499 14.964 -1.333 1155 HA GLU 63 HA GLU 63 -7.852 12.159 -0.766 1156 HB2 GLU 63 HB2 GLU 63 -8.880 13.463 -3.319 1157 HB3 GLU 63 HB3 GLU 63 -8.608 11.732 -3.106 1158 HG2 GLU 63 HG2 GLU 63 -10.271 11.833 -1.178 1159 HG3 GLU 63 HG3 GLU 63 -10.657 13.471 -1.706 1160 H ILE 64 H ILE 64 -6.658 10.934 -2.510 1161 HA ILE 64 HA ILE 64 -3.942 11.928 -2.598 1162 HB ILE 64 HB ILE 64 -5.119 9.262 -3.495 1163 HG12 ILE 64 HG12 ILE 64 -3.613 10.002 -0.942 1164 HG13 ILE 64 HG13 ILE 64 -5.331 9.640 -1.050 1165 HG21 ILE 64 HG21 ILE 64 -2.797 8.396 -3.520 1166 HG22 ILE 64 HG22 ILE 64 -2.191 10.018 -3.173 1167 HG23 ILE 64 HG23 ILE 64 -3.017 9.694 -4.698 1168 HD11 ILE 64 HD11 ILE 64 -3.062 7.705 -1.546 1169 HD12 ILE 64 HD12 ILE 64 -4.780 7.325 -1.701 1170 HD13 ILE 64 HD13 ILE 64 -4.112 7.767 -0.130 1171 H PHE 65 H PHE 65 -3.005 12.866 -4.247 1172 HA PHE 65 HA PHE 65 -3.796 12.377 -7.062 1173 HB2 PHE 65 HB2 PHE 65 -4.490 14.657 -6.535 1174 HB3 PHE 65 HB3 PHE 65 -2.964 15.002 -5.735 1175 HD1 PHE 65 HD2 PHE 65 -4.524 14.390 -9.074 1176 HD2 PHE 65 HD1 PHE 65 -1.076 15.831 -6.993 1177 HE1 PHE 65 HE2 PHE 65 -3.632 15.308 -11.171 1178 HE2 PHE 65 HE1 PHE 65 -0.193 16.743 -9.097 1179 HZ PHE 65 HZ PHE 65 -1.467 16.483 -11.187 1180 H VAL 66 H VAL 66 -2.149 11.149 -7.879 1181 HA VAL 66 HA VAL 66 0.637 11.728 -7.014 1182 HB VAL 66 HB VAL 66 1.233 9.397 -7.611 1183 HG11 VAL 66 HG11 VAL 66 0.658 9.918 -5.285 1184 HG12 VAL 66 HG12 VAL 66 0.131 8.284 -5.690 1185 HG13 VAL 66 HG13 VAL 66 -1.047 9.594 -5.610 1186 HG21 VAL 66 HG21 VAL 66 -1.746 8.970 -8.072 1187 HG22 VAL 66 HG22 VAL 66 -0.520 7.698 -8.046 1188 HG23 VAL 66 HG23 VAL 66 -0.488 8.927 -9.310 1189 H LYS 67 H LYS 67 2.316 11.583 -8.584 1190 HA LYS 67 HA LYS 67 1.613 11.609 -11.421 1191 HB2 LYS 67 HB2 LYS 67 2.679 13.867 -11.791 1192 HB3 LYS 67 HB3 LYS 67 1.144 13.907 -10.935 1193 HG2 LYS 67 HG2 LYS 67 2.344 14.211 -8.793 1194 HG3 LYS 67 HG3 LYS 67 3.883 14.204 -9.668 1195 HD2 LYS 67 HD2 LYS 67 3.192 16.221 -10.919 1196 HD3 LYS 67 HD3 LYS 67 1.631 16.214 -10.090 1197 HE2 LYS 67 HE2 LYS 67 3.146 17.872 -9.103 1198 HE3 LYS 67 HE3 LYS 67 2.769 16.605 -7.938 1199 HZ1 LYS 67 HZ1 LYS 67 4.901 15.584 -8.418 1200 HZ2 LYS 67 HZ2 LYS 67 5.114 17.180 -7.913 1201 HZ3 LYS 67 HZ3 LYS 67 5.265 16.783 -9.549 1202 H LEU 68 H LEU 68 3.442 11.539 -12.838 1203 HA LEU 68 HA LEU 68 5.473 9.813 -11.823 1204 HB2 LEU 68 HB2 LEU 68 5.400 11.165 -14.547 1205 HB3 LEU 68 HB3 LEU 68 6.346 9.749 -14.099 1206 HG LEU 68 HG LEU 68 3.331 9.927 -14.469 1207 HD11 LEU 68 HD11 LEU 68 3.689 8.224 -16.187 1208 HD12 LEU 68 HD12 LEU 68 5.429 8.256 -15.882 1209 HD13 LEU 68 HD13 LEU 68 4.613 9.686 -16.525 1210 HD21 LEU 68 HD21 LEU 68 3.210 7.530 -13.855 1211 HD22 LEU 68 HD22 LEU 68 3.678 8.551 -12.500 1212 HD23 LEU 68 HD23 LEU 68 4.899 7.585 -13.335 1213 H VAL 69 H VAL 69 7.428 10.304 -11.002 1214 HA VAL 69 HA VAL 69 8.536 12.961 -10.995 1215 HB VAL 69 HB VAL 69 9.935 10.339 -10.258 1216 HG11 VAL 69 HG11 VAL 69 11.537 12.183 -10.666 1217 HG12 VAL 69 HG12 VAL 69 11.494 11.762 -8.953 1218 HG13 VAL 69 HG13 VAL 69 10.663 13.210 -9.526 1219 HG21 VAL 69 HG21 VAL 69 9.378 10.869 -7.911 1220 HG22 VAL 69 HG22 VAL 69 7.916 10.669 -8.879 1221 HG23 VAL 69 HG23 VAL 69 8.466 12.287 -8.438 1222 H LEU 70 H LEU 70 8.794 13.596 -13.127 1223 HA LEU 70 HA LEU 70 10.210 12.200 -15.158 1224 HB2 LEU 70 HB2 LEU 70 9.780 15.197 -14.789 1225 HB3 LEU 70 HB3 LEU 70 10.371 14.446 -16.265 1226 HG LEU 70 HG LEU 70 7.598 14.037 -15.060 1227 HD11 LEU 70 HD11 LEU 70 6.767 15.294 -17.009 1228 HD12 LEU 70 HD12 LEU 70 8.426 15.612 -17.521 1229 HD13 LEU 70 HD13 LEU 70 7.829 16.274 -15.998 1230 HD21 LEU 70 HD21 LEU 70 7.077 12.805 -17.148 1231 HD22 LEU 70 HD22 LEU 70 8.327 12.006 -16.201 1232 HD23 LEU 70 HD23 LEU 70 8.769 12.930 -17.639 1233 H GLU 71 H GLU 71 11.200 14.693 -12.817 1234 HA GLU 71 HA GLU 71 13.799 13.543 -12.436 1235 HB2 GLU 71 HB2 GLU 71 13.814 15.201 -14.596 1236 HB3 GLU 71 HB3 GLU 71 14.033 16.421 -13.352 1237 HG2 GLU 71 HG2 GLU 71 15.833 14.010 -13.789 1238 HG3 GLU 71 HG3 GLU 71 16.154 15.629 -14.397 1239 H HIS 72 H HIS 72 14.716 14.260 -10.476 1240 HA HIS 72 HA HIS 72 12.890 15.348 -8.549 1241 HB2 HIS 72 HB2 HIS 72 15.845 14.671 -8.252 1242 HB3 HIS 72 HB3 HIS 72 14.767 15.077 -6.918 1243 HD1 HIS 72 HD1 HIS 72 15.848 12.266 -9.051 1244 HD2 HIS 72 HD2 HIS 72 12.760 13.112 -6.394 1245 HE1 HIS 72 HE1 HIS 72 14.785 10.063 -8.524 1246 HE2 HIS 72 HE2 HIS 72 13.008 10.578 -6.819 1247 H HIS 73 H HIS 73 16.249 16.476 -9.143 1248 HA HIS 73 HA HIS 73 17.283 18.362 -8.440 1249 HB2 HIS 73 HB2 HIS 73 16.912 20.280 -9.976 1250 HB3 HIS 73 HB3 HIS 73 16.988 18.736 -10.808 1251 HD1 HIS 73 HD1 HIS 73 14.578 21.482 -9.902 1252 HD2 HIS 73 HD2 HIS 73 14.666 18.041 -12.240 1253 HE1 HIS 73 HE1 HIS 73 12.472 21.532 -11.259 1254 HE2 HIS 73 HE2 HIS 73 12.613 19.522 -12.758 1255 H HIS 74 H HIS 74 17.316 19.434 -6.569 1256 HA HIS 74 HA HIS 74 15.048 20.410 -5.160 1257 HB2 HIS 74 HB2 HIS 74 17.411 19.857 -4.230 1258 HB3 HIS 74 HB3 HIS 74 17.891 21.461 -4.775 1259 HD1 HIS 74 HD1 HIS 74 18.176 22.646 -2.553 1260 HD2 HIS 74 HD2 HIS 74 14.571 20.585 -2.784 1261 HE1 HIS 74 HE1 HIS 74 16.925 23.231 -0.454 1262 HE2 HIS 74 HE2 HIS 74 14.784 21.921 -0.576 1263 H HIS 75 H HIS 75 14.506 22.712 -4.693 1264 HA HIS 75 HA HIS 75 13.624 24.677 -5.370 1265 HB2 HIS 75 HB2 HIS 75 15.885 24.791 -7.410 1266 HB3 HIS 75 HB3 HIS 75 14.730 26.089 -7.137 1267 HD1 HIS 75 HD1 HIS 75 15.512 27.837 -5.571 1268 HD2 HIS 75 HD2 HIS 75 17.435 24.217 -4.901 1269 HE1 HIS 75 HE1 HIS 75 17.234 28.312 -3.811 1270 HE2 HIS 75 HE2 HIS 75 18.337 26.099 -3.374 1271 H HIS 76 H HIS 76 11.656 24.512 -6.234 1272 HA HIS 76 HA HIS 76 11.323 23.569 -9.038 1273 HB2 HIS 76 HB2 HIS 76 9.370 23.175 -6.725 1274 HB3 HIS 76 HB3 HIS 76 9.098 22.683 -8.392 1275 HD1 HIS 76 HD1 HIS 76 9.825 21.149 -5.366 1276 HD2 HIS 76 HD2 HIS 76 11.569 20.877 -9.130 1277 HE1 HIS 76 HE1 HIS 76 11.051 18.957 -5.385 1278 HE2 HIS 76 HE2 HIS 76 12.288 18.943 -7.573 1279 H HIS 77 H HIS 77 9.861 24.700 -10.349 1280 HA HIS 77 HA HIS 77 9.203 27.440 -9.486 1281 HB2 HIS 77 HB2 HIS 77 10.536 26.962 -11.608 1282 HB3 HIS 77 HB3 HIS 77 9.086 26.246 -12.294 1283 HD1 HIS 77 HD1 HIS 77 10.858 29.408 -11.969 1284 HD2 HIS 77 HD2 HIS 77 6.915 28.258 -12.625 1285 HE1 HIS 77 HE1 HIS 77 9.717 31.425 -12.939 1286 HE2 HIS 77 HE2 HIS 77 7.323 30.736 -13.254 Start of MODEL 8 1 H1 MET 1 H1 MET 1 7.081 18.115 5.211 2 H2 MET 1 H2 MET 1 7.270 17.650 3.599 3 H3 MET 1 H3 MET 1 8.621 18.095 4.516 4 HA MET 1 HA MET 1 8.518 15.728 4.246 5 HB2 MET 1 HB2 MET 1 8.027 16.763 7.052 6 HB3 MET 1 HB3 MET 1 8.491 15.100 6.738 7 HG2 MET 1 HG2 MET 1 10.223 17.338 5.715 8 HG3 MET 1 HG3 MET 1 10.311 16.842 7.399 9 HE1 MET 1 HE1 MET 1 11.731 14.264 3.805 10 HE2 MET 1 HE2 MET 1 11.238 15.953 3.693 11 HE3 MET 1 HE3 MET 1 10.024 14.691 3.921 12 H LYS 2 H LYS 2 5.416 17.063 4.996 13 HA LYS 2 HA LYS 2 4.163 14.559 5.734 14 HB2 LYS 2 HB2 LYS 2 3.404 16.759 6.645 15 HB3 LYS 2 HB3 LYS 2 2.844 17.218 5.041 16 HG2 LYS 2 HG2 LYS 2 1.175 15.409 5.082 17 HG3 LYS 2 HG3 LYS 2 1.787 14.854 6.642 18 HD2 LYS 2 HD2 LYS 2 -0.281 16.154 6.932 19 HD3 LYS 2 HD3 LYS 2 1.082 16.978 7.691 20 HE2 LYS 2 HE2 LYS 2 -0.370 18.567 6.491 21 HE3 LYS 2 HE3 LYS 2 1.231 18.507 5.757 22 HZ1 LYS 2 HZ1 LYS 2 -1.165 17.070 4.756 23 HZ2 LYS 2 HZ2 LYS 2 0.361 17.086 4.029 24 HZ3 LYS 2 HZ3 LYS 2 -0.550 18.506 4.114 25 H MET 3 H MET 3 4.978 13.443 3.858 26 HA MET 3 HA MET 3 3.179 13.579 1.502 27 HB2 MET 3 HB2 MET 3 6.081 12.641 1.581 28 HB3 MET 3 HB3 MET 3 5.036 12.602 0.168 29 HG2 MET 3 HG2 MET 3 4.983 15.026 0.086 30 HG3 MET 3 HG3 MET 3 5.887 15.132 1.599 31 HE1 MET 3 HE1 MET 3 6.550 12.582 -1.417 32 HE2 MET 3 HE2 MET 3 7.726 13.507 -2.348 33 HE3 MET 3 HE3 MET 3 6.061 14.071 -2.234 34 H LEU 4 H LEU 4 2.361 11.596 0.782 35 HA LEU 4 HA LEU 4 1.674 9.647 2.636 36 HB2 LEU 4 HB2 LEU 4 0.418 10.045 0.583 37 HB3 LEU 4 HB3 LEU 4 1.737 9.445 -0.397 38 HG LEU 4 HG LEU 4 0.531 7.533 1.598 39 HD11 LEU 4 HD11 LEU 4 -1.268 6.877 0.100 40 HD12 LEU 4 HD12 LEU 4 -0.852 8.191 -1.003 41 HD13 LEU 4 HD13 LEU 4 -1.455 8.553 0.616 42 HD21 LEU 4 HD21 LEU 4 2.419 6.755 0.229 43 HD22 LEU 4 HD22 LEU 4 1.518 7.113 -1.245 44 HD23 LEU 4 HD23 LEU 4 0.953 5.849 -0.149 45 H LYS 5 H LYS 5 4.132 9.382 0.083 46 HA LYS 5 HA LYS 5 5.145 6.837 0.537 47 HB2 LYS 5 HB2 LYS 5 5.636 8.350 -1.408 48 HB3 LYS 5 HB3 LYS 5 6.696 9.296 -0.370 49 HG2 LYS 5 HG2 LYS 5 8.200 7.368 -0.105 50 HG3 LYS 5 HG3 LYS 5 7.110 6.368 -1.075 51 HD2 LYS 5 HD2 LYS 5 7.490 7.981 -2.995 52 HD3 LYS 5 HD3 LYS 5 8.719 8.773 -2.001 53 HE2 LYS 5 HE2 LYS 5 8.773 5.869 -2.894 54 HE3 LYS 5 HE3 LYS 5 9.717 7.179 -3.601 55 HZ1 LYS 5 HZ1 LYS 5 10.765 7.483 -1.395 56 HZ2 LYS 5 HZ2 LYS 5 11.082 5.974 -2.087 57 HZ3 LYS 5 HZ3 LYS 5 9.951 6.109 -0.840 58 H GLU 6 H GLU 6 6.144 9.905 2.075 59 HA GLU 6 HA GLU 6 8.419 8.837 3.444 60 HB2 GLU 6 HB2 GLU 6 6.930 11.424 4.034 61 HB3 GLU 6 HB3 GLU 6 8.578 11.026 4.522 62 HG2 GLU 6 HG2 GLU 6 7.542 11.618 1.737 63 HG3 GLU 6 HG3 GLU 6 8.711 12.544 2.672 64 H LYS 7 H LYS 7 5.130 9.752 4.538 65 HA LYS 7 HA LYS 7 5.569 8.939 7.259 66 HB2 LYS 7 HB2 LYS 7 3.284 9.547 7.673 67 HB3 LYS 7 HB3 LYS 7 3.973 10.740 6.600 68 HG2 LYS 7 HG2 LYS 7 2.023 10.513 5.445 69 HG3 LYS 7 HG3 LYS 7 2.801 9.089 4.754 70 HD2 LYS 7 HD2 LYS 7 0.553 8.497 5.486 71 HD3 LYS 7 HD3 LYS 7 1.728 7.677 6.518 72 HE2 LYS 7 HE2 LYS 7 1.384 9.441 8.258 73 HE3 LYS 7 HE3 LYS 7 0.168 10.199 7.227 74 HZ1 LYS 7 HZ1 LYS 7 -0.906 8.865 8.846 75 HZ2 LYS 7 HZ2 LYS 7 0.030 7.515 8.479 76 HZ3 LYS 7 HZ3 LYS 7 -1.093 8.094 7.359 77 H ALA 8 H ALA 8 4.517 7.275 4.388 78 HA ALA 8 HA ALA 8 3.428 4.915 5.521 79 HB1 ALA 8 HB1 ALA 8 4.023 3.814 3.393 80 HB2 ALA 8 HB2 ALA 8 5.055 5.183 2.959 81 HB3 ALA 8 HB3 ALA 8 3.310 5.403 3.106 82 H GLY 9 H GLY 9 6.789 5.887 4.860 83 HA2 GLY 9 HA2 GLY 9 8.097 3.553 5.809 84 HA3 GLY 9 HA3 GLY 9 8.806 5.151 5.658 85 H ALA 10 H ALA 10 7.052 6.519 7.468 86 HA ALA 10 HA ALA 10 8.209 5.986 10.011 87 HB1 ALA 10 HB1 ALA 10 7.453 8.229 9.342 88 HB2 ALA 10 HB2 ALA 10 6.679 7.728 10.849 89 HB3 ALA 10 HB3 ALA 10 5.778 7.672 9.331 90 H LEU 11 H LEU 11 5.080 5.148 8.578 91 HA LEU 11 HA LEU 11 3.955 3.838 10.878 92 HB2 LEU 11 HB2 LEU 11 3.266 3.751 7.918 93 HB3 LEU 11 HB3 LEU 11 2.311 2.939 9.152 94 HG LEU 11 HG LEU 11 2.784 5.950 9.132 95 HD11 LEU 11 HD11 LEU 11 0.539 6.202 8.199 96 HD12 LEU 11 HD12 LEU 11 0.390 4.452 8.030 97 HD13 LEU 11 HD13 LEU 11 1.596 5.333 7.088 98 HD21 LEU 11 HD21 LEU 11 0.874 6.001 10.689 99 HD22 LEU 11 HD22 LEU 11 2.203 5.038 11.327 100 HD23 LEU 11 HD23 LEU 11 0.782 4.238 10.647 101 H ALA 12 H ALA 12 5.947 2.839 8.142 102 HA ALA 12 HA ALA 12 5.616 0.077 8.119 103 HB1 ALA 12 HB1 ALA 12 8.184 1.588 7.557 104 HB2 ALA 12 HB2 ALA 12 6.869 1.323 6.413 105 HB3 ALA 12 HB3 ALA 12 7.791 -0.054 7.020 106 H GLY 13 H GLY 13 7.889 1.991 10.062 107 HA2 GLY 13 HA2 GLY 13 9.209 0.007 11.498 108 HA3 GLY 13 HA3 GLY 13 8.824 1.603 12.125 109 H GLN 14 H GLN 14 6.116 1.599 12.301 110 HA GLN 14 HA GLN 14 5.581 0.380 14.769 111 HB2 GLN 14 HB2 GLN 14 3.507 1.310 12.736 112 HB3 GLN 14 HB3 GLN 14 3.262 1.121 14.471 113 HG2 GLN 14 HG2 GLN 14 4.811 2.973 14.905 114 HG3 GLN 14 HG3 GLN 14 5.113 3.143 13.173 115 HE21 GLN 14 HE21 GLN 14 4.337 5.286 13.189 116 HE22 GLN 14 HE22 GLN 14 2.657 5.653 13.336 117 H ILE 15 H ILE 15 4.313 -0.527 11.528 118 HA ILE 15 HA ILE 15 2.765 -2.742 12.415 119 HB ILE 15 HB ILE 15 3.704 -1.966 9.611 120 HG12 ILE 15 HG12 ILE 15 1.225 -1.596 9.206 121 HG13 ILE 15 HG13 ILE 15 0.923 -1.960 10.895 122 HG21 ILE 15 HG21 ILE 15 3.544 -4.423 9.625 123 HG22 ILE 15 HG22 ILE 15 2.240 -3.730 8.663 124 HG23 ILE 15 HG23 ILE 15 1.912 -4.334 10.291 125 HD11 ILE 15 HD11 ILE 15 0.825 0.396 10.467 126 HD12 ILE 15 HD12 ILE 15 2.465 0.383 9.821 127 HD13 ILE 15 HD13 ILE 15 2.185 0.032 11.529 128 H TRP 16 H TRP 16 6.087 -2.536 11.112 129 HA TRP 16 HA TRP 16 6.716 -5.282 11.045 130 HB2 TRP 16 HB2 TRP 16 8.108 -3.462 10.023 131 HB3 TRP 16 HB3 TRP 16 8.615 -2.963 11.631 132 HD1 TRP 16 HD1 TRP 16 9.180 -5.703 9.018 133 HE1 TRP 16 HE1 TRP 16 11.261 -7.067 9.662 134 HE3 TRP 16 HE3 TRP 16 10.063 -3.722 13.659 135 HZ2 TRP 16 HZ2 TRP 16 13.048 -7.288 11.833 136 HZ3 TRP 16 HZ3 TRP 16 11.975 -4.563 14.963 137 HH2 TRP 16 HH2 TRP 16 13.441 -6.314 14.066 138 H GLU 17 H GLU 17 7.040 -2.912 13.707 139 HA GLU 17 HA GLU 17 8.230 -4.587 15.653 140 HB2 GLU 17 HB2 GLU 17 6.534 -2.079 15.951 141 HB3 GLU 17 HB3 GLU 17 7.312 -2.875 17.318 142 HG2 GLU 17 HG2 GLU 17 9.517 -2.445 16.382 143 HG3 GLU 17 HG3 GLU 17 8.803 -1.773 14.915 144 H ALA 18 H ALA 18 4.891 -4.343 14.622 145 HA ALA 18 HA ALA 18 3.751 -5.868 16.783 146 HB1 ALA 18 HB1 ALA 18 2.719 -5.431 13.956 147 HB2 ALA 18 HB2 ALA 18 2.381 -4.404 15.351 148 HB3 ALA 18 HB3 ALA 18 1.782 -6.062 15.316 149 H LEU 19 H LEU 19 5.125 -6.700 13.593 150 HA LEU 19 HA LEU 19 4.330 -9.493 13.743 151 HB2 LEU 19 HB2 LEU 19 5.757 -7.809 11.691 152 HB3 LEU 19 HB3 LEU 19 5.847 -9.553 11.569 153 HG LEU 19 HG LEU 19 3.386 -9.699 11.364 154 HD11 LEU 19 HD11 LEU 19 2.722 -7.724 12.644 155 HD12 LEU 19 HD12 LEU 19 2.000 -7.725 11.038 156 HD13 LEU 19 HD13 LEU 19 3.375 -6.674 11.384 157 HD21 LEU 19 HD21 LEU 19 4.767 -9.546 9.336 158 HD22 LEU 19 HD22 LEU 19 4.627 -7.785 9.363 159 HD23 LEU 19 HD23 LEU 19 3.193 -8.785 9.106 160 H ASN 20 H ASN 20 7.308 -7.734 14.533 161 HA ASN 20 HA ASN 20 9.096 -9.920 14.146 162 HB2 ASN 20 HB2 ASN 20 10.822 -8.604 15.185 163 HB3 ASN 20 HB3 ASN 20 9.848 -7.532 14.194 164 HD21 ASN 20 HD21 ASN 20 11.618 -6.901 16.430 165 HD22 ASN 20 HD22 ASN 20 10.645 -6.070 17.588 166 H GLY 21 H GLY 21 9.871 -11.489 15.466 167 HA2 GLY 21 HA2 GLY 21 10.024 -12.960 17.226 168 HA3 GLY 21 HA3 GLY 21 9.377 -11.721 18.285 169 H THR 22 H THR 22 7.348 -12.245 15.630 170 HA THR 22 HA THR 22 5.509 -14.004 17.166 171 HB THR 22 HB THR 22 4.711 -11.646 15.371 172 HG1 THR 22 HG1 THR 22 5.381 -10.587 17.110 173 HG21 THR 22 HG21 THR 22 2.466 -11.891 16.363 174 HG22 THR 22 HG22 THR 22 3.013 -13.279 17.303 175 HG23 THR 22 HG23 THR 22 2.935 -13.384 15.541 176 H GLU 23 H GLU 23 4.057 -15.322 15.846 177 HA GLU 23 HA GLU 23 5.136 -16.467 13.456 178 HB2 GLU 23 HB2 GLU 23 3.114 -17.848 13.449 179 HB3 GLU 23 HB3 GLU 23 3.729 -17.719 15.094 180 HG2 GLU 23 HG2 GLU 23 2.034 -15.979 15.579 181 HG3 GLU 23 HG3 GLU 23 1.401 -16.151 13.943 182 H GLY 24 H GLY 24 3.616 -13.549 13.806 183 HA2 GLY 24 HA2 GLY 24 3.067 -12.166 11.911 184 HA3 GLY 24 HA3 GLY 24 2.309 -13.564 11.156 185 H LEU 25 H LEU 25 1.015 -11.085 11.536 186 HA LEU 25 HA LEU 25 -1.114 -11.791 13.473 187 HB2 LEU 25 HB2 LEU 25 0.177 -9.056 13.108 188 HB3 LEU 25 HB3 LEU 25 -1.333 -9.309 13.972 189 HG LEU 25 HG LEU 25 1.402 -10.364 14.796 190 HD11 LEU 25 HD11 LEU 25 -0.368 -8.235 16.046 191 HD12 LEU 25 HD12 LEU 25 1.142 -7.965 15.170 192 HD13 LEU 25 HD13 LEU 25 1.163 -8.830 16.703 193 HD21 LEU 25 HD21 LEU 25 -1.275 -10.715 16.191 194 HD22 LEU 25 HD22 LEU 25 0.300 -11.183 16.842 195 HD23 LEU 25 HD23 LEU 25 -0.329 -11.983 15.406 196 H THR 26 H THR 26 -3.171 -10.848 13.033 197 HA THR 26 HA THR 26 -3.809 -10.342 10.221 198 HB THR 26 HB THR 26 -6.172 -10.287 10.990 199 HG1 THR 26 HG1 THR 26 -6.555 -10.747 13.265 200 HG21 THR 26 HG21 THR 26 -6.377 -12.610 11.794 201 HG22 THR 26 HG22 THR 26 -4.656 -12.646 12.180 202 HG23 THR 26 HG23 THR 26 -5.181 -12.505 10.498 203 H GLN 27 H GLN 27 -5.258 -8.446 9.713 204 HA GLN 27 HA GLN 27 -4.048 -6.011 10.172 205 HB2 GLN 27 HB2 GLN 27 -6.154 -4.974 9.255 206 HB3 GLN 27 HB3 GLN 27 -5.481 -6.275 8.282 207 HG2 GLN 27 HG2 GLN 27 -7.191 -7.826 9.215 208 HG3 GLN 27 HG3 GLN 27 -7.893 -6.483 10.122 209 HE21 GLN 27 HE21 GLN 27 -8.970 -4.832 8.950 210 HE22 GLN 27 HE22 GLN 27 -9.543 -5.101 7.348 211 H LYS 28 H LYS 28 -6.851 -7.335 11.912 212 HA LYS 28 HA LYS 28 -7.497 -5.174 13.576 213 HB2 LYS 28 HB2 LYS 28 -7.795 -8.171 13.983 214 HB3 LYS 28 HB3 LYS 28 -8.505 -6.985 15.076 215 HG2 LYS 28 HG2 LYS 28 -9.126 -7.144 12.108 216 HG3 LYS 28 HG3 LYS 28 -10.080 -7.941 13.363 217 HD2 LYS 28 HD2 LYS 28 -9.619 -4.940 13.118 218 HD3 LYS 28 HD3 LYS 28 -11.088 -5.798 12.643 219 HE2 LYS 28 HE2 LYS 28 -9.981 -5.583 15.471 220 HE3 LYS 28 HE3 LYS 28 -11.373 -4.712 14.829 221 HZ1 LYS 28 HZ1 LYS 28 -12.056 -6.617 16.135 222 HZ2 LYS 28 HZ2 LYS 28 -11.180 -7.661 15.137 223 HZ3 LYS 28 HZ3 LYS 28 -12.509 -6.824 14.521 224 H GLN 29 H GLN 29 -5.268 -7.902 14.231 225 HA GLN 29 HA GLN 29 -4.636 -7.264 16.920 226 HB2 GLN 29 HB2 GLN 29 -2.970 -8.774 14.868 227 HB3 GLN 29 HB3 GLN 29 -2.675 -8.778 16.605 228 HG2 GLN 29 HG2 GLN 29 -5.230 -9.805 15.338 229 HG3 GLN 29 HG3 GLN 29 -3.828 -10.819 15.672 230 HE21 GLN 29 HE21 GLN 29 -4.911 -12.134 17.125 231 HE22 GLN 29 HE22 GLN 29 -5.435 -11.599 18.679 232 H ILE 30 H ILE 30 -3.078 -6.413 13.875 233 HA ILE 30 HA ILE 30 -0.798 -5.097 14.932 234 HB ILE 30 HB ILE 30 -2.123 -4.812 12.201 235 HG12 ILE 30 HG12 ILE 30 0.246 -6.564 12.999 236 HG13 ILE 30 HG13 ILE 30 -1.407 -7.158 12.919 237 HG21 ILE 30 HG21 ILE 30 -0.576 -2.938 12.627 238 HG22 ILE 30 HG22 ILE 30 0.072 -4.021 11.394 239 HG23 ILE 30 HG23 ILE 30 0.708 -4.080 13.040 240 HD11 ILE 30 HD11 ILE 30 0.191 -6.084 10.598 241 HD12 ILE 30 HD12 ILE 30 -1.459 -6.714 10.524 242 HD13 ILE 30 HD13 ILE 30 -0.126 -7.781 10.963 243 H LYS 31 H LYS 31 -4.017 -3.876 13.919 244 HA LYS 31 HA LYS 31 -3.635 -1.112 14.228 245 HB2 LYS 31 HB2 LYS 31 -6.127 -2.758 14.827 246 HB3 LYS 31 HB3 LYS 31 -6.106 -0.997 14.756 247 HG2 LYS 31 HG2 LYS 31 -5.554 -1.049 12.388 248 HG3 LYS 31 HG3 LYS 31 -5.404 -2.806 12.426 249 HD2 LYS 31 HD2 LYS 31 -7.562 -2.313 11.486 250 HD3 LYS 31 HD3 LYS 31 -7.842 -2.927 13.116 251 HE2 LYS 31 HE2 LYS 31 -9.300 -1.022 12.733 252 HE3 LYS 31 HE3 LYS 31 -8.073 -0.544 13.906 253 HZ1 LYS 31 HZ1 LYS 31 -8.514 1.115 12.159 254 HZ2 LYS 31 HZ2 LYS 31 -7.930 0.031 11.000 255 HZ3 LYS 31 HZ3 LYS 31 -6.897 0.622 12.205 256 H LYS 32 H LYS 32 -4.418 -3.560 16.695 257 HA LYS 32 HA LYS 32 -4.854 -1.748 18.859 258 HB2 LYS 32 HB2 LYS 32 -5.739 -4.085 18.778 259 HB3 LYS 32 HB3 LYS 32 -4.103 -4.698 18.942 260 HG2 LYS 32 HG2 LYS 32 -5.213 -4.855 21.078 261 HG3 LYS 32 HG3 LYS 32 -3.948 -3.633 21.190 262 HD2 LYS 32 HD2 LYS 32 -5.959 -2.872 22.347 263 HD3 LYS 32 HD3 LYS 32 -5.661 -1.849 20.939 264 HE2 LYS 32 HE2 LYS 32 -8.059 -2.417 21.208 265 HE3 LYS 32 HE3 LYS 32 -7.411 -3.025 19.687 266 HZ1 LYS 32 HZ1 LYS 32 -7.234 -5.222 20.678 267 HZ2 LYS 32 HZ2 LYS 32 -8.821 -4.652 20.784 268 HZ3 LYS 32 HZ3 LYS 32 -7.824 -4.634 22.150 269 H ALA 33 H ALA 33 -1.990 -3.529 17.735 270 HA ALA 33 HA ALA 33 -0.276 -2.894 19.945 271 HB1 ALA 33 HB1 ALA 33 1.518 -3.821 18.531 272 HB2 ALA 33 HB2 ALA 33 0.437 -3.800 17.133 273 HB3 ALA 33 HB3 ALA 33 0.087 -4.855 18.503 274 H THR 34 H THR 34 -0.690 -1.521 16.703 275 HA THR 34 HA THR 34 1.371 0.524 16.969 276 HB THR 34 HB THR 34 0.677 1.200 14.690 277 HG1 THR 34 HG1 THR 34 -1.087 -0.774 14.145 278 HG21 THR 34 HG21 THR 34 2.225 -0.734 14.893 279 HG22 THR 34 HG22 THR 34 1.175 -0.884 13.483 280 HG23 THR 34 HG23 THR 34 0.840 -1.833 14.933 281 H LYS 35 H LYS 35 -1.999 0.280 17.625 282 HA LYS 35 HA LYS 35 -3.613 1.641 18.385 283 HB2 LYS 35 HB2 LYS 35 -1.320 3.551 18.951 284 HB3 LYS 35 HB3 LYS 35 -2.981 3.846 19.464 285 HG2 LYS 35 HG2 LYS 35 -2.936 1.850 20.881 286 HG3 LYS 35 HG3 LYS 35 -1.320 1.438 20.302 287 HD2 LYS 35 HD2 LYS 35 -1.197 2.455 22.528 288 HD3 LYS 35 HD3 LYS 35 -0.419 3.497 21.337 289 HE2 LYS 35 HE2 LYS 35 -2.497 4.902 21.283 290 HE3 LYS 35 HE3 LYS 35 -3.187 3.883 22.549 291 HZ1 LYS 35 HZ1 LYS 35 -1.348 4.537 23.992 292 HZ2 LYS 35 HZ2 LYS 35 -2.241 5.874 23.475 293 HZ3 LYS 35 HZ3 LYS 35 -0.735 5.543 22.778 294 H LEU 36 H LEU 36 -3.009 1.563 15.617 295 HA LEU 36 HA LEU 36 -3.659 4.196 14.497 296 HB2 LEU 36 HB2 LEU 36 -3.244 1.488 13.160 297 HB3 LEU 36 HB3 LEU 36 -3.576 2.982 12.289 298 HG LEU 36 HG LEU 36 -1.107 2.443 13.991 299 HD11 LEU 36 HD11 LEU 36 0.128 2.409 11.868 300 HD12 LEU 36 HD12 LEU 36 -1.389 2.552 10.975 301 HD13 LEU 36 HD13 LEU 36 -1.071 1.121 11.957 302 HD21 LEU 36 HD21 LEU 36 -1.689 4.815 14.057 303 HD22 LEU 36 HD22 LEU 36 -1.770 4.876 12.295 304 HD23 LEU 36 HD23 LEU 36 -0.229 4.568 13.101 305 H LYS 37 H LYS 37 -5.678 4.861 14.434 306 HA LYS 37 HA LYS 37 -7.948 3.248 15.083 307 HB2 LYS 37 HB2 LYS 37 -7.717 6.153 14.188 308 HB3 LYS 37 HB3 LYS 37 -9.256 5.404 14.580 309 HG2 LYS 37 HG2 LYS 37 -8.581 6.642 16.500 310 HG3 LYS 37 HG3 LYS 37 -8.366 4.933 16.888 311 HD2 LYS 37 HD2 LYS 37 -5.913 5.179 16.386 312 HD3 LYS 37 HD3 LYS 37 -6.172 6.906 16.115 313 HE2 LYS 37 HE2 LYS 37 -6.945 7.133 18.461 314 HE3 LYS 37 HE3 LYS 37 -6.644 5.413 18.716 315 HZ1 LYS 37 HZ1 LYS 37 -4.298 5.828 18.178 316 HZ2 LYS 37 HZ2 LYS 37 -4.820 6.686 19.538 317 HZ3 LYS 37 HZ3 LYS 37 -4.626 7.483 18.059 318 H ALA 38 H ALA 38 -6.790 4.775 12.068 319 HA ALA 38 HA ALA 38 -8.956 3.528 10.500 320 HB1 ALA 38 HB1 ALA 38 -6.821 5.503 9.610 321 HB2 ALA 38 HB2 ALA 38 -8.476 5.907 10.070 322 HB3 ALA 38 HB3 ALA 38 -8.177 4.925 8.634 323 H ASP 39 H ASP 39 -8.642 1.928 8.995 324 HA ASP 39 HA ASP 39 -6.338 0.255 8.983 325 HB2 ASP 39 HB2 ASP 39 -8.518 0.408 6.871 326 HB3 ASP 39 HB3 ASP 39 -7.425 -0.948 7.151 327 H LYS 40 H LYS 40 -7.188 3.079 7.162 328 HA LYS 40 HA LYS 40 -5.634 2.831 4.853 329 HB2 LYS 40 HB2 LYS 40 -6.281 5.381 6.391 330 HB3 LYS 40 HB3 LYS 40 -5.797 5.289 4.696 331 HG2 LYS 40 HG2 LYS 40 -8.356 4.164 5.893 332 HG3 LYS 40 HG3 LYS 40 -8.221 5.637 4.924 333 HD2 LYS 40 HD2 LYS 40 -7.446 4.255 2.990 334 HD3 LYS 40 HD3 LYS 40 -7.634 2.799 3.972 335 HE2 LYS 40 HE2 LYS 40 -9.869 4.701 3.174 336 HE3 LYS 40 HE3 LYS 40 -9.553 3.115 2.461 337 HZ1 LYS 40 HZ1 LYS 40 -11.322 2.994 4.090 338 HZ2 LYS 40 HZ2 LYS 40 -10.322 3.633 5.291 339 HZ3 LYS 40 HZ3 LYS 40 -9.988 2.112 4.632 340 H ASP 41 H ASP 41 -4.668 3.921 8.110 341 HA ASP 41 HA ASP 41 -1.980 4.694 7.446 342 HB2 ASP 41 HB2 ASP 41 -3.171 3.845 10.124 343 HB3 ASP 41 HB3 ASP 41 -1.603 4.622 9.913 344 H PHE 42 H PHE 42 -3.532 1.702 8.526 345 HA PHE 42 HA PHE 42 -1.220 0.104 8.878 346 HB2 PHE 42 HB2 PHE 42 -3.285 -0.657 9.849 347 HB3 PHE 42 HB3 PHE 42 -4.123 -0.602 8.302 348 HD1 PHE 42 HD1 PHE 42 -1.142 -2.274 9.864 349 HD2 PHE 42 HD2 PHE 42 -4.465 -2.658 7.195 350 HE1 PHE 42 HE1 PHE 42 -0.573 -4.621 9.478 351 HE2 PHE 42 HE2 PHE 42 -3.888 -5.024 6.834 352 HZ PHE 42 HZ PHE 42 -1.937 -6.001 7.979 353 H PHE 43 H PHE 43 -3.258 0.696 5.991 354 HA PHE 43 HA PHE 43 -2.102 -1.249 4.283 355 HB2 PHE 43 HB2 PHE 43 -3.536 1.342 3.553 356 HB3 PHE 43 HB3 PHE 43 -3.166 0.050 2.414 357 HD1 PHE 43 HD2 PHE 43 -3.849 -2.302 4.299 358 HD2 PHE 43 HD1 PHE 43 -5.939 1.309 3.338 359 HE1 PHE 43 HE2 PHE 43 -5.981 -3.393 4.818 360 HE2 PHE 43 HE1 PHE 43 -8.074 0.204 3.859 361 HZ PHE 43 HZ PHE 43 -8.097 -2.147 4.597 362 H LEU 44 H LEU 44 -1.260 2.143 4.868 363 HA LEU 44 HA LEU 44 0.791 2.353 2.885 364 HB2 LEU 44 HB2 LEU 44 -0.083 3.992 5.250 365 HB3 LEU 44 HB3 LEU 44 1.501 4.320 4.578 366 HG LEU 44 HG LEU 44 0.527 4.894 2.405 367 HD11 LEU 44 HD11 LEU 44 -1.882 5.059 2.015 368 HD12 LEU 44 HD12 LEU 44 -2.203 4.341 3.594 369 HD13 LEU 44 HD13 LEU 44 -1.401 3.394 2.341 370 HD21 LEU 44 HD21 LEU 44 0.778 6.672 4.064 371 HD22 LEU 44 HD22 LEU 44 -0.848 6.357 4.675 372 HD23 LEU 44 HD23 LEU 44 -0.621 6.967 3.035 373 H GLY 45 H GLY 45 0.886 1.726 6.418 374 HA2 GLY 45 HA2 GLY 45 3.681 1.501 6.742 375 HA3 GLY 45 HA3 GLY 45 2.472 0.776 7.789 376 H LEU 46 H LEU 46 1.292 -1.126 6.485 377 HA LEU 46 HA LEU 46 3.014 -3.324 6.262 378 HB2 LEU 46 HB2 LEU 46 0.623 -3.573 6.721 379 HB3 LEU 46 HB3 LEU 46 0.214 -2.902 5.151 380 HG LEU 46 HG LEU 46 1.265 -4.891 4.046 381 HD11 LEU 46 HD11 LEU 46 1.860 -6.859 5.360 382 HD12 LEU 46 HD12 LEU 46 1.586 -5.965 6.856 383 HD13 LEU 46 HD13 LEU 46 2.886 -5.484 5.761 384 HD21 LEU 46 HD21 LEU 46 -1.166 -4.852 4.462 385 HD22 LEU 46 HD22 LEU 46 -0.912 -5.623 6.028 386 HD23 LEU 46 HD23 LEU 46 -0.514 -6.490 4.545 387 H GLY 47 H GLY 47 1.753 -1.154 3.804 388 HA2 GLY 47 HA2 GLY 47 2.471 -2.576 1.455 389 HA3 GLY 47 HA3 GLY 47 2.141 -0.852 1.560 390 H TRP 48 H TRP 48 4.205 -0.319 3.499 391 HA TRP 48 HA TRP 48 6.501 -0.042 1.793 392 HB2 TRP 48 HB2 TRP 48 5.650 1.622 3.575 393 HB3 TRP 48 HB3 TRP 48 6.396 0.563 4.769 394 HD1 TRP 48 HD1 TRP 48 9.074 0.590 4.906 395 HE1 TRP 48 HE1 TRP 48 10.844 2.196 3.948 396 HE3 TRP 48 HE3 TRP 48 6.166 3.041 1.524 397 HZ2 TRP 48 HZ2 TRP 48 10.982 4.242 1.981 398 HZ3 TRP 48 HZ3 TRP 48 7.173 4.794 0.137 399 HH2 TRP 48 HH2 TRP 48 9.531 5.383 0.361 400 H LEU 49 H LEU 49 5.555 -2.276 4.350 401 HA LEU 49 HA LEU 49 8.092 -3.615 4.583 402 HB2 LEU 49 HB2 LEU 49 5.252 -4.357 5.305 403 HB3 LEU 49 HB3 LEU 49 6.497 -5.583 5.372 404 HG LEU 49 HG LEU 49 7.662 -4.463 7.153 405 HD11 LEU 49 HD11 LEU 49 6.953 -2.314 8.080 406 HD12 LEU 49 HD12 LEU 49 5.766 -2.147 6.776 407 HD13 LEU 49 HD13 LEU 49 7.496 -2.176 6.408 408 HD21 LEU 49 HD21 LEU 49 4.675 -4.344 7.688 409 HD22 LEU 49 HD22 LEU 49 5.947 -4.399 8.916 410 HD23 LEU 49 HD23 LEU 49 5.702 -5.776 7.845 411 H LEU 50 H LEU 50 5.259 -3.984 2.497 412 HA LEU 50 HA LEU 50 6.036 -6.343 1.098 413 HB2 LEU 50 HB2 LEU 50 4.192 -4.063 0.253 414 HB3 LEU 50 HB3 LEU 50 4.351 -5.581 -0.620 415 HG LEU 50 HG LEU 50 3.249 -5.271 2.208 416 HD11 LEU 50 HD11 LEU 50 1.070 -5.865 1.242 417 HD12 LEU 50 HD12 LEU 50 1.776 -5.890 -0.378 418 HD13 LEU 50 HD13 LEU 50 1.702 -4.379 0.533 419 HD21 LEU 50 HD21 LEU 50 4.402 -7.419 1.914 420 HD22 LEU 50 HD22 LEU 50 3.419 -7.766 0.491 421 HD23 LEU 50 HD23 LEU 50 2.664 -7.636 2.079 422 H ARG 51 H ARG 51 6.565 -2.856 0.556 423 HA ARG 51 HA ARG 51 7.785 -3.038 -1.994 424 HB2 ARG 51 HB2 ARG 51 8.072 -0.725 -1.873 425 HB3 ARG 51 HB3 ARG 51 6.799 -0.950 -0.702 426 HG2 ARG 51 HG2 ARG 51 8.096 0.458 0.546 427 HG3 ARG 51 HG3 ARG 51 8.902 -1.041 0.985 428 HD2 ARG 51 HD2 ARG 51 10.583 -0.594 -0.831 429 HD3 ARG 51 HD3 ARG 51 9.816 0.980 -1.081 430 HE ARG 51 HE ARG 51 10.451 0.786 1.625 431 HH11 ARG 51 HH11 ARG 51 12.194 0.966 -1.380 432 HH12 ARG 51 HH12 ARG 51 13.609 1.590 -0.616 433 HH21 ARG 51 HH21 ARG 51 12.296 1.561 2.539 434 HH22 ARG 51 HH22 ARG 51 13.662 1.940 1.545 435 H GLU 52 H GLU 52 9.126 -3.392 1.255 436 HA GLU 52 HA GLU 52 11.875 -3.675 0.217 437 HB2 GLU 52 HB2 GLU 52 10.776 -3.598 3.056 438 HB3 GLU 52 HB3 GLU 52 12.475 -3.882 2.680 439 HG2 GLU 52 HG2 GLU 52 12.589 -1.674 1.573 440 HG3 GLU 52 HG3 GLU 52 10.897 -1.391 1.978 441 H ASP 53 H ASP 53 9.308 -5.718 0.422 442 HA ASP 53 HA ASP 53 9.058 -7.947 0.116 443 HB2 ASP 53 HB2 ASP 53 12.094 -8.058 -0.135 444 HB3 ASP 53 HB3 ASP 53 10.973 -9.304 -0.677 445 H LYS 54 H LYS 54 9.777 -6.765 2.879 446 HA LYS 54 HA LYS 54 11.257 -8.824 4.294 447 HB2 LYS 54 HB2 LYS 54 9.832 -6.333 5.301 448 HB3 LYS 54 HB3 LYS 54 10.833 -7.380 6.308 449 HG2 LYS 54 HG2 LYS 54 12.791 -6.858 4.872 450 HG3 LYS 54 HG3 LYS 54 11.780 -5.779 3.904 451 HD2 LYS 54 HD2 LYS 54 12.481 -5.448 6.852 452 HD3 LYS 54 HD3 LYS 54 13.127 -4.501 5.508 453 HE2 LYS 54 HE2 LYS 54 10.724 -3.745 5.051 454 HE3 LYS 54 HE3 LYS 54 10.285 -4.498 6.587 455 HZ1 LYS 54 HZ1 LYS 54 12.248 -2.307 6.198 456 HZ2 LYS 54 HZ2 LYS 54 11.891 -3.039 7.677 457 HZ3 LYS 54 HZ3 LYS 54 10.698 -2.161 6.864 458 H VAL 55 H VAL 55 8.016 -8.582 3.388 459 HA VAL 55 HA VAL 55 7.182 -10.508 5.454 460 HB VAL 55 HB VAL 55 4.978 -9.434 5.751 461 HG11 VAL 55 HG11 VAL 55 6.715 -8.926 7.401 462 HG12 VAL 55 HG12 VAL 55 5.650 -7.539 7.169 463 HG13 VAL 55 HG13 VAL 55 7.256 -7.550 6.434 464 HG21 VAL 55 HG21 VAL 55 4.791 -8.235 3.617 465 HG22 VAL 55 HG22 VAL 55 6.088 -7.138 4.094 466 HG23 VAL 55 HG23 VAL 55 4.551 -7.122 4.966 467 H VAL 56 H VAL 56 5.208 -11.657 4.917 468 HA VAL 56 HA VAL 56 4.514 -11.805 2.082 469 HB VAL 56 HB VAL 56 6.044 -13.657 2.454 470 HG11 VAL 56 HG11 VAL 56 5.655 -15.440 4.112 471 HG12 VAL 56 HG12 VAL 56 4.256 -14.562 4.734 472 HG13 VAL 56 HG13 VAL 56 5.872 -13.868 4.890 473 HG21 VAL 56 HG21 VAL 56 4.648 -15.579 1.773 474 HG22 VAL 56 HG22 VAL 56 4.146 -14.109 0.935 475 HG23 VAL 56 HG23 VAL 56 3.194 -14.720 2.290 476 H THR 57 H THR 57 2.382 -12.068 1.623 477 HA THR 57 HA THR 57 0.492 -11.780 3.897 478 HB THR 57 HB THR 57 -0.949 -10.546 2.186 479 HG1 THR 57 HG1 THR 57 0.407 -11.492 0.403 480 HG21 THR 57 HG21 THR 57 0.311 -8.422 2.267 481 HG22 THR 57 HG22 THR 57 1.766 -9.293 2.758 482 HG23 THR 57 HG23 THR 57 0.362 -9.246 3.829 483 H SER 58 H SER 58 -1.153 -13.183 4.044 484 HA SER 58 HA SER 58 -1.944 -14.905 1.762 485 HB2 SER 58 HB2 SER 58 -0.775 -16.259 3.481 486 HB3 SER 58 HB3 SER 58 -1.874 -15.665 4.723 487 HG SER 58 HG SER 58 -2.220 -17.669 2.898 488 H GLU 59 H GLU 59 -4.199 -15.614 1.829 489 HA GLU 59 HA GLU 59 -6.017 -13.522 2.870 490 HB2 GLU 59 HB2 GLU 59 -6.106 -13.896 0.433 491 HB3 GLU 59 HB3 GLU 59 -6.425 -15.608 0.683 492 HG2 GLU 59 HG2 GLU 59 -8.576 -14.970 1.829 493 HG3 GLU 59 HG3 GLU 59 -8.250 -13.292 1.397 494 H VAL 60 H VAL 60 -6.608 -14.135 4.910 495 HA VAL 60 HA VAL 60 -7.593 -16.908 5.349 496 HB VAL 60 HB VAL 60 -6.578 -14.861 7.378 497 HG11 VAL 60 HG11 VAL 60 -7.732 -17.636 7.920 498 HG12 VAL 60 HG12 VAL 60 -8.475 -16.101 8.375 499 HG13 VAL 60 HG13 VAL 60 -6.955 -16.597 9.119 500 HG21 VAL 60 HG21 VAL 60 -4.803 -16.023 6.103 501 HG22 VAL 60 HG22 VAL 60 -5.495 -17.585 6.556 502 HG23 VAL 60 HG23 VAL 60 -4.798 -16.536 7.795 503 H GLU 61 H GLU 61 -9.633 -16.957 4.914 504 HA GLU 61 HA GLU 61 -11.865 -16.673 4.866 505 HB2 GLU 61 HB2 GLU 61 -11.477 -15.755 7.733 506 HB3 GLU 61 HB3 GLU 61 -12.914 -16.513 7.047 507 HG2 GLU 61 HG2 GLU 61 -11.445 -18.565 6.592 508 HG3 GLU 61 HG3 GLU 61 -10.206 -17.780 7.559 509 H GLY 62 H GLY 62 -10.489 -14.260 3.913 510 HA2 GLY 62 HA2 GLY 62 -11.556 -12.448 2.836 511 HA3 GLY 62 HA3 GLY 62 -12.787 -12.425 4.076 512 H GLU 63 H GLU 63 -9.762 -12.500 5.629 513 HA GLU 63 HA GLU 63 -9.457 -9.547 5.516 514 HB2 GLU 63 HB2 GLU 63 -9.081 -9.340 7.845 515 HB3 GLU 63 HB3 GLU 63 -10.508 -10.354 7.698 516 HG2 GLU 63 HG2 GLU 63 -9.161 -12.353 8.195 517 HG3 GLU 63 HG3 GLU 63 -7.705 -11.362 8.285 518 H ILE 64 H ILE 64 -7.318 -8.746 6.160 519 HA ILE 64 HA ILE 64 -5.248 -10.161 4.746 520 HB ILE 64 HB ILE 64 -5.097 -7.537 6.285 521 HG12 ILE 64 HG12 ILE 64 -5.540 -8.030 3.302 522 HG13 ILE 64 HG13 ILE 64 -6.744 -7.429 4.437 523 HG21 ILE 64 HG21 ILE 64 -2.863 -8.520 5.988 524 HG22 ILE 64 HG22 ILE 64 -3.039 -7.087 4.976 525 HG23 ILE 64 HG23 ILE 64 -3.149 -8.695 4.255 526 HD11 ILE 64 HD11 ILE 64 -4.221 -5.990 3.593 527 HD12 ILE 64 HD12 ILE 64 -5.413 -5.385 4.747 528 HD13 ILE 64 HD13 ILE 64 -5.866 -5.639 3.064 529 H PHE 65 H PHE 65 -4.241 -11.816 5.723 530 HA PHE 65 HA PHE 65 -3.066 -11.467 8.425 531 HB2 PHE 65 HB2 PHE 65 -4.266 -13.588 8.247 532 HB3 PHE 65 HB3 PHE 65 -3.459 -13.977 6.732 533 HD1 PHE 65 HD2 PHE 65 -2.639 -13.225 10.329 534 HD2 PHE 65 HD1 PHE 65 -1.586 -15.421 6.805 535 HE1 PHE 65 HE2 PHE 65 -0.843 -14.364 11.564 536 HE2 PHE 65 HE1 PHE 65 0.209 -16.552 8.052 537 HZ PHE 65 HZ PHE 65 0.585 -16.022 10.429 538 H VAL 66 H VAL 66 -0.884 -11.146 8.574 539 HA VAL 66 HA VAL 66 0.857 -11.735 6.270 540 HB VAL 66 HB VAL 66 0.172 -9.388 5.994 541 HG11 VAL 66 HG11 VAL 66 1.361 -8.865 8.743 542 HG12 VAL 66 HG12 VAL 66 -0.357 -8.832 8.338 543 HG13 VAL 66 HG13 VAL 66 0.737 -7.639 7.634 544 HG21 VAL 66 HG21 VAL 66 3.072 -9.619 6.877 545 HG22 VAL 66 HG22 VAL 66 2.410 -8.379 5.812 546 HG23 VAL 66 HG23 VAL 66 2.439 -10.061 5.290 547 H LYS 67 H LYS 67 3.088 -12.033 6.773 548 HA LYS 67 HA LYS 67 3.982 -11.879 9.570 549 HB2 LYS 67 HB2 LYS 67 4.754 -14.238 9.599 550 HB3 LYS 67 HB3 LYS 67 3.004 -14.115 9.463 551 HG2 LYS 67 HG2 LYS 67 3.192 -14.540 7.012 552 HG3 LYS 67 HG3 LYS 67 4.935 -14.764 7.211 553 HD2 LYS 67 HD2 LYS 67 2.746 -16.447 8.502 554 HD3 LYS 67 HD3 LYS 67 3.755 -16.932 7.137 555 HE2 LYS 67 HE2 LYS 67 5.757 -16.868 8.573 556 HE3 LYS 67 HE3 LYS 67 4.784 -16.302 9.931 557 HZ1 LYS 67 HZ1 LYS 67 5.232 -18.661 10.044 558 HZ2 LYS 67 HZ2 LYS 67 4.465 -18.909 8.563 559 HZ3 LYS 67 HZ3 LYS 67 3.576 -18.368 9.897 560 H LEU 68 H LEU 68 6.346 -12.117 9.787 561 HA LEU 68 HA LEU 68 7.805 -10.821 7.708 562 HB2 LEU 68 HB2 LEU 68 8.905 -12.351 10.103 563 HB3 LEU 68 HB3 LEU 68 9.823 -11.247 9.089 564 HG LEU 68 HG LEU 68 7.608 -10.536 11.054 565 HD11 LEU 68 HD11 LEU 68 10.553 -9.792 11.001 566 HD12 LEU 68 HD12 LEU 68 9.791 -10.971 12.073 567 HD13 LEU 68 HD13 LEU 68 9.364 -9.268 12.199 568 HD21 LEU 68 HD21 LEU 68 9.035 -8.677 9.122 569 HD22 LEU 68 HD22 LEU 68 7.981 -8.171 10.446 570 HD23 LEU 68 HD23 LEU 68 7.321 -9.104 9.108 571 H VAL 69 H VAL 69 8.999 -11.660 6.013 572 HA VAL 69 HA VAL 69 9.406 -14.502 5.634 573 HB VAL 69 HB VAL 69 10.757 -12.186 4.153 574 HG11 VAL 69 HG11 VAL 69 11.218 -13.857 2.370 575 HG12 VAL 69 HG12 VAL 69 10.504 -15.125 3.368 576 HG13 VAL 69 HG13 VAL 69 11.985 -14.321 3.892 577 HG21 VAL 69 HG21 VAL 69 9.071 -12.526 2.381 578 HG22 VAL 69 HG22 VAL 69 8.308 -12.070 3.904 579 HG23 VAL 69 HG23 VAL 69 8.268 -13.751 3.368 580 H LEU 70 H LEU 70 10.462 -15.079 7.597 581 HA LEU 70 HA LEU 70 13.002 -13.962 8.390 582 HB2 LEU 70 HB2 LEU 70 11.590 -16.516 9.271 583 HB3 LEU 70 HB3 LEU 70 13.034 -15.858 10.031 584 HG LEU 70 HG LEU 70 10.279 -14.545 9.983 585 HD11 LEU 70 HD11 LEU 70 11.812 -15.777 12.292 586 HD12 LEU 70 HD12 LEU 70 10.387 -16.456 11.501 587 HD13 LEU 70 HD13 LEU 70 10.257 -14.946 12.399 588 HD21 LEU 70 HD21 LEU 70 12.008 -12.822 9.893 589 HD22 LEU 70 HD22 LEU 70 12.848 -13.546 11.266 590 HD23 LEU 70 HD23 LEU 70 11.246 -12.834 11.482 591 H GLU 71 H GLU 71 15.008 -14.571 7.744 592 HA GLU 71 HA GLU 71 15.380 -16.209 5.464 593 HB2 GLU 71 HB2 GLU 71 17.338 -14.890 7.367 594 HB3 GLU 71 HB3 GLU 71 17.876 -15.834 5.979 595 HG2 GLU 71 HG2 GLU 71 16.131 -13.344 5.857 596 HG3 GLU 71 HG3 GLU 71 17.856 -13.420 5.499 597 H HIS 72 H HIS 72 14.608 -18.242 5.907 598 HA HIS 72 HA HIS 72 16.006 -19.983 7.825 599 HB2 HIS 72 HB2 HIS 72 13.714 -20.660 5.924 600 HB3 HIS 72 HB3 HIS 72 14.303 -21.657 7.249 601 HD1 HIS 72 HD1 HIS 72 11.453 -19.918 6.598 602 HD2 HIS 72 HD2 HIS 72 14.138 -19.649 9.750 603 HE1 HIS 72 HE1 HIS 72 10.165 -18.881 8.474 604 HE2 HIS 72 HE2 HIS 72 11.753 -18.932 10.426 605 H HIS 73 H HIS 73 16.666 -22.192 6.963 606 HA HIS 73 HA HIS 73 18.307 -22.084 4.622 607 HB2 HIS 73 HB2 HIS 73 17.339 -24.477 6.256 608 HB3 HIS 73 HB3 HIS 73 18.588 -24.545 5.013 609 HD1 HIS 73 HD1 HIS 73 17.993 -23.481 8.540 610 HD2 HIS 73 HD2 HIS 73 21.069 -23.405 5.747 611 HE1 HIS 73 HE1 HIS 73 20.059 -22.912 9.836 612 HE2 HIS 73 HE2 HIS 73 21.923 -23.040 8.155 613 H HIS 74 H HIS 74 17.709 -22.336 2.531 614 HA HIS 74 HA HIS 74 14.999 -22.220 1.838 615 HB2 HIS 74 HB2 HIS 74 15.818 -22.387 -0.574 616 HB3 HIS 74 HB3 HIS 74 16.491 -21.092 0.399 617 HD1 HIS 74 HD1 HIS 74 17.488 -24.576 -0.791 618 HD2 HIS 74 HD2 HIS 74 19.206 -20.951 0.273 619 HE1 HIS 74 HE1 HIS 74 19.930 -24.824 -1.289 620 HE2 HIS 74 HE2 HIS 74 20.916 -22.568 -0.796 621 H HIS 75 H HIS 75 13.678 -23.863 2.300 622 HA HIS 75 HA HIS 75 14.364 -26.648 1.785 623 HB2 HIS 75 HB2 HIS 75 13.138 -25.805 3.869 624 HB3 HIS 75 HB3 HIS 75 11.733 -25.536 2.848 625 HD1 HIS 75 HD1 HIS 75 13.486 -28.131 4.776 626 HD2 HIS 75 HD2 HIS 75 10.570 -28.014 1.813 627 HE1 HIS 75 HE1 HIS 75 12.435 -30.404 4.777 628 HE2 HIS 75 HE2 HIS 75 10.754 -30.347 2.919 629 H HIS 76 H HIS 76 14.566 -26.117 -0.574 630 HA HIS 76 HA HIS 76 12.108 -26.810 -2.038 631 HB2 HIS 76 HB2 HIS 76 13.822 -24.380 -2.749 632 HB3 HIS 76 HB3 HIS 76 12.556 -25.040 -3.774 633 HD1 HIS 76 HD1 HIS 76 13.128 -22.643 -1.091 634 HD2 HIS 76 HD2 HIS 76 9.871 -24.770 -2.569 635 HE1 HIS 76 HE1 HIS 76 11.098 -21.505 -0.150 636 HE2 HIS 76 HE2 HIS 76 9.157 -22.881 -0.945 637 H HIS 77 H HIS 77 12.888 -26.811 -4.568 638 HA HIS 77 HA HIS 77 15.603 -27.828 -4.949 639 HB2 HIS 77 HB2 HIS 77 14.848 -29.922 -6.060 640 HB3 HIS 77 HB3 HIS 77 14.374 -29.882 -4.366 641 HD1 HIS 77 HD1 HIS 77 12.977 -30.005 -7.809 642 HD2 HIS 77 HD2 HIS 77 11.558 -29.633 -3.925 643 HE1 HIS 77 HE1 HIS 77 10.519 -30.451 -7.947 644 HE2 HIS 77 HE2 HIS 77 9.739 -30.454 -5.564 645 H1 MET 1 H MET 1 -1.858 -20.581 -4.581 646 HA MET 1 HA MET 1 0.215 -18.851 -3.778 647 HB2 MET 1 HB2 MET 1 -0.722 -19.587 -6.585 648 HB3 MET 1 HB3 MET 1 0.784 -18.743 -6.237 649 HG2 MET 1 HG2 MET 1 0.068 -21.543 -5.326 650 HG3 MET 1 HG3 MET 1 1.187 -21.124 -6.625 651 HE1 MET 1 HE1 MET 1 4.131 -19.428 -4.592 652 HE2 MET 1 HE2 MET 1 2.775 -18.620 -5.380 653 HE3 MET 1 HE3 MET 1 3.597 -19.955 -6.189 654 H LYS 2 H LYS 2 -2.821 -17.896 -3.818 655 HA LYS 2 HA LYS 2 -2.739 -15.414 -5.295 656 HB2 LYS 2 HB2 LYS 2 -4.631 -16.212 -3.040 657 HB3 LYS 2 HB3 LYS 2 -4.855 -14.871 -4.160 658 HG2 LYS 2 HG2 LYS 2 -5.065 -16.494 -6.024 659 HG3 LYS 2 HG3 LYS 2 -4.896 -17.826 -4.873 660 HD2 LYS 2 HD2 LYS 2 -7.108 -15.727 -4.762 661 HD3 LYS 2 HD3 LYS 2 -7.280 -17.292 -5.551 662 HE2 LYS 2 HE2 LYS 2 -8.310 -17.436 -3.377 663 HE3 LYS 2 HE3 LYS 2 -6.834 -18.390 -3.326 664 HZ1 LYS 2 HZ1 LYS 2 -6.975 -15.604 -2.327 665 HZ2 LYS 2 HZ2 LYS 2 -5.769 -16.755 -2.031 666 HZ3 LYS 2 HZ3 LYS 2 -7.305 -16.942 -1.354 667 H MET 3 H MET 3 -0.640 -14.665 -4.425 668 HA MET 3 HA MET 3 -0.510 -13.736 -1.667 669 HB2 MET 3 HB2 MET 3 1.434 -13.362 -3.982 670 HB3 MET 3 HB3 MET 3 1.747 -12.887 -2.318 671 HG2 MET 3 HG2 MET 3 1.275 -15.744 -3.228 672 HG3 MET 3 HG3 MET 3 2.861 -15.009 -2.994 673 HE1 MET 3 HE1 MET 3 0.250 -17.229 -1.370 674 HE2 MET 3 HE2 MET 3 -0.587 -15.720 -1.007 675 HE3 MET 3 HE3 MET 3 0.119 -16.672 0.297 676 H LEU 4 H LEU 4 -1.216 -11.812 -1.002 677 HA LEU 4 HA LEU 4 -2.288 -9.788 -2.696 678 HB2 LEU 4 HB2 LEU 4 -1.553 -9.672 0.253 679 HB3 LEU 4 HB3 LEU 4 -2.355 -8.364 -0.593 680 HG LEU 4 HG LEU 4 -4.302 -9.930 -1.037 681 HD11 LEU 4 HD11 LEU 4 -2.902 -11.790 0.909 682 HD12 LEU 4 HD12 LEU 4 -3.168 -12.094 -0.809 683 HD13 LEU 4 HD13 LEU 4 -4.546 -11.982 0.285 684 HD21 LEU 4 HD21 LEU 4 -4.371 -8.280 0.777 685 HD22 LEU 4 HD22 LEU 4 -3.626 -9.438 1.882 686 HD23 LEU 4 HD23 LEU 4 -5.239 -9.747 1.232 687 H LYS 5 H LYS 5 0.908 -10.409 -1.577 688 HA LYS 5 HA LYS 5 2.106 -7.866 -2.180 689 HB2 LYS 5 HB2 LYS 5 2.996 -9.600 -0.570 690 HB3 LYS 5 HB3 LYS 5 3.385 -10.621 -1.947 691 HG2 LYS 5 HG2 LYS 5 4.567 -7.876 -1.997 692 HG3 LYS 5 HG3 LYS 5 5.157 -8.940 -0.718 693 HD2 LYS 5 HD2 LYS 5 5.734 -10.639 -2.466 694 HD3 LYS 5 HD3 LYS 5 5.229 -9.494 -3.715 695 HE2 LYS 5 HE2 LYS 5 6.972 -7.907 -2.922 696 HE3 LYS 5 HE3 LYS 5 7.483 -9.091 -1.714 697 HZ1 LYS 5 HZ1 LYS 5 7.547 -9.501 -4.653 698 HZ2 LYS 5 HZ2 LYS 5 8.091 -10.592 -3.479 699 HZ3 LYS 5 HZ3 LYS 5 8.875 -9.111 -3.682 700 H GLU 6 H GLU 6 1.438 -10.834 -3.993 701 HA GLU 6 HA GLU 6 3.217 -10.278 -6.180 702 HB2 GLU 6 HB2 GLU 6 2.434 -12.579 -5.400 703 HB3 GLU 6 HB3 GLU 6 0.897 -12.237 -6.177 704 HG2 GLU 6 HG2 GLU 6 2.241 -13.616 -7.637 705 HG3 GLU 6 HG3 GLU 6 2.060 -12.015 -8.359 706 H LYS 7 H LYS 7 -0.355 -10.181 -5.808 707 HA LYS 7 HA LYS 7 -1.131 -9.194 -8.307 708 HB2 LYS 7 HB2 LYS 7 -3.175 -8.373 -7.218 709 HB3 LYS 7 HB3 LYS 7 -2.729 -9.941 -6.542 710 HG2 LYS 7 HG2 LYS 7 -1.762 -8.868 -4.579 711 HG3 LYS 7 HG3 LYS 7 -2.076 -7.272 -5.247 712 HD2 LYS 7 HD2 LYS 7 -4.250 -9.252 -4.550 713 HD3 LYS 7 HD3 LYS 7 -3.619 -8.045 -3.434 714 HE2 LYS 7 HE2 LYS 7 -5.612 -7.098 -4.296 715 HE3 LYS 7 HE3 LYS 7 -4.313 -6.289 -5.164 716 HZ1 LYS 7 HZ1 LYS 7 -6.122 -6.915 -6.616 717 HZ2 LYS 7 HZ2 LYS 7 -5.930 -8.547 -6.199 718 HZ3 LYS 7 HZ3 LYS 7 -4.713 -7.744 -7.043 719 H ALA 8 H ALA 8 0.227 -7.495 -5.549 720 HA ALA 8 HA ALA 8 -0.418 -4.834 -6.135 721 HB1 ALA 8 HB1 ALA 8 1.380 -4.285 -4.535 722 HB2 ALA 8 HB2 ALA 8 1.984 -5.943 -4.636 723 HB3 ALA 8 HB3 ALA 8 0.388 -5.623 -3.950 724 H GLY 9 H GLY 9 2.167 -6.918 -7.253 725 HA2 GLY 9 HA2 GLY 9 3.835 -4.916 -8.488 726 HA3 GLY 9 HA3 GLY 9 3.940 -6.653 -8.717 727 H ALA 10 H ALA 10 1.390 -7.186 -9.744 728 HA ALA 10 HA ALA 10 1.576 -6.484 -12.489 729 HB1 ALA 10 HB1 ALA 10 0.480 -8.552 -11.740 730 HB2 ALA 10 HB2 ALA 10 -0.623 -7.585 -12.729 731 HB3 ALA 10 HB3 ALA 10 -0.800 -7.612 -10.971 732 H LEU 11 H LEU 11 -0.639 -5.380 -9.917 733 HA LEU 11 HA LEU 11 -2.135 -3.487 -11.385 734 HB2 LEU 11 HB2 LEU 11 -1.517 -3.611 -8.408 735 HB3 LEU 11 HB3 LEU 11 -2.732 -2.557 -9.121 736 HG LEU 11 HG LEU 11 -2.821 -5.602 -9.256 737 HD11 LEU 11 HD11 LEU 11 -4.341 -3.749 -7.403 738 HD12 LEU 11 HD12 LEU 11 -3.057 -4.873 -6.947 739 HD13 LEU 11 HD13 LEU 11 -4.587 -5.491 -7.563 740 HD21 LEU 11 HD21 LEU 11 -4.009 -4.525 -11.115 741 HD22 LEU 11 HD22 LEU 11 -4.935 -3.540 -9.977 742 HD23 LEU 11 HD23 LEU 11 -5.143 -5.294 -10.005 743 H ALA 12 H ALA 12 0.983 -3.259 -9.737 744 HA ALA 12 HA ALA 12 1.384 -0.484 -9.694 745 HB1 ALA 12 HB1 ALA 12 3.781 -0.973 -9.619 746 HB2 ALA 12 HB2 ALA 12 3.482 -2.632 -10.163 747 HB3 ALA 12 HB3 ALA 12 2.886 -2.094 -8.591 748 H GLY 13 H GLY 13 2.163 -2.833 -12.268 749 HA2 GLY 13 HA2 GLY 13 3.234 -1.099 -14.197 750 HA3 GLY 13 HA3 GLY 13 2.431 -2.624 -14.537 751 H GLN 14 H GLN 14 -0.130 -2.016 -13.599 752 HA GLN 14 HA GLN 14 -1.221 -0.765 -15.945 753 HB2 GLN 14 HB2 GLN 14 -2.664 -1.710 -13.426 754 HB3 GLN 14 HB3 GLN 14 -3.394 -1.431 -15.012 755 HG2 GLN 14 HG2 GLN 14 -2.064 -3.274 -15.960 756 HG3 GLN 14 HG3 GLN 14 -1.277 -3.520 -14.404 757 HE21 GLN 14 HE21 GLN 14 -4.193 -4.036 -16.238 758 HE22 GLN 14 HE22 GLN 14 -4.947 -5.093 -15.104 759 H ILE 15 H ILE 15 -0.928 0.197 -12.539 760 HA ILE 15 HA ILE 15 -2.472 2.604 -12.697 761 HB ILE 15 HB ILE 15 -0.448 1.595 -10.655 762 HG12 ILE 15 HG12 ILE 15 -3.480 1.923 -10.512 763 HG13 ILE 15 HG13 ILE 15 -2.630 0.401 -10.752 764 HG21 ILE 15 HG21 ILE 15 -1.126 3.433 -9.130 765 HG22 ILE 15 HG22 ILE 15 -2.048 4.168 -10.440 766 HG23 ILE 15 HG23 ILE 15 -0.296 4.037 -10.567 767 HD11 ILE 15 HD11 ILE 15 -2.531 2.119 -8.266 768 HD12 ILE 15 HD12 ILE 15 -1.653 0.605 -8.505 769 HD13 ILE 15 HD13 ILE 15 -3.415 0.607 -8.474 770 H TRP 16 H TRP 16 1.037 1.962 -12.827 771 HA TRP 16 HA TRP 16 1.880 4.665 -13.023 772 HB2 TRP 16 HB2 TRP 16 3.321 2.694 -12.314 773 HB3 TRP 16 HB3 TRP 16 3.403 2.205 -14.003 774 HD1 TRP 16 HD1 TRP 16 4.819 4.759 -11.548 775 HE1 TRP 16 HE1 TRP 16 6.722 6.067 -12.681 776 HE3 TRP 16 HE3 TRP 16 4.233 3.043 -16.317 777 HZ2 TRP 16 HZ2 TRP 16 7.820 6.347 -15.280 778 HZ3 TRP 16 HZ3 TRP 16 5.722 3.879 -18.068 779 HH2 TRP 16 HH2 TRP 16 7.467 5.500 -17.578 780 H GLU 17 H GLU 17 1.418 2.157 -15.561 781 HA GLU 17 HA GLU 17 2.076 3.750 -17.801 782 HB2 GLU 17 HB2 GLU 17 0.419 1.245 -17.473 783 HB3 GLU 17 HB3 GLU 17 0.573 2.012 -19.050 784 HG2 GLU 17 HG2 GLU 17 2.966 1.135 -17.409 785 HG3 GLU 17 HG3 GLU 17 2.145 0.067 -18.548 786 H ALA 18 H ALA 18 -0.965 3.462 -16.018 787 HA ALA 18 HA ALA 18 -2.677 4.831 -17.822 788 HB1 ALA 18 HB1 ALA 18 -3.508 3.526 -15.910 789 HB2 ALA 18 HB2 ALA 18 -4.134 5.175 -15.862 790 HB3 ALA 18 HB3 ALA 18 -2.811 4.698 -14.792 791 H LEU 19 H LEU 19 -0.317 5.973 -15.487 792 HA LEU 19 HA LEU 19 -1.037 8.800 -15.801 793 HB2 LEU 19 HB2 LEU 19 1.161 7.500 -14.143 794 HB3 LEU 19 HB3 LEU 19 0.676 9.191 -14.066 795 HG LEU 19 HG LEU 19 -1.050 6.813 -13.250 796 HD11 LEU 19 HD11 LEU 19 0.781 7.205 -11.671 797 HD12 LEU 19 HD12 LEU 19 -0.773 7.618 -10.955 798 HD13 LEU 19 HD13 LEU 19 0.308 8.899 -11.511 799 HD21 LEU 19 HD21 LEU 19 -2.426 8.614 -14.147 800 HD22 LEU 19 HD22 LEU 19 -1.642 9.787 -13.086 801 HD23 LEU 19 HD23 LEU 19 -2.638 8.499 -12.403 802 H ASN 20 H ASN 20 1.128 6.559 -17.300 803 HA ASN 20 HA ASN 20 3.354 8.235 -17.842 804 HB2 ASN 20 HB2 ASN 20 3.347 5.722 -18.041 805 HB3 ASN 20 HB3 ASN 20 2.416 5.865 -19.515 806 HD21 ASN 20 HD21 ASN 20 4.775 4.536 -19.517 807 HD22 ASN 20 HD22 ASN 20 5.967 5.421 -20.393 808 H GLY 21 H GLY 21 3.546 9.921 -19.154 809 HA2 GLY 21 HA2 GLY 21 3.270 11.114 -21.217 810 HA3 GLY 21 HA3 GLY 21 1.711 10.343 -21.452 811 H THR 22 H THR 22 0.819 10.847 -18.689 812 HA THR 22 HA THR 22 -0.182 13.570 -19.016 813 HB THR 22 HB THR 22 -1.730 13.122 -17.243 814 HG1 THR 22 HG1 THR 22 -0.525 10.686 -16.505 815 HG21 THR 22 HG21 THR 22 -2.787 10.968 -17.842 816 HG22 THR 22 HG22 THR 22 -1.316 10.482 -18.687 817 HG23 THR 22 HG23 THR 22 -2.265 11.844 -19.286 818 H GLU 23 H GLU 23 -0.318 14.985 -16.945 819 HA GLU 23 HA GLU 23 2.329 15.428 -15.840 820 HB2 GLU 23 HB2 GLU 23 -0.303 16.841 -15.239 821 HB3 GLU 23 HB3 GLU 23 1.297 17.398 -14.754 822 HG2 GLU 23 HG2 GLU 23 1.902 17.638 -17.170 823 HG3 GLU 23 HG3 GLU 23 0.254 17.177 -17.599 824 H GLY 24 H GLY 24 0.124 13.181 -14.984 825 HA2 GLY 24 HA2 GLY 24 0.186 11.832 -13.039 826 HA3 GLY 24 HA3 GLY 24 0.755 13.208 -12.102 827 H LEU 25 H LEU 25 -1.601 11.319 -11.753 828 HA LEU 25 HA LEU 25 -3.799 13.313 -11.637 829 HB2 LEU 25 HB2 LEU 25 -4.049 10.402 -12.485 830 HB3 LEU 25 HB3 LEU 25 -5.393 11.509 -12.265 831 HG LEU 25 HG LEU 25 -3.212 11.846 -14.369 832 HD11 LEU 25 HD11 LEU 25 -4.574 9.881 -14.850 833 HD12 LEU 25 HD12 LEU 25 -4.896 11.166 -16.012 834 HD13 LEU 25 HD13 LEU 25 -6.051 10.840 -14.714 835 HD21 LEU 25 HD21 LEU 25 -5.810 13.380 -13.983 836 HD22 LEU 25 HD22 LEU 25 -4.680 13.580 -15.328 837 HD23 LEU 25 HD23 LEU 25 -4.179 13.995 -13.691 838 H THR 26 H THR 26 -5.628 12.599 -10.142 839 HA THR 26 HA THR 26 -4.523 11.798 -7.557 840 HB THR 26 HB THR 26 -6.783 12.292 -6.644 841 HG1 THR 26 HG1 THR 26 -8.480 12.620 -7.897 842 HG21 THR 26 HG21 THR 26 -5.195 14.167 -6.848 843 HG22 THR 26 HG22 THR 26 -6.860 14.706 -7.077 844 HG23 THR 26 HG23 THR 26 -5.799 14.507 -8.474 845 H GLN 27 H GLN 27 -5.878 10.257 -6.175 846 HA GLN 27 HA GLN 27 -5.840 7.670 -7.154 847 HB2 GLN 27 HB2 GLN 27 -7.121 7.034 -5.123 848 HB3 GLN 27 HB3 GLN 27 -5.790 8.129 -4.779 849 HG2 GLN 27 HG2 GLN 27 -7.381 10.011 -4.602 850 HG3 GLN 27 HG3 GLN 27 -8.721 8.919 -4.944 851 HE21 GLN 27 HE21 GLN 27 -7.609 6.742 -3.277 852 HE22 GLN 27 HE22 GLN 27 -7.845 7.248 -1.646 853 H LYS 28 H LYS 28 -8.599 9.894 -7.026 854 HA LYS 28 HA LYS 28 -10.669 8.171 -7.836 855 HB2 LYS 28 HB2 LYS 28 -10.952 10.452 -6.853 856 HB3 LYS 28 HB3 LYS 28 -10.352 11.162 -8.342 857 HG2 LYS 28 HG2 LYS 28 -12.765 11.354 -8.228 858 HG3 LYS 28 HG3 LYS 28 -12.312 10.281 -9.555 859 HD2 LYS 28 HD2 LYS 28 -12.840 8.313 -8.129 860 HD3 LYS 28 HD3 LYS 28 -13.303 9.397 -6.811 861 HE2 LYS 28 HE2 LYS 28 -15.275 8.553 -8.041 862 HE3 LYS 28 HE3 LYS 28 -15.133 10.305 -8.175 863 HZ1 LYS 28 HZ1 LYS 28 -14.325 8.326 -10.239 864 HZ2 LYS 28 HZ2 LYS 28 -14.126 9.997 -10.369 865 HZ3 LYS 28 HZ3 LYS 28 -15.677 9.335 -10.300 866 H GLN 29 H GLN 29 -8.481 10.214 -9.794 867 HA GLN 29 HA GLN 29 -9.615 9.520 -12.347 868 HB2 GLN 29 HB2 GLN 29 -7.022 10.917 -11.598 869 HB3 GLN 29 HB3 GLN 29 -7.572 10.720 -13.257 870 HG2 GLN 29 HG2 GLN 29 -9.167 12.195 -11.139 871 HG3 GLN 29 HG3 GLN 29 -8.006 12.979 -12.208 872 HE21 GLN 29 HE21 GLN 29 -9.585 14.288 -13.144 873 HE22 GLN 29 HE22 GLN 29 -10.783 13.677 -14.226 874 H ILE 30 H ILE 30 -6.986 8.205 -10.411 875 HA ILE 30 HA ILE 30 -5.853 6.514 -12.433 876 HB ILE 30 HB ILE 30 -5.718 6.369 -9.389 877 HG12 ILE 30 HG12 ILE 30 -3.678 7.381 -11.425 878 HG13 ILE 30 HG13 ILE 30 -4.715 8.411 -10.448 879 HG21 ILE 30 HG21 ILE 30 -5.279 4.131 -10.318 880 HG22 ILE 30 HG22 ILE 30 -3.800 4.835 -9.668 881 HG23 ILE 30 HG23 ILE 30 -4.066 4.805 -11.412 882 HD11 ILE 30 HD11 ILE 30 -2.460 8.334 -9.578 883 HD12 ILE 30 HD12 ILE 30 -2.551 6.581 -9.411 884 HD13 ILE 30 HD13 ILE 30 -3.588 7.619 -8.426 885 H LYS 31 H LYS 31 -8.127 5.905 -9.744 886 HA LYS 31 HA LYS 31 -8.834 3.242 -10.306 887 HB2 LYS 31 HB2 LYS 31 -10.375 5.486 -8.951 888 HB3 LYS 31 HB3 LYS 31 -10.971 3.829 -9.015 889 HG2 LYS 31 HG2 LYS 31 -9.194 3.022 -7.637 890 HG3 LYS 31 HG3 LYS 31 -8.272 4.516 -7.815 891 HD2 LYS 31 HD2 LYS 31 -9.292 4.406 -5.589 892 HD3 LYS 31 HD3 LYS 31 -9.977 5.742 -6.517 893 HE2 LYS 31 HE2 LYS 31 -11.782 4.666 -5.348 894 HE3 LYS 31 HE3 LYS 31 -11.949 4.241 -7.050 895 HZ1 LYS 31 HZ1 LYS 31 -12.318 2.343 -5.641 896 HZ2 LYS 31 HZ2 LYS 31 -10.803 2.530 -4.916 897 HZ3 LYS 31 HZ3 LYS 31 -10.909 2.106 -6.549 898 H LYS 32 H LYS 32 -9.874 6.232 -11.825 899 HA LYS 32 HA LYS 32 -12.067 5.233 -13.353 900 HB2 LYS 32 HB2 LYS 32 -11.744 7.633 -12.999 901 HB3 LYS 32 HB3 LYS 32 -10.169 7.580 -13.764 902 HG2 LYS 32 HG2 LYS 32 -11.671 8.605 -15.305 903 HG3 LYS 32 HG3 LYS 32 -11.301 6.995 -15.934 904 HD2 LYS 32 HD2 LYS 32 -13.473 6.168 -15.035 905 HD3 LYS 32 HD3 LYS 32 -13.832 7.792 -14.436 906 HE2 LYS 32 HE2 LYS 32 -13.481 6.983 -17.346 907 HE3 LYS 32 HE3 LYS 32 -15.000 7.390 -16.548 908 HZ1 LYS 32 HZ1 LYS 32 -12.718 9.249 -16.989 909 HZ2 LYS 32 HZ2 LYS 32 -14.169 9.642 -16.214 910 HZ3 LYS 32 HZ3 LYS 32 -14.172 9.234 -17.855 911 H ALA 33 H ALA 33 -8.628 5.821 -14.213 912 HA ALA 33 HA ALA 33 -8.819 4.896 -16.903 913 HB1 ALA 33 HB1 ALA 33 -6.382 5.186 -16.955 914 HB2 ALA 33 HB2 ALA 33 -6.345 5.313 -15.192 915 HB3 ALA 33 HB3 ALA 33 -7.160 6.550 -16.151 916 H THR 34 H THR 34 -7.799 3.303 -13.917 917 HA THR 34 HA THR 34 -6.989 0.825 -15.281 918 HB THR 34 HB THR 34 -6.254 0.055 -13.040 919 HG1 THR 34 HG1 THR 34 -6.559 2.433 -11.722 920 HG21 THR 34 HG21 THR 34 -4.459 1.699 -12.629 921 HG22 THR 34 HG22 THR 34 -5.293 2.887 -13.633 922 HG23 THR 34 HG23 THR 34 -4.650 1.410 -14.360 923 H LYS 35 H LYS 35 -9.759 2.144 -13.816 924 HA LYS 35 HA LYS 35 -11.861 1.441 -13.440 925 HB2 LYS 35 HB2 LYS 35 -11.088 -1.243 -14.655 926 HB3 LYS 35 HB3 LYS 35 -12.730 -0.661 -14.376 927 HG2 LYS 35 HG2 LYS 35 -12.285 1.197 -16.012 928 HG3 LYS 35 HG3 LYS 35 -10.711 0.470 -16.354 929 HD2 LYS 35 HD2 LYS 35 -13.458 -0.732 -16.882 930 HD3 LYS 35 HD3 LYS 35 -12.280 -0.197 -18.083 931 HE2 LYS 35 HE2 LYS 35 -11.968 -2.554 -16.187 932 HE3 LYS 35 HE3 LYS 35 -12.301 -2.644 -17.913 933 HZ1 LYS 35 HZ1 LYS 35 -9.989 -3.069 -17.459 934 HZ2 LYS 35 HZ2 LYS 35 -9.816 -1.585 -16.671 935 HZ3 LYS 35 HZ3 LYS 35 -10.135 -1.626 -18.331 936 H LEU 36 H LEU 36 -9.556 0.892 -11.557 937 HA LEU 36 HA LEU 36 -10.324 -1.411 -9.962 938 HB2 LEU 36 HB2 LEU 36 -8.371 0.847 -9.360 939 HB3 LEU 36 HB3 LEU 36 -8.628 -0.538 -8.307 940 HG LEU 36 HG LEU 36 -7.464 -0.616 -11.123 941 HD11 LEU 36 HD11 LEU 36 -5.378 -1.311 -10.008 942 HD12 LEU 36 HD12 LEU 36 -6.144 -1.097 -8.431 943 HD13 LEU 36 HD13 LEU 36 -5.896 0.293 -9.492 944 HD21 LEU 36 HD21 LEU 36 -7.075 -3.021 -10.743 945 HD22 LEU 36 HD22 LEU 36 -8.793 -2.635 -10.729 946 HD23 LEU 36 HD23 LEU 36 -7.945 -2.929 -9.208 947 H LYS 37 H LYS 37 -12.541 -0.916 -9.611 948 HA LYS 37 HA LYS 37 -13.496 1.430 -8.328 949 HB2 LYS 37 HB2 LYS 37 -14.762 -1.319 -8.654 950 HB3 LYS 37 HB3 LYS 37 -15.618 0.085 -8.014 951 HG2 LYS 37 HG2 LYS 37 -15.362 1.274 -10.129 952 HG3 LYS 37 HG3 LYS 37 -14.364 -0.028 -10.787 953 HD2 LYS 37 HD2 LYS 37 -17.286 -0.317 -9.961 954 HD3 LYS 37 HD3 LYS 37 -16.730 -0.065 -11.618 955 HE2 LYS 37 HE2 LYS 37 -15.494 -2.204 -11.527 956 HE3 LYS 37 HE3 LYS 37 -16.021 -2.442 -9.861 957 HZ1 LYS 37 HZ1 LYS 37 -18.308 -2.487 -10.663 958 HZ2 LYS 37 HZ2 LYS 37 -17.366 -3.706 -11.364 959 HZ3 LYS 37 HZ3 LYS 37 -17.765 -2.333 -12.257 960 H ALA 38 H ALA 38 -11.997 -1.429 -7.002 961 HA ALA 38 HA ALA 38 -12.866 -0.845 -4.261 962 HB1 ALA 38 HB1 ALA 38 -10.887 -2.924 -5.254 963 HB2 ALA 38 HB2 ALA 38 -12.595 -3.208 -4.915 964 HB3 ALA 38 HB3 ALA 38 -11.497 -2.773 -3.598 965 H ASP 39 H ASP 39 -11.682 0.256 -2.825 966 HA ASP 39 HA ASP 39 -9.541 1.965 -3.541 967 HB2 ASP 39 HB2 ASP 39 -9.521 2.573 -1.139 968 HB3 ASP 39 HB3 ASP 39 -11.162 2.521 -1.772 969 H LYS 40 H LYS 40 -9.654 -1.173 -2.047 970 HA LYS 40 HA LYS 40 -7.183 -1.409 -0.794 971 HB2 LYS 40 HB2 LYS 40 -8.742 -3.630 -2.178 972 HB3 LYS 40 HB3 LYS 40 -7.596 -3.821 -0.848 973 HG2 LYS 40 HG2 LYS 40 -10.170 -2.224 -0.626 974 HG3 LYS 40 HG3 LYS 40 -10.053 -3.949 -0.229 975 HD2 LYS 40 HD2 LYS 40 -8.322 -3.367 1.499 976 HD3 LYS 40 HD3 LYS 40 -8.565 -1.656 1.116 977 HE2 LYS 40 HE2 LYS 40 -10.730 -3.534 2.126 978 HE3 LYS 40 HE3 LYS 40 -9.842 -2.385 3.130 979 HZ1 LYS 40 HZ1 LYS 40 -11.610 -1.703 0.833 980 HZ2 LYS 40 HZ2 LYS 40 -10.757 -0.589 1.765 981 HZ3 LYS 40 HZ3 LYS 40 -11.993 -1.505 2.473 982 H ASP 41 H ASP 41 -8.031 -2.268 -4.161 983 HA ASP 41 HA ASP 41 -5.573 -3.489 -4.901 984 HB2 ASP 41 HB2 ASP 41 -7.775 -2.234 -6.592 985 HB3 ASP 41 HB3 ASP 41 -6.430 -3.156 -7.265 986 H PHE 42 H PHE 42 -6.725 -0.153 -4.982 987 HA PHE 42 HA PHE 42 -4.650 0.984 -6.540 988 HB2 PHE 42 HB2 PHE 42 -6.702 2.247 -6.184 989 HB3 PHE 42 HB3 PHE 42 -6.458 2.250 -4.439 990 HD1 PHE 42 HD2 PHE 42 -4.760 3.347 -7.605 991 HD2 PHE 42 HD1 PHE 42 -5.418 4.132 -3.449 992 HE1 PHE 42 HE2 PHE 42 -3.476 5.424 -7.782 993 HE2 PHE 42 HE1 PHE 42 -4.120 6.209 -3.648 994 HZ PHE 42 HZ PHE 42 -3.152 6.858 -5.816 995 H PHE 43 H PHE 43 -4.992 0.578 -2.982 996 HA PHE 43 HA PHE 43 -2.707 2.091 -2.237 997 HB2 PHE 43 HB2 PHE 43 -4.017 -0.173 -0.669 998 HB3 PHE 43 HB3 PHE 43 -2.942 1.055 -0.003 999 HD1 PHE 43 HD1 PHE 43 -3.958 3.549 -1.204 1000 HD2 PHE 43 HD2 PHE 43 -6.099 0.188 0.352 1001 HE1 PHE 43 HE1 PHE 43 -5.880 4.997 -0.734 1002 HE2 PHE 43 HE2 PHE 43 -8.026 1.625 0.815 1003 HZ PHE 43 HZ PHE 43 -7.924 4.038 0.282 1004 H LEU 44 H LEU 44 -3.108 -1.388 -2.813 1005 HA LEU 44 HA LEU 44 -0.471 -2.166 -2.058 1006 HB2 LEU 44 HB2 LEU 44 -2.732 -3.504 -3.540 1007 HB3 LEU 44 HB3 LEU 44 -1.153 -4.266 -3.526 1008 HG LEU 44 HG LEU 44 -1.209 -4.358 -1.036 1009 HD11 LEU 44 HD11 LEU 44 -4.048 -3.313 -1.223 1010 HD12 LEU 44 HD12 LEU 44 -2.666 -2.446 -0.551 1011 HD13 LEU 44 HD13 LEU 44 -3.245 -3.913 0.232 1012 HD21 LEU 44 HD21 LEU 44 -2.858 -6.154 -0.822 1013 HD22 LEU 44 HD22 LEU 44 -1.962 -6.292 -2.332 1014 HD23 LEU 44 HD23 LEU 44 -3.611 -5.663 -2.343 1015 H GLY 45 H GLY 45 -1.963 -1.492 -5.261 1016 HA2 GLY 45 HA2 GLY 45 0.300 -1.950 -6.895 1017 HA3 GLY 45 HA3 GLY 45 -1.041 -0.882 -7.286 1018 H LEU 46 H LEU 46 -0.849 1.045 -5.369 1019 HA LEU 46 HA LEU 46 1.127 2.846 -6.288 1020 HB2 LEU 46 HB2 LEU 46 -0.980 3.627 -5.366 1021 HB3 LEU 46 HB3 LEU 46 -0.655 2.854 -3.826 1022 HG LEU 46 HG LEU 46 1.208 4.480 -3.423 1023 HD11 LEU 46 HD11 LEU 46 0.271 5.828 -5.969 1024 HD12 LEU 46 HD12 LEU 46 1.820 5.017 -5.719 1025 HD13 LEU 46 HD13 LEU 46 1.439 6.481 -4.817 1026 HD21 LEU 46 HD21 LEU 46 -0.211 6.400 -2.894 1027 HD22 LEU 46 HD22 LEU 46 -1.039 4.892 -2.507 1028 HD23 LEU 46 HD23 LEU 46 -1.475 5.790 -3.965 1029 H GLY 47 H GLY 47 1.005 0.725 -3.469 1030 HA2 GLY 47 HA2 GLY 47 3.224 1.679 -1.995 1031 HA3 GLY 47 HA3 GLY 47 2.548 0.057 -1.899 1032 H TRP 48 H TRP 48 2.971 -0.547 -4.691 1033 HA TRP 48 HA TRP 48 5.709 -1.431 -4.659 1034 HB2 TRP 48 HB2 TRP 48 3.592 -2.619 -5.651 1035 HB3 TRP 48 HB3 TRP 48 3.863 -1.601 -7.060 1036 HD1 TRP 48 HD1 TRP 48 6.289 -2.020 -8.380 1037 HE1 TRP 48 HE1 TRP 48 7.704 -4.155 -8.560 1038 HE3 TRP 48 HE3 TRP 48 4.230 -4.670 -4.533 1039 HZ2 TRP 48 HZ2 TRP 48 7.914 -6.628 -7.250 1040 HZ3 TRP 48 HZ3 TRP 48 5.078 -6.928 -4.063 1041 HH2 TRP 48 HH2 TRP 48 6.879 -7.898 -5.394 1042 H LEU 49 H LEU 49 3.908 1.155 -6.302 1043 HA LEU 49 HA LEU 49 5.946 2.099 -8.037 1044 HB2 LEU 49 HB2 LEU 49 3.545 3.386 -6.738 1045 HB3 LEU 49 HB3 LEU 49 4.691 4.410 -7.567 1046 HG LEU 49 HG LEU 49 4.203 3.454 -9.702 1047 HD11 LEU 49 HD11 LEU 49 2.630 1.319 -8.281 1048 HD12 LEU 49 HD12 LEU 49 4.177 1.125 -9.117 1049 HD13 LEU 49 HD13 LEU 49 2.731 1.540 -10.034 1050 HD21 LEU 49 HD21 LEU 49 2.483 5.036 -8.882 1051 HD22 LEU 49 HD22 LEU 49 1.560 3.686 -8.218 1052 HD23 LEU 49 HD23 LEU 49 1.797 3.824 -9.962 1053 H LEU 50 H LEU 50 5.436 2.511 -4.609 1054 HA LEU 50 HA LEU 50 7.310 4.598 -4.144 1055 HB2 LEU 50 HB2 LEU 50 6.328 2.543 -2.139 1056 HB3 LEU 50 HB3 LEU 50 7.050 4.105 -1.773 1057 HG LEU 50 HG LEU 50 4.305 3.580 -2.983 1058 HD11 LEU 50 HD11 LEU 50 4.400 3.274 -0.571 1059 HD12 LEU 50 HD12 LEU 50 3.432 4.685 -0.990 1060 HD13 LEU 50 HD13 LEU 50 5.071 4.895 -0.365 1061 HD21 LEU 50 HD21 LEU 50 5.236 5.504 -4.138 1062 HD22 LEU 50 HD22 LEU 50 5.640 6.276 -2.604 1063 HD23 LEU 50 HD23 LEU 50 3.952 6.012 -3.046 1064 H ARG 51 H ARG 51 7.702 1.004 -4.201 1065 HA ARG 51 HA ARG 51 10.219 0.904 -2.913 1066 HB2 ARG 51 HB2 ARG 51 10.544 -1.343 -3.710 1067 HB3 ARG 51 HB3 ARG 51 8.860 -1.145 -3.284 1068 HG2 ARG 51 HG2 ARG 51 8.128 -1.305 -5.512 1069 HG3 ARG 51 HG3 ARG 51 9.711 -0.890 -6.162 1070 HD2 ARG 51 HD2 ARG 51 9.201 -3.252 -6.526 1071 HD3 ARG 51 HD3 ARG 51 10.591 -3.064 -5.448 1072 HE ARG 51 HE ARG 51 7.992 -3.438 -4.184 1073 HH11 ARG 51 HH11 ARG 51 10.913 -4.970 -5.237 1074 HH12 ARG 51 HH12 ARG 51 10.687 -6.327 -4.185 1075 HH21 ARG 51 HH21 ARG 51 7.728 -5.216 -2.902 1076 HH22 ARG 51 HH22 ARG 51 8.927 -6.459 -2.911 1077 H GLU 52 H GLU 52 9.464 1.530 -6.287 1078 HA GLU 52 HA GLU 52 12.309 1.452 -7.051 1079 HB2 GLU 52 HB2 GLU 52 9.801 1.804 -8.763 1080 HB3 GLU 52 HB3 GLU 52 11.448 1.651 -9.383 1081 HG2 GLU 52 HG2 GLU 52 11.601 -0.613 -8.403 1082 HG3 GLU 52 HG3 GLU 52 9.957 -0.463 -7.793 1083 H ASP 53 H ASP 53 10.047 3.689 -5.909 1084 HA ASP 53 HA ASP 53 10.032 5.910 -5.570 1085 HB2 ASP 53 HB2 ASP 53 12.947 5.685 -6.450 1086 HB3 ASP 53 HB3 ASP 53 12.239 7.204 -5.898 1087 H LYS 54 H LYS 54 9.123 4.788 -8.044 1088 HA LYS 54 HA LYS 54 10.021 6.450 -10.263 1089 HB2 LYS 54 HB2 LYS 54 8.634 4.951 -11.627 1090 HB3 LYS 54 HB3 LYS 54 9.672 4.032 -10.540 1091 HG2 LYS 54 HG2 LYS 54 7.581 3.951 -8.971 1092 HG3 LYS 54 HG3 LYS 54 6.670 4.416 -10.412 1093 HD2 LYS 54 HD2 LYS 54 8.338 1.905 -9.989 1094 HD3 LYS 54 HD3 LYS 54 6.589 2.004 -10.190 1095 HE2 LYS 54 HE2 LYS 54 6.901 2.719 -12.538 1096 HE3 LYS 54 HE3 LYS 54 8.650 2.660 -12.336 1097 HZ1 LYS 54 HZ1 LYS 54 8.430 0.275 -11.858 1098 HZ2 LYS 54 HZ2 LYS 54 7.877 0.686 -13.409 1099 HZ3 LYS 54 HZ3 LYS 54 6.771 0.372 -12.182 1100 H VAL 55 H VAL 55 7.781 6.880 -7.823 1101 HA VAL 55 HA VAL 55 6.268 8.885 -9.403 1102 HB VAL 55 HB VAL 55 4.199 8.432 -8.150 1103 HG11 VAL 55 HG11 VAL 55 4.530 7.303 -10.309 1104 HG12 VAL 55 HG12 VAL 55 3.548 6.329 -9.218 1105 HG13 VAL 55 HG13 VAL 55 5.243 5.912 -9.487 1106 HG21 VAL 55 HG21 VAL 55 3.953 6.432 -6.696 1107 HG22 VAL 55 HG22 VAL 55 5.145 7.558 -6.048 1108 HG23 VAL 55 HG23 VAL 55 5.679 6.091 -6.872 1109 H VAL 56 H VAL 56 5.497 10.697 -8.253 1110 HA VAL 56 HA VAL 56 6.499 11.153 -5.515 1111 HB VAL 56 HB VAL 56 5.559 13.203 -7.571 1112 HG11 VAL 56 HG11 VAL 56 6.384 14.921 -5.985 1113 HG12 VAL 56 HG12 VAL 56 6.778 13.664 -4.813 1114 HG13 VAL 56 HG13 VAL 56 5.095 13.957 -5.256 1115 HG21 VAL 56 HG21 VAL 56 7.933 13.908 -7.699 1116 HG22 VAL 56 HG22 VAL 56 7.726 12.234 -8.218 1117 HG23 VAL 56 HG23 VAL 56 8.384 12.586 -6.617 1118 H THR 57 H THR 57 5.013 11.100 -3.908 1119 HA THR 57 HA THR 57 2.120 11.166 -4.582 1120 HB THR 57 HB THR 57 1.761 10.064 -2.365 1121 HG1 THR 57 HG1 THR 57 4.089 10.898 -1.723 1122 HG21 THR 57 HG21 THR 57 2.677 7.836 -2.940 1123 HG22 THR 57 HG22 THR 57 3.725 8.580 -4.151 1124 HG23 THR 57 HG23 THR 57 1.970 8.629 -4.352 1125 H SER 58 H SER 58 0.840 12.735 -3.739 1126 HA SER 58 HA SER 58 1.808 14.535 -1.625 1127 HB2 SER 58 HB2 SER 58 1.224 16.556 -2.993 1128 HB3 SER 58 HB3 SER 58 2.537 15.627 -3.715 1129 HG SER 58 HG SER 58 0.640 14.581 -4.906 1130 H GLU 59 H GLU 59 0.070 16.027 -0.902 1131 HA GLU 59 HA GLU 59 -2.487 14.538 -0.664 1132 HB2 GLU 59 HB2 GLU 59 -1.055 14.850 1.388 1133 HB3 GLU 59 HB3 GLU 59 -1.225 16.590 1.216 1134 HG2 GLU 59 HG2 GLU 59 -3.727 16.274 1.491 1135 HG3 GLU 59 HG3 GLU 59 -3.401 14.583 1.872 1136 H VAL 60 H VAL 60 -3.925 15.448 -2.122 1137 HA VAL 60 HA VAL 60 -4.300 18.409 -2.037 1138 HB VAL 60 HB VAL 60 -4.809 16.538 -4.402 1139 HG11 VAL 60 HG11 VAL 60 -5.408 19.526 -4.188 1140 HG12 VAL 60 HG12 VAL 60 -6.612 18.240 -4.297 1141 HG13 VAL 60 HG13 VAL 60 -5.538 18.555 -5.659 1142 HG21 VAL 60 HG21 VAL 60 -3.100 17.933 -5.541 1143 HG22 VAL 60 HG22 VAL 60 -2.438 17.150 -4.103 1144 HG23 VAL 60 HG23 VAL 60 -2.878 18.862 -4.052 1145 H GLU 61 H GLU 61 -5.880 18.760 -0.716 1146 HA GLU 61 HA GLU 61 -7.826 18.771 0.430 1147 HB2 GLU 61 HB2 GLU 61 -9.007 18.107 -2.294 1148 HB3 GLU 61 HB3 GLU 61 -9.789 19.006 -0.987 1149 HG2 GLU 61 HG2 GLU 61 -7.939 20.753 -1.251 1150 HG3 GLU 61 HG3 GLU 61 -7.424 19.877 -2.685 1151 H GLY 62 H GLY 62 -6.572 16.316 0.774 1152 HA2 GLY 62 HA2 GLY 62 -7.222 14.460 2.084 1153 HA3 GLY 62 HA3 GLY 62 -8.835 14.548 1.410 1154 H GLU 63 H GLU 63 -7.477 14.714 -1.367 1155 HA GLU 63 HA GLU 63 -7.536 11.851 -1.879 1156 HB2 GLU 63 HB2 GLU 63 -7.339 14.245 -3.748 1157 HB3 GLU 63 HB3 GLU 63 -7.254 12.574 -4.316 1158 HG2 GLU 63 HG2 GLU 63 -9.509 12.176 -3.267 1159 HG3 GLU 63 HG3 GLU 63 -9.595 13.909 -2.927 1160 H ILE 64 H ILE 64 -5.959 10.573 -2.547 1161 HA ILE 64 HA ILE 64 -3.186 11.210 -2.255 1162 HB ILE 64 HB ILE 64 -4.535 8.763 -3.498 1163 HG12 ILE 64 HG12 ILE 64 -3.546 9.131 -0.631 1164 HG13 ILE 64 HG13 ILE 64 -5.233 9.216 -1.125 1165 HG21 ILE 64 HG21 ILE 64 -2.421 7.579 -3.036 1166 HG22 ILE 64 HG22 ILE 64 -1.693 9.084 -2.472 1167 HG23 ILE 64 HG23 ILE 64 -2.180 8.917 -4.160 1168 HD11 ILE 64 HD11 ILE 64 -4.706 7.070 -0.115 1169 HD12 ILE 64 HD12 ILE 64 -3.462 6.772 -1.326 1170 HD13 ILE 64 HD13 ILE 64 -5.160 6.865 -1.806 1171 H PHE 65 H PHE 65 -2.515 12.760 -3.720 1172 HA PHE 65 HA PHE 65 -3.102 12.545 -6.593 1173 HB2 PHE 65 HB2 PHE 65 -3.302 14.752 -5.470 1174 HB3 PHE 65 HB3 PHE 65 -1.597 14.699 -5.038 1175 HD1 PHE 65 HD2 PHE 65 -3.277 13.883 -8.310 1176 HD2 PHE 65 HD1 PHE 65 -0.617 16.504 -6.222 1177 HE1 PHE 65 HE2 PHE 65 -2.741 15.030 -10.414 1178 HE2 PHE 65 HE1 PHE 65 -0.099 17.645 -8.334 1179 HZ PHE 65 HZ PHE 65 -1.158 16.912 -10.429 1180 H VAL 66 H VAL 66 -1.836 11.160 -7.694 1181 HA VAL 66 HA VAL 66 0.993 10.738 -6.920 1182 HB VAL 66 HB VAL 66 -0.798 8.911 -8.578 1183 HG11 VAL 66 HG11 VAL 66 0.936 7.184 -8.153 1184 HG12 VAL 66 HG12 VAL 66 1.921 8.382 -7.314 1185 HG13 VAL 66 HG13 VAL 66 1.597 8.562 -9.039 1186 HG21 VAL 66 HG21 VAL 66 -0.104 8.689 -5.626 1187 HG22 VAL 66 HG22 VAL 66 -1.008 7.495 -6.562 1188 HG23 VAL 66 HG23 VAL 66 -1.690 9.101 -6.289 1189 H LYS 67 H LYS 67 2.418 11.759 -8.186 1190 HA LYS 67 HA LYS 67 1.957 12.059 -11.111 1191 HB2 LYS 67 HB2 LYS 67 3.898 13.548 -9.278 1192 HB3 LYS 67 HB3 LYS 67 3.669 13.851 -11.002 1193 HG2 LYS 67 HG2 LYS 67 1.361 14.580 -10.589 1194 HG3 LYS 67 HG3 LYS 67 1.537 14.228 -8.868 1195 HD2 LYS 67 HD2 LYS 67 3.108 16.333 -10.420 1196 HD3 LYS 67 HD3 LYS 67 1.723 16.653 -9.379 1197 HE2 LYS 67 HE2 LYS 67 3.503 17.174 -7.962 1198 HE3 LYS 67 HE3 LYS 67 3.205 15.499 -7.513 1199 HZ1 LYS 67 HZ1 LYS 67 5.292 16.444 -9.401 1200 HZ2 LYS 67 HZ2 LYS 67 5.032 14.836 -8.949 1201 HZ3 LYS 67 HZ3 LYS 67 5.549 15.963 -7.802 1202 H LEU 68 H LEU 68 4.025 11.765 -12.466 1203 HA LEU 68 HA LEU 68 5.585 9.472 -11.425 1204 HB2 LEU 68 HB2 LEU 68 5.478 10.526 -14.278 1205 HB3 LEU 68 HB3 LEU 68 6.238 9.034 -13.735 1206 HG LEU 68 HG LEU 68 3.269 9.648 -13.967 1207 HD11 LEU 68 HD11 LEU 68 3.243 7.671 -15.410 1208 HD12 LEU 68 HD12 LEU 68 4.980 7.461 -15.182 1209 HD13 LEU 68 HD13 LEU 68 4.361 8.893 -16.007 1210 HD21 LEU 68 HD21 LEU 68 2.814 7.402 -13.010 1211 HD22 LEU 68 HD22 LEU 68 3.488 8.528 -11.838 1212 HD23 LEU 68 HD23 LEU 68 4.513 7.275 -12.542 1213 H VAL 69 H VAL 69 7.788 9.564 -11.101 1214 HA VAL 69 HA VAL 69 9.225 12.050 -11.224 1215 HB VAL 69 HB VAL 69 10.328 9.222 -10.862 1216 HG11 VAL 69 HG11 VAL 69 12.364 10.328 -9.943 1217 HG12 VAL 69 HG12 VAL 69 11.698 11.905 -10.372 1218 HG13 VAL 69 HG13 VAL 69 12.106 10.746 -11.640 1219 HG21 VAL 69 HG21 VAL 69 9.652 11.335 -8.776 1220 HG22 VAL 69 HG22 VAL 69 10.415 9.777 -8.449 1221 HG23 VAL 69 HG23 VAL 69 8.762 9.835 -9.063 1222 H LEU 70 H LEU 70 8.957 12.729 -13.356 1223 HA LEU 70 HA LEU 70 9.813 11.326 -15.662 1224 HB2 LEU 70 HB2 LEU 70 9.578 13.425 -16.885 1225 HB3 LEU 70 HB3 LEU 70 8.204 13.174 -15.833 1226 HG LEU 70 HG LEU 70 10.472 15.131 -15.233 1227 HD11 LEU 70 HD11 LEU 70 7.729 15.718 -16.379 1228 HD12 LEU 70 HD12 LEU 70 9.270 15.834 -17.234 1229 HD13 LEU 70 HD13 LEU 70 8.930 16.919 -15.887 1230 HD21 LEU 70 HD21 LEU 70 9.313 14.403 -13.193 1231 HD22 LEU 70 HD22 LEU 70 7.755 14.846 -13.899 1232 HD23 LEU 70 HD23 LEU 70 8.958 16.094 -13.549 1233 H GLU 71 H GLU 71 11.872 10.454 -15.264 1234 HA GLU 71 HA GLU 71 14.075 12.001 -14.309 1235 HB2 GLU 71 HB2 GLU 71 13.982 9.626 -13.824 1236 HB3 GLU 71 HB3 GLU 71 14.018 9.224 -15.535 1237 HG2 GLU 71 HG2 GLU 71 16.199 8.827 -14.461 1238 HG3 GLU 71 HG3 GLU 71 16.320 10.053 -15.722 1239 H HIS 72 H HIS 72 14.780 13.620 -15.482 1240 HA HIS 72 HA HIS 72 16.005 13.045 -18.116 1241 HB2 HIS 72 HB2 HIS 72 14.747 15.700 -17.271 1242 HB3 HIS 72 HB3 HIS 72 15.561 15.384 -18.799 1243 HD1 HIS 72 HD1 HIS 72 12.337 14.839 -16.991 1244 HD2 HIS 72 HD2 HIS 72 13.999 13.969 -20.700 1245 HE1 HIS 72 HE1 HIS 72 10.424 14.088 -18.426 1246 HE2 HIS 72 HE2 HIS 72 11.422 13.797 -20.709 1247 H HIS 73 H HIS 73 18.025 12.624 -17.158 1248 HA HIS 73 HA HIS 73 19.220 14.369 -15.213 1249 HB2 HIS 73 HB2 HIS 73 21.336 12.999 -15.716 1250 HB3 HIS 73 HB3 HIS 73 19.950 12.139 -15.070 1251 HD1 HIS 73 HD1 HIS 73 21.400 12.829 -18.552 1252 HD2 HIS 73 HD2 HIS 73 19.530 9.803 -16.403 1253 HE1 HIS 73 HE1 HIS 73 21.336 10.861 -20.092 1254 HE2 HIS 73 HE2 HIS 73 20.087 9.094 -18.828 1255 H HIS 74 H HIS 74 18.929 16.402 -16.285 1256 HA HIS 74 HA HIS 74 20.356 16.954 -18.765 1257 HB2 HIS 74 HB2 HIS 74 19.270 19.257 -18.547 1258 HB3 HIS 74 HB3 HIS 74 18.179 17.894 -18.723 1259 HD1 HIS 74 HD1 HIS 74 19.454 20.249 -16.022 1260 HD2 HIS 74 HD2 HIS 74 16.245 17.720 -16.770 1261 HE1 HIS 74 HE1 HIS 74 17.803 20.709 -14.198 1262 HE2 HIS 74 HE2 HIS 74 15.987 19.011 -14.545 1263 H HIS 75 H HIS 75 22.515 16.633 -17.914 1264 HA HIS 75 HA HIS 75 23.714 18.627 -16.200 1265 HB2 HIS 75 HB2 HIS 75 24.932 16.573 -18.096 1266 HB3 HIS 75 HB3 HIS 75 25.909 17.677 -17.133 1267 HD1 HIS 75 HD1 HIS 75 24.470 14.376 -17.010 1268 HD2 HIS 75 HD2 HIS 75 25.370 17.318 -14.216 1269 HE1 HIS 75 HE1 HIS 75 24.508 13.210 -14.795 1270 HE2 HIS 75 HE2 HIS 75 24.884 15.030 -13.115 1271 H HIS 76 H HIS 76 22.939 18.424 -19.581 1272 HA HIS 76 HA HIS 76 22.921 19.895 -21.287 1273 HB2 HIS 76 HB2 HIS 76 21.887 21.303 -19.408 1274 HB3 HIS 76 HB3 HIS 76 23.458 22.068 -19.221 1275 HD1 HIS 76 HD1 HIS 76 20.990 21.468 -22.076 1276 HD2 HIS 76 HD2 HIS 76 23.604 24.378 -20.662 1277 HE1 HIS 76 HE1 HIS 76 20.714 23.426 -23.619 1278 HE2 HIS 76 HE2 HIS 76 22.168 25.221 -22.633 1279 H HIS 77 H HIS 77 25.356 18.583 -20.762 1280 HA HIS 77 HA HIS 77 27.402 20.510 -21.711 1281 HB2 HIS 77 HB2 HIS 77 27.722 19.593 -19.342 1282 HB3 HIS 77 HB3 HIS 77 27.923 17.998 -20.055 1283 HD1 HIS 77 HD1 HIS 77 29.679 21.189 -19.411 1284 HD2 HIS 77 HD2 HIS 77 30.395 17.678 -21.515 1285 HE1 HIS 77 HE1 HIS 77 32.132 21.206 -19.922 1286 HE2 HIS 77 HE2 HIS 77 32.499 19.179 -21.363 Start of MODEL 9 1 H1 MET 1 H1 MET 1 10.631 16.457 6.061 2 H2 MET 1 H2 MET 1 12.054 15.580 5.813 3 H3 MET 1 H3 MET 1 10.568 14.780 5.849 4 HA MET 1 HA MET 1 11.434 16.748 3.816 5 HB2 MET 1 HB2 MET 1 11.077 13.731 3.636 6 HB3 MET 1 HB3 MET 1 11.429 14.776 2.265 7 HG2 MET 1 HG2 MET 1 13.587 15.371 3.236 8 HG3 MET 1 HG3 MET 1 13.233 14.399 4.668 9 HE1 MET 1 HE1 MET 1 16.019 12.266 2.931 10 HE2 MET 1 HE2 MET 1 15.502 13.047 4.425 11 HE3 MET 1 HE3 MET 1 15.928 14.025 3.018 12 H LYS 2 H LYS 2 8.746 15.499 5.469 13 HA LYS 2 HA LYS 2 6.502 15.739 5.302 14 HB2 LYS 2 HB2 LYS 2 7.308 18.109 4.646 15 HB3 LYS 2 HB3 LYS 2 6.967 17.664 2.985 16 HG2 LYS 2 HG2 LYS 2 5.118 18.950 3.801 17 HG3 LYS 2 HG3 LYS 2 4.567 17.279 3.641 18 HD2 LYS 2 HD2 LYS 2 4.837 16.950 6.084 19 HD3 LYS 2 HD3 LYS 2 5.436 18.604 6.247 20 HE2 LYS 2 HE2 LYS 2 3.228 19.436 5.414 21 HE3 LYS 2 HE3 LYS 2 2.648 17.767 5.380 22 HZ1 LYS 2 HZ1 LYS 2 3.001 17.630 7.755 23 HZ2 LYS 2 HZ2 LYS 2 1.992 18.940 7.392 24 HZ3 LYS 2 HZ3 LYS 2 3.611 19.206 7.794 25 H MET 3 H MET 3 7.990 13.777 3.481 26 HA MET 3 HA MET 3 6.315 13.553 1.088 27 HB2 MET 3 HB2 MET 3 8.974 13.270 1.353 28 HB3 MET 3 HB3 MET 3 8.552 11.618 1.759 29 HG2 MET 3 HG2 MET 3 7.848 13.019 -0.833 30 HG3 MET 3 HG3 MET 3 9.202 11.916 -0.606 31 HE1 MET 3 HE1 MET 3 6.891 9.703 -2.825 32 HE2 MET 3 HE2 MET 3 8.519 10.340 -2.588 33 HE3 MET 3 HE3 MET 3 7.188 11.434 -2.990 34 H LEU 4 H LEU 4 5.010 11.771 0.615 35 HA LEU 4 HA LEU 4 3.625 10.324 2.550 36 HB2 LEU 4 HB2 LEU 4 2.934 10.646 0.157 37 HB3 LEU 4 HB3 LEU 4 4.135 9.462 -0.324 38 HG LEU 4 HG LEU 4 2.878 7.732 1.048 39 HD11 LEU 4 HD11 LEU 4 0.562 8.184 1.707 40 HD12 LEU 4 HD12 LEU 4 0.743 9.877 1.243 41 HD13 LEU 4 HD13 LEU 4 1.691 9.221 2.579 42 HD21 LEU 4 HD21 LEU 4 2.607 7.847 -1.390 43 HD22 LEU 4 HD22 LEU 4 1.299 9.018 -1.208 44 HD23 LEU 4 HD23 LEU 4 1.101 7.369 -0.607 45 H LYS 5 H LYS 5 6.663 9.535 1.003 46 HA LYS 5 HA LYS 5 6.976 6.830 1.768 47 HB2 LYS 5 HB2 LYS 5 8.304 7.909 -0.008 48 HB3 LYS 5 HB3 LYS 5 9.049 8.981 1.175 49 HG2 LYS 5 HG2 LYS 5 10.129 7.066 2.258 50 HG3 LYS 5 HG3 LYS 5 9.356 5.963 1.122 51 HD2 LYS 5 HD2 LYS 5 11.325 8.147 0.335 52 HD3 LYS 5 HD3 LYS 5 11.763 6.459 0.618 53 HE2 LYS 5 HE2 LYS 5 10.190 5.790 -1.224 54 HE3 LYS 5 HE3 LYS 5 9.896 7.505 -1.544 55 HZ1 LYS 5 HZ1 LYS 5 11.581 6.511 -2.986 56 HZ2 LYS 5 HZ2 LYS 5 12.556 6.206 -1.643 57 HZ3 LYS 5 HZ3 LYS 5 12.183 7.800 -2.077 58 H GLU 6 H GLU 6 7.847 9.873 3.393 59 HA GLU 6 HA GLU 6 9.528 8.889 5.421 60 HB2 GLU 6 HB2 GLU 6 7.720 11.342 5.479 61 HB3 GLU 6 HB3 GLU 6 9.029 11.026 6.620 62 HG2 GLU 6 HG2 GLU 6 9.366 11.437 3.632 63 HG3 GLU 6 HG3 GLU 6 9.629 12.666 4.867 64 H LYS 7 H LYS 7 6.036 9.689 5.583 65 HA LYS 7 HA LYS 7 5.597 8.718 8.217 66 HB2 LYS 7 HB2 LYS 7 3.212 8.904 7.732 67 HB3 LYS 7 HB3 LYS 7 4.068 10.319 7.129 68 HG2 LYS 7 HG2 LYS 7 3.927 9.536 4.855 69 HG3 LYS 7 HG3 LYS 7 3.311 7.968 5.366 70 HD2 LYS 7 HD2 LYS 7 1.858 10.611 5.615 71 HD3 LYS 7 HD3 LYS 7 1.572 9.374 4.396 72 HE2 LYS 7 HE2 LYS 7 -0.163 9.016 5.934 73 HE3 LYS 7 HE3 LYS 7 1.033 7.814 6.399 74 HZ1 LYS 7 HZ1 LYS 7 0.044 9.000 8.281 75 HZ2 LYS 7 HZ2 LYS 7 0.707 10.453 7.715 76 HZ3 LYS 7 HZ3 LYS 7 1.720 9.198 8.212 77 H ALA 8 H ALA 8 5.232 7.175 5.011 78 HA ALA 8 HA ALA 8 3.888 4.829 5.827 79 HB1 ALA 8 HB1 ALA 8 5.679 5.229 3.403 80 HB2 ALA 8 HB2 ALA 8 3.954 5.588 3.487 81 HB3 ALA 8 HB3 ALA 8 4.510 3.919 3.618 82 H GLY 9 H GLY 9 7.287 5.669 5.660 83 HA2 GLY 9 HA2 GLY 9 8.421 3.077 6.190 84 HA3 GLY 9 HA3 GLY 9 9.240 4.624 6.304 85 H ALA 10 H ALA 10 7.429 5.790 8.222 86 HA ALA 10 HA ALA 10 8.464 4.774 10.702 87 HB1 ALA 10 HB1 ALA 10 6.320 6.865 10.193 88 HB2 ALA 10 HB2 ALA 10 8.050 7.176 10.338 89 HB3 ALA 10 HB3 ALA 10 7.147 6.583 11.733 90 H LEU 11 H LEU 11 5.278 4.686 9.102 91 HA LEU 11 HA LEU 11 3.823 3.230 11.059 92 HB2 LEU 11 HB2 LEU 11 3.411 3.334 8.040 93 HB3 LEU 11 HB3 LEU 11 2.237 2.718 9.198 94 HG LEU 11 HG LEU 11 3.181 5.608 8.992 95 HD11 LEU 11 HD11 LEU 11 0.507 4.405 8.245 96 HD12 LEU 11 HD12 LEU 11 1.745 4.981 7.124 97 HD13 LEU 11 HD13 LEU 11 0.934 6.119 8.197 98 HD21 LEU 11 HD21 LEU 11 1.440 6.129 10.649 99 HD22 LEU 11 HD22 LEU 11 2.669 5.054 11.308 100 HD23 LEU 11 HD23 LEU 11 1.096 4.406 10.834 101 H ALA 12 H ALA 12 5.835 2.273 8.314 102 HA ALA 12 HA ALA 12 5.521 -0.507 8.326 103 HB1 ALA 12 HB1 ALA 12 8.050 1.067 7.715 104 HB2 ALA 12 HB2 ALA 12 6.741 0.735 6.581 105 HB3 ALA 12 HB3 ALA 12 7.709 -0.599 7.214 106 H GLY 13 H GLY 13 7.826 1.504 10.172 107 HA2 GLY 13 HA2 GLY 13 9.189 -0.494 11.597 108 HA3 GLY 13 HA3 GLY 13 8.976 1.168 12.124 109 H GLN 14 H GLN 14 6.168 1.204 12.408 110 HA GLN 14 HA GLN 14 5.813 0.120 15.032 111 HB2 GLN 14 HB2 GLN 14 3.806 1.371 13.108 112 HB3 GLN 14 HB3 GLN 14 3.484 1.036 14.810 113 HG2 GLN 14 HG2 GLN 14 5.225 2.633 15.475 114 HG3 GLN 14 HG3 GLN 14 5.623 2.932 13.785 115 HE21 GLN 14 HE21 GLN 14 4.261 4.228 12.561 116 HE22 GLN 14 HE22 GLN 14 3.006 5.184 13.258 117 H ILE 15 H ILE 15 4.441 -0.744 11.860 118 HA ILE 15 HA ILE 15 2.707 -2.831 12.756 119 HB ILE 15 HB ILE 15 3.759 -2.107 9.987 120 HG12 ILE 15 HG12 ILE 15 1.047 -1.668 11.324 121 HG13 ILE 15 HG13 ILE 15 2.268 -0.432 11.048 122 HG21 ILE 15 HG21 ILE 15 2.044 -3.578 8.998 123 HG22 ILE 15 HG22 ILE 15 1.594 -4.155 10.600 124 HG23 ILE 15 HG23 ILE 15 3.196 -4.511 9.957 125 HD11 ILE 15 HD11 ILE 15 1.958 -0.722 8.620 126 HD12 ILE 15 HD12 ILE 15 0.489 -0.228 9.454 127 HD13 ILE 15 HD13 ILE 15 0.688 -1.903 8.943 128 H TRP 16 H TRP 16 6.000 -2.856 11.407 129 HA TRP 16 HA TRP 16 6.414 -5.650 11.429 130 HB2 TRP 16 HB2 TRP 16 7.923 -3.999 10.269 131 HB3 TRP 16 HB3 TRP 16 8.540 -3.490 11.841 132 HD1 TRP 16 HD1 TRP 16 8.597 -6.490 9.429 133 HE1 TRP 16 HE1 TRP 16 10.541 -8.045 10.077 134 HE3 TRP 16 HE3 TRP 16 10.078 -4.187 13.741 135 HZ2 TRP 16 HZ2 TRP 16 12.440 -8.283 12.143 136 HZ3 TRP 16 HZ3 TRP 16 11.954 -5.139 15.008 137 HH2 TRP 16 HH2 TRP 16 13.119 -7.150 14.223 138 H GLU 17 H GLU 17 7.126 -3.178 13.945 139 HA GLU 17 HA GLU 17 8.108 -4.944 15.927 140 HB2 GLU 17 HB2 GLU 17 6.917 -2.170 16.039 141 HB3 GLU 17 HB3 GLU 17 7.333 -3.010 17.529 142 HG2 GLU 17 HG2 GLU 17 9.338 -2.523 15.302 143 HG3 GLU 17 HG3 GLU 17 9.060 -1.381 16.613 144 H ALA 18 H ALA 18 4.788 -4.161 15.026 145 HA ALA 18 HA ALA 18 3.454 -5.389 17.226 146 HB1 ALA 18 HB1 ALA 18 2.527 -5.099 14.348 147 HB2 ALA 18 HB2 ALA 18 2.296 -3.913 15.632 148 HB3 ALA 18 HB3 ALA 18 1.494 -5.482 15.730 149 H LEU 19 H LEU 19 4.572 -6.622 14.086 150 HA LEU 19 HA LEU 19 3.784 -9.366 14.483 151 HB2 LEU 19 HB2 LEU 19 5.605 -7.985 12.487 152 HB3 LEU 19 HB3 LEU 19 5.253 -9.705 12.419 153 HG LEU 19 HG LEU 19 3.076 -7.584 12.251 154 HD11 LEU 19 HD11 LEU 19 4.614 -7.236 10.377 155 HD12 LEU 19 HD12 LEU 19 3.079 -7.894 9.818 156 HD13 LEU 19 HD13 LEU 19 4.496 -8.943 9.934 157 HD21 LEU 19 HD21 LEU 19 1.726 -9.409 11.309 158 HD22 LEU 19 HD22 LEU 19 2.309 -9.825 12.917 159 HD23 LEU 19 HD23 LEU 19 3.079 -10.530 11.493 160 H ASN 20 H ASN 20 6.564 -7.494 15.438 161 HA ASN 20 HA ASN 20 8.468 -9.665 15.550 162 HB2 ASN 20 HB2 ASN 20 9.148 -7.269 15.194 163 HB3 ASN 20 HB3 ASN 20 8.632 -6.901 16.838 164 HD21 ASN 20 HD21 ASN 20 10.660 -6.315 17.565 165 HD22 ASN 20 HD22 ASN 20 11.976 -7.419 17.730 166 H GLY 21 H GLY 21 8.821 -11.019 17.241 167 HA2 GLY 21 HA2 GLY 21 8.675 -11.865 19.435 168 HA3 GLY 21 HA3 GLY 21 7.540 -10.593 19.860 169 H THR 22 H THR 22 6.391 -11.659 16.988 170 HA THR 22 HA THR 22 4.910 -14.024 18.028 171 HB THR 22 HB THR 22 2.868 -13.372 16.894 172 HG1 THR 22 HG1 THR 22 4.097 -10.975 15.982 173 HG21 THR 22 HG21 THR 22 3.911 -10.918 18.362 174 HG22 THR 22 HG22 THR 22 3.105 -12.305 19.102 175 HG23 THR 22 HG23 THR 22 2.216 -11.255 17.997 176 H GLU 23 H GLU 23 3.962 -15.354 16.168 177 HA GLU 23 HA GLU 23 5.898 -15.582 13.941 178 HB2 GLU 23 HB2 GLU 23 3.878 -17.587 15.032 179 HB3 GLU 23 HB3 GLU 23 4.879 -17.866 13.608 180 HG2 GLU 23 HG2 GLU 23 6.911 -17.602 15.058 181 HG3 GLU 23 HG3 GLU 23 5.842 -17.496 16.461 182 H GLY 24 H GLY 24 3.184 -13.903 14.346 183 HA2 GLY 24 HA2 GLY 24 2.513 -13.138 11.916 184 HA3 GLY 24 HA3 GLY 24 1.758 -14.721 11.902 185 H LEU 25 H LEU 25 0.820 -11.760 11.932 186 HA LEU 25 HA LEU 25 -1.464 -12.154 13.773 187 HB2 LEU 25 HB2 LEU 25 0.013 -9.527 13.282 188 HB3 LEU 25 HB3 LEU 25 -1.482 -9.684 14.190 189 HG LEU 25 HG LEU 25 1.252 -10.754 15.008 190 HD11 LEU 25 HD11 LEU 25 1.006 -8.327 15.269 191 HD12 LEU 25 HD12 LEU 25 1.111 -9.134 16.831 192 HD13 LEU 25 HD13 LEU 25 -0.454 -8.564 16.237 193 HD21 LEU 25 HD21 LEU 25 -0.471 -12.328 15.747 194 HD22 LEU 25 HD22 LEU 25 -1.391 -11.016 16.487 195 HD23 LEU 25 HD23 LEU 25 0.197 -11.457 17.127 196 H THR 26 H THR 26 -3.423 -11.072 13.063 197 HA THR 26 HA THR 26 -3.715 -10.639 10.176 198 HB THR 26 HB THR 26 -6.127 -10.414 10.653 199 HG1 THR 26 HG1 THR 26 -6.012 -11.035 13.336 200 HG21 THR 26 HG21 THR 26 -6.576 -12.660 11.600 201 HG22 THR 26 HG22 THR 26 -4.909 -12.764 12.168 202 HG23 THR 26 HG23 THR 26 -5.250 -12.718 10.436 203 H GLN 27 H GLN 27 -5.393 -8.674 9.705 204 HA GLN 27 HA GLN 27 -4.061 -6.236 9.975 205 HB2 GLN 27 HB2 GLN 27 -7.037 -6.688 9.533 206 HB3 GLN 27 HB3 GLN 27 -6.222 -5.139 9.319 207 HG2 GLN 27 HG2 GLN 27 -4.816 -6.217 7.531 208 HG3 GLN 27 HG3 GLN 27 -5.806 -7.666 7.693 209 HE21 GLN 27 HE21 GLN 27 -7.032 -4.333 7.845 210 HE22 GLN 27 HE22 GLN 27 -7.944 -4.425 6.388 211 H LYS 28 H LYS 28 -6.833 -7.456 11.886 212 HA LYS 28 HA LYS 28 -7.262 -5.215 13.528 213 HB2 LYS 28 HB2 LYS 28 -8.926 -7.012 13.292 214 HB3 LYS 28 HB3 LYS 28 -7.862 -8.156 14.094 215 HG2 LYS 28 HG2 LYS 28 -8.723 -5.682 15.596 216 HG3 LYS 28 HG3 LYS 28 -9.887 -6.986 15.383 217 HD2 LYS 28 HD2 LYS 28 -8.552 -8.529 16.644 218 HD3 LYS 28 HD3 LYS 28 -7.133 -7.485 16.578 219 HE2 LYS 28 HE2 LYS 28 -8.154 -7.435 18.811 220 HE3 LYS 28 HE3 LYS 28 -8.247 -5.850 18.045 221 HZ1 LYS 28 HZ1 LYS 28 -10.468 -7.820 18.156 222 HZ2 LYS 28 HZ2 LYS 28 -10.551 -6.264 17.503 223 HZ3 LYS 28 HZ3 LYS 28 -10.311 -6.474 19.164 224 H GLN 29 H GLN 29 -5.286 -8.117 14.157 225 HA GLN 29 HA GLN 29 -4.629 -7.571 16.854 226 HB2 GLN 29 HB2 GLN 29 -3.201 -9.273 14.775 227 HB3 GLN 29 HB3 GLN 29 -2.818 -9.294 16.498 228 HG2 GLN 29 HG2 GLN 29 -5.034 -10.159 17.028 229 HG3 GLN 29 HG3 GLN 29 -5.535 -9.997 15.343 230 HE21 GLN 29 HE21 GLN 29 -3.527 -11.836 17.566 231 HE22 GLN 29 HE22 GLN 29 -3.310 -13.196 16.526 232 H ILE 30 H ILE 30 -2.962 -6.682 13.854 233 HA ILE 30 HA ILE 30 -0.716 -5.385 15.107 234 HB ILE 30 HB ILE 30 -1.857 -5.171 12.292 235 HG12 ILE 30 HG12 ILE 30 0.565 -6.694 13.363 236 HG13 ILE 30 HG13 ILE 30 -0.970 -7.416 12.891 237 HG21 ILE 30 HG21 ILE 30 -0.614 -3.113 12.796 238 HG22 ILE 30 HG22 ILE 30 0.265 -4.096 11.628 239 HG23 ILE 30 HG23 ILE 30 0.783 -4.063 13.313 240 HD11 ILE 30 HD11 ILE 30 -0.570 -6.693 10.576 241 HD12 ILE 30 HD12 ILE 30 0.695 -7.756 11.189 242 HD13 ILE 30 HD13 ILE 30 0.986 -6.022 11.068 243 H LYS 31 H LYS 31 -3.711 -4.183 13.580 244 HA LYS 31 HA LYS 31 -3.408 -1.414 13.914 245 HB2 LYS 31 HB2 LYS 31 -5.036 -2.390 12.408 246 HB3 LYS 31 HB3 LYS 31 -5.899 -3.148 13.736 247 HG2 LYS 31 HG2 LYS 31 -6.786 -1.056 14.480 248 HG3 LYS 31 HG3 LYS 31 -5.687 -0.139 13.442 249 HD2 LYS 31 HD2 LYS 31 -6.865 -0.730 11.465 250 HD3 LYS 31 HD3 LYS 31 -7.699 -2.072 12.247 251 HE2 LYS 31 HE2 LYS 31 -9.153 -0.104 11.761 252 HE3 LYS 31 HE3 LYS 31 -9.140 -0.565 13.457 253 HZ1 LYS 31 HZ1 LYS 31 -7.663 1.250 13.919 254 HZ2 LYS 31 HZ2 LYS 31 -9.031 1.832 13.121 255 HZ3 LYS 31 HZ3 LYS 31 -7.570 1.661 12.284 256 H LYS 32 H LYS 32 -4.450 -3.843 16.196 257 HA LYS 32 HA LYS 32 -5.374 -2.194 18.316 258 HB2 LYS 32 HB2 LYS 32 -5.918 -4.564 18.251 259 HB3 LYS 32 HB3 LYS 32 -4.219 -5.011 18.255 260 HG2 LYS 32 HG2 LYS 32 -5.239 -5.443 20.432 261 HG3 LYS 32 HG3 LYS 32 -3.981 -4.211 20.561 262 HD2 LYS 32 HD2 LYS 32 -5.774 -2.448 20.548 263 HD3 LYS 32 HD3 LYS 32 -6.994 -3.728 20.534 264 HE2 LYS 32 HE2 LYS 32 -6.160 -4.543 22.712 265 HE3 LYS 32 HE3 LYS 32 -4.917 -3.289 22.714 266 HZ1 LYS 32 HZ1 LYS 32 -6.817 -2.688 24.066 267 HZ2 LYS 32 HZ2 LYS 32 -7.842 -2.801 22.728 268 HZ3 LYS 32 HZ3 LYS 32 -6.641 -1.615 22.773 269 H ALA 33 H ALA 33 -2.172 -3.713 17.723 270 HA ALA 33 HA ALA 33 -0.892 -2.704 20.073 271 HB1 ALA 33 HB1 ALA 33 1.179 -3.590 19.061 272 HB2 ALA 33 HB2 ALA 33 0.347 -3.790 17.514 273 HB3 ALA 33 HB3 ALA 33 -0.146 -4.746 18.913 274 H THR 34 H THR 34 -1.008 -1.602 16.738 275 HA THR 34 HA THR 34 0.938 0.541 17.032 276 HB THR 34 HB THR 34 0.453 0.996 14.633 277 HG1 THR 34 HG1 THR 34 -1.117 -1.190 14.168 278 HG21 THR 34 HG21 THR 34 2.116 -0.766 15.164 279 HG22 THR 34 HG22 THR 34 1.230 -1.145 13.686 280 HG23 THR 34 HG23 THR 34 0.827 -1.977 15.189 281 H LYS 35 H LYS 35 -2.534 0.172 17.108 282 HA LYS 35 HA LYS 35 -4.312 1.516 17.397 283 HB2 LYS 35 HB2 LYS 35 -2.273 3.407 18.629 284 HB3 LYS 35 HB3 LYS 35 -4.019 3.612 18.745 285 HG2 LYS 35 HG2 LYS 35 -4.175 1.442 19.959 286 HG3 LYS 35 HG3 LYS 35 -2.419 1.281 19.864 287 HD2 LYS 35 HD2 LYS 35 -3.040 2.119 22.070 288 HD3 LYS 35 HD3 LYS 35 -2.171 3.377 21.188 289 HE2 LYS 35 HE2 LYS 35 -4.381 4.422 20.608 290 HE3 LYS 35 HE3 LYS 35 -5.182 3.210 21.610 291 HZ1 LYS 35 HZ1 LYS 35 -4.886 5.222 22.843 292 HZ2 LYS 35 HZ2 LYS 35 -3.231 5.250 22.517 293 HZ3 LYS 35 HZ3 LYS 35 -3.875 4.038 23.502 294 H LEU 36 H LEU 36 -3.118 1.575 14.864 295 HA LEU 36 HA LEU 36 -3.158 4.180 13.690 296 HB2 LEU 36 HB2 LEU 36 -3.640 1.443 12.432 297 HB3 LEU 36 HB3 LEU 36 -3.397 2.931 11.527 298 HG LEU 36 HG LEU 36 -1.349 1.602 13.343 299 HD11 LEU 36 HD11 LEU 36 -0.076 1.153 11.303 300 HD12 LEU 36 HD12 LEU 36 -1.374 1.841 10.325 301 HD13 LEU 36 HD13 LEU 36 -1.656 0.372 11.261 302 HD21 LEU 36 HD21 LEU 36 0.248 3.302 12.557 303 HD22 LEU 36 HD22 LEU 36 -1.089 4.030 13.441 304 HD23 LEU 36 HD23 LEU 36 -1.047 4.122 11.678 305 H LYS 37 H LYS 37 -4.888 5.457 13.174 306 HA LYS 37 HA LYS 37 -7.372 5.060 14.365 307 HB2 LYS 37 HB2 LYS 37 -8.102 7.114 13.262 308 HB3 LYS 37 HB3 LYS 37 -6.433 7.289 13.790 309 HG2 LYS 37 HG2 LYS 37 -5.643 6.903 11.487 310 HG3 LYS 37 HG3 LYS 37 -7.308 6.675 10.944 311 HD2 LYS 37 HD2 LYS 37 -7.769 9.059 11.713 312 HD3 LYS 37 HD3 LYS 37 -6.027 9.234 11.974 313 HE2 LYS 37 HE2 LYS 37 -7.414 8.619 9.336 314 HE3 LYS 37 HE3 LYS 37 -6.629 10.136 9.780 315 HZ1 LYS 37 HZ1 LYS 37 -5.222 8.806 8.354 316 HZ2 LYS 37 HZ2 LYS 37 -5.272 7.508 9.438 317 HZ3 LYS 37 HZ3 LYS 37 -4.516 8.950 9.881 318 H ALA 38 H ALA 38 -6.413 4.318 11.061 319 HA ALA 38 HA ALA 38 -9.034 3.060 10.500 320 HB1 ALA 38 HB1 ALA 38 -9.061 5.311 9.474 321 HB2 ALA 38 HB2 ALA 38 -9.065 4.050 8.239 322 HB3 ALA 38 HB3 ALA 38 -7.578 4.935 8.596 323 H ASP 39 H ASP 39 -8.907 1.757 8.465 324 HA ASP 39 HA ASP 39 -6.800 -0.129 8.352 325 HB2 ASP 39 HB2 ASP 39 -7.949 -0.861 6.227 326 HB3 ASP 39 HB3 ASP 39 -9.039 -0.709 7.602 327 H LYS 40 H LYS 40 -7.378 2.885 6.676 328 HA LYS 40 HA LYS 40 -5.781 2.748 4.406 329 HB2 LYS 40 HB2 LYS 40 -6.273 5.205 6.144 330 HB3 LYS 40 HB3 LYS 40 -5.825 5.209 4.437 331 HG2 LYS 40 HG2 LYS 40 -8.397 3.993 5.500 332 HG3 LYS 40 HG3 LYS 40 -8.265 5.664 4.929 333 HD2 LYS 40 HD2 LYS 40 -7.563 4.781 2.686 334 HD3 LYS 40 HD3 LYS 40 -7.794 3.138 3.296 335 HE2 LYS 40 HE2 LYS 40 -9.956 5.263 3.034 336 HE3 LYS 40 HE3 LYS 40 -9.739 3.864 1.980 337 HZ1 LYS 40 HZ1 LYS 40 -11.458 3.392 3.562 338 HZ2 LYS 40 HZ2 LYS 40 -10.466 3.825 4.860 339 HZ3 LYS 40 HZ3 LYS 40 -10.111 2.443 3.959 340 H ASP 41 H ASP 41 -4.873 3.762 7.684 341 HA ASP 41 HA ASP 41 -2.209 4.621 7.236 342 HB2 ASP 41 HB2 ASP 41 -3.366 3.387 9.783 343 HB3 ASP 41 HB3 ASP 41 -1.951 4.436 9.678 344 H PHE 42 H PHE 42 -3.646 1.492 7.957 345 HA PHE 42 HA PHE 42 -1.315 0.005 8.565 346 HB2 PHE 42 HB2 PHE 42 -3.514 -0.731 9.314 347 HB3 PHE 42 HB3 PHE 42 -4.084 -0.879 7.659 348 HD1 PHE 42 HD1 PHE 42 -1.645 -2.315 10.105 349 HD2 PHE 42 HD2 PHE 42 -3.836 -2.946 6.483 350 HE1 PHE 42 HE1 PHE 42 -0.968 -4.671 10.092 351 HE2 PHE 42 HE2 PHE 42 -3.149 -5.304 6.491 352 HZ PHE 42 HZ PHE 42 -1.715 -6.168 8.295 353 H PHE 43 H PHE 43 -3.055 0.507 5.475 354 HA PHE 43 HA PHE 43 -1.616 -1.431 3.954 355 HB2 PHE 43 HB2 PHE 43 -3.092 1.041 2.962 356 HB3 PHE 43 HB3 PHE 43 -2.555 -0.295 1.945 357 HD1 PHE 43 HD2 PHE 43 -3.330 -2.727 3.041 358 HD2 PHE 43 HD1 PHE 43 -5.386 1.003 3.425 359 HE1 PHE 43 HE2 PHE 43 -5.425 -3.925 3.519 360 HE2 PHE 43 HE1 PHE 43 -7.466 -0.195 3.908 361 HZ PHE 43 HZ PHE 43 -7.494 -2.663 3.954 362 H LEU 44 H LEU 44 -0.935 1.975 4.634 363 HA LEU 44 HA LEU 44 1.206 2.334 2.781 364 HB2 LEU 44 HB2 LEU 44 0.281 3.799 5.253 365 HB3 LEU 44 HB3 LEU 44 1.845 4.203 4.574 366 HG LEU 44 HG LEU 44 0.805 4.864 2.443 367 HD11 LEU 44 HD11 LEU 44 -1.620 5.025 2.145 368 HD12 LEU 44 HD12 LEU 44 -1.877 4.230 3.700 369 HD13 LEU 44 HD13 LEU 44 -1.112 3.351 2.375 370 HD21 LEU 44 HD21 LEU 44 -0.336 6.896 3.197 371 HD22 LEU 44 HD22 LEU 44 1.088 6.568 4.181 372 HD23 LEU 44 HD23 LEU 44 -0.522 6.212 4.814 373 H GLY 45 H GLY 45 1.121 1.217 6.159 374 HA2 GLY 45 HA2 GLY 45 3.979 0.969 6.472 375 HA3 GLY 45 HA3 GLY 45 2.745 0.326 7.542 376 H LEU 46 H LEU 46 1.375 -1.475 6.120 377 HA LEU 46 HA LEU 46 2.982 -3.788 6.031 378 HB2 LEU 46 HB2 LEU 46 0.539 -3.840 6.446 379 HB3 LEU 46 HB3 LEU 46 0.239 -3.331 4.792 380 HG LEU 46 HG LEU 46 1.340 -5.481 4.002 381 HD11 LEU 46 HD11 LEU 46 1.617 -7.325 5.590 382 HD12 LEU 46 HD12 LEU 46 1.239 -6.241 6.930 383 HD13 LEU 46 HD13 LEU 46 2.690 -5.974 5.959 384 HD21 LEU 46 HD21 LEU 46 -1.117 -5.871 5.739 385 HD22 LEU 46 HD22 LEU 46 -0.586 -6.925 4.427 386 HD23 LEU 46 HD23 LEU 46 -1.109 -5.280 4.076 387 H GLY 47 H GLY 47 1.913 -1.625 3.491 388 HA2 GLY 47 HA2 GLY 47 2.639 -3.122 1.182 389 HA3 GLY 47 HA3 GLY 47 2.424 -1.377 1.255 390 H TRP 48 H TRP 48 4.405 -0.956 3.300 391 HA TRP 48 HA TRP 48 6.842 -0.855 1.818 392 HB2 TRP 48 HB2 TRP 48 6.102 0.777 3.650 393 HB3 TRP 48 HB3 TRP 48 6.507 -0.468 4.827 394 HD1 TRP 48 HD1 TRP 48 9.217 -1.348 4.604 395 HE1 TRP 48 HE1 TRP 48 11.298 0.055 4.155 396 HE3 TRP 48 HE3 TRP 48 6.964 2.870 2.861 397 HZ2 TRP 48 HZ2 TRP 48 11.928 2.626 3.238 398 HZ3 TRP 48 HZ3 TRP 48 8.375 4.785 2.248 399 HH2 TRP 48 HH2 TRP 48 10.814 4.672 2.438 400 H LEU 49 H LEU 49 5.696 -2.866 4.543 401 HA LEU 49 HA LEU 49 7.976 -4.447 4.956 402 HB2 LEU 49 HB2 LEU 49 5.036 -4.849 5.473 403 HB3 LEU 49 HB3 LEU 49 6.127 -6.186 5.742 404 HG LEU 49 HG LEU 49 7.283 -5.048 7.519 405 HD11 LEU 49 HD11 LEU 49 6.794 -2.773 8.218 406 HD12 LEU 49 HD12 LEU 49 5.708 -2.572 6.834 407 HD13 LEU 49 HD13 LEU 49 7.437 -2.831 6.577 408 HD21 LEU 49 HD21 LEU 49 5.483 -4.651 9.139 409 HD22 LEU 49 HD22 LEU 49 5.122 -6.061 8.145 410 HD23 LEU 49 HD23 LEU 49 4.305 -4.525 7.826 411 H LEU 50 H LEU 50 5.452 -4.769 2.512 412 HA LEU 50 HA LEU 50 6.346 -7.219 1.352 413 HB2 LEU 50 HB2 LEU 50 4.693 -4.935 0.229 414 HB3 LEU 50 HB3 LEU 50 5.040 -6.394 -0.691 415 HG LEU 50 HG LEU 50 3.490 -6.283 1.931 416 HD11 LEU 50 HD11 LEU 50 1.523 -6.889 0.598 417 HD12 LEU 50 HD12 LEU 50 2.476 -6.799 -0.887 418 HD13 LEU 50 HD13 LEU 50 2.196 -5.344 0.075 419 HD21 LEU 50 HD21 LEU 50 4.114 -8.656 0.136 420 HD22 LEU 50 HD22 LEU 50 3.023 -8.677 1.522 421 HD23 LEU 50 HD23 LEU 50 4.738 -8.371 1.764 422 H ARG 51 H ARG 51 7.206 -3.785 0.650 423 HA ARG 51 HA ARG 51 8.375 -4.224 -1.869 424 HB2 ARG 51 HB2 ARG 51 9.113 -1.995 -1.839 425 HB3 ARG 51 HB3 ARG 51 7.688 -1.982 -0.815 426 HG2 ARG 51 HG2 ARG 51 9.140 -1.917 1.188 427 HG3 ARG 51 HG3 ARG 51 10.570 -1.975 0.167 428 HD2 ARG 51 HD2 ARG 51 10.104 0.308 0.956 429 HD3 ARG 51 HD3 ARG 51 9.995 0.197 -0.803 430 HE ARG 51 HE ARG 51 7.501 -0.056 0.664 431 HH11 ARG 51 HH11 ARG 51 9.602 2.185 -0.932 432 HH12 ARG 51 HH12 ARG 51 8.324 3.290 -1.275 433 HH21 ARG 51 HH21 ARG 51 5.877 1.386 0.205 434 HH22 ARG 51 HH22 ARG 51 6.245 2.839 -0.646 435 H GLU 52 H GLU 52 9.814 -4.636 1.300 436 HA GLU 52 HA GLU 52 12.538 -5.017 0.224 437 HB2 GLU 52 HB2 GLU 52 11.536 -4.928 3.106 438 HB3 GLU 52 HB3 GLU 52 13.228 -5.003 2.612 439 HG2 GLU 52 HG2 GLU 52 13.090 -2.790 1.623 440 HG3 GLU 52 HG3 GLU 52 11.354 -2.722 1.918 441 H ASP 53 H ASP 53 9.871 -6.998 0.739 442 HA ASP 53 HA ASP 53 9.410 -9.130 1.273 443 HB2 ASP 53 HB2 ASP 53 12.324 -9.543 0.470 444 HB3 ASP 53 HB3 ASP 53 11.247 -10.881 0.874 445 H LYS 54 H LYS 54 9.679 -7.541 3.360 446 HA LYS 54 HA LYS 54 11.406 -8.731 5.415 447 HB2 LYS 54 HB2 LYS 54 11.288 -6.242 5.051 448 HB3 LYS 54 HB3 LYS 54 9.604 -6.273 5.551 449 HG2 LYS 54 HG2 LYS 54 10.212 -6.897 7.806 450 HG3 LYS 54 HG3 LYS 54 11.897 -7.150 7.343 451 HD2 LYS 54 HD2 LYS 54 10.477 -4.451 7.198 452 HD3 LYS 54 HD3 LYS 54 11.463 -4.973 8.568 453 HE2 LYS 54 HE2 LYS 54 13.452 -5.083 7.146 454 HE3 LYS 54 HE3 LYS 54 12.488 -4.727 5.713 455 HZ1 LYS 54 HZ1 LYS 54 13.715 -2.804 6.574 456 HZ2 LYS 54 HZ2 LYS 54 12.808 -2.871 8.003 457 HZ3 LYS 54 HZ3 LYS 54 12.045 -2.549 6.525 458 H VAL 55 H VAL 55 8.139 -8.880 4.311 459 HA VAL 55 HA VAL 55 7.448 -10.721 6.523 460 HB VAL 55 HB VAL 55 5.111 -9.972 6.586 461 HG11 VAL 55 HG11 VAL 55 6.622 -9.020 8.235 462 HG12 VAL 55 HG12 VAL 55 5.400 -7.831 7.777 463 HG13 VAL 55 HG13 VAL 55 7.040 -7.701 7.137 464 HG21 VAL 55 HG21 VAL 55 4.838 -9.114 4.308 465 HG22 VAL 55 HG22 VAL 55 5.927 -7.768 4.649 466 HG23 VAL 55 HG23 VAL 55 4.368 -7.871 5.472 467 H VAL 56 H VAL 56 5.688 -12.211 6.000 468 HA VAL 56 HA VAL 56 5.228 -12.725 3.112 469 HB VAL 56 HB VAL 56 4.838 -14.684 5.423 470 HG11 VAL 56 HG11 VAL 56 4.645 -16.420 3.663 471 HG12 VAL 56 HG12 VAL 56 4.801 -15.184 2.414 472 HG13 VAL 56 HG13 VAL 56 3.396 -15.184 3.482 473 HG21 VAL 56 HG21 VAL 56 7.165 -14.558 3.471 474 HG22 VAL 56 HG22 VAL 56 6.891 -15.827 4.669 475 HG23 VAL 56 HG23 VAL 56 7.226 -14.177 5.196 476 H THR 57 H THR 57 3.190 -12.319 2.390 477 HA THR 57 HA THR 57 0.967 -12.006 4.347 478 HB THR 57 HB THR 57 -0.108 -10.533 2.545 479 HG1 THR 57 HG1 THR 57 1.455 -9.635 1.027 480 HG21 THR 57 HG21 THR 57 0.941 -9.516 4.536 481 HG22 THR 57 HG22 THR 57 1.214 -8.518 3.106 482 HG23 THR 57 HG23 THR 57 2.514 -9.534 3.730 483 H SER 58 H SER 58 -0.822 -13.170 4.058 484 HA SER 58 HA SER 58 -1.269 -14.798 1.638 485 HB2 SER 58 HB2 SER 58 -1.328 -15.850 4.509 486 HB3 SER 58 HB3 SER 58 -1.834 -16.768 3.087 487 HG SER 58 HG SER 58 0.661 -15.734 2.775 488 H GLU 59 H GLU 59 -3.454 -15.490 1.375 489 HA GLU 59 HA GLU 59 -5.447 -13.645 2.547 490 HB2 GLU 59 HB2 GLU 59 -5.269 -13.734 0.072 491 HB3 GLU 59 HB3 GLU 59 -5.609 -15.461 0.100 492 HG2 GLU 59 HG2 GLU 59 -7.859 -14.889 1.141 493 HG3 GLU 59 HG3 GLU 59 -7.495 -13.193 0.813 494 H VAL 60 H VAL 60 -6.356 -14.466 4.333 495 HA VAL 60 HA VAL 60 -7.094 -17.350 4.486 496 HB VAL 60 HB VAL 60 -6.225 -15.470 6.735 497 HG11 VAL 60 HG11 VAL 60 -7.303 -18.311 7.003 498 HG12 VAL 60 HG12 VAL 60 -8.098 -16.840 7.570 499 HG13 VAL 60 HG13 VAL 60 -6.582 -17.360 8.307 500 HG21 VAL 60 HG21 VAL 60 -4.367 -16.453 5.437 501 HG22 VAL 60 HG22 VAL 60 -5.017 -18.073 5.717 502 HG23 VAL 60 HG23 VAL 60 -4.406 -17.120 7.073 503 H GLU 61 H GLU 61 -9.174 -17.482 4.050 504 HA GLU 61 HA GLU 61 -11.428 -17.247 4.030 505 HB2 GLU 61 HB2 GLU 61 -11.038 -16.233 6.872 506 HB3 GLU 61 HB3 GLU 61 -12.458 -17.054 6.223 507 HG2 GLU 61 HG2 GLU 61 -11.046 -19.109 5.898 508 HG3 GLU 61 HG3 GLU 61 -9.706 -18.259 6.645 509 H GLY 62 H GLY 62 -10.068 -14.953 2.945 510 HA2 GLY 62 HA2 GLY 62 -10.905 -12.985 1.952 511 HA3 GLY 62 HA3 GLY 62 -12.105 -12.846 3.220 512 H GLU 63 H GLU 63 -9.920 -13.245 5.275 513 HA GLU 63 HA GLU 63 -9.204 -10.484 5.710 514 HB2 GLU 63 HB2 GLU 63 -9.824 -11.828 7.634 515 HB3 GLU 63 HB3 GLU 63 -8.632 -13.053 7.246 516 HG2 GLU 63 HG2 GLU 63 -7.777 -11.886 9.122 517 HG3 GLU 63 HG3 GLU 63 -6.825 -11.346 7.747 518 H ILE 64 H ILE 64 -7.186 -9.498 5.527 519 HA ILE 64 HA ILE 64 -4.992 -10.860 4.186 520 HB ILE 64 HB ILE 64 -5.094 -8.071 5.428 521 HG12 ILE 64 HG12 ILE 64 -5.320 -8.897 2.493 522 HG13 ILE 64 HG13 ILE 64 -6.654 -8.343 3.500 523 HG21 ILE 64 HG21 ILE 64 -2.773 -8.887 5.323 524 HG22 ILE 64 HG22 ILE 64 -3.022 -7.585 4.163 525 HG23 ILE 64 HG23 ILE 64 -2.962 -9.259 3.606 526 HD11 ILE 64 HD11 ILE 64 -5.573 -6.139 3.698 527 HD12 ILE 64 HD12 ILE 64 -5.891 -6.582 2.022 528 HD13 ILE 64 HD13 ILE 64 -4.255 -6.702 2.664 529 H PHE 65 H PHE 65 -4.193 -12.460 5.493 530 HA PHE 65 HA PHE 65 -3.230 -11.906 8.202 531 HB2 PHE 65 HB2 PHE 65 -4.209 -14.128 7.740 532 HB3 PHE 65 HB3 PHE 65 -3.031 -14.412 6.464 533 HD1 PHE 65 HD2 PHE 65 -3.306 -13.813 10.157 534 HD2 PHE 65 HD1 PHE 65 -0.946 -15.461 6.986 535 HE1 PHE 65 HE2 PHE 65 -1.761 -14.785 11.803 536 HE2 PHE 65 HE1 PHE 65 0.597 -16.425 8.642 537 HZ PHE 65 HZ PHE 65 0.192 -16.088 11.049 538 H VAL 66 H VAL 66 -1.076 -11.686 8.741 539 HA VAL 66 HA VAL 66 0.996 -11.910 6.667 540 HB VAL 66 HB VAL 66 0.426 -9.573 6.544 541 HG11 VAL 66 HG11 VAL 66 0.421 -8.038 8.477 542 HG12 VAL 66 HG12 VAL 66 0.728 -9.398 9.561 543 HG13 VAL 66 HG13 VAL 66 -0.786 -9.316 8.658 544 HG21 VAL 66 HG21 VAL 66 2.543 -8.473 7.170 545 HG22 VAL 66 HG22 VAL 66 2.841 -10.058 6.458 546 HG23 VAL 66 HG23 VAL 66 2.960 -9.840 8.206 547 H LYS 67 H LYS 67 3.053 -12.418 7.424 548 HA LYS 67 HA LYS 67 3.552 -12.655 10.319 549 HB2 LYS 67 HB2 LYS 67 4.327 -14.928 10.165 550 HB3 LYS 67 HB3 LYS 67 2.727 -14.886 9.432 551 HG2 LYS 67 HG2 LYS 67 3.739 -14.906 7.189 552 HG3 LYS 67 HG3 LYS 67 5.352 -14.880 7.914 553 HD2 LYS 67 HD2 LYS 67 4.632 -17.077 9.110 554 HD3 LYS 67 HD3 LYS 67 3.308 -17.120 7.938 555 HE2 LYS 67 HE2 LYS 67 5.181 -18.473 7.150 556 HE3 LYS 67 HE3 LYS 67 4.986 -17.073 6.095 557 HZ1 LYS 67 HZ1 LYS 67 6.968 -17.313 8.296 558 HZ2 LYS 67 HZ2 LYS 67 6.800 -15.983 7.267 559 HZ3 LYS 67 HZ3 LYS 67 7.304 -17.474 6.649 560 H LEU 68 H LEU 68 6.109 -13.465 10.465 561 HA LEU 68 HA LEU 68 7.525 -11.362 8.978 562 HB2 LEU 68 HB2 LEU 68 8.303 -12.999 11.409 563 HB3 LEU 68 HB3 LEU 68 9.445 -11.944 10.588 564 HG LEU 68 HG LEU 68 6.907 -11.111 12.044 565 HD11 LEU 68 HD11 LEU 68 8.807 -11.566 13.512 566 HD12 LEU 68 HD12 LEU 68 8.430 -9.846 13.487 567 HD13 LEU 68 HD13 LEU 68 9.820 -10.455 12.583 568 HD21 LEU 68 HD21 LEU 68 8.765 -9.362 10.394 569 HD22 LEU 68 HD22 LEU 68 7.483 -8.776 11.459 570 HD23 LEU 68 HD23 LEU 68 7.075 -9.737 10.041 571 H VAL 69 H VAL 69 9.771 -11.708 8.369 572 HA VAL 69 HA VAL 69 10.272 -14.249 6.928 573 HB VAL 69 HB VAL 69 11.074 -11.364 6.362 574 HG11 VAL 69 HG11 VAL 69 12.478 -12.118 4.464 575 HG12 VAL 69 HG12 VAL 69 12.280 -13.794 4.985 576 HG13 VAL 69 HG13 VAL 69 13.139 -12.649 6.014 577 HG21 VAL 69 HG21 VAL 69 9.698 -13.450 4.634 578 HG22 VAL 69 HG22 VAL 69 10.026 -11.779 4.171 579 HG23 VAL 69 HG23 VAL 69 8.902 -12.126 5.484 580 H LEU 70 H LEU 70 12.017 -15.435 7.463 581 HA LEU 70 HA LEU 70 13.954 -14.592 9.472 582 HB2 LEU 70 HB2 LEU 70 13.632 -17.171 7.876 583 HB3 LEU 70 HB3 LEU 70 14.953 -16.906 9.000 584 HG LEU 70 HG LEU 70 13.263 -16.692 10.862 585 HD11 LEU 70 HD11 LEU 70 11.268 -16.060 9.610 586 HD12 LEU 70 HD12 LEU 70 10.968 -17.530 10.532 587 HD13 LEU 70 HD13 LEU 70 11.250 -17.624 8.791 588 HD21 LEU 70 HD21 LEU 70 14.472 -18.791 10.489 589 HD22 LEU 70 HD22 LEU 70 13.228 -19.329 9.357 590 HD23 LEU 70 HD23 LEU 70 12.834 -19.106 11.063 591 H GLU 71 H GLU 71 13.988 -15.583 6.026 592 HA GLU 71 HA GLU 71 16.278 -13.874 5.423 593 HB2 GLU 71 HB2 GLU 71 17.798 -15.576 4.746 594 HB3 GLU 71 HB3 GLU 71 17.151 -16.161 6.269 595 HG2 GLU 71 HG2 GLU 71 16.535 -17.152 3.472 596 HG3 GLU 71 HG3 GLU 71 17.307 -18.030 4.783 597 H HIS 72 H HIS 72 16.889 -14.352 2.923 598 HA HIS 72 HA HIS 72 14.347 -14.275 1.396 599 HB2 HIS 72 HB2 HIS 72 17.134 -13.229 0.729 600 HB3 HIS 72 HB3 HIS 72 15.773 -13.184 -0.393 601 HD1 HIS 72 HD1 HIS 72 17.069 -11.564 2.744 602 HD2 HIS 72 HD2 HIS 72 13.832 -11.233 0.155 603 HE1 HIS 72 HE1 HIS 72 15.893 -9.444 3.393 604 HE2 HIS 72 HE2 HIS 72 14.009 -9.209 1.750 605 H HIS 73 H HIS 73 14.729 -16.793 1.994 606 HA HIS 73 HA HIS 73 15.556 -18.024 -0.579 607 HB2 HIS 73 HB2 HIS 73 16.153 -19.127 2.203 608 HB3 HIS 73 HB3 HIS 73 16.316 -20.069 0.725 609 HD1 HIS 73 HD1 HIS 73 18.352 -18.199 2.960 610 HD2 HIS 73 HD2 HIS 73 18.200 -18.603 -1.170 611 HE1 HIS 73 HE1 HIS 73 20.587 -17.423 2.128 612 HE2 HIS 73 HE2 HIS 73 20.544 -17.915 -0.332 613 H HIS 74 H HIS 74 13.420 -18.214 2.267 614 HA HIS 74 HA HIS 74 11.924 -20.497 1.176 615 HB2 HIS 74 HB2 HIS 74 11.769 -19.016 3.829 616 HB3 HIS 74 HB3 HIS 74 10.653 -20.305 3.389 617 HD1 HIS 74 HD1 HIS 74 11.327 -22.233 4.813 618 HD2 HIS 74 HD2 HIS 74 14.634 -20.363 3.140 619 HE1 HIS 74 HE1 HIS 74 13.299 -23.601 5.533 620 HE2 HIS 74 HE2 HIS 74 15.290 -22.338 4.674 621 H HIS 75 H HIS 75 11.736 -17.945 -0.253 622 HA HIS 75 HA HIS 75 8.777 -17.636 -0.281 623 HB2 HIS 75 HB2 HIS 75 10.614 -15.275 -0.872 624 HB3 HIS 75 HB3 HIS 75 8.897 -15.255 -0.488 625 HD1 HIS 75 HD1 HIS 75 8.506 -16.340 2.122 626 HD2 HIS 75 HD2 HIS 75 12.100 -14.446 1.239 627 HE1 HIS 75 HE1 HIS 75 9.558 -15.830 4.332 628 HE2 HIS 75 HE2 HIS 75 11.821 -14.920 3.766 629 H HIS 76 H HIS 76 10.472 -19.368 -1.824 630 HA HIS 76 HA HIS 76 11.566 -18.269 -4.173 631 HB2 HIS 76 HB2 HIS 76 12.175 -20.476 -3.110 632 HB3 HIS 76 HB3 HIS 76 10.686 -21.156 -3.751 633 HD1 HIS 76 HD1 HIS 76 10.691 -21.877 -6.200 634 HD2 HIS 76 HD2 HIS 76 14.189 -19.919 -5.086 635 HE1 HIS 76 HE1 HIS 76 12.274 -22.184 -8.122 636 HE2 HIS 76 HE2 HIS 76 14.308 -20.848 -7.505 637 H HIS 77 H HIS 77 8.253 -19.256 -3.544 638 HA HIS 77 HA HIS 77 7.449 -19.289 -6.333 639 HB2 HIS 77 HB2 HIS 77 5.200 -19.701 -5.537 640 HB3 HIS 77 HB3 HIS 77 6.293 -20.682 -4.575 641 HD1 HIS 77 HD1 HIS 77 3.651 -18.168 -4.308 642 HD2 HIS 77 HD2 HIS 77 6.657 -19.643 -1.841 643 HE1 HIS 77 HE1 HIS 77 3.034 -17.435 -1.990 644 HE2 HIS 77 HE2 HIS 77 4.765 -18.486 -0.503 645 H1 MET 1 H MET 1 -0.584 -18.091 -9.344 646 HA MET 1 HA MET 1 -1.308 -18.920 -6.700 647 HB2 MET 1 HB2 MET 1 0.484 -17.703 -5.467 648 HB3 MET 1 HB3 MET 1 1.131 -19.045 -6.401 649 HG2 MET 1 HG2 MET 1 1.922 -17.489 -8.121 650 HG3 MET 1 HG3 MET 1 1.211 -16.136 -7.237 651 HE1 MET 1 HE1 MET 1 5.058 -15.533 -6.796 652 HE2 MET 1 HE2 MET 1 3.523 -14.826 -7.304 653 HE3 MET 1 HE3 MET 1 4.227 -16.162 -8.219 654 H LYS 2 H LYS 2 -2.028 -17.128 -5.345 655 HA LYS 2 HA LYS 2 -2.659 -14.608 -6.803 656 HB2 LYS 2 HB2 LYS 2 -4.145 -15.848 -4.434 657 HB3 LYS 2 HB3 LYS 2 -4.596 -14.370 -5.283 658 HG2 LYS 2 HG2 LYS 2 -4.908 -15.813 -7.368 659 HG3 LYS 2 HG3 LYS 2 -4.719 -17.224 -6.322 660 HD2 LYS 2 HD2 LYS 2 -6.891 -15.092 -6.149 661 HD3 LYS 2 HD3 LYS 2 -7.096 -16.762 -6.679 662 HE2 LYS 2 HE2 LYS 2 -6.644 -17.578 -4.429 663 HE3 LYS 2 HE3 LYS 2 -6.234 -15.953 -3.878 664 HZ1 LYS 2 HZ1 LYS 2 -8.894 -16.910 -4.752 665 HZ2 LYS 2 HZ2 LYS 2 -8.533 -15.296 -4.401 666 HZ3 LYS 2 HZ3 LYS 2 -8.429 -16.469 -3.188 667 H MET 3 H MET 3 -0.136 -14.947 -5.627 668 HA MET 3 HA MET 3 0.186 -14.409 -2.915 669 HB2 MET 3 HB2 MET 3 1.977 -15.229 -4.518 670 HB3 MET 3 HB3 MET 3 2.166 -13.567 -5.077 671 HG2 MET 3 HG2 MET 3 3.890 -14.186 -3.443 672 HG3 MET 3 HG3 MET 3 2.875 -12.869 -2.850 673 HE1 MET 3 HE1 MET 3 3.713 -14.793 0.476 674 HE2 MET 3 HE2 MET 3 3.799 -13.254 -0.378 675 HE3 MET 3 HE3 MET 3 4.809 -14.607 -0.893 676 H LEU 4 H LEU 4 -0.061 -12.640 -1.671 677 HA LEU 4 HA LEU 4 -1.138 -10.234 -2.705 678 HB2 LEU 4 HB2 LEU 4 -0.209 -10.985 0.074 679 HB3 LEU 4 HB3 LEU 4 -0.880 -9.408 -0.290 680 HG LEU 4 HG LEU 4 -3.029 -10.522 -0.983 681 HD11 LEU 4 HD11 LEU 4 -2.204 -12.750 -1.567 682 HD12 LEU 4 HD12 LEU 4 -3.485 -12.849 -0.360 683 HD13 LEU 4 HD13 LEU 4 -1.799 -13.064 0.124 684 HD21 LEU 4 HD21 LEU 4 -2.791 -9.571 1.265 685 HD22 LEU 4 HD22 LEU 4 -2.152 -11.104 1.865 686 HD23 LEU 4 HD23 LEU 4 -3.822 -11.003 1.296 687 H LYS 5 H LYS 5 2.138 -11.187 -1.999 688 HA LYS 5 HA LYS 5 3.514 -8.748 -2.187 689 HB2 LYS 5 HB2 LYS 5 4.633 -10.858 -1.583 690 HB3 LYS 5 HB3 LYS 5 4.282 -11.519 -3.171 691 HG2 LYS 5 HG2 LYS 5 6.582 -10.947 -3.198 692 HG3 LYS 5 HG3 LYS 5 5.756 -9.726 -4.170 693 HD2 LYS 5 HD2 LYS 5 5.789 -8.221 -2.110 694 HD3 LYS 5 HD3 LYS 5 6.819 -9.430 -1.334 695 HE2 LYS 5 HE2 LYS 5 7.444 -7.777 -3.798 696 HE3 LYS 5 HE3 LYS 5 8.252 -7.717 -2.236 697 HZ1 LYS 5 HZ1 LYS 5 9.661 -8.911 -3.632 698 HZ2 LYS 5 HZ2 LYS 5 8.405 -9.831 -4.295 699 HZ3 LYS 5 HZ3 LYS 5 8.895 -10.094 -2.703 700 H GLU 6 H GLU 6 2.592 -11.020 -4.815 701 HA GLU 6 HA GLU 6 3.890 -9.408 -6.823 702 HB2 GLU 6 HB2 GLU 6 3.952 -11.897 -6.868 703 HB3 GLU 6 HB3 GLU 6 2.225 -11.924 -7.219 704 HG2 GLU 6 HG2 GLU 6 2.588 -10.817 -9.353 705 HG3 GLU 6 HG3 GLU 6 4.289 -10.559 -8.980 706 H LYS 7 H LYS 7 0.487 -10.043 -5.919 707 HA LYS 7 HA LYS 7 -0.721 -8.869 -8.187 708 HB2 LYS 7 HB2 LYS 7 -2.788 -8.631 -6.797 709 HB3 LYS 7 HB3 LYS 7 -2.082 -10.236 -6.759 710 HG2 LYS 7 HG2 LYS 7 -2.638 -9.981 -4.538 711 HG3 LYS 7 HG3 LYS 7 -0.976 -9.415 -4.519 712 HD2 LYS 7 HD2 LYS 7 -2.071 -7.818 -3.210 713 HD3 LYS 7 HD3 LYS 7 -2.011 -7.025 -4.780 714 HE2 LYS 7 HE2 LYS 7 -4.425 -8.503 -3.665 715 HE3 LYS 7 HE3 LYS 7 -4.203 -6.757 -3.630 716 HZ1 LYS 7 HZ1 LYS 7 -4.080 -6.893 -6.115 717 HZ2 LYS 7 HZ2 LYS 7 -5.588 -7.216 -5.435 718 HZ3 LYS 7 HZ3 LYS 7 -4.620 -8.491 -5.991 719 H ALA 8 H ALA 8 0.592 -7.386 -5.266 720 HA ALA 8 HA ALA 8 -0.266 -4.728 -5.598 721 HB1 ALA 8 HB1 ALA 8 1.688 -4.100 -4.238 722 HB2 ALA 8 HB2 ALA 8 2.403 -5.695 -4.505 723 HB3 ALA 8 HB3 ALA 8 0.904 -5.539 -3.585 724 H GLY 9 H GLY 9 2.480 -6.448 -7.067 725 HA2 GLY 9 HA2 GLY 9 3.562 -4.271 -8.568 726 HA3 GLY 9 HA3 GLY 9 3.882 -5.976 -8.818 727 H ALA 10 H ALA 10 1.100 -6.717 -9.323 728 HA ALA 10 HA ALA 10 0.879 -6.148 -12.129 729 HB1 ALA 10 HB1 ALA 10 0.149 -8.299 -11.170 730 HB2 ALA 10 HB2 ALA 10 -1.174 -7.512 -12.033 731 HB3 ALA 10 HB3 ALA 10 -1.125 -7.477 -10.267 732 H LEU 11 H LEU 11 -0.955 -5.109 -9.264 733 HA LEU 11 HA LEU 11 -2.793 -3.315 -10.440 734 HB2 LEU 11 HB2 LEU 11 -1.493 -3.280 -7.689 735 HB3 LEU 11 HB3 LEU 11 -2.889 -2.305 -8.135 736 HG LEU 11 HG LEU 11 -2.923 -5.347 -8.234 737 HD11 LEU 11 HD11 LEU 11 -3.773 -3.588 -5.925 738 HD12 LEU 11 HD12 LEU 11 -2.421 -4.722 -5.951 739 HD13 LEU 11 HD13 LEU 11 -4.072 -5.322 -6.067 740 HD21 LEU 11 HD21 LEU 11 -5.369 -5.079 -8.201 741 HD22 LEU 11 HD22 LEU 11 -4.652 -4.259 -9.586 742 HD23 LEU 11 HD23 LEU 11 -5.186 -3.322 -8.188 743 H ALA 12 H ALA 12 0.497 -2.911 -9.240 744 HA ALA 12 HA ALA 12 0.886 -0.157 -9.539 745 HB1 ALA 12 HB1 ALA 12 2.435 -1.636 -8.353 746 HB2 ALA 12 HB2 ALA 12 3.290 -0.704 -9.585 747 HB3 ALA 12 HB3 ALA 12 2.896 -2.405 -9.871 748 H GLY 13 H GLY 13 1.272 -2.791 -11.899 749 HA2 GLY 13 HA2 GLY 13 2.290 -1.361 -14.089 750 HA3 GLY 13 HA3 GLY 13 1.328 -2.827 -14.184 751 H GLN 14 H GLN 14 -1.104 -1.989 -13.150 752 HA GLN 14 HA GLN 14 -2.399 -0.712 -15.324 753 HB2 GLN 14 HB2 GLN 14 -3.396 -1.075 -12.464 754 HB3 GLN 14 HB3 GLN 14 -4.409 -0.667 -13.849 755 HG2 GLN 14 HG2 GLN 14 -3.862 -2.853 -14.876 756 HG3 GLN 14 HG3 GLN 14 -2.864 -3.257 -13.478 757 HE21 GLN 14 HE21 GLN 14 -3.894 -3.745 -11.511 758 HE22 GLN 14 HE22 GLN 14 -5.572 -4.130 -11.420 759 H ILE 15 H ILE 15 -1.498 0.510 -12.100 760 HA ILE 15 HA ILE 15 -2.646 3.108 -12.361 761 HB ILE 15 HB ILE 15 -0.507 2.107 -10.426 762 HG12 ILE 15 HG12 ILE 15 -3.531 2.379 -10.046 763 HG13 ILE 15 HG13 ILE 15 -2.691 0.862 -10.347 764 HG21 ILE 15 HG21 ILE 15 -2.223 4.615 -10.216 765 HG22 ILE 15 HG22 ILE 15 -0.485 4.575 -10.514 766 HG23 ILE 15 HG23 ILE 15 -1.127 4.015 -8.970 767 HD11 ILE 15 HD11 ILE 15 -2.393 2.618 -7.918 768 HD12 ILE 15 HD12 ILE 15 -1.495 1.128 -8.219 769 HD13 ILE 15 HD13 ILE 15 -3.246 1.078 -8.023 770 H TRP 16 H TRP 16 0.614 1.851 -12.974 771 HA TRP 16 HA TRP 16 1.924 4.303 -13.526 772 HB2 TRP 16 HB2 TRP 16 3.066 2.054 -13.169 773 HB3 TRP 16 HB3 TRP 16 2.566 1.595 -14.792 774 HD1 TRP 16 HD1 TRP 16 5.122 3.714 -12.932 775 HE1 TRP 16 HE1 TRP 16 6.857 4.619 -14.590 776 HE3 TRP 16 HE3 TRP 16 2.864 2.368 -17.324 777 HZ2 TRP 16 HZ2 TRP 16 7.226 4.778 -17.373 778 HZ3 TRP 16 HZ3 TRP 16 3.961 2.945 -19.441 779 HH2 TRP 16 HH2 TRP 16 6.093 4.130 -19.470 780 H GLU 17 H GLU 17 0.322 1.941 -15.727 781 HA GLU 17 HA GLU 17 0.590 3.371 -18.140 782 HB2 GLU 17 HB2 GLU 17 -1.622 1.444 -17.315 783 HB3 GLU 17 HB3 GLU 17 -1.373 2.027 -18.957 784 HG2 GLU 17 HG2 GLU 17 0.559 0.321 -17.361 785 HG3 GLU 17 HG3 GLU 17 -0.504 -0.250 -18.642 786 H ALA 18 H ALA 18 -1.790 3.665 -15.550 787 HA ALA 18 HA ALA 18 -3.725 5.303 -16.818 788 HB1 ALA 18 HB1 ALA 18 -3.012 5.151 -13.869 789 HB2 ALA 18 HB2 ALA 18 -4.141 4.089 -14.711 790 HB3 ALA 18 HB3 ALA 18 -4.512 5.805 -14.542 791 H LEU 19 H LEU 19 -0.794 6.122 -14.980 792 HA LEU 19 HA LEU 19 -1.134 9.004 -15.322 793 HB2 LEU 19 HB2 LEU 19 0.913 7.262 -13.933 794 HB3 LEU 19 HB3 LEU 19 1.265 8.952 -14.231 795 HG LEU 19 HG LEU 19 -0.682 9.626 -12.849 796 HD11 LEU 19 HD11 LEU 19 -2.162 7.709 -13.181 797 HD12 LEU 19 HD12 LEU 19 -1.901 8.016 -11.466 798 HD13 LEU 19 HD13 LEU 19 -1.064 6.678 -12.258 799 HD21 LEU 19 HD21 LEU 19 1.534 9.422 -11.808 800 HD22 LEU 19 HD22 LEU 19 1.203 7.734 -11.402 801 HD23 LEU 19 HD23 LEU 19 0.250 9.025 -10.665 802 H ASN 20 H ASN 20 0.213 6.481 -17.197 803 HA ASN 20 HA ASN 20 2.410 7.879 -18.410 804 HB2 ASN 20 HB2 ASN 20 2.356 5.419 -18.296 805 HB3 ASN 20 HB3 ASN 20 0.918 5.373 -19.303 806 HD21 ASN 20 HD21 ASN 20 1.845 4.168 -20.946 807 HD22 ASN 20 HD22 ASN 20 3.101 4.768 -21.967 808 H GLY 21 H GLY 21 2.424 9.224 -20.133 809 HA2 GLY 21 HA2 GLY 21 1.769 10.331 -22.062 810 HA3 GLY 21 HA3 GLY 21 0.310 9.360 -22.122 811 H THR 22 H THR 22 0.493 10.679 -19.054 812 HA THR 22 HA THR 22 -0.998 13.165 -19.752 813 HB THR 22 HB THR 22 -2.408 12.861 -17.728 814 HG1 THR 22 HG1 THR 22 -1.211 10.286 -17.489 815 HG21 THR 22 HG21 THR 22 -2.518 10.384 -19.496 816 HG22 THR 22 HG22 THR 22 -3.300 11.928 -19.844 817 HG23 THR 22 HG23 THR 22 -3.821 10.971 -18.456 818 H GLU 23 H GLU 23 -1.056 14.687 -17.872 819 HA GLU 23 HA GLU 23 1.615 15.215 -16.915 820 HB2 GLU 23 HB2 GLU 23 0.771 17.393 -16.230 821 HB3 GLU 23 HB3 GLU 23 0.220 17.031 -17.858 822 HG2 GLU 23 HG2 GLU 23 -1.481 16.779 -15.351 823 HG3 GLU 23 HG3 GLU 23 -1.473 18.165 -16.430 824 H GLY 24 H GLY 24 -0.978 13.490 -15.556 825 HA2 GLY 24 HA2 GLY 24 -0.394 12.370 -13.399 826 HA3 GLY 24 HA3 GLY 24 -0.016 13.962 -12.764 827 H LEU 25 H LEU 25 -1.988 11.919 -11.829 828 HA LEU 25 HA LEU 25 -4.537 13.437 -12.088 829 HB2 LEU 25 HB2 LEU 25 -4.331 10.393 -12.025 830 HB3 LEU 25 HB3 LEU 25 -5.804 11.334 -12.134 831 HG LEU 25 HG LEU 25 -4.770 12.185 -14.425 832 HD11 LEU 25 HD11 LEU 25 -3.389 10.525 -15.583 833 HD12 LEU 25 HD12 LEU 25 -3.266 9.573 -14.103 834 HD13 LEU 25 HD13 LEU 25 -2.555 11.187 -14.177 835 HD21 LEU 25 HD21 LEU 25 -5.925 9.390 -14.148 836 HD22 LEU 25 HD22 LEU 25 -5.862 10.337 -15.638 837 HD23 LEU 25 HD23 LEU 25 -6.842 10.895 -14.283 838 H THR 26 H THR 26 -6.086 13.099 -10.339 839 HA THR 26 HA THR 26 -4.957 12.512 -7.690 840 HB THR 26 HB THR 26 -7.146 13.207 -6.779 841 HG1 THR 26 HG1 THR 26 -8.844 13.020 -8.003 842 HG21 THR 26 HG21 THR 26 -5.520 14.995 -7.268 843 HG22 THR 26 HG22 THR 26 -7.175 15.560 -7.509 844 HG23 THR 26 HG23 THR 26 -6.173 15.154 -8.903 845 H GLN 27 H GLN 27 -6.312 11.058 -6.196 846 HA GLN 27 HA GLN 27 -5.931 8.468 -7.055 847 HB2 GLN 27 HB2 GLN 27 -7.052 7.726 -4.981 848 HB3 GLN 27 HB3 GLN 27 -5.916 9.038 -4.711 849 HG2 GLN 27 HG2 GLN 27 -7.780 10.632 -4.557 850 HG3 GLN 27 HG3 GLN 27 -8.933 9.332 -4.853 851 HE21 GLN 27 HE21 GLN 27 -7.545 7.388 -3.154 852 HE22 GLN 27 HE22 GLN 27 -7.815 7.894 -1.528 853 H LYS 28 H LYS 28 -9.141 10.088 -6.880 854 HA LYS 28 HA LYS 28 -10.697 7.863 -7.736 855 HB2 LYS 28 HB2 LYS 28 -11.286 10.839 -7.966 856 HB3 LYS 28 HB3 LYS 28 -12.470 9.564 -8.260 857 HG2 LYS 28 HG2 LYS 28 -12.186 8.809 -5.897 858 HG3 LYS 28 HG3 LYS 28 -11.087 10.163 -5.627 859 HD2 LYS 28 HD2 LYS 28 -13.212 10.847 -4.777 860 HD3 LYS 28 HD3 LYS 28 -12.990 11.715 -6.293 861 HE2 LYS 28 HE2 LYS 28 -14.646 9.173 -6.037 862 HE3 LYS 28 HE3 LYS 28 -15.317 10.795 -5.909 863 HZ1 LYS 28 HZ1 LYS 28 -14.470 11.202 -8.188 864 HZ2 LYS 28 HZ2 LYS 28 -15.664 10.012 -8.097 865 HZ3 LYS 28 HZ3 LYS 28 -14.048 9.569 -8.292 866 H GLN 29 H GLN 29 -9.141 10.466 -9.579 867 HA GLN 29 HA GLN 29 -10.206 9.855 -12.152 868 HB2 GLN 29 HB2 GLN 29 -7.622 11.285 -11.395 869 HB3 GLN 29 HB3 GLN 29 -8.332 11.283 -13.007 870 HG2 GLN 29 HG2 GLN 29 -9.732 12.413 -10.564 871 HG3 GLN 29 HG3 GLN 29 -8.705 13.370 -11.628 872 HE21 GLN 29 HE21 GLN 29 -10.418 14.735 -12.172 873 HE22 GLN 29 HE22 GLN 29 -11.698 14.243 -13.219 874 H ILE 30 H ILE 30 -7.379 8.708 -10.388 875 HA ILE 30 HA ILE 30 -6.190 7.158 -12.481 876 HB ILE 30 HB ILE 30 -5.971 6.783 -9.458 877 HG12 ILE 30 HG12 ILE 30 -4.106 8.334 -11.312 878 HG13 ILE 30 HG13 ILE 30 -5.345 9.088 -10.318 879 HG21 ILE 30 HG21 ILE 30 -5.196 4.790 -10.677 880 HG22 ILE 30 HG22 ILE 30 -3.827 5.634 -9.952 881 HG23 ILE 30 HG23 ILE 30 -4.141 5.790 -11.682 882 HD11 ILE 30 HD11 ILE 30 -4.217 8.284 -8.305 883 HD12 ILE 30 HD12 ILE 30 -3.180 9.298 -9.308 884 HD13 ILE 30 HD13 ILE 30 -2.963 7.549 -9.311 885 H LYS 31 H LYS 31 -8.426 6.365 -9.805 886 HA LYS 31 HA LYS 31 -8.771 3.609 -10.305 887 HB2 LYS 31 HB2 LYS 31 -10.628 5.629 -9.002 888 HB3 LYS 31 HB3 LYS 31 -10.967 3.900 -9.042 889 HG2 LYS 31 HG2 LYS 31 -8.928 3.446 -7.751 890 HG3 LYS 31 HG3 LYS 31 -8.526 5.162 -7.753 891 HD2 LYS 31 HD2 LYS 31 -9.470 4.662 -5.607 892 HD3 LYS 31 HD3 LYS 31 -10.674 5.596 -6.491 893 HE2 LYS 31 HE2 LYS 31 -10.726 2.562 -6.235 894 HE3 LYS 31 HE3 LYS 31 -11.594 3.656 -5.164 895 HZ1 LYS 31 HZ1 LYS 31 -12.746 4.498 -7.198 896 HZ2 LYS 31 HZ2 LYS 31 -13.111 2.909 -6.762 897 HZ3 LYS 31 HZ3 LYS 31 -12.059 3.209 -8.050 898 H LYS 32 H LYS 32 -10.223 6.404 -11.871 899 HA LYS 32 HA LYS 32 -12.200 5.088 -13.431 900 HB2 LYS 32 HB2 LYS 32 -10.660 7.680 -13.704 901 HB3 LYS 32 HB3 LYS 32 -11.705 7.149 -15.014 902 HG2 LYS 32 HG2 LYS 32 -12.664 7.572 -12.161 903 HG3 LYS 32 HG3 LYS 32 -12.738 8.802 -13.431 904 HD2 LYS 32 HD2 LYS 32 -14.128 7.196 -14.805 905 HD3 LYS 32 HD3 LYS 32 -14.157 6.102 -13.418 906 HE2 LYS 32 HE2 LYS 32 -15.382 7.753 -12.098 907 HE3 LYS 32 HE3 LYS 32 -15.234 8.949 -13.389 908 HZ1 LYS 32 HZ1 LYS 32 -17.398 7.933 -13.419 909 HZ2 LYS 32 HZ2 LYS 32 -16.728 6.390 -13.545 910 HZ3 LYS 32 HZ3 LYS 32 -16.554 7.490 -14.815 911 H ALA 33 H ALA 33 -8.825 6.018 -14.268 912 HA ALA 33 HA ALA 33 -8.850 4.900 -16.892 913 HB1 ALA 33 HB1 ALA 33 -7.339 6.729 -16.244 914 HB2 ALA 33 HB2 ALA 33 -6.430 5.367 -16.900 915 HB3 ALA 33 HB3 ALA 33 -6.470 5.646 -15.156 916 H THR 34 H THR 34 -7.697 3.650 -13.787 917 HA THR 34 HA THR 34 -6.649 1.149 -14.784 918 HB THR 34 HB THR 34 -6.386 0.528 -12.393 919 HG1 THR 34 HG1 THR 34 -7.103 2.890 -11.267 920 HG21 THR 34 HG21 THR 34 -4.856 2.314 -11.680 921 HG22 THR 34 HG22 THR 34 -5.516 3.396 -12.908 922 HG23 THR 34 HG23 THR 34 -4.628 1.948 -13.391 923 H LYS 35 H LYS 35 -9.727 2.327 -13.783 924 HA LYS 35 HA LYS 35 -11.809 1.512 -13.610 925 HB2 LYS 35 HB2 LYS 35 -10.719 -0.939 -15.056 926 HB3 LYS 35 HB3 LYS 35 -12.426 -0.561 -14.836 927 HG2 LYS 35 HG2 LYS 35 -12.058 1.561 -16.155 928 HG3 LYS 35 HG3 LYS 35 -10.406 1.026 -16.462 929 HD2 LYS 35 HD2 LYS 35 -11.728 0.487 -18.405 930 HD3 LYS 35 HD3 LYS 35 -11.349 -1.030 -17.585 931 HE2 LYS 35 HE2 LYS 35 -13.686 -1.022 -18.335 932 HE3 LYS 35 HE3 LYS 35 -13.622 -1.032 -16.575 933 HZ1 LYS 35 HZ1 LYS 35 -14.073 1.344 -16.577 934 HZ2 LYS 35 HZ2 LYS 35 -15.282 0.513 -17.417 935 HZ3 LYS 35 HZ3 LYS 35 -14.098 1.362 -18.267 936 H LEU 36 H LEU 36 -9.865 1.099 -11.507 937 HA LEU 36 HA LEU 36 -10.541 -1.396 -10.138 938 HB2 LEU 36 HB2 LEU 36 -8.841 0.976 -9.260 939 HB3 LEU 36 HB3 LEU 36 -9.113 -0.444 -8.260 940 HG LEU 36 HG LEU 36 -7.650 -0.392 -10.933 941 HD11 LEU 36 HD11 LEU 36 -5.644 -0.951 -9.639 942 HD12 LEU 36 HD12 LEU 36 -6.565 -0.860 -8.136 943 HD13 LEU 36 HD13 LEU 36 -6.329 0.589 -9.118 944 HD21 LEU 36 HD21 LEU 36 -7.125 -2.771 -10.529 945 HD22 LEU 36 HD22 LEU 36 -8.857 -2.504 -10.711 946 HD23 LEU 36 HD23 LEU 36 -8.171 -2.760 -9.104 947 H LYS 37 H LYS 37 -12.241 -1.640 -8.814 948 HA LYS 37 HA LYS 37 -13.958 0.557 -8.033 949 HB2 LYS 37 HB2 LYS 37 -14.066 -2.404 -7.314 950 HB3 LYS 37 HB3 LYS 37 -15.312 -1.227 -6.901 951 HG2 LYS 37 HG2 LYS 37 -15.685 -0.816 -9.335 952 HG3 LYS 37 HG3 LYS 37 -14.499 -2.071 -9.710 953 HD2 LYS 37 HD2 LYS 37 -17.085 -2.504 -8.150 954 HD3 LYS 37 HD3 LYS 37 -16.867 -2.867 -9.863 955 HE2 LYS 37 HE2 LYS 37 -15.327 -4.169 -7.586 956 HE3 LYS 37 HE3 LYS 37 -16.689 -4.892 -8.442 957 HZ1 LYS 37 HZ1 LYS 37 -14.546 -5.684 -9.262 958 HZ2 LYS 37 HZ2 LYS 37 -14.110 -4.112 -9.692 959 HZ3 LYS 37 HZ3 LYS 37 -15.404 -4.870 -10.469 960 H ALA 38 H ALA 38 -11.880 -1.788 -6.275 961 HA ALA 38 HA ALA 38 -12.253 -0.546 -3.702 962 HB1 ALA 38 HB1 ALA 38 -10.239 -2.647 -4.585 963 HB2 ALA 38 HB2 ALA 38 -11.844 -2.964 -3.919 964 HB3 ALA 38 HB3 ALA 38 -10.610 -2.200 -2.914 965 H ASP 39 H ASP 39 -11.160 1.123 -2.874 966 HA ASP 39 HA ASP 39 -8.992 2.523 -4.058 967 HB2 ASP 39 HB2 ASP 39 -9.950 2.475 -1.164 968 HB3 ASP 39 HB3 ASP 39 -8.845 3.674 -1.840 969 H LYS 40 H LYS 40 -9.096 -0.264 -1.997 970 HA LYS 40 HA LYS 40 -6.588 0.038 -0.680 971 HB2 LYS 40 HB2 LYS 40 -8.077 -2.593 -0.994 972 HB3 LYS 40 HB3 LYS 40 -7.036 -2.076 0.333 973 HG2 LYS 40 HG2 LYS 40 -9.824 -1.086 -0.328 974 HG3 LYS 40 HG3 LYS 40 -9.319 -2.002 1.092 975 HD2 LYS 40 HD2 LYS 40 -8.002 -0.052 1.868 976 HD3 LYS 40 HD3 LYS 40 -8.473 0.852 0.427 977 HE2 LYS 40 HE2 LYS 40 -9.827 1.540 2.325 978 HE3 LYS 40 HE3 LYS 40 -10.842 0.714 1.144 979 HZ1 LYS 40 HZ1 LYS 40 -9.754 -0.467 3.649 980 HZ2 LYS 40 HZ2 LYS 40 -10.694 -1.290 2.508 981 HZ3 LYS 40 HZ3 LYS 40 -11.356 -0.001 3.372 982 H ASP 41 H ASP 41 -7.633 -1.870 -3.489 983 HA ASP 41 HA ASP 41 -5.125 -3.033 -4.142 984 HB2 ASP 41 HB2 ASP 41 -7.571 -2.389 -5.831 985 HB3 ASP 41 HB3 ASP 41 -6.165 -3.235 -6.473 986 H PHE 42 H PHE 42 -6.574 0.106 -4.926 987 HA PHE 42 HA PHE 42 -4.538 1.090 -6.633 988 HB2 PHE 42 HB2 PHE 42 -6.569 2.318 -6.665 989 HB3 PHE 42 HB3 PHE 42 -6.642 2.432 -4.911 990 HD1 PHE 42 HD2 PHE 42 -4.648 3.633 -7.858 991 HD2 PHE 42 HD1 PHE 42 -5.861 4.394 -3.824 992 HE1 PHE 42 HE2 PHE 42 -3.566 5.834 -7.937 993 HE2 PHE 42 HE1 PHE 42 -4.765 6.591 -3.914 994 HZ PHE 42 HZ PHE 42 -3.617 7.314 -5.970 995 H PHE 43 H PHE 43 -4.832 1.155 -3.045 996 HA PHE 43 HA PHE 43 -2.544 2.814 -2.576 997 HB2 PHE 43 HB2 PHE 43 -3.842 0.825 -0.664 998 HB3 PHE 43 HB3 PHE 43 -2.692 2.080 -0.205 999 HD1 PHE 43 HD1 PHE 43 -3.698 4.435 -1.726 1000 HD2 PHE 43 HD2 PHE 43 -5.843 1.425 0.426 1001 HE1 PHE 43 HE1 PHE 43 -5.544 6.012 -1.356 1002 HE2 PHE 43 HE2 PHE 43 -7.691 2.993 0.778 1003 HZ PHE 43 HZ PHE 43 -7.546 5.295 -0.106 1004 H LEU 44 H LEU 44 -2.941 -0.724 -2.697 1005 HA LEU 44 HA LEU 44 -0.278 -1.440 -1.968 1006 HB2 LEU 44 HB2 LEU 44 -2.580 -2.882 -3.277 1007 HB3 LEU 44 HB3 LEU 44 -0.995 -3.622 -3.377 1008 HG LEU 44 HG LEU 44 -0.843 -3.717 -0.912 1009 HD11 LEU 44 HD11 LEU 44 -2.170 -1.758 -0.296 1010 HD12 LEU 44 HD12 LEU 44 -2.729 -3.198 0.549 1011 HD13 LEU 44 HD13 LEU 44 -3.645 -2.572 -0.824 1012 HD21 LEU 44 HD21 LEU 44 -1.790 -5.639 -2.112 1013 HD22 LEU 44 HD22 LEU 44 -3.413 -4.962 -1.944 1014 HD23 LEU 44 HD23 LEU 44 -2.512 -5.466 -0.512 1015 H GLY 45 H GLY 45 -1.820 -0.843 -5.125 1016 HA2 GLY 45 HA2 GLY 45 0.413 -1.445 -6.788 1017 HA3 GLY 45 HA3 GLY 45 -0.966 -0.450 -7.224 1018 H LEU 46 H LEU 46 -0.800 1.678 -5.547 1019 HA LEU 46 HA LEU 46 1.170 3.361 -6.717 1020 HB2 LEU 46 HB2 LEU 46 -1.033 4.162 -5.917 1021 HB3 LEU 46 HB3 LEU 46 -0.573 3.804 -4.262 1022 HG LEU 46 HG LEU 46 1.223 5.558 -4.416 1023 HD11 LEU 46 HD11 LEU 46 1.616 5.559 -6.818 1024 HD12 LEU 46 HD12 LEU 46 1.203 7.178 -6.262 1025 HD13 LEU 46 HD13 LEU 46 -0.002 6.206 -7.113 1026 HD21 LEU 46 HD21 LEU 46 -0.272 7.497 -4.246 1027 HD22 LEU 46 HD22 LEU 46 -0.949 6.101 -3.411 1028 HD23 LEU 46 HD23 LEU 46 -1.581 6.574 -4.990 1029 H GLY 47 H GLY 47 1.051 1.578 -3.712 1030 HA2 GLY 47 HA2 GLY 47 3.297 2.679 -2.347 1031 HA3 GLY 47 HA3 GLY 47 2.594 1.090 -2.070 1032 H TRP 48 H TRP 48 2.946 0.168 -4.780 1033 HA TRP 48 HA TRP 48 5.661 -0.753 -4.740 1034 HB2 TRP 48 HB2 TRP 48 3.602 -2.046 -5.568 1035 HB3 TRP 48 HB3 TRP 48 3.674 -1.060 -7.025 1036 HD1 TRP 48 HD1 TRP 48 5.750 -1.556 -8.732 1037 HE1 TRP 48 HE1 TRP 48 7.343 -3.557 -8.940 1038 HE3 TRP 48 HE3 TRP 48 4.761 -3.843 -4.268 1039 HZ2 TRP 48 HZ2 TRP 48 8.079 -5.806 -7.422 1040 HZ3 TRP 48 HZ3 TRP 48 5.945 -5.934 -3.725 1041 HH2 TRP 48 HH2 TRP 48 7.567 -6.903 -5.281 1042 H LEU 49 H LEU 49 3.887 1.714 -6.588 1043 HA LEU 49 HA LEU 49 5.947 2.499 -8.374 1044 HB2 LEU 49 HB2 LEU 49 3.509 3.876 -7.244 1045 HB3 LEU 49 HB3 LEU 49 4.659 4.823 -8.161 1046 HG LEU 49 HG LEU 49 4.226 3.594 -10.190 1047 HD11 LEU 49 HD11 LEU 49 2.686 1.703 -10.326 1048 HD12 LEU 49 HD12 LEU 49 2.525 1.706 -8.564 1049 HD13 LEU 49 HD13 LEU 49 4.083 1.344 -9.312 1050 HD21 LEU 49 HD21 LEU 49 1.568 4.106 -8.808 1051 HD22 LEU 49 HD22 LEU 49 1.842 4.017 -10.553 1052 HD23 LEU 49 HD23 LEU 49 2.556 5.325 -9.619 1053 H LEU 50 H LEU 50 5.353 3.309 -4.990 1054 HA LEU 50 HA LEU 50 7.301 5.356 -4.664 1055 HB2 LEU 50 HB2 LEU 50 6.101 3.434 -2.636 1056 HB3 LEU 50 HB3 LEU 50 7.129 4.791 -2.200 1057 HG LEU 50 HG LEU 50 4.404 5.005 -3.548 1058 HD11 LEU 50 HD11 LEU 50 4.190 4.279 -1.226 1059 HD12 LEU 50 HD12 LEU 50 3.619 5.935 -1.411 1060 HD13 LEU 50 HD13 LEU 50 5.197 5.623 -0.681 1061 HD21 LEU 50 HD21 LEU 50 4.621 7.436 -3.167 1062 HD22 LEU 50 HD22 LEU 50 5.869 6.830 -4.252 1063 HD23 LEU 50 HD23 LEU 50 6.267 7.200 -2.571 1064 H ARG 51 H ARG 51 7.531 1.780 -4.262 1065 HA ARG 51 HA ARG 51 10.201 1.873 -3.196 1066 HB2 ARG 51 HB2 ARG 51 10.218 -0.592 -3.370 1067 HB3 ARG 51 HB3 ARG 51 8.804 0.033 -2.554 1068 HG2 ARG 51 HG2 ARG 51 7.914 -1.709 -3.813 1069 HG3 ARG 51 HG3 ARG 51 7.593 -0.315 -4.836 1070 HD2 ARG 51 HD2 ARG 51 8.368 -2.127 -6.218 1071 HD3 ARG 51 HD3 ARG 51 9.632 -0.894 -6.174 1072 HE ARG 51 HE ARG 51 9.717 -3.338 -4.503 1073 HH11 ARG 51 HH11 ARG 51 11.349 -1.116 -6.599 1074 HH12 ARG 51 HH12 ARG 51 12.824 -2.010 -6.551 1075 HH21 ARG 51 HH21 ARG 51 11.623 -4.424 -4.430 1076 HH22 ARG 51 HH22 ARG 51 12.976 -3.857 -5.341 1077 H GLU 52 H GLU 52 9.047 2.007 -6.426 1078 HA GLU 52 HA GLU 52 11.768 1.567 -7.505 1079 HB2 GLU 52 HB2 GLU 52 9.093 1.887 -8.925 1080 HB3 GLU 52 HB3 GLU 52 10.645 1.692 -9.744 1081 HG2 GLU 52 HG2 GLU 52 10.912 -0.525 -8.624 1082 HG3 GLU 52 HG3 GLU 52 9.305 -0.332 -7.924 1083 H ASP 53 H ASP 53 9.656 4.104 -6.545 1084 HA ASP 53 HA ASP 53 9.655 6.343 -6.658 1085 HB2 ASP 53 HB2 ASP 53 12.583 5.797 -7.180 1086 HB3 ASP 53 HB3 ASP 53 11.983 7.452 -7.222 1087 H LYS 54 H LYS 54 8.747 4.936 -8.949 1088 HA LYS 54 HA LYS 54 9.533 6.484 -11.305 1089 HB2 LYS 54 HB2 LYS 54 7.245 4.496 -10.936 1090 HB3 LYS 54 HB3 LYS 54 7.783 5.172 -12.476 1091 HG2 LYS 54 HG2 LYS 54 9.977 4.062 -12.188 1092 HG3 LYS 54 HG3 LYS 54 9.424 3.370 -10.662 1093 HD2 LYS 54 HD2 LYS 54 8.293 2.799 -13.433 1094 HD3 LYS 54 HD3 LYS 54 9.293 1.711 -12.463 1095 HE2 LYS 54 HE2 LYS 54 7.460 1.692 -10.731 1096 HE3 LYS 54 HE3 LYS 54 6.465 2.636 -11.845 1097 HZ1 LYS 54 HZ1 LYS 54 7.496 -0.109 -12.206 1098 HZ2 LYS 54 HZ2 LYS 54 6.834 0.793 -13.471 1099 HZ3 LYS 54 HZ3 LYS 54 5.883 0.398 -12.130 1100 H VAL 55 H VAL 55 7.666 7.157 -8.640 1101 HA VAL 55 HA VAL 55 6.142 9.240 -10.083 1102 HB VAL 55 HB VAL 55 4.230 8.956 -8.538 1103 HG11 VAL 55 HG11 VAL 55 4.109 7.913 -10.748 1104 HG12 VAL 55 HG12 VAL 55 3.252 6.939 -9.551 1105 HG13 VAL 55 HG13 VAL 55 4.849 6.438 -10.113 1106 HG21 VAL 55 HG21 VAL 55 4.000 6.925 -7.131 1107 HG22 VAL 55 HG22 VAL 55 5.368 7.914 -6.617 1108 HG23 VAL 55 HG23 VAL 55 5.647 6.443 -7.554 1109 H VAL 56 H VAL 56 5.632 11.114 -8.917 1110 HA VAL 56 HA VAL 56 6.764 11.485 -6.210 1111 HB VAL 56 HB VAL 56 6.068 13.605 -8.305 1112 HG11 VAL 56 HG11 VAL 56 6.890 15.299 -6.681 1113 HG12 VAL 56 HG12 VAL 56 7.095 14.041 -5.462 1114 HG13 VAL 56 HG13 VAL 56 5.480 14.444 -6.047 1115 HG21 VAL 56 HG21 VAL 56 8.767 12.855 -7.104 1116 HG22 VAL 56 HG22 VAL 56 8.484 14.142 -8.280 1117 HG23 VAL 56 HG23 VAL 56 8.219 12.460 -8.735 1118 H THR 57 H THR 57 5.303 11.580 -4.596 1119 HA THR 57 HA THR 57 2.404 11.714 -5.234 1120 HB THR 57 HB THR 57 2.111 10.544 -2.987 1121 HG1 THR 57 HG1 THR 57 4.157 11.068 -2.092 1122 HG21 THR 57 HG21 THR 57 2.805 8.299 -3.774 1123 HG22 THR 57 HG22 THR 57 3.759 9.044 -5.059 1124 HG23 THR 57 HG23 THR 57 2.000 9.215 -5.050 1125 H SER 58 H SER 58 1.049 13.009 -4.036 1126 HA SER 58 HA SER 58 1.962 14.676 -1.827 1127 HB2 SER 58 HB2 SER 58 1.379 16.821 -2.922 1128 HB3 SER 58 HB3 SER 58 2.633 16.006 -3.849 1129 HG SER 58 HG SER 58 0.852 15.196 -5.185 1130 H GLU 59 H GLU 59 0.021 16.173 -1.151 1131 HA GLU 59 HA GLU 59 -2.553 14.737 -1.550 1132 HB2 GLU 59 HB2 GLU 59 -1.591 14.393 0.756 1133 HB3 GLU 59 HB3 GLU 59 -1.691 16.130 1.027 1134 HG2 GLU 59 HG2 GLU 59 -4.135 16.053 0.790 1135 HG3 GLU 59 HG3 GLU 59 -4.067 14.332 0.419 1136 H VAL 60 H VAL 60 -3.901 15.942 -2.632 1137 HA VAL 60 HA VAL 60 -3.872 18.911 -2.457 1138 HB VAL 60 HB VAL 60 -4.104 17.193 -4.972 1139 HG11 VAL 60 HG11 VAL 60 -4.662 20.182 -4.745 1140 HG12 VAL 60 HG12 VAL 60 -5.834 18.930 -5.162 1141 HG13 VAL 60 HG13 VAL 60 -4.504 19.291 -6.262 1142 HG21 VAL 60 HG21 VAL 60 -2.174 19.421 -4.215 1143 HG22 VAL 60 HG22 VAL 60 -2.179 18.555 -5.755 1144 HG23 VAL 60 HG23 VAL 60 -1.799 17.694 -4.261 1145 H GLU 61 H GLU 61 -5.687 19.665 -1.736 1146 HA GLU 61 HA GLU 61 -7.803 19.934 -0.986 1147 HB2 GLU 61 HB2 GLU 61 -8.490 18.919 -3.768 1148 HB3 GLU 61 HB3 GLU 61 -9.474 19.990 -2.771 1149 HG2 GLU 61 HG2 GLU 61 -7.638 21.701 -2.898 1150 HG3 GLU 61 HG3 GLU 61 -6.759 20.627 -3.969 1151 H GLY 62 H GLY 62 -6.802 17.364 -0.188 1152 HA2 GLY 62 HA2 GLY 62 -7.773 15.816 1.276 1153 HA3 GLY 62 HA3 GLY 62 -9.337 16.106 0.549 1154 H GLU 63 H GLU 63 -7.186 15.504 -1.951 1155 HA GLU 63 HA GLU 63 -7.549 12.546 -1.890 1156 HB2 GLU 63 HB2 GLU 63 -7.627 14.480 -4.241 1157 HB3 GLU 63 HB3 GLU 63 -7.367 12.750 -4.458 1158 HG2 GLU 63 HG2 GLU 63 -9.560 12.324 -3.332 1159 HG3 GLU 63 HG3 GLU 63 -9.823 14.072 -3.272 1160 H ILE 64 H ILE 64 -5.877 11.261 -2.860 1161 HA ILE 64 HA ILE 64 -3.168 12.264 -2.603 1162 HB ILE 64 HB ILE 64 -4.117 9.587 -3.728 1163 HG12 ILE 64 HG12 ILE 64 -3.229 10.256 -0.880 1164 HG13 ILE 64 HG13 ILE 64 -4.883 9.916 -1.378 1165 HG21 ILE 64 HG21 ILE 64 -1.814 8.794 -3.244 1166 HG22 ILE 64 HG22 ILE 64 -1.358 10.422 -2.742 1167 HG23 ILE 64 HG23 ILE 64 -1.816 10.113 -4.417 1168 HD11 ILE 64 HD11 ILE 64 -2.573 7.966 -1.455 1169 HD12 ILE 64 HD12 ILE 64 -4.229 7.620 -1.962 1170 HD13 ILE 64 HD13 ILE 64 -3.884 8.002 -0.276 1171 H PHE 65 H PHE 65 -2.480 13.659 -4.158 1172 HA PHE 65 HA PHE 65 -3.054 13.166 -7.023 1173 HB2 PHE 65 HB2 PHE 65 -3.490 15.459 -6.187 1174 HB3 PHE 65 HB3 PHE 65 -1.816 15.601 -5.657 1175 HD1 PHE 65 HD2 PHE 65 -3.892 15.041 -8.729 1176 HD2 PHE 65 HD1 PHE 65 -0.185 16.488 -7.162 1177 HE1 PHE 65 HE2 PHE 65 -3.283 15.889 -10.951 1178 HE2 PHE 65 HE1 PHE 65 0.419 17.332 -9.396 1179 HZ PHE 65 HZ PHE 65 -1.131 17.032 -11.286 1180 H VAL 66 H VAL 66 -1.507 12.313 -8.312 1181 HA VAL 66 HA VAL 66 1.318 12.319 -7.480 1182 HB VAL 66 HB VAL 66 0.460 10.309 -6.465 1183 HG11 VAL 66 HG11 VAL 66 -1.601 10.009 -7.753 1184 HG12 VAL 66 HG12 VAL 66 -0.677 8.507 -7.703 1185 HG13 VAL 66 HG13 VAL 66 -0.669 9.499 -9.164 1186 HG21 VAL 66 HG21 VAL 66 1.824 8.564 -7.523 1187 HG22 VAL 66 HG22 VAL 66 2.685 10.103 -7.488 1188 HG23 VAL 66 HG23 VAL 66 1.955 9.538 -8.992 1189 H LYS 67 H LYS 67 2.847 12.102 -9.121 1190 HA LYS 67 HA LYS 67 1.920 12.059 -11.967 1191 HB2 LYS 67 HB2 LYS 67 4.089 13.857 -10.770 1192 HB3 LYS 67 HB3 LYS 67 3.637 13.801 -12.472 1193 HG2 LYS 67 HG2 LYS 67 1.407 14.697 -11.906 1194 HG3 LYS 67 HG3 LYS 67 1.852 14.741 -10.195 1195 HD2 LYS 67 HD2 LYS 67 3.261 16.299 -12.406 1196 HD3 LYS 67 HD3 LYS 67 2.023 16.968 -11.340 1197 HE2 LYS 67 HE2 LYS 67 3.488 16.574 -9.386 1198 HE3 LYS 67 HE3 LYS 67 4.711 15.862 -10.442 1199 HZ1 LYS 67 HZ1 LYS 67 4.979 17.956 -11.544 1200 HZ2 LYS 67 HZ2 LYS 67 5.162 18.186 -9.876 1201 HZ3 LYS 67 HZ3 LYS 67 3.730 18.654 -10.642 1202 H LEU 68 H LEU 68 3.705 11.296 -13.510 1203 HA LEU 68 HA LEU 68 5.451 9.283 -12.322 1204 HB2 LEU 68 HB2 LEU 68 5.150 10.191 -15.211 1205 HB3 LEU 68 HB3 LEU 68 6.218 8.894 -14.704 1206 HG LEU 68 HG LEU 68 3.176 8.894 -14.576 1207 HD11 LEU 68 HD11 LEU 68 3.320 7.070 -16.214 1208 HD12 LEU 68 HD12 LEU 68 5.080 7.220 -16.249 1209 HD13 LEU 68 HD13 LEU 68 4.068 8.545 -16.830 1210 HD21 LEU 68 HD21 LEU 68 5.096 6.731 -13.635 1211 HD22 LEU 68 HD22 LEU 68 3.340 6.567 -13.760 1212 HD23 LEU 68 HD23 LEU 68 4.036 7.713 -12.617 1213 H VAL 69 H VAL 69 6.562 11.030 -10.998 1214 HA VAL 69 HA VAL 69 8.142 12.580 -10.464 1215 HB VAL 69 HB VAL 69 9.898 11.120 -12.500 1216 HG11 VAL 69 HG11 VAL 69 11.756 11.596 -10.908 1217 HG12 VAL 69 HG12 VAL 69 10.639 12.474 -9.860 1218 HG13 VAL 69 HG13 VAL 69 11.006 13.093 -11.470 1219 HG21 VAL 69 HG21 VAL 69 9.241 10.280 -9.657 1220 HG22 VAL 69 HG22 VAL 69 10.443 9.518 -10.703 1221 HG23 VAL 69 HG23 VAL 69 8.735 9.459 -11.137 1222 H LEU 70 H LEU 70 6.346 13.426 -12.559 1223 HA LEU 70 HA LEU 70 7.725 14.805 -14.663 1224 HB2 LEU 70 HB2 LEU 70 4.841 15.029 -13.695 1225 HB3 LEU 70 HB3 LEU 70 5.457 15.703 -15.201 1226 HG LEU 70 HG LEU 70 5.420 12.726 -14.543 1227 HD11 LEU 70 HD11 LEU 70 3.136 13.566 -14.741 1228 HD12 LEU 70 HD12 LEU 70 3.549 12.501 -16.079 1229 HD13 LEU 70 HD13 LEU 70 3.504 14.250 -16.327 1230 HD21 LEU 70 HD21 LEU 70 5.929 12.362 -16.911 1231 HD22 LEU 70 HD22 LEU 70 7.188 13.329 -16.148 1232 HD23 LEU 70 HD23 LEU 70 5.993 14.106 -17.191 1233 H GLU 71 H GLU 71 9.111 16.327 -13.965 1234 HA GLU 71 HA GLU 71 10.032 18.209 -13.144 1235 HB2 GLU 71 HB2 GLU 71 7.156 19.220 -13.073 1236 HB3 GLU 71 HB3 GLU 71 8.560 20.228 -12.767 1237 HG2 GLU 71 HG2 GLU 71 7.843 20.631 -15.014 1238 HG3 GLU 71 HG3 GLU 71 9.377 19.766 -15.071 1239 H HIS 72 H HIS 72 10.821 17.133 -11.265 1240 HA HIS 72 HA HIS 72 9.371 17.402 -8.741 1241 HB2 HIS 72 HB2 HIS 72 10.787 15.414 -9.074 1242 HB3 HIS 72 HB3 HIS 72 12.205 16.425 -9.319 1243 HD1 HIS 72 HD1 HIS 72 9.998 15.029 -6.622 1244 HD2 HIS 72 HD2 HIS 72 13.360 17.458 -6.934 1245 HE1 HIS 72 HE1 HIS 72 10.882 15.255 -4.286 1246 HE2 HIS 72 HE2 HIS 72 12.872 16.782 -4.486 1247 H HIS 73 H HIS 73 9.132 19.516 -8.198 1248 HA HIS 73 HA HIS 73 11.547 21.134 -7.628 1249 HB2 HIS 73 HB2 HIS 73 9.037 22.103 -9.074 1250 HB3 HIS 73 HB3 HIS 73 10.220 23.196 -8.363 1251 HD1 HIS 73 HD1 HIS 73 12.542 23.355 -9.535 1252 HD2 HIS 73 HD2 HIS 73 9.790 20.966 -11.532 1253 HE1 HIS 73 HE1 HIS 73 13.492 23.018 -11.831 1254 HE2 HIS 73 HE2 HIS 73 11.933 21.376 -12.920 1255 H HIS 74 H HIS 74 10.865 23.107 -6.211 1256 HA HIS 74 HA HIS 74 9.308 22.239 -3.929 1257 HB2 HIS 74 HB2 HIS 74 10.699 24.873 -4.580 1258 HB3 HIS 74 HB3 HIS 74 9.830 24.588 -3.076 1259 HD1 HIS 74 HD1 HIS 74 10.905 23.004 -1.357 1260 HD2 HIS 74 HD2 HIS 74 13.225 23.630 -4.741 1261 HE1 HIS 74 HE1 HIS 74 13.172 22.098 -0.788 1262 HE2 HIS 74 HE2 HIS 74 14.610 22.722 -2.755 1263 H HIS 75 H HIS 75 7.162 22.429 -3.739 1264 HA HIS 75 HA HIS 75 5.501 23.717 -5.665 1265 HB2 HIS 75 HB2 HIS 75 3.602 23.092 -4.131 1266 HB3 HIS 75 HB3 HIS 75 4.650 21.745 -4.548 1267 HD1 HIS 75 HD1 HIS 75 5.860 20.565 -2.655 1268 HD2 HIS 75 HD2 HIS 75 3.773 23.923 -1.380 1269 HE1 HIS 75 HE1 HIS 75 5.850 20.433 -0.156 1270 HE2 HIS 75 HE2 HIS 75 4.745 22.560 0.595 1271 H HIS 76 H HIS 76 4.334 25.600 -5.597 1272 HA HIS 76 HA HIS 76 5.343 27.724 -3.862 1273 HB2 HIS 76 HB2 HIS 76 3.463 27.838 -6.263 1274 HB3 HIS 76 HB3 HIS 76 4.098 29.245 -5.413 1275 HD1 HIS 76 HD1 HIS 76 6.250 30.169 -6.289 1276 HD2 HIS 76 HD2 HIS 76 5.605 26.260 -7.558 1277 HE1 HIS 76 HE1 HIS 76 8.096 29.673 -7.913 1278 HE2 HIS 76 HE2 HIS 76 7.575 27.379 -8.792 1279 H HIS 77 H HIS 77 3.641 29.453 -3.214 1280 HA HIS 77 HA HIS 77 1.717 28.137 -1.431 1281 HB2 HIS 77 HB2 HIS 77 2.510 31.077 -1.579 1282 HB3 HIS 77 HB3 HIS 77 1.658 30.284 -0.255 1283 HD1 HIS 77 HD1 HIS 77 4.934 31.363 -1.203 1284 HD2 HIS 77 HD2 HIS 77 3.440 28.131 0.946 1285 HE1 HIS 77 HE1 HIS 77 6.877 30.480 0.118 1286 HE2 HIS 77 HE2 HIS 77 5.985 28.453 1.301 Start of MODEL 10 1 H1 MET 1 H1 MET 1 8.629 14.403 6.665 2 H2 MET 1 H2 MET 1 8.078 14.433 8.260 3 H3 MET 1 H3 MET 1 8.726 15.831 7.572 4 HA MET 1 HA MET 1 6.248 14.459 6.709 5 HB2 MET 1 HB2 MET 1 5.141 16.581 7.665 6 HB3 MET 1 HB3 MET 1 5.777 15.429 8.831 7 HG2 MET 1 HG2 MET 1 7.809 16.839 9.070 8 HG3 MET 1 HG3 MET 1 7.078 18.021 7.981 9 HE1 MET 1 HE1 MET 1 6.879 19.691 11.570 10 HE2 MET 1 HE2 MET 1 7.501 19.870 9.930 11 HE3 MET 1 HE3 MET 1 8.153 18.619 10.990 12 H LYS 2 H LYS 2 6.323 14.616 4.508 13 HA LYS 2 HA LYS 2 6.159 17.185 3.231 14 HB2 LYS 2 HB2 LYS 2 8.123 16.959 1.733 15 HB3 LYS 2 HB3 LYS 2 8.593 17.066 3.425 16 HG2 LYS 2 HG2 LYS 2 8.854 14.557 3.447 17 HG3 LYS 2 HG3 LYS 2 8.563 14.559 1.706 18 HD2 LYS 2 HD2 LYS 2 10.829 16.056 3.096 19 HD3 LYS 2 HD3 LYS 2 10.998 14.473 2.334 20 HE2 LYS 2 HE2 LYS 2 10.472 15.435 0.142 21 HE3 LYS 2 HE3 LYS 2 10.157 17.008 0.876 22 HZ1 LYS 2 HZ1 LYS 2 12.421 17.229 1.460 23 HZ2 LYS 2 HZ2 LYS 2 12.373 16.767 -0.168 24 HZ3 LYS 2 HZ3 LYS 2 12.772 15.635 1.019 25 H MET 3 H MET 3 5.990 13.676 3.048 26 HA MET 3 HA MET 3 4.210 13.810 0.748 27 HB2 MET 3 HB2 MET 3 5.495 12.206 -0.646 28 HB3 MET 3 HB3 MET 3 6.378 13.702 -0.382 29 HG2 MET 3 HG2 MET 3 7.807 12.614 1.271 30 HG3 MET 3 HG3 MET 3 6.879 11.120 1.120 31 HE1 MET 3 HE1 MET 3 9.385 13.590 -0.664 32 HE2 MET 3 HE2 MET 3 8.021 13.599 -1.784 33 HE3 MET 3 HE3 MET 3 9.544 12.845 -2.256 34 H LEU 4 H LEU 4 3.064 11.901 0.298 35 HA LEU 4 HA LEU 4 2.249 10.303 2.496 36 HB2 LEU 4 HB2 LEU 4 1.678 10.040 -0.480 37 HB3 LEU 4 HB3 LEU 4 0.966 8.970 0.707 38 HG LEU 4 HG LEU 4 -0.674 10.623 0.091 39 HD11 LEU 4 HD11 LEU 4 -1.254 11.616 2.247 40 HD12 LEU 4 HD12 LEU 4 0.363 11.259 2.861 41 HD13 LEU 4 HD13 LEU 4 -0.726 9.943 2.417 42 HD21 LEU 4 HD21 LEU 4 1.286 12.806 0.868 43 HD22 LEU 4 HD22 LEU 4 -0.392 13.041 0.367 44 HD23 LEU 4 HD23 LEU 4 0.783 12.389 -0.773 45 H LYS 5 H LYS 5 4.724 9.799 0.097 46 HA LYS 5 HA LYS 5 5.179 7.007 0.454 47 HB2 LYS 5 HB2 LYS 5 6.077 8.285 -1.475 48 HB3 LYS 5 HB3 LYS 5 7.106 9.212 -0.386 49 HG2 LYS 5 HG2 LYS 5 8.275 7.069 0.230 50 HG3 LYS 5 HG3 LYS 5 7.322 6.242 -1.003 51 HD2 LYS 5 HD2 LYS 5 9.254 8.544 -1.520 52 HD3 LYS 5 HD3 LYS 5 9.632 6.837 -1.759 53 HE2 LYS 5 HE2 LYS 5 7.881 6.689 -3.490 54 HE3 LYS 5 HE3 LYS 5 7.483 8.388 -3.238 55 HZ1 LYS 5 HZ1 LYS 5 9.711 8.965 -3.945 56 HZ2 LYS 5 HZ2 LYS 5 8.909 8.098 -5.141 57 HZ3 LYS 5 HZ3 LYS 5 10.079 7.337 -4.181 58 H GLU 6 H GLU 6 6.285 9.882 2.218 59 HA GLU 6 HA GLU 6 8.411 8.603 3.637 60 HB2 GLU 6 HB2 GLU 6 8.316 11.079 3.231 61 HB3 GLU 6 HB3 GLU 6 6.987 11.187 4.387 62 HG2 GLU 6 HG2 GLU 6 8.657 10.045 6.056 63 HG3 GLU 6 HG3 GLU 6 9.895 10.516 4.896 64 H LYS 7 H LYS 7 5.117 9.673 4.634 65 HA LYS 7 HA LYS 7 5.288 8.648 7.271 66 HB2 LYS 7 HB2 LYS 7 2.777 8.893 7.345 67 HB3 LYS 7 HB3 LYS 7 3.665 10.337 6.910 68 HG2 LYS 7 HG2 LYS 7 1.751 10.341 5.529 69 HG3 LYS 7 HG3 LYS 7 3.079 9.853 4.479 70 HD2 LYS 7 HD2 LYS 7 1.051 8.532 4.024 71 HD3 LYS 7 HD3 LYS 7 2.345 7.500 4.629 72 HE2 LYS 7 HE2 LYS 7 0.239 6.846 5.656 73 HE3 LYS 7 HE3 LYS 7 1.284 7.551 6.887 74 HZ1 LYS 7 HZ1 LYS 7 0.053 9.622 6.690 75 HZ2 LYS 7 HZ2 LYS 7 -0.978 8.341 7.085 76 HZ3 LYS 7 HZ3 LYS 7 -0.943 8.942 5.506 77 H ALA 8 H ALA 8 4.509 7.058 4.260 78 HA ALA 8 HA ALA 8 3.480 4.600 5.202 79 HB1 ALA 8 HB1 ALA 8 5.294 5.107 2.813 80 HB2 ALA 8 HB2 ALA 8 3.533 5.211 2.817 81 HB3 ALA 8 HB3 ALA 8 4.321 3.654 3.077 82 H GLY 9 H GLY 9 6.816 5.731 4.788 83 HA2 GLY 9 HA2 GLY 9 8.168 3.408 5.744 84 HA3 GLY 9 HA3 GLY 9 8.850 5.016 5.574 85 H ALA 10 H ALA 10 7.070 6.388 7.345 86 HA ALA 10 HA ALA 10 8.214 5.990 9.889 87 HB1 ALA 10 HB1 ALA 10 5.629 7.425 9.196 88 HB2 ALA 10 HB2 ALA 10 7.246 8.131 9.161 89 HB3 ALA 10 HB3 ALA 10 6.548 7.610 10.696 90 H LEU 11 H LEU 11 5.053 4.966 8.600 91 HA LEU 11 HA LEU 11 4.160 3.661 11.019 92 HB2 LEU 11 HB2 LEU 11 3.068 3.422 8.192 93 HB3 LEU 11 HB3 LEU 11 2.248 2.916 9.664 94 HG LEU 11 HG LEU 11 2.925 5.788 8.904 95 HD11 LEU 11 HD11 LEU 11 1.138 4.893 7.533 96 HD12 LEU 11 HD12 LEU 11 0.518 6.109 8.647 97 HD13 LEU 11 HD13 LEU 11 0.242 4.394 8.972 98 HD21 LEU 11 HD21 LEU 11 3.034 5.548 11.323 99 HD22 LEU 11 HD22 LEU 11 1.453 4.765 11.353 100 HD23 LEU 11 HD23 LEU 11 1.593 6.459 10.875 101 H ALA 12 H ALA 12 6.110 2.711 8.321 102 HA ALA 12 HA ALA 12 5.750 -0.048 8.197 103 HB1 ALA 12 HB1 ALA 12 8.354 1.468 7.818 104 HB2 ALA 12 HB2 ALA 12 7.112 1.225 6.588 105 HB3 ALA 12 HB3 ALA 12 7.998 -0.161 7.228 106 H GLY 13 H GLY 13 8.120 1.723 10.192 107 HA2 GLY 13 HA2 GLY 13 9.408 -0.391 11.450 108 HA3 GLY 13 HA3 GLY 13 9.248 1.218 12.126 109 H GLN 14 H GLN 14 6.424 1.245 12.545 110 HA GLN 14 HA GLN 14 6.340 -0.107 15.088 111 HB2 GLN 14 HB2 GLN 14 4.177 1.008 15.426 112 HB3 GLN 14 HB3 GLN 14 5.395 2.144 14.855 113 HG2 GLN 14 HG2 GLN 14 4.439 1.990 12.569 114 HG3 GLN 14 HG3 GLN 14 3.199 0.896 13.178 115 HE21 GLN 14 HE21 GLN 14 4.341 4.196 13.172 116 HE22 GLN 14 HE22 GLN 14 2.895 4.893 13.793 117 H ILE 15 H ILE 15 4.721 -0.629 11.944 118 HA ILE 15 HA ILE 15 2.982 -2.740 12.789 119 HB ILE 15 HB ILE 15 4.065 -2.113 10.002 120 HG12 ILE 15 HG12 ILE 15 1.378 -1.448 11.298 121 HG13 ILE 15 HG13 ILE 15 2.671 -0.297 10.977 122 HG21 ILE 15 HG21 ILE 15 2.239 -3.530 9.098 123 HG22 ILE 15 HG22 ILE 15 1.778 -3.987 10.737 124 HG23 ILE 15 HG23 ILE 15 3.344 -4.479 10.096 125 HD11 ILE 15 HD11 ILE 15 0.911 -0.077 9.349 126 HD12 ILE 15 HD12 ILE 15 1.033 -1.781 8.920 127 HD13 ILE 15 HD13 ILE 15 2.365 -0.680 8.557 128 H TRP 16 H TRP 16 6.236 -2.696 11.377 129 HA TRP 16 HA TRP 16 6.789 -5.431 11.216 130 HB2 TRP 16 HB2 TRP 16 8.220 -3.560 10.300 131 HB3 TRP 16 HB3 TRP 16 8.759 -3.209 11.938 132 HD1 TRP 16 HD1 TRP 16 9.207 -5.751 9.108 133 HE1 TRP 16 HE1 TRP 16 11.217 -7.261 9.647 134 HE3 TRP 16 HE3 TRP 16 10.187 -4.162 13.878 135 HZ2 TRP 16 HZ2 TRP 16 12.996 -7.716 11.784 136 HZ3 TRP 16 HZ3 TRP 16 12.059 -5.185 15.101 137 HH2 TRP 16 HH2 TRP 16 13.435 -6.927 14.075 138 H GLU 17 H GLU 17 7.328 -3.181 13.930 139 HA GLU 17 HA GLU 17 8.334 -5.039 15.815 140 HB2 GLU 17 HB2 GLU 17 7.254 -2.240 15.950 141 HB3 GLU 17 HB3 GLU 17 7.402 -3.116 17.467 142 HG2 GLU 17 HG2 GLU 17 9.713 -2.781 15.532 143 HG3 GLU 17 HG3 GLU 17 9.358 -1.623 16.818 144 H ALA 18 H ALA 18 5.005 -4.171 15.005 145 HA ALA 18 HA ALA 18 3.686 -5.439 17.195 146 HB1 ALA 18 HB1 ALA 18 2.667 -4.970 14.367 147 HB2 ALA 18 HB2 ALA 18 2.540 -3.834 15.710 148 HB3 ALA 18 HB3 ALA 18 1.667 -5.366 15.769 149 H LEU 19 H LEU 19 4.821 -6.598 14.055 150 HA LEU 19 HA LEU 19 3.841 -9.305 14.368 151 HB2 LEU 19 HB2 LEU 19 5.486 -7.880 12.273 152 HB3 LEU 19 HB3 LEU 19 5.398 -9.630 12.257 153 HG LEU 19 HG LEU 19 2.981 -9.569 11.881 154 HD11 LEU 19 HD11 LEU 19 1.739 -7.502 11.503 155 HD12 LEU 19 HD12 LEU 19 3.159 -6.548 11.926 156 HD13 LEU 19 HD13 LEU 19 2.378 -7.558 13.143 157 HD21 LEU 19 HD21 LEU 19 4.466 -9.487 9.920 158 HD22 LEU 19 HD22 LEU 19 4.432 -7.721 9.956 159 HD23 LEU 19 HD23 LEU 19 2.956 -8.629 9.619 160 H ASN 20 H ASN 20 6.768 -7.615 15.201 161 HA ASN 20 HA ASN 20 8.574 -9.800 15.031 162 HB2 ASN 20 HB2 ASN 20 9.264 -7.395 14.927 163 HB3 ASN 20 HB3 ASN 20 8.917 -7.241 16.647 164 HD21 ASN 20 HD21 ASN 20 11.119 -6.669 16.986 165 HD22 ASN 20 HD22 ASN 20 12.369 -7.859 16.971 166 H GLY 21 H GLY 21 9.300 -11.247 16.509 167 HA2 GLY 21 HA2 GLY 21 9.456 -12.486 18.452 168 HA3 GLY 21 HA3 GLY 21 8.546 -11.254 19.311 169 H THR 22 H THR 22 6.903 -12.191 16.506 170 HA THR 22 HA THR 22 5.177 -14.144 17.942 171 HB THR 22 HB THR 22 4.144 -12.019 16.001 172 HG1 THR 22 HG1 THR 22 5.093 -11.172 18.036 173 HG21 THR 22 HG21 THR 22 1.941 -12.507 17.009 174 HG22 THR 22 HG22 THR 22 2.676 -13.722 18.056 175 HG23 THR 22 HG23 THR 22 2.642 -13.971 16.309 176 H GLU 23 H GLU 23 3.918 -15.570 16.437 177 HA GLU 23 HA GLU 23 5.555 -16.459 14.184 178 HB2 GLU 23 HB2 GLU 23 3.006 -17.662 15.338 179 HB3 GLU 23 HB3 GLU 23 4.085 -18.444 14.181 180 HG2 GLU 23 HG2 GLU 23 4.780 -17.676 17.040 181 HG3 GLU 23 HG3 GLU 23 4.384 -19.297 16.480 182 H GLY 24 H GLY 24 3.165 -14.163 14.398 183 HA2 GLY 24 HA2 GLY 24 2.786 -13.203 12.066 184 HA3 GLY 24 HA3 GLY 24 2.028 -14.744 11.713 185 H LEU 25 H LEU 25 1.055 -11.847 11.839 186 HA LEU 25 HA LEU 25 -1.366 -12.319 13.499 187 HB2 LEU 25 HB2 LEU 25 -0.027 -9.628 12.943 188 HB3 LEU 25 HB3 LEU 25 -1.579 -9.831 13.736 189 HG LEU 25 HG LEU 25 -0.280 -11.130 15.569 190 HD11 LEU 25 HD11 LEU 25 2.085 -9.755 14.277 191 HD12 LEU 25 HD12 LEU 25 1.815 -11.496 14.377 192 HD13 LEU 25 HD13 LEU 25 2.086 -10.564 15.845 193 HD21 LEU 25 HD21 LEU 25 -1.227 -8.899 15.952 194 HD22 LEU 25 HD22 LEU 25 0.208 -8.149 15.246 195 HD23 LEU 25 HD23 LEU 25 0.336 -9.055 16.757 196 H THR 26 H THR 26 -3.350 -11.576 12.598 197 HA THR 26 HA THR 26 -3.411 -10.978 9.711 198 HB THR 26 HB THR 26 -5.977 -10.930 10.148 199 HG1 THR 26 HG1 THR 26 -5.460 -12.438 12.458 200 HG21 THR 26 HG21 THR 26 -6.194 -13.386 10.147 201 HG22 THR 26 HG22 THR 26 -4.519 -13.549 10.674 202 HG23 THR 26 HG23 THR 26 -4.880 -12.881 9.081 203 H GLN 27 H GLN 27 -4.806 -9.134 9.005 204 HA GLN 27 HA GLN 27 -3.783 -6.689 9.838 205 HB2 GLN 27 HB2 GLN 27 -5.542 -5.667 8.389 206 HB3 GLN 27 HB3 GLN 27 -4.673 -6.987 7.621 207 HG2 GLN 27 HG2 GLN 27 -6.583 -8.496 8.077 208 HG3 GLN 27 HG3 GLN 27 -7.463 -7.153 8.805 209 HE21 GLN 27 HE21 GLN 27 -6.547 -5.191 6.798 210 HE22 GLN 27 HE22 GLN 27 -7.407 -5.567 5.354 211 H LYS 28 H LYS 28 -6.696 -8.290 10.971 212 HA LYS 28 HA LYS 28 -7.915 -6.211 12.425 213 HB2 LYS 28 HB2 LYS 28 -9.188 -7.954 13.541 214 HB3 LYS 28 HB3 LYS 28 -8.967 -8.403 11.857 215 HG2 LYS 28 HG2 LYS 28 -6.963 -9.817 12.726 216 HG3 LYS 28 HG3 LYS 28 -7.686 -9.603 14.317 217 HD2 LYS 28 HD2 LYS 28 -8.916 -10.988 11.899 218 HD3 LYS 28 HD3 LYS 28 -8.361 -11.748 13.388 219 HE2 LYS 28 HE2 LYS 28 -10.689 -11.719 13.642 220 HE3 LYS 28 HE3 LYS 28 -10.198 -10.288 14.541 221 HZ1 LYS 28 HZ1 LYS 28 -12.142 -10.064 12.965 222 HZ2 LYS 28 HZ2 LYS 28 -11.015 -10.136 11.702 223 HZ3 LYS 28 HZ3 LYS 28 -10.936 -8.891 12.845 224 H GLN 29 H GLN 29 -5.340 -8.472 13.418 225 HA GLN 29 HA GLN 29 -5.327 -7.702 16.203 226 HB2 GLN 29 HB2 GLN 29 -3.287 -9.318 14.615 227 HB3 GLN 29 HB3 GLN 29 -3.360 -9.201 16.370 228 HG2 GLN 29 HG2 GLN 29 -5.499 -10.442 14.615 229 HG3 GLN 29 HG3 GLN 29 -4.248 -11.330 15.479 230 HE21 GLN 29 HE21 GLN 29 -5.709 -12.516 16.682 231 HE22 GLN 29 HE22 GLN 29 -6.670 -11.835 17.943 232 H ILE 30 H ILE 30 -3.384 -6.874 13.379 233 HA ILE 30 HA ILE 30 -1.122 -5.799 14.672 234 HB ILE 30 HB ILE 30 -2.179 -5.034 11.918 235 HG12 ILE 30 HG12 ILE 30 -0.228 -7.279 12.625 236 HG13 ILE 30 HG13 ILE 30 -1.931 -7.534 12.269 237 HG21 ILE 30 HG21 ILE 30 0.648 -4.890 13.050 238 HG22 ILE 30 HG22 ILE 30 -0.403 -3.514 12.711 239 HG23 ILE 30 HG23 ILE 30 0.190 -4.513 11.386 240 HD11 ILE 30 HD11 ILE 30 -1.581 -6.704 9.999 241 HD12 ILE 30 HD12 ILE 30 -0.525 -8.066 10.374 242 HD13 ILE 30 HD13 ILE 30 0.126 -6.427 10.362 243 H LYS 31 H LYS 31 -4.058 -4.173 13.463 244 HA LYS 31 HA LYS 31 -3.197 -1.496 13.909 245 HB2 LYS 31 HB2 LYS 31 -6.055 -2.511 13.733 246 HB3 LYS 31 HB3 LYS 31 -5.538 -0.832 13.549 247 HG2 LYS 31 HG2 LYS 31 -4.204 -1.542 11.529 248 HG3 LYS 31 HG3 LYS 31 -4.909 -3.155 11.685 249 HD2 LYS 31 HD2 LYS 31 -6.374 -0.545 11.105 250 HD3 LYS 31 HD3 LYS 31 -6.147 -1.904 9.999 251 HE2 LYS 31 HE2 LYS 31 -7.812 -1.930 12.548 252 HE3 LYS 31 HE3 LYS 31 -8.437 -1.864 10.901 253 HZ1 LYS 31 HZ1 LYS 31 -6.890 -4.114 12.077 254 HZ2 LYS 31 HZ2 LYS 31 -7.491 -4.052 10.501 255 HZ3 LYS 31 HZ3 LYS 31 -8.561 -4.090 11.807 256 H LYS 32 H LYS 32 -4.681 -3.836 16.062 257 HA LYS 32 HA LYS 32 -5.324 -2.154 18.256 258 HB2 LYS 32 HB2 LYS 32 -6.150 -4.436 18.181 259 HB3 LYS 32 HB3 LYS 32 -4.525 -5.087 18.068 260 HG2 LYS 32 HG2 LYS 32 -5.369 -5.515 20.284 261 HG3 LYS 32 HG3 LYS 32 -4.079 -4.322 20.402 262 HD2 LYS 32 HD2 LYS 32 -5.892 -3.683 21.890 263 HD3 LYS 32 HD3 LYS 32 -5.803 -2.514 20.569 264 HE2 LYS 32 HE2 LYS 32 -7.697 -3.647 19.448 265 HE3 LYS 32 HE3 LYS 32 -7.783 -4.819 20.765 266 HZ1 LYS 32 HZ1 LYS 32 -8.298 -3.012 22.280 267 HZ2 LYS 32 HZ2 LYS 32 -9.419 -3.084 21.020 268 HZ3 LYS 32 HZ3 LYS 32 -8.216 -1.896 21.013 269 H ALA 33 H ALA 33 -2.381 -3.985 17.440 270 HA ALA 33 HA ALA 33 -0.864 -3.246 19.747 271 HB1 ALA 33 HB1 ALA 33 1.010 -4.356 18.596 272 HB2 ALA 33 HB2 ALA 33 0.075 -4.398 17.098 273 HB3 ALA 33 HB3 ALA 33 -0.462 -5.329 18.498 274 H THR 34 H THR 34 -1.168 -1.859 16.522 275 HA THR 34 HA THR 34 1.104 -0.021 16.848 276 HB THR 34 HB THR 34 0.642 0.616 14.477 277 HG1 THR 34 HG1 THR 34 -1.070 -1.412 13.893 278 HG21 THR 34 HG21 THR 34 2.175 -1.278 14.904 279 HG22 THR 34 HG22 THR 34 1.258 -1.518 13.416 280 HG23 THR 34 HG23 THR 34 0.806 -2.395 14.880 281 H LYS 35 H LYS 35 -2.349 -0.010 17.057 282 HA LYS 35 HA LYS 35 -3.910 1.490 17.615 283 HB2 LYS 35 HB2 LYS 35 -2.162 2.189 19.317 284 HB3 LYS 35 HB3 LYS 35 -1.691 3.480 18.222 285 HG2 LYS 35 HG2 LYS 35 -3.907 4.497 18.413 286 HG3 LYS 35 HG3 LYS 35 -4.461 3.164 19.431 287 HD2 LYS 35 HD2 LYS 35 -2.251 5.137 20.146 288 HD3 LYS 35 HD3 LYS 35 -3.913 5.206 20.742 289 HE2 LYS 35 HE2 LYS 35 -3.577 2.959 21.801 290 HE3 LYS 35 HE3 LYS 35 -1.891 2.993 21.278 291 HZ1 LYS 35 HZ1 LYS 35 -1.609 5.010 22.601 292 HZ2 LYS 35 HZ2 LYS 35 -2.070 3.683 23.536 293 HZ3 LYS 35 HZ3 LYS 35 -3.201 4.879 23.152 294 H LEU 36 H LEU 36 -2.804 1.346 14.851 295 HA LEU 36 HA LEU 36 -2.860 3.894 13.585 296 HB2 LEU 36 HB2 LEU 36 -3.333 1.114 12.451 297 HB3 LEU 36 HB3 LEU 36 -3.285 2.558 11.450 298 HG LEU 36 HG LEU 36 -0.982 1.468 13.113 299 HD11 LEU 36 HD11 LEU 36 0.095 1.018 10.963 300 HD12 LEU 36 HD12 LEU 36 -1.333 1.601 10.104 301 HD13 LEU 36 HD13 LEU 36 -1.432 0.145 11.099 302 HD21 LEU 36 HD21 LEU 36 -1.059 3.942 11.345 303 HD22 LEU 36 HD22 LEU 36 0.387 3.247 12.082 304 HD23 LEU 36 HD23 LEU 36 -0.884 3.909 13.104 305 H LYS 37 H LYS 37 -5.422 1.550 14.266 306 HA LYS 37 HA LYS 37 -7.674 1.558 14.178 307 HB2 LYS 37 HB2 LYS 37 -7.430 4.545 13.666 308 HB3 LYS 37 HB3 LYS 37 -8.952 3.714 13.980 309 HG2 LYS 37 HG2 LYS 37 -8.292 3.179 16.236 310 HG3 LYS 37 HG3 LYS 37 -6.633 3.711 15.942 311 HD2 LYS 37 HD2 LYS 37 -9.071 5.539 15.882 312 HD3 LYS 37 HD3 LYS 37 -7.998 5.346 17.273 313 HE2 LYS 37 HE2 LYS 37 -7.169 6.389 14.533 314 HE3 LYS 37 HE3 LYS 37 -7.436 7.374 15.973 315 HZ1 LYS 37 HZ1 LYS 37 -5.375 5.257 15.678 316 HZ2 LYS 37 HZ2 LYS 37 -5.622 6.196 17.061 317 HZ3 LYS 37 HZ3 LYS 37 -5.091 6.922 15.630 318 H ALA 38 H ALA 38 -6.748 3.883 11.566 319 HA ALA 38 HA ALA 38 -8.665 2.896 9.686 320 HB1 ALA 38 HB1 ALA 38 -6.220 4.648 9.220 321 HB2 ALA 38 HB2 ALA 38 -7.841 5.219 9.623 322 HB3 ALA 38 HB3 ALA 38 -7.553 4.406 8.077 323 H ASP 39 H ASP 39 -8.510 1.238 8.286 324 HA ASP 39 HA ASP 39 -6.234 -0.412 7.889 325 HB2 ASP 39 HB2 ASP 39 -7.545 -1.331 5.927 326 HB3 ASP 39 HB3 ASP 39 -8.437 -1.319 7.446 327 H LYS 40 H LYS 40 -7.294 2.532 6.419 328 HA LYS 40 HA LYS 40 -6.076 2.557 3.912 329 HB2 LYS 40 HB2 LYS 40 -6.499 4.976 5.728 330 HB3 LYS 40 HB3 LYS 40 -6.228 5.024 3.992 331 HG2 LYS 40 HG2 LYS 40 -8.526 5.341 4.144 332 HG3 LYS 40 HG3 LYS 40 -8.400 3.616 3.823 333 HD2 LYS 40 HD2 LYS 40 -8.847 3.064 6.125 334 HD3 LYS 40 HD3 LYS 40 -8.713 4.748 6.610 335 HE2 LYS 40 HE2 LYS 40 -10.880 3.590 4.829 336 HE3 LYS 40 HE3 LYS 40 -11.065 4.002 6.534 337 HZ1 LYS 40 HZ1 LYS 40 -10.480 5.899 4.324 338 HZ2 LYS 40 HZ2 LYS 40 -10.585 6.317 5.959 339 HZ3 LYS 40 HZ3 LYS 40 -11.948 5.736 5.148 340 H ASP 41 H ASP 41 -4.821 4.011 6.929 341 HA ASP 41 HA ASP 41 -2.222 4.694 5.927 342 HB2 ASP 41 HB2 ASP 41 -3.268 4.410 8.781 343 HB3 ASP 41 HB3 ASP 41 -1.697 5.094 8.372 344 H PHE 42 H PHE 42 -3.622 1.884 7.432 345 HA PHE 42 HA PHE 42 -1.289 0.458 8.191 346 HB2 PHE 42 HB2 PHE 42 -3.396 -0.200 9.136 347 HB3 PHE 42 HB3 PHE 42 -4.125 -0.418 7.552 348 HD1 PHE 42 HD1 PHE 42 -1.426 -1.796 9.756 349 HD2 PHE 42 HD2 PHE 42 -4.187 -2.573 6.578 350 HE1 PHE 42 HE1 PHE 42 -0.822 -4.170 9.796 351 HE2 PHE 42 HE2 PHE 42 -3.578 -4.953 6.642 352 HZ PHE 42 HZ PHE 42 -1.895 -5.751 8.250 353 H PHE 43 H PHE 43 -3.098 0.554 5.095 354 HA PHE 43 HA PHE 43 -1.649 -1.534 3.789 355 HB2 PHE 43 HB2 PHE 43 -3.196 0.791 2.568 356 HB3 PHE 43 HB3 PHE 43 -2.596 -0.597 1.661 357 HD1 PHE 43 HD2 PHE 43 -3.231 -2.907 3.279 358 HD2 PHE 43 HD1 PHE 43 -5.540 0.651 2.677 359 HE1 PHE 43 HE2 PHE 43 -5.287 -4.145 3.809 360 HE2 PHE 43 HE1 PHE 43 -7.578 -0.600 3.206 361 HZ PHE 43 HZ PHE 43 -7.460 -2.996 3.773 362 H LEU 44 H LEU 44 -1.065 1.951 4.045 363 HA LEU 44 HA LEU 44 1.111 2.060 2.185 364 HB2 LEU 44 HB2 LEU 44 0.103 3.930 4.340 365 HB3 LEU 44 HB3 LEU 44 1.639 4.255 3.558 366 HG LEU 44 HG LEU 44 0.482 4.344 1.342 367 HD11 LEU 44 HD11 LEU 44 -1.961 4.513 1.195 368 HD12 LEU 44 HD12 LEU 44 -2.100 4.131 2.913 369 HD13 LEU 44 HD13 LEU 44 -1.461 2.929 1.790 370 HD21 LEU 44 HD21 LEU 44 0.927 6.425 2.569 371 HD22 LEU 44 HD22 LEU 44 -0.634 6.289 3.386 372 HD23 LEU 44 HD23 LEU 44 -0.569 6.540 1.640 373 H GLY 45 H GLY 45 0.949 1.686 5.741 374 HA2 GLY 45 HA2 GLY 45 3.753 1.618 6.253 375 HA3 GLY 45 HA3 GLY 45 2.495 0.991 7.306 376 H LEU 46 H LEU 46 1.402 -1.064 6.032 377 HA LEU 46 HA LEU 46 3.257 -3.211 6.221 378 HB2 LEU 46 HB2 LEU 46 0.829 -3.437 6.722 379 HB3 LEU 46 HB3 LEU 46 0.454 -3.183 5.026 380 HG LEU 46 HG LEU 46 1.716 -5.302 4.477 381 HD11 LEU 46 HD11 LEU 46 2.269 -6.873 6.278 382 HD12 LEU 46 HD12 LEU 46 1.843 -5.659 7.483 383 HD13 LEU 46 HD13 LEU 46 3.211 -5.389 6.399 384 HD21 LEU 46 HD21 LEU 46 -0.596 -5.680 6.409 385 HD22 LEU 46 HD22 LEU 46 -0.025 -6.859 5.228 386 HD23 LEU 46 HD23 LEU 46 -0.739 -5.343 4.682 387 H GLY 47 H GLY 47 1.972 -1.399 3.510 388 HA2 GLY 47 HA2 GLY 47 2.935 -2.981 1.342 389 HA3 GLY 47 HA3 GLY 47 2.525 -1.269 1.278 390 H TRP 48 H TRP 48 4.379 -0.459 3.346 391 HA TRP 48 HA TRP 48 6.816 -0.231 1.852 392 HB2 TRP 48 HB2 TRP 48 5.791 1.520 3.469 393 HB3 TRP 48 HB3 TRP 48 6.500 0.563 4.770 394 HD1 TRP 48 HD1 TRP 48 9.174 0.699 5.056 395 HE1 TRP 48 HE1 TRP 48 10.959 2.243 4.012 396 HE3 TRP 48 HE3 TRP 48 6.381 2.740 1.304 397 HZ2 TRP 48 HZ2 TRP 48 11.156 4.067 1.851 398 HZ3 TRP 48 HZ3 TRP 48 7.426 4.358 -0.221 399 HH2 TRP 48 HH2 TRP 48 9.767 5.020 0.045 400 H LEU 49 H LEU 49 5.731 -2.299 4.497 401 HA LEU 49 HA LEU 49 8.212 -3.529 5.101 402 HB2 LEU 49 HB2 LEU 49 5.330 -4.370 5.401 403 HB3 LEU 49 HB3 LEU 49 6.569 -5.582 5.642 404 HG LEU 49 HG LEU 49 7.476 -4.452 7.557 405 HD11 LEU 49 HD11 LEU 49 6.667 -2.296 8.351 406 HD12 LEU 49 HD12 LEU 49 5.648 -2.143 6.913 407 HD13 LEU 49 HD13 LEU 49 7.408 -2.176 6.759 408 HD21 LEU 49 HD21 LEU 49 5.570 -4.340 9.099 409 HD22 LEU 49 HD22 LEU 49 5.423 -5.729 8.027 410 HD23 LEU 49 HD23 LEU 49 4.448 -4.287 7.734 411 H LEU 50 H LEU 50 5.944 -4.068 2.437 412 HA LEU 50 HA LEU 50 7.391 -6.271 1.253 413 HB2 LEU 50 HB2 LEU 50 5.282 -4.394 0.141 414 HB3 LEU 50 HB3 LEU 50 6.014 -5.670 -0.825 415 HG LEU 50 HG LEU 50 4.398 -6.122 1.726 416 HD11 LEU 50 HD11 LEU 50 2.946 -5.362 -0.087 417 HD12 LEU 50 HD12 LEU 50 2.663 -7.068 0.250 418 HD13 LEU 50 HD13 LEU 50 3.602 -6.596 -1.169 419 HD21 LEU 50 HD21 LEU 50 6.113 -7.853 1.433 420 HD22 LEU 50 HD22 LEU 50 5.577 -8.141 -0.225 421 HD23 LEU 50 HD23 LEU 50 4.512 -8.522 1.129 422 H ARG 51 H ARG 51 7.449 -2.716 0.844 423 HA ARG 51 HA ARG 51 9.445 -2.448 -1.127 424 HB2 ARG 51 HB2 ARG 51 8.401 -0.431 -0.447 425 HB3 ARG 51 HB3 ARG 51 8.620 -0.772 1.253 426 HG2 ARG 51 HG2 ARG 51 10.023 1.084 0.703 427 HG3 ARG 51 HG3 ARG 51 11.074 -0.299 1.002 428 HD2 ARG 51 HD2 ARG 51 11.282 -0.636 -1.445 429 HD3 ARG 51 HD3 ARG 51 10.265 0.780 -1.712 430 HE ARG 51 HE ARG 51 12.268 1.747 -0.182 431 HH11 ARG 51 HH11 ARG 51 12.249 0.036 -3.202 432 HH12 ARG 51 HH12 ARG 51 13.757 0.703 -3.700 433 HH21 ARG 51 HH21 ARG 51 14.150 2.609 -0.854 434 HH22 ARG 51 HH22 ARG 51 14.818 2.165 -2.379 435 H GLU 52 H GLU 52 9.748 -3.065 2.358 436 HA GLU 52 HA GLU 52 12.657 -3.072 2.327 437 HB2 GLU 52 HB2 GLU 52 10.670 -3.794 4.511 438 HB3 GLU 52 HB3 GLU 52 12.410 -3.649 4.724 439 HG2 GLU 52 HG2 GLU 52 12.267 -1.237 4.179 440 HG3 GLU 52 HG3 GLU 52 10.516 -1.388 4.010 441 H ASP 53 H ASP 53 10.114 -5.332 1.852 442 HA ASP 53 HA ASP 53 9.909 -7.531 1.447 443 HB2 ASP 53 HB2 ASP 53 12.029 -6.949 0.034 444 HB3 ASP 53 HB3 ASP 53 12.927 -7.812 1.274 445 H LYS 54 H LYS 54 10.561 -6.434 4.199 446 HA LYS 54 HA LYS 54 11.821 -8.584 5.688 447 HB2 LYS 54 HB2 LYS 54 10.557 -5.944 6.508 448 HB3 LYS 54 HB3 LYS 54 11.169 -7.082 7.701 449 HG2 LYS 54 HG2 LYS 54 13.408 -6.751 7.081 450 HG3 LYS 54 HG3 LYS 54 12.985 -6.143 5.481 451 HD2 LYS 54 HD2 LYS 54 13.794 -4.272 6.762 452 HD3 LYS 54 HD3 LYS 54 12.062 -4.082 6.566 453 HE2 LYS 54 HE2 LYS 54 11.822 -5.043 8.906 454 HE3 LYS 54 HE3 LYS 54 13.562 -4.834 9.069 455 HZ1 LYS 54 HZ1 LYS 54 12.383 -2.931 9.945 456 HZ2 LYS 54 HZ2 LYS 54 11.575 -2.705 8.473 457 HZ3 LYS 54 HZ3 LYS 54 13.242 -2.460 8.561 458 H VAL 55 H VAL 55 8.765 -8.473 4.399 459 HA VAL 55 HA VAL 55 7.689 -10.216 6.557 460 HB VAL 55 HB VAL 55 5.373 -9.442 6.065 461 HG11 VAL 55 HG11 VAL 55 6.576 -8.568 8.003 462 HG12 VAL 55 HG12 VAL 55 5.515 -7.331 7.326 463 HG13 VAL 55 HG13 VAL 55 7.254 -7.263 7.024 464 HG21 VAL 55 HG21 VAL 55 6.700 -7.253 4.407 465 HG22 VAL 55 HG22 VAL 55 4.990 -7.313 4.841 466 HG23 VAL 55 HG23 VAL 55 5.675 -8.549 3.784 467 H VAL 56 H VAL 56 6.495 -11.963 6.032 468 HA VAL 56 HA VAL 56 6.111 -12.781 3.252 469 HB VAL 56 HB VAL 56 5.468 -14.421 5.743 470 HG11 VAL 56 HG11 VAL 56 5.720 -16.366 4.246 471 HG12 VAL 56 HG12 VAL 56 6.090 -15.299 2.892 472 HG13 VAL 56 HG13 VAL 56 4.487 -15.259 3.635 473 HG21 VAL 56 HG21 VAL 56 8.150 -14.365 4.304 474 HG22 VAL 56 HG22 VAL 56 7.687 -15.497 5.577 475 HG23 VAL 56 HG23 VAL 56 7.829 -13.775 5.938 476 H THR 57 H THR 57 4.079 -12.519 2.328 477 HA THR 57 HA THR 57 1.765 -11.846 4.061 478 HB THR 57 HB THR 57 0.748 -10.841 2.000 479 HG1 THR 57 HG1 THR 57 2.340 -12.216 0.621 480 HG21 THR 57 HG21 THR 57 1.987 -9.378 3.547 481 HG22 THR 57 HG22 THR 57 2.193 -8.840 1.878 482 HG23 THR 57 HG23 THR 57 3.492 -9.720 2.686 483 H SER 58 H SER 58 -0.225 -12.814 3.760 484 HA SER 58 HA SER 58 -0.773 -14.882 1.805 485 HB2 SER 58 HB2 SER 58 0.538 -16.137 3.548 486 HB3 SER 58 HB3 SER 58 -0.637 -15.650 4.766 487 HG SER 58 HG SER 58 -0.801 -17.595 2.808 488 H GLU 59 H GLU 59 -3.055 -15.861 2.313 489 HA GLU 59 HA GLU 59 -4.826 -13.814 3.557 490 HB2 GLU 59 HB2 GLU 59 -5.125 -13.912 1.091 491 HB3 GLU 59 HB3 GLU 59 -5.449 -15.641 1.187 492 HG2 GLU 59 HG2 GLU 59 -7.471 -15.116 2.604 493 HG3 GLU 59 HG3 GLU 59 -7.168 -13.399 2.319 494 H VAL 60 H VAL 60 -5.795 -14.534 5.343 495 HA VAL 60 HA VAL 60 -6.594 -17.386 5.585 496 HB VAL 60 HB VAL 60 -5.547 -15.500 7.742 497 HG11 VAL 60 HG11 VAL 60 -6.991 -18.140 8.228 498 HG12 VAL 60 HG12 VAL 60 -7.558 -16.540 8.713 499 HG13 VAL 60 HG13 VAL 60 -6.106 -17.220 9.449 500 HG21 VAL 60 HG21 VAL 60 -3.951 -17.345 8.176 501 HG22 VAL 60 HG22 VAL 60 -3.862 -16.811 6.495 502 HG23 VAL 60 HG23 VAL 60 -4.710 -18.306 6.902 503 H GLU 61 H GLU 61 -8.655 -17.532 5.250 504 HA GLU 61 HA GLU 61 -10.897 -17.336 5.290 505 HB2 GLU 61 HB2 GLU 61 -10.405 -16.227 8.076 506 HB3 GLU 61 HB3 GLU 61 -11.866 -17.042 7.514 507 HG2 GLU 61 HG2 GLU 61 -10.478 -19.105 7.117 508 HG3 GLU 61 HG3 GLU 61 -9.107 -18.269 7.834 509 H GLY 62 H GLY 62 -9.795 -15.207 3.928 510 HA2 GLY 62 HA2 GLY 62 -10.795 -13.457 2.758 511 HA3 GLY 62 HA3 GLY 62 -11.999 -13.299 4.020 512 H GLU 63 H GLU 63 -9.054 -13.273 5.578 513 HA GLU 63 HA GLU 63 -8.741 -10.320 5.373 514 HB2 GLU 63 HB2 GLU 63 -8.405 -12.091 7.839 515 HB3 GLU 63 HB3 GLU 63 -7.903 -10.402 7.757 516 HG2 GLU 63 HG2 GLU 63 -10.289 -9.774 7.269 517 HG3 GLU 63 HG3 GLU 63 -10.736 -11.463 7.522 518 H ILE 64 H ILE 64 -6.620 -9.482 5.667 519 HA ILE 64 HA ILE 64 -4.565 -10.973 4.310 520 HB ILE 64 HB ILE 64 -4.413 -8.230 5.644 521 HG12 ILE 64 HG12 ILE 64 -4.948 -8.902 2.710 522 HG13 ILE 64 HG13 ILE 64 -6.171 -8.356 3.853 523 HG21 ILE 64 HG21 ILE 64 -2.165 -9.176 5.286 524 HG22 ILE 64 HG22 ILE 64 -2.442 -7.822 4.191 525 HG23 ILE 64 HG23 ILE 64 -2.544 -9.477 3.587 526 HD11 ILE 64 HD11 ILE 64 -3.781 -6.755 2.924 527 HD12 ILE 64 HD12 ILE 64 -5.020 -6.204 4.056 528 HD13 ILE 64 HD13 ILE 64 -5.448 -6.565 2.385 529 H PHE 65 H PHE 65 -3.514 -12.535 5.406 530 HA PHE 65 HA PHE 65 -2.636 -12.163 8.201 531 HB2 PHE 65 HB2 PHE 65 -3.726 -14.317 7.683 532 HB3 PHE 65 HB3 PHE 65 -2.557 -14.630 6.405 533 HD1 PHE 65 HD2 PHE 65 -2.819 -14.089 10.106 534 HD2 PHE 65 HD1 PHE 65 -0.526 -15.793 6.925 535 HE1 PHE 65 HE2 PHE 65 -1.344 -15.170 11.741 536 HE2 PHE 65 HE1 PHE 65 0.952 -16.864 8.576 537 HZ PHE 65 HZ PHE 65 0.544 -16.555 10.982 538 H VAL 66 H VAL 66 -0.604 -11.455 8.552 539 HA VAL 66 HA VAL 66 1.528 -12.001 6.597 540 HB VAL 66 HB VAL 66 0.620 -9.797 6.007 541 HG11 VAL 66 HG11 VAL 66 1.272 -8.912 8.839 542 HG12 VAL 66 HG12 VAL 66 -0.347 -9.152 8.179 543 HG13 VAL 66 HG13 VAL 66 0.686 -7.873 7.538 544 HG21 VAL 66 HG21 VAL 66 3.349 -9.540 7.325 545 HG22 VAL 66 HG22 VAL 66 2.701 -8.472 6.079 546 HG23 VAL 66 HG23 VAL 66 3.040 -10.161 5.701 547 H LYS 67 H LYS 67 3.579 -12.166 7.416 548 HA LYS 67 HA LYS 67 4.109 -11.719 10.281 549 HB2 LYS 67 HB2 LYS 67 5.139 -13.954 10.512 550 HB3 LYS 67 HB3 LYS 67 3.427 -14.073 10.121 551 HG2 LYS 67 HG2 LYS 67 4.038 -14.528 7.736 552 HG3 LYS 67 HG3 LYS 67 5.744 -14.533 8.217 553 HD2 LYS 67 HD2 LYS 67 5.264 -16.392 9.807 554 HD3 LYS 67 HD3 LYS 67 3.580 -16.397 9.275 555 HE2 LYS 67 HE2 LYS 67 4.334 -17.015 6.987 556 HE3 LYS 67 HE3 LYS 67 6.007 -17.045 7.562 557 HZ1 LYS 67 HZ1 LYS 67 5.390 -18.788 9.117 558 HZ2 LYS 67 HZ2 LYS 67 5.041 -19.253 7.530 559 HZ3 LYS 67 HZ3 LYS 67 3.795 -18.755 8.556 560 H LEU 68 H LEU 68 6.631 -12.226 10.607 561 HA LEU 68 HA LEU 68 8.032 -10.642 8.594 562 HB2 LEU 68 HB2 LEU 68 9.094 -11.860 11.174 563 HB3 LEU 68 HB3 LEU 68 9.945 -10.710 10.147 564 HG LEU 68 HG LEU 68 7.492 -10.190 11.871 565 HD11 LEU 68 HD11 LEU 68 9.627 -10.167 13.055 566 HD12 LEU 68 HD12 LEU 68 8.926 -8.554 12.984 567 HD13 LEU 68 HD13 LEU 68 10.272 -8.975 11.920 568 HD21 LEU 68 HD21 LEU 68 8.736 -8.289 9.847 569 HD22 LEU 68 HD22 LEU 68 7.517 -7.858 11.050 570 HD23 LEU 68 HD23 LEU 68 7.120 -9.001 9.773 571 H VAL 69 H VAL 69 9.964 -11.275 7.547 572 HA VAL 69 HA VAL 69 10.300 -14.065 6.854 573 HB VAL 69 HB VAL 69 12.113 -11.684 6.204 574 HG11 VAL 69 HG11 VAL 69 13.002 -13.112 4.373 575 HG12 VAL 69 HG12 VAL 69 12.025 -14.462 4.957 576 HG13 VAL 69 HG13 VAL 69 13.323 -13.812 5.963 577 HG21 VAL 69 HG21 VAL 69 10.997 -11.663 3.990 578 HG22 VAL 69 HG22 VAL 69 9.848 -11.351 5.290 579 HG23 VAL 69 HG23 VAL 69 9.902 -12.942 4.526 580 H LEU 70 H LEU 70 10.795 -15.183 8.688 581 HA LEU 70 HA LEU 70 12.464 -14.310 10.789 582 HB2 LEU 70 HB2 LEU 70 12.287 -16.599 11.713 583 HB3 LEU 70 HB3 LEU 70 10.735 -15.901 11.309 584 HG LEU 70 HG LEU 70 12.084 -17.866 9.416 585 HD11 LEU 70 HD11 LEU 70 10.836 -19.704 10.456 586 HD12 LEU 70 HD12 LEU 70 10.272 -18.616 11.728 587 HD13 LEU 70 HD13 LEU 70 11.990 -18.991 11.583 588 HD21 LEU 70 HD21 LEU 70 10.163 -16.622 8.508 589 HD22 LEU 70 HD22 LEU 70 9.152 -17.180 9.843 590 HD23 LEU 70 HD23 LEU 70 9.787 -18.337 8.670 591 H GLU 71 H GLU 71 14.478 -13.737 10.129 592 HA GLU 71 HA GLU 71 16.370 -15.881 9.291 593 HB2 GLU 71 HB2 GLU 71 16.541 -12.886 8.731 594 HB3 GLU 71 HB3 GLU 71 17.745 -14.084 8.252 595 HG2 GLU 71 HG2 GLU 71 16.137 -15.129 6.737 596 HG3 GLU 71 HG3 GLU 71 14.872 -14.014 7.261 597 H HIS 72 H HIS 72 18.486 -15.772 10.262 598 HA HIS 72 HA HIS 72 18.334 -15.179 13.074 599 HB2 HIS 72 HB2 HIS 72 20.587 -16.285 13.183 600 HB3 HIS 72 HB3 HIS 72 19.334 -17.257 12.428 601 HD1 HIS 72 HD1 HIS 72 19.973 -18.326 10.296 602 HD2 HIS 72 HD2 HIS 72 22.362 -15.025 11.105 603 HE1 HIS 72 HE1 HIS 72 21.725 -18.310 8.502 604 HE2 HIS 72 HE2 HIS 72 23.266 -16.429 9.130 605 H HIS 73 H HIS 73 18.860 -12.890 10.873 606 HA HIS 73 HA HIS 73 21.188 -11.584 12.027 607 HB2 HIS 73 HB2 HIS 73 20.752 -9.721 10.521 608 HB3 HIS 73 HB3 HIS 73 20.618 -11.221 9.627 609 HD1 HIS 73 HD1 HIS 73 18.304 -11.774 8.591 610 HD2 HIS 73 HD2 HIS 73 18.380 -8.195 10.695 611 HE1 HIS 73 HE1 HIS 73 16.176 -10.591 7.979 612 HE2 HIS 73 HE2 HIS 73 16.348 -8.358 9.110 613 H HIS 74 H HIS 74 21.135 -10.700 13.994 614 HA HIS 74 HA HIS 74 18.659 -9.483 15.063 615 HB2 HIS 74 HB2 HIS 74 21.288 -10.241 16.410 616 HB3 HIS 74 HB3 HIS 74 20.000 -9.361 17.228 617 HD1 HIS 74 HD1 HIS 74 18.189 -10.720 18.264 618 HD2 HIS 74 HD2 HIS 74 20.441 -12.945 15.575 619 HE1 HIS 74 HE1 HIS 74 17.345 -13.067 18.473 620 HE2 HIS 74 HE2 HIS 74 18.628 -14.368 16.750 621 H HIS 75 H HIS 75 18.627 -7.685 13.732 622 HA HIS 75 HA HIS 75 20.297 -5.426 14.495 623 HB2 HIS 75 HB2 HIS 75 21.604 -6.495 12.672 624 HB3 HIS 75 HB3 HIS 75 20.204 -6.423 11.611 625 HD1 HIS 75 HD1 HIS 75 20.345 -4.559 10.007 626 HD2 HIS 75 HD2 HIS 75 22.338 -3.658 13.535 627 HE1 HIS 75 HE1 HIS 75 21.344 -2.290 9.634 628 HE2 HIS 75 HE2 HIS 75 22.506 -1.746 11.799 629 H HIS 76 H HIS 76 19.045 -3.660 14.607 630 HA HIS 76 HA HIS 76 17.271 -2.292 14.662 631 HB2 HIS 76 HB2 HIS 76 16.943 -3.388 11.875 632 HB3 HIS 76 HB3 HIS 76 15.615 -2.459 12.552 633 HD1 HIS 76 HD1 HIS 76 15.732 -0.030 12.193 634 HD2 HIS 76 HD2 HIS 76 19.490 -1.782 11.954 635 HE1 HIS 76 HE1 HIS 76 17.273 1.806 11.471 636 HE2 HIS 76 HE2 HIS 76 19.492 0.682 11.146 637 H HIS 77 H HIS 77 16.367 -3.226 16.507 638 HA HIS 77 HA HIS 77 14.149 -5.119 16.272 639 HB2 HIS 77 HB2 HIS 77 15.659 -5.235 18.237 640 HB3 HIS 77 HB3 HIS 77 15.227 -3.590 18.686 641 HD1 HIS 77 HD1 HIS 77 13.299 -3.354 20.248 642 HD2 HIS 77 HD2 HIS 77 13.404 -7.104 18.481 643 HE1 HIS 77 HE1 HIS 77 11.536 -4.684 21.424 644 HE2 HIS 77 HE2 HIS 77 11.469 -6.867 20.185 645 H1 MET 1 H MET 1 0.424 -20.214 -6.312 646 HA MET 1 HA MET 1 -1.407 -20.034 -4.095 647 HB2 MET 1 HB2 MET 1 0.249 -18.987 -2.524 648 HB3 MET 1 HB3 MET 1 0.576 -20.681 -2.848 649 HG2 MET 1 HG2 MET 1 2.672 -19.553 -2.803 650 HG3 MET 1 HG3 MET 1 2.345 -19.937 -4.493 651 HE1 MET 1 HE1 MET 1 4.564 -17.734 -3.496 652 HE2 MET 1 HE2 MET 1 4.280 -16.502 -4.726 653 HE3 MET 1 HE3 MET 1 4.287 -18.210 -5.173 654 H LYS 2 H LYS 2 -1.528 -17.671 -3.278 655 HA LYS 2 HA LYS 2 -0.855 -15.728 -5.408 656 HB2 LYS 2 HB2 LYS 2 -2.907 -14.509 -5.127 657 HB3 LYS 2 HB3 LYS 2 -3.308 -16.186 -5.432 658 HG2 LYS 2 HG2 LYS 2 -3.438 -14.791 -2.739 659 HG3 LYS 2 HG3 LYS 2 -4.814 -15.136 -3.788 660 HD2 LYS 2 HD2 LYS 2 -4.496 -17.546 -3.469 661 HD3 LYS 2 HD3 LYS 2 -3.022 -17.261 -2.537 662 HE2 LYS 2 HE2 LYS 2 -4.929 -17.767 -1.060 663 HE3 LYS 2 HE3 LYS 2 -4.328 -16.132 -0.786 664 HZ1 LYS 2 HZ1 LYS 2 -6.749 -16.256 -0.860 665 HZ2 LYS 2 HZ2 LYS 2 -6.685 -16.819 -2.450 666 HZ3 LYS 2 HZ3 LYS 2 -6.137 -15.261 -2.080 667 H MET 3 H MET 3 1.040 -15.130 -4.427 668 HA MET 3 HA MET 3 1.247 -14.063 -1.780 669 HB2 MET 3 HB2 MET 3 3.182 -14.941 -3.136 670 HB3 MET 3 HB3 MET 3 3.028 -13.557 -4.207 671 HG2 MET 3 HG2 MET 3 4.861 -13.220 -2.686 672 HG3 MET 3 HG3 MET 3 3.578 -12.064 -2.327 673 HE1 MET 3 HE1 MET 3 6.121 -12.924 -0.387 674 HE2 MET 3 HE2 MET 3 5.287 -12.884 1.167 675 HE3 MET 3 HE3 MET 3 4.984 -11.623 -0.028 676 H LEU 4 H LEU 4 0.541 -12.118 -1.095 677 HA LEU 4 HA LEU 4 -0.886 -10.274 -2.690 678 HB2 LEU 4 HB2 LEU 4 0.268 -9.931 0.100 679 HB3 LEU 4 HB3 LEU 4 -0.742 -8.724 -0.666 680 HG LEU 4 HG LEU 4 -2.074 -9.980 0.921 681 HD11 LEU 4 HD11 LEU 4 -3.910 -10.771 -0.487 682 HD12 LEU 4 HD12 LEU 4 -2.845 -10.763 -1.896 683 HD13 LEU 4 HD13 LEU 4 -3.238 -9.250 -1.075 684 HD21 LEU 4 HD21 LEU 4 -2.490 -12.388 0.755 685 HD22 LEU 4 HD22 LEU 4 -0.786 -12.049 1.043 686 HD23 LEU 4 HD23 LEU 4 -1.329 -12.511 -0.572 687 H LYS 5 H LYS 5 2.501 -10.530 -2.108 688 HA LYS 5 HA LYS 5 3.452 -7.998 -2.892 689 HB2 LYS 5 HB2 LYS 5 4.824 -9.845 -1.894 690 HB3 LYS 5 HB3 LYS 5 4.667 -10.734 -3.406 691 HG2 LYS 5 HG2 LYS 5 5.897 -8.931 -4.575 692 HG3 LYS 5 HG3 LYS 5 6.100 -8.089 -3.037 693 HD2 LYS 5 HD2 LYS 5 7.197 -10.853 -3.708 694 HD3 LYS 5 HD3 LYS 5 8.133 -9.356 -3.702 695 HE2 LYS 5 HE2 LYS 5 7.766 -9.112 -1.286 696 HE3 LYS 5 HE3 LYS 5 6.749 -10.551 -1.277 697 HZ1 LYS 5 HZ1 LYS 5 8.900 -11.150 -0.520 698 HZ2 LYS 5 HZ2 LYS 5 9.653 -10.407 -1.828 699 HZ3 LYS 5 HZ3 LYS 5 8.731 -11.806 -2.071 700 H GLU 6 H GLU 6 2.700 -10.911 -4.826 701 HA GLU 6 HA GLU 6 3.401 -9.806 -7.366 702 HB2 GLU 6 HB2 GLU 6 1.515 -12.166 -6.954 703 HB3 GLU 6 HB3 GLU 6 2.527 -11.824 -8.358 704 HG2 GLU 6 HG2 GLU 6 3.369 -12.826 -5.631 705 HG3 GLU 6 HG3 GLU 6 3.515 -13.647 -7.179 706 H LYS 7 H LYS 7 0.352 -10.255 -5.636 707 HA LYS 7 HA LYS 7 -1.539 -9.327 -7.478 708 HB2 LYS 7 HB2 LYS 7 -2.174 -10.394 -5.371 709 HB3 LYS 7 HB3 LYS 7 -1.445 -9.084 -4.446 710 HG2 LYS 7 HG2 LYS 7 -3.182 -7.547 -5.606 711 HG3 LYS 7 HG3 LYS 7 -3.995 -9.045 -6.079 712 HD2 LYS 7 HD2 LYS 7 -4.116 -9.672 -3.658 713 HD3 LYS 7 HD3 LYS 7 -3.383 -8.114 -3.251 714 HE2 LYS 7 HE2 LYS 7 -5.824 -8.042 -2.966 715 HE3 LYS 7 HE3 LYS 7 -5.317 -6.949 -4.257 716 HZ1 LYS 7 HZ1 LYS 7 -6.397 -9.679 -4.677 717 HZ2 LYS 7 HZ2 LYS 7 -6.017 -8.555 -5.879 718 HZ3 LYS 7 HZ3 LYS 7 -7.293 -8.256 -4.815 719 H ALA 8 H ALA 8 0.170 -7.497 -4.957 720 HA ALA 8 HA ALA 8 -0.691 -4.902 -5.482 721 HB1 ALA 8 HB1 ALA 8 1.358 -4.162 -4.326 722 HB2 ALA 8 HB2 ALA 8 2.053 -5.778 -4.511 723 HB3 ALA 8 HB3 ALA 8 0.624 -5.541 -3.502 724 H GLY 9 H GLY 9 1.902 -6.763 -7.016 725 HA2 GLY 9 HA2 GLY 9 2.914 -4.744 -8.762 726 HA3 GLY 9 HA3 GLY 9 3.144 -6.477 -8.929 727 H ALA 10 H ALA 10 0.325 -7.138 -9.139 728 HA ALA 10 HA ALA 10 -0.077 -6.879 -11.942 729 HB1 ALA 10 HB1 ALA 10 -0.877 -8.815 -10.654 730 HB2 ALA 10 HB2 ALA 10 -2.203 -8.057 -11.540 731 HB3 ALA 10 HB3 ALA 10 -2.031 -7.787 -9.803 732 H LEU 11 H LEU 11 -1.762 -5.404 -9.167 733 HA LEU 11 HA LEU 11 -3.517 -3.691 -10.627 734 HB2 LEU 11 HB2 LEU 11 -2.477 -3.418 -7.782 735 HB3 LEU 11 HB3 LEU 11 -3.868 -2.565 -8.444 736 HG LEU 11 HG LEU 11 -3.700 -5.597 -8.123 737 HD11 LEU 11 HD11 LEU 11 -5.244 -5.342 -6.238 738 HD12 LEU 11 HD12 LEU 11 -5.145 -3.585 -6.380 739 HD13 LEU 11 HD13 LEU 11 -3.715 -4.519 -5.936 740 HD21 LEU 11 HD21 LEU 11 -6.079 -3.839 -8.843 741 HD22 LEU 11 HD22 LEU 11 -6.115 -5.587 -8.594 742 HD23 LEU 11 HD23 LEU 11 -5.211 -4.913 -9.946 743 H ALA 12 H ALA 12 -0.267 -3.336 -9.370 744 HA ALA 12 HA ALA 12 0.198 -0.592 -9.557 745 HB1 ALA 12 HB1 ALA 12 2.584 -1.183 -9.614 746 HB2 ALA 12 HB2 ALA 12 2.164 -2.859 -9.985 747 HB3 ALA 12 HB3 ALA 12 1.705 -2.154 -8.435 748 H GLY 13 H GLY 13 0.771 -3.117 -12.014 749 HA2 GLY 13 HA2 GLY 13 2.039 -1.669 -14.014 750 HA3 GLY 13 HA3 GLY 13 1.005 -3.060 -14.300 751 H GLN 14 H GLN 14 -1.401 -1.889 -13.325 752 HA GLN 14 HA GLN 14 -2.378 -0.490 -15.613 753 HB2 GLN 14 HB2 GLN 14 -3.723 -0.787 -12.896 754 HB3 GLN 14 HB3 GLN 14 -4.515 -0.456 -14.438 755 HG2 GLN 14 HG2 GLN 14 -3.778 -2.725 -15.229 756 HG3 GLN 14 HG3 GLN 14 -3.132 -3.035 -13.615 757 HE21 GLN 14 HE21 GLN 14 -4.598 -3.349 -11.895 758 HE22 GLN 14 HE22 GLN 14 -6.261 -3.703 -12.171 759 H ILE 15 H ILE 15 -1.780 0.514 -12.225 760 HA ILE 15 HA ILE 15 -2.766 3.164 -12.445 761 HB ILE 15 HB ILE 15 -0.810 2.020 -10.401 762 HG12 ILE 15 HG12 ILE 15 -3.852 2.325 -10.289 763 HG13 ILE 15 HG13 ILE 15 -2.982 0.805 -10.470 764 HG21 ILE 15 HG21 ILE 15 -1.492 3.894 -8.914 765 HG22 ILE 15 HG22 ILE 15 -2.456 4.579 -10.222 766 HG23 ILE 15 HG23 ILE 15 -0.702 4.484 -10.378 767 HD11 ILE 15 HD11 ILE 15 -2.972 2.609 -8.049 768 HD12 ILE 15 HD12 ILE 15 -2.026 1.129 -8.213 769 HD13 ILE 15 HD13 ILE 15 -3.786 1.056 -8.216 770 H TRP 16 H TRP 16 0.539 1.885 -12.716 771 HA TRP 16 HA TRP 16 1.981 4.270 -13.015 772 HB2 TRP 16 HB2 TRP 16 2.973 1.947 -12.722 773 HB3 TRP 16 HB3 TRP 16 2.594 1.619 -14.408 774 HD1 TRP 16 HD1 TRP 16 5.159 3.349 -12.206 775 HE1 TRP 16 HE1 TRP 16 7.072 4.269 -13.654 776 HE3 TRP 16 HE3 TRP 16 3.125 2.608 -16.855 777 HZ2 TRP 16 HZ2 TRP 16 7.648 4.652 -16.386 778 HZ3 TRP 16 HZ3 TRP 16 4.417 3.290 -18.832 779 HH2 TRP 16 HH2 TRP 16 6.625 4.296 -18.601 780 H GLU 17 H GLU 17 0.504 2.176 -15.517 781 HA GLU 17 HA GLU 17 1.179 3.768 -17.773 782 HB2 GLU 17 HB2 GLU 17 -0.973 1.644 -17.443 783 HB3 GLU 17 HB3 GLU 17 -0.554 2.391 -18.985 784 HG2 GLU 17 HG2 GLU 17 1.792 1.544 -18.690 785 HG3 GLU 17 HG3 GLU 17 1.252 0.684 -17.248 786 H ALA 18 H ALA 18 -1.511 3.959 -15.537 787 HA ALA 18 HA ALA 18 -3.170 5.782 -16.973 788 HB1 ALA 18 HB1 ALA 18 -4.190 6.261 -14.775 789 HB2 ALA 18 HB2 ALA 18 -2.863 5.422 -13.965 790 HB3 ALA 18 HB3 ALA 18 -3.970 4.526 -15.006 791 H LEU 19 H LEU 19 -0.493 6.261 -14.661 792 HA LEU 19 HA LEU 19 -0.575 9.150 -14.665 793 HB2 LEU 19 HB2 LEU 19 1.608 7.248 -13.737 794 HB3 LEU 19 HB3 LEU 19 1.531 8.965 -13.363 795 HG LEU 19 HG LEU 19 -0.480 6.869 -12.426 796 HD11 LEU 19 HD11 LEU 19 0.469 7.183 -10.189 797 HD12 LEU 19 HD12 LEU 19 1.684 8.286 -10.838 798 HD13 LEU 19 HD13 LEU 19 1.687 6.585 -11.315 799 HD21 LEU 19 HD21 LEU 19 -1.397 8.658 -10.998 800 HD22 LEU 19 HD22 LEU 19 -1.545 9.054 -12.707 801 HD23 LEU 19 HD23 LEU 19 -0.286 9.821 -11.733 802 H ASN 20 H ASN 20 0.871 6.758 -16.713 803 HA ASN 20 HA ASN 20 3.051 8.239 -17.807 804 HB2 ASN 20 HB2 ASN 20 3.057 5.814 -17.942 805 HB3 ASN 20 HB3 ASN 20 1.521 5.794 -18.782 806 HD21 ASN 20 HD21 ASN 20 4.940 6.266 -19.098 807 HD22 ASN 20 HD22 ASN 20 4.976 6.300 -20.823 808 H GLY 21 H GLY 21 3.040 9.832 -19.298 809 HA2 GLY 21 HA2 GLY 21 2.452 11.023 -21.214 810 HA3 GLY 21 HA3 GLY 21 0.983 10.073 -21.363 811 H THR 22 H THR 22 1.186 11.200 -18.204 812 HA THR 22 HA THR 22 -0.318 13.710 -18.750 813 HB THR 22 HB THR 22 -1.002 11.737 -16.514 814 HG1 THR 22 HG1 THR 22 -1.575 10.768 -18.462 815 HG21 THR 22 HG21 THR 22 -2.538 14.143 -17.578 816 HG22 THR 22 HG22 THR 22 -1.702 14.054 -16.026 817 HG23 THR 22 HG23 THR 22 -3.107 13.033 -16.330 818 H GLU 23 H GLU 23 -0.284 15.255 -16.880 819 HA GLU 23 HA GLU 23 2.311 15.492 -15.597 820 HB2 GLU 23 HB2 GLU 23 -0.199 17.213 -15.440 821 HB3 GLU 23 HB3 GLU 23 1.360 17.659 -14.745 822 HG2 GLU 23 HG2 GLU 23 0.811 17.206 -17.696 823 HG3 GLU 23 HG3 GLU 23 0.886 18.785 -16.911 824 H GLY 24 H GLY 24 0.454 13.271 -14.722 825 HA2 GLY 24 HA2 GLY 24 0.325 12.216 -12.609 826 HA3 GLY 24 HA3 GLY 24 0.309 13.793 -11.829 827 H LEU 25 H LEU 25 -1.524 11.558 -11.474 828 HA LEU 25 HA LEU 25 -4.090 12.878 -12.193 829 HB2 LEU 25 HB2 LEU 25 -3.546 9.886 -11.953 830 HB3 LEU 25 HB3 LEU 25 -5.139 10.598 -12.152 831 HG LEU 25 HG LEU 25 -2.890 10.654 -14.209 832 HD11 LEU 25 HD11 LEU 25 -5.512 9.114 -14.184 833 HD12 LEU 25 HD12 LEU 25 -3.893 8.436 -13.982 834 HD13 LEU 25 HD13 LEU 25 -4.354 9.161 -15.519 835 HD21 LEU 25 HD21 LEU 25 -5.724 11.737 -14.447 836 HD22 LEU 25 HD22 LEU 25 -4.536 11.651 -15.752 837 HD23 LEU 25 HD23 LEU 25 -4.246 12.699 -14.366 838 H THR 26 H THR 26 -5.748 12.746 -10.625 839 HA THR 26 HA THR 26 -4.985 12.380 -7.826 840 HB THR 26 HB THR 26 -7.307 13.076 -7.313 841 HG1 THR 26 HG1 THR 26 -8.669 13.663 -9.163 842 HG21 THR 26 HG21 THR 26 -5.663 14.885 -7.747 843 HG22 THR 26 HG22 THR 26 -7.284 15.353 -8.262 844 HG23 THR 26 HG23 THR 26 -6.089 14.860 -9.462 845 H GLN 27 H GLN 27 -6.455 10.982 -6.416 846 HA GLN 27 HA GLN 27 -6.497 8.296 -7.206 847 HB2 GLN 27 HB2 GLN 27 -7.725 7.853 -5.134 848 HB3 GLN 27 HB3 GLN 27 -6.469 9.052 -4.848 849 HG2 GLN 27 HG2 GLN 27 -8.258 10.836 -5.029 850 HG3 GLN 27 HG3 GLN 27 -9.459 9.545 -5.076 851 HE21 GLN 27 HE21 GLN 27 -9.607 8.153 -3.184 852 HE22 GLN 27 HE22 GLN 27 -9.166 8.770 -1.635 853 H LYS 28 H LYS 28 -8.983 10.747 -7.488 854 HA LYS 28 HA LYS 28 -11.225 9.267 -8.315 855 HB2 LYS 28 HB2 LYS 28 -10.410 12.018 -9.353 856 HB3 LYS 28 HB3 LYS 28 -12.046 11.358 -9.294 857 HG2 LYS 28 HG2 LYS 28 -10.338 11.978 -6.855 858 HG3 LYS 28 HG3 LYS 28 -11.557 13.066 -7.527 859 HD2 LYS 28 HD2 LYS 28 -12.170 10.252 -6.521 860 HD3 LYS 28 HD3 LYS 28 -12.308 11.701 -5.522 861 HE2 LYS 28 HE2 LYS 28 -13.988 12.612 -7.124 862 HE3 LYS 28 HE3 LYS 28 -13.878 11.118 -8.061 863 HZ1 LYS 28 HZ1 LYS 28 -14.709 11.290 -5.221 864 HZ2 LYS 28 HZ2 LYS 28 -14.693 9.898 -6.182 865 HZ3 LYS 28 HZ3 LYS 28 -15.759 11.159 -6.537 866 H GLN 29 H GLN 29 -8.687 10.784 -10.296 867 HA GLN 29 HA GLN 29 -9.727 10.004 -12.848 868 HB2 GLN 29 HB2 GLN 29 -7.046 11.140 -11.979 869 HB3 GLN 29 HB3 GLN 29 -7.458 10.851 -13.669 870 HG2 GLN 29 HG2 GLN 29 -9.256 12.461 -13.574 871 HG3 GLN 29 HG3 GLN 29 -9.047 12.665 -11.834 872 HE21 GLN 29 HE21 GLN 29 -8.817 14.551 -14.191 873 HE22 GLN 29 HE22 GLN 29 -7.289 15.326 -13.972 874 H ILE 30 H ILE 30 -7.180 8.713 -10.757 875 HA ILE 30 HA ILE 30 -6.031 6.831 -12.518 876 HB ILE 30 HB ILE 30 -6.184 6.877 -9.474 877 HG12 ILE 30 HG12 ILE 30 -3.885 7.548 -11.370 878 HG13 ILE 30 HG13 ILE 30 -4.931 8.737 -10.610 879 HG21 ILE 30 HG21 ILE 30 -5.841 4.535 -10.143 880 HG22 ILE 30 HG22 ILE 30 -4.370 5.192 -9.424 881 HG23 ILE 30 HG23 ILE 30 -4.488 5.008 -11.176 882 HD11 ILE 30 HD11 ILE 30 -4.073 8.076 -8.415 883 HD12 ILE 30 HD12 ILE 30 -2.791 8.612 -9.502 884 HD13 ILE 30 HD13 ILE 30 -3.018 6.890 -9.191 885 H LYS 31 H LYS 31 -8.693 6.474 -10.144 886 HA LYS 31 HA LYS 31 -9.243 3.751 -10.457 887 HB2 LYS 31 HB2 LYS 31 -11.053 6.076 -9.754 888 HB3 LYS 31 HB3 LYS 31 -11.674 4.426 -9.834 889 HG2 LYS 31 HG2 LYS 31 -10.051 3.745 -8.092 890 HG3 LYS 31 HG3 LYS 31 -9.479 5.417 -7.988 891 HD2 LYS 31 HD2 LYS 31 -11.660 6.172 -7.214 892 HD3 LYS 31 HD3 LYS 31 -12.364 4.574 -7.487 893 HE2 LYS 31 HE2 LYS 31 -10.860 3.657 -5.727 894 HE3 LYS 31 HE3 LYS 31 -10.255 5.287 -5.421 895 HZ1 LYS 31 HZ1 LYS 31 -11.960 4.694 -3.855 896 HZ2 LYS 31 HZ2 LYS 31 -13.059 4.369 -5.096 897 HZ3 LYS 31 HZ3 LYS 31 -12.516 5.947 -4.841 898 H LYS 32 H LYS 32 -10.452 6.485 -12.407 899 HA LYS 32 HA LYS 32 -12.205 4.904 -14.035 900 HB2 LYS 32 HB2 LYS 32 -11.066 7.695 -14.475 901 HB3 LYS 32 HB3 LYS 32 -12.295 6.954 -15.504 902 HG2 LYS 32 HG2 LYS 32 -12.582 7.566 -12.542 903 HG3 LYS 32 HG3 LYS 32 -13.311 8.480 -13.871 904 HD2 LYS 32 HD2 LYS 32 -14.703 6.565 -14.491 905 HD3 LYS 32 HD3 LYS 32 -13.887 5.534 -13.313 906 HE2 LYS 32 HE2 LYS 32 -16.063 6.216 -12.463 907 HE3 LYS 32 HE3 LYS 32 -14.787 6.935 -11.480 908 HZ1 LYS 32 HZ1 LYS 32 -16.304 8.312 -13.630 909 HZ2 LYS 32 HZ2 LYS 32 -15.090 9.006 -12.676 910 HZ3 LYS 32 HZ3 LYS 32 -16.541 8.509 -11.965 911 H ALA 33 H ALA 33 -8.945 6.243 -14.625 912 HA ALA 33 HA ALA 33 -8.636 5.387 -17.303 913 HB1 ALA 33 HB1 ALA 33 -7.262 7.153 -16.271 914 HB2 ALA 33 HB2 ALA 33 -6.247 5.904 -16.993 915 HB3 ALA 33 HB3 ALA 33 -6.476 5.953 -15.242 916 H THR 34 H THR 34 -8.153 3.668 -14.294 917 HA THR 34 HA THR 34 -6.919 1.317 -15.614 918 HB THR 34 HB THR 34 -6.407 0.541 -13.325 919 HG1 THR 34 HG1 THR 34 -7.071 2.779 -11.946 920 HG21 THR 34 HG21 THR 34 -4.782 2.096 -14.366 921 HG22 THR 34 HG22 THR 34 -4.849 2.320 -12.617 922 HG23 THR 34 HG23 THR 34 -5.657 3.471 -13.684 923 H LYS 35 H LYS 35 -9.912 2.417 -14.309 924 HA LYS 35 HA LYS 35 -11.929 1.567 -13.853 925 HB2 LYS 35 HB2 LYS 35 -10.943 -0.763 -15.534 926 HB3 LYS 35 HB3 LYS 35 -12.565 -0.734 -14.842 927 HG2 LYS 35 HG2 LYS 35 -13.004 1.408 -16.062 928 HG3 LYS 35 HG3 LYS 35 -11.412 1.268 -16.820 929 HD2 LYS 35 HD2 LYS 35 -12.090 -0.829 -17.911 930 HD3 LYS 35 HD3 LYS 35 -13.648 -0.787 -17.082 931 HE2 LYS 35 HE2 LYS 35 -12.679 1.256 -19.116 932 HE3 LYS 35 HE3 LYS 35 -13.838 -0.038 -19.426 933 HZ1 LYS 35 HZ1 LYS 35 -14.236 2.166 -17.465 934 HZ2 LYS 35 HZ2 LYS 35 -15.356 0.962 -17.863 935 HZ3 LYS 35 HZ3 LYS 35 -14.907 2.108 -19.017 936 H LEU 36 H LEU 36 -9.700 1.188 -11.982 937 HA LEU 36 HA LEU 36 -10.295 -1.178 -10.417 938 HB2 LEU 36 HB2 LEU 36 -8.816 1.375 -9.663 939 HB3 LEU 36 HB3 LEU 36 -8.966 -0.021 -8.607 940 HG LEU 36 HG LEU 36 -7.490 0.067 -11.267 941 HD11 LEU 36 HD11 LEU 36 -6.411 -0.214 -8.447 942 HD12 LEU 36 HD12 LEU 36 -6.277 1.207 -9.487 943 HD13 LEU 36 HD13 LEU 36 -5.459 -0.288 -9.935 944 HD21 LEU 36 HD21 LEU 36 -7.805 -2.294 -9.384 945 HD22 LEU 36 HD22 LEU 36 -6.759 -2.240 -10.806 946 HD23 LEU 36 HD23 LEU 36 -8.506 -2.141 -10.997 947 H LYS 37 H LYS 37 -11.823 -1.417 -8.861 948 HA LYS 37 HA LYS 37 -14.035 0.449 -8.934 949 HB2 LYS 37 HB2 LYS 37 -15.277 -1.356 -7.757 950 HB3 LYS 37 HB3 LYS 37 -14.467 -1.930 -9.211 951 HG2 LYS 37 HG2 LYS 37 -12.656 -2.905 -7.832 952 HG3 LYS 37 HG3 LYS 37 -13.457 -2.325 -6.368 953 HD2 LYS 37 HD2 LYS 37 -15.396 -3.773 -6.843 954 HD3 LYS 37 HD3 LYS 37 -14.633 -4.330 -8.338 955 HE2 LYS 37 HE2 LYS 37 -12.785 -5.322 -7.014 956 HE3 LYS 37 HE3 LYS 37 -13.552 -4.766 -5.524 957 HZ1 LYS 37 HZ1 LYS 37 -15.464 -6.162 -6.073 958 HZ2 LYS 37 HZ2 LYS 37 -14.045 -7.065 -5.919 959 HZ3 LYS 37 HZ3 LYS 37 -14.664 -6.724 -7.452 960 H ALA 38 H ALA 38 -11.567 -0.358 -6.598 961 HA ALA 38 HA ALA 38 -12.887 1.300 -4.522 962 HB1 ALA 38 HB1 ALA 38 -13.289 -1.082 -3.984 963 HB2 ALA 38 HB2 ALA 38 -12.243 -0.319 -2.782 964 HB3 ALA 38 HB3 ALA 38 -11.549 -1.383 -4.009 965 H ASP 39 H ASP 39 -11.517 2.265 -2.967 966 HA ASP 39 HA ASP 39 -8.932 3.141 -3.676 967 HB2 ASP 39 HB2 ASP 39 -10.213 2.972 -0.917 968 HB3 ASP 39 HB3 ASP 39 -8.730 3.850 -1.273 969 H LYS 40 H LYS 40 -10.023 0.294 -1.964 970 HA LYS 40 HA LYS 40 -7.729 -0.766 -0.814 971 HB2 LYS 40 HB2 LYS 40 -10.061 -2.128 -2.208 972 HB3 LYS 40 HB3 LYS 40 -8.852 -3.019 -1.282 973 HG2 LYS 40 HG2 LYS 40 -10.463 -0.755 -0.059 974 HG3 LYS 40 HG3 LYS 40 -11.053 -2.429 -0.098 975 HD2 LYS 40 HD2 LYS 40 -8.998 -3.143 1.134 976 HD3 LYS 40 HD3 LYS 40 -8.478 -1.454 1.208 977 HE2 LYS 40 HE2 LYS 40 -11.046 -2.533 2.428 978 HE3 LYS 40 HE3 LYS 40 -9.546 -2.249 3.314 979 HZ1 LYS 40 HZ1 LYS 40 -9.702 0.070 2.878 980 HZ2 LYS 40 HZ2 LYS 40 -11.187 -0.441 3.500 981 HZ3 LYS 40 HZ3 LYS 40 -11.023 -0.142 1.846 982 H ASP 41 H ASP 41 -8.824 -1.157 -4.202 983 HA ASP 41 HA ASP 41 -6.654 -2.779 -5.122 984 HB2 ASP 41 HB2 ASP 41 -8.340 -0.876 -6.811 985 HB3 ASP 41 HB3 ASP 41 -7.497 -2.323 -7.361 986 H PHE 42 H PHE 42 -7.241 0.662 -4.917 987 HA PHE 42 HA PHE 42 -5.079 1.608 -6.486 988 HB2 PHE 42 HB2 PHE 42 -7.049 2.989 -6.110 989 HB3 PHE 42 HB3 PHE 42 -6.789 2.974 -4.370 990 HD1 PHE 42 HD2 PHE 42 -4.629 3.737 -7.361 991 HD2 PHE 42 HD1 PHE 42 -6.115 5.088 -3.580 992 HE1 PHE 42 HE2 PHE 42 -3.297 5.780 -7.560 993 HE2 PHE 42 HE1 PHE 42 -4.769 7.137 -3.798 994 HZ PHE 42 HZ PHE 42 -3.363 7.484 -5.794 995 H PHE 43 H PHE 43 -5.396 1.132 -2.930 996 HA PHE 43 HA PHE 43 -2.957 2.407 -2.209 997 HB2 PHE 43 HB2 PHE 43 -4.540 0.323 -0.650 998 HB3 PHE 43 HB3 PHE 43 -3.232 1.294 0.015 999 HD1 PHE 43 HD1 PHE 43 -3.965 3.973 -1.276 1000 HD2 PHE 43 HD2 PHE 43 -6.332 1.030 0.739 1001 HE1 PHE 43 HE1 PHE 43 -5.578 5.715 -0.634 1002 HE2 PHE 43 HE2 PHE 43 -7.947 2.761 1.377 1003 HZ PHE 43 HZ PHE 43 -7.571 5.114 0.703 1004 H LEU 44 H LEU 44 -3.725 -1.005 -2.879 1005 HA LEU 44 HA LEU 44 -1.141 -2.037 -2.161 1006 HB2 LEU 44 HB2 LEU 44 -3.537 -3.189 -3.601 1007 HB3 LEU 44 HB3 LEU 44 -2.024 -4.079 -3.590 1008 HG LEU 44 HG LEU 44 -2.072 -4.172 -1.112 1009 HD11 LEU 44 HD11 LEU 44 -4.051 -3.519 0.183 1010 HD12 LEU 44 HD12 LEU 44 -4.778 -2.816 -1.262 1011 HD13 LEU 44 HD13 LEU 44 -3.303 -2.122 -0.589 1012 HD21 LEU 44 HD21 LEU 44 -3.894 -5.789 -0.856 1013 HD22 LEU 44 HD22 LEU 44 -3.058 -6.027 -2.390 1014 HD23 LEU 44 HD23 LEU 44 -4.630 -5.223 -2.359 1015 H GLY 45 H GLY 45 -2.677 -1.176 -5.276 1016 HA2 GLY 45 HA2 GLY 45 -0.526 -1.835 -7.005 1017 HA3 GLY 45 HA3 GLY 45 -1.798 -0.670 -7.345 1018 H LEU 46 H LEU 46 -1.453 1.354 -5.705 1019 HA LEU 46 HA LEU 46 0.745 2.877 -6.583 1020 HB2 LEU 46 HB2 LEU 46 -1.319 3.923 -5.790 1021 HB3 LEU 46 HB3 LEU 46 -1.087 3.254 -4.185 1022 HG LEU 46 HG LEU 46 0.938 4.696 -3.892 1023 HD11 LEU 46 HD11 LEU 46 0.163 5.905 -6.560 1024 HD12 LEU 46 HD12 LEU 46 1.611 4.948 -6.224 1025 HD13 LEU 46 HD13 LEU 46 1.399 6.522 -5.460 1026 HD21 LEU 46 HD21 LEU 46 -1.235 5.467 -3.028 1027 HD22 LEU 46 HD22 LEU 46 -1.584 6.248 -4.572 1028 HD23 LEU 46 HD23 LEU 46 -0.250 6.824 -3.574 1029 H GLY 47 H GLY 47 0.309 0.914 -3.702 1030 HA2 GLY 47 HA2 GLY 47 2.552 1.710 -2.165 1031 HA3 GLY 47 HA3 GLY 47 1.727 0.158 -2.054 1032 H TRP 48 H TRP 48 2.185 -0.606 -4.791 1033 HA TRP 48 HA TRP 48 4.837 -1.687 -4.700 1034 HB2 TRP 48 HB2 TRP 48 2.780 -2.776 -5.735 1035 HB3 TRP 48 HB3 TRP 48 2.938 -1.647 -7.076 1036 HD1 TRP 48 HD1 TRP 48 4.700 -2.296 -8.955 1037 HE1 TRP 48 HE1 TRP 48 6.318 -4.268 -9.261 1038 HE3 TRP 48 HE3 TRP 48 4.287 -4.371 -4.334 1039 HZ2 TRP 48 HZ2 TRP 48 7.291 -6.435 -7.728 1040 HZ3 TRP 48 HZ3 TRP 48 5.591 -6.372 -3.807 1041 HH2 TRP 48 HH2 TRP 48 7.065 -7.395 -5.466 1042 H LEU 49 H LEU 49 3.291 0.954 -6.511 1043 HA LEU 49 HA LEU 49 5.487 1.774 -8.106 1044 HB2 LEU 49 HB2 LEU 49 3.050 3.188 -7.015 1045 HB3 LEU 49 HB3 LEU 49 4.280 4.120 -7.832 1046 HG LEU 49 HG LEU 49 3.892 2.990 -9.936 1047 HD11 LEU 49 HD11 LEU 49 1.942 1.203 -8.477 1048 HD12 LEU 49 HD12 LEU 49 3.505 0.727 -9.153 1049 HD13 LEU 49 HD13 LEU 49 2.207 1.246 -10.226 1050 HD21 LEU 49 HD21 LEU 49 1.228 3.694 -8.649 1051 HD22 LEU 49 HD22 LEU 49 1.567 3.636 -10.385 1052 HD23 LEU 49 HD23 LEU 49 2.359 4.842 -9.376 1053 H LEU 50 H LEU 50 4.642 2.481 -4.746 1054 HA LEU 50 HA LEU 50 6.790 4.325 -4.213 1055 HB2 LEU 50 HB2 LEU 50 5.117 2.683 -2.267 1056 HB3 LEU 50 HB3 LEU 50 6.186 4.009 -1.821 1057 HG LEU 50 HG LEU 50 3.620 4.226 -3.448 1058 HD11 LEU 50 HD11 LEU 50 3.221 3.881 -1.052 1059 HD12 LEU 50 HD12 LEU 50 2.741 5.499 -1.557 1060 HD13 LEU 50 HD13 LEU 50 4.250 5.267 -0.666 1061 HD21 LEU 50 HD21 LEU 50 5.550 6.440 -2.669 1062 HD22 LEU 50 HD22 LEU 50 3.979 6.655 -3.445 1063 HD23 LEU 50 HD23 LEU 50 5.269 5.823 -4.301 1064 H ARG 51 H ARG 51 6.322 0.817 -3.880 1065 HA ARG 51 HA ARG 51 8.688 0.286 -2.395 1066 HB2 ARG 51 HB2 ARG 51 8.005 -1.907 -2.359 1067 HB3 ARG 51 HB3 ARG 51 6.500 -1.221 -2.920 1068 HG2 ARG 51 HG2 ARG 51 6.659 -2.944 -4.417 1069 HG3 ARG 51 HG3 ARG 51 7.564 -1.740 -5.325 1070 HD2 ARG 51 HD2 ARG 51 9.675 -2.726 -4.266 1071 HD3 ARG 51 HD3 ARG 51 8.654 -4.050 -3.693 1072 HE ARG 51 HE ARG 51 8.264 -3.728 -6.460 1073 HH11 ARG 51 HH11 ARG 51 10.682 -4.905 -4.312 1074 HH12 ARG 51 HH12 ARG 51 11.441 -5.854 -5.534 1075 HH21 ARG 51 HH21 ARG 51 9.279 -4.904 -8.012 1076 HH22 ARG 51 HH22 ARG 51 10.657 -5.858 -7.588 1077 H GLU 52 H GLU 52 8.068 0.586 -5.853 1078 HA GLU 52 HA GLU 52 10.873 -0.086 -6.504 1079 HB2 GLU 52 HB2 GLU 52 8.562 0.479 -8.413 1080 HB3 GLU 52 HB3 GLU 52 10.152 -0.146 -8.847 1081 HG2 GLU 52 HG2 GLU 52 9.598 -2.126 -7.303 1082 HG3 GLU 52 HG3 GLU 52 7.941 -1.541 -7.319 1083 H ASP 53 H ASP 53 9.111 2.616 -5.654 1084 HA ASP 53 HA ASP 53 9.602 4.810 -5.449 1085 HB2 ASP 53 HB2 ASP 53 11.880 3.748 -4.880 1086 HB3 ASP 53 HB3 ASP 53 12.389 4.186 -6.506 1087 H LYS 54 H LYS 54 8.704 3.638 -8.071 1088 HA LYS 54 HA LYS 54 9.795 5.178 -10.239 1089 HB2 LYS 54 HB2 LYS 54 7.217 3.564 -10.092 1090 HB3 LYS 54 HB3 LYS 54 7.953 4.178 -11.576 1091 HG2 LYS 54 HG2 LYS 54 9.930 2.764 -11.186 1092 HG3 LYS 54 HG3 LYS 54 9.209 2.158 -9.691 1093 HD2 LYS 54 HD2 LYS 54 8.109 1.770 -12.503 1094 HD3 LYS 54 HD3 LYS 54 8.934 0.552 -11.526 1095 HE2 LYS 54 HE2 LYS 54 7.079 0.777 -9.820 1096 HE3 LYS 54 HE3 LYS 54 6.229 1.821 -10.973 1097 HZ1 LYS 54 HZ1 LYS 54 6.266 -0.009 -12.548 1098 HZ2 LYS 54 HZ2 LYS 54 5.471 -0.431 -11.127 1099 HZ3 LYS 54 HZ3 LYS 54 7.043 -0.992 -11.418 1100 H VAL 55 H VAL 55 7.580 6.031 -7.797 1101 HA VAL 55 HA VAL 55 6.530 8.285 -9.402 1102 HB VAL 55 HB VAL 55 4.332 8.161 -8.327 1103 HG11 VAL 55 HG11 VAL 55 5.069 5.532 -9.655 1104 HG12 VAL 55 HG12 VAL 55 4.608 7.023 -10.480 1105 HG13 VAL 55 HG13 VAL 55 3.435 6.175 -9.474 1106 HG21 VAL 55 HG21 VAL 55 3.643 6.200 -6.954 1107 HG22 VAL 55 HG22 VAL 55 4.932 7.118 -6.176 1108 HG23 VAL 55 HG23 VAL 55 5.302 5.596 -6.990 1109 H VAL 56 H VAL 56 5.878 10.091 -8.206 1110 HA VAL 56 HA VAL 56 6.849 10.360 -5.467 1111 HB VAL 56 HB VAL 56 8.308 11.710 -6.816 1112 HG11 VAL 56 HG11 VAL 56 5.856 12.971 -8.089 1113 HG12 VAL 56 HG12 VAL 56 6.977 11.854 -8.867 1114 HG13 VAL 56 HG13 VAL 56 7.527 13.460 -8.385 1115 HG21 VAL 56 HG21 VAL 56 7.623 12.783 -4.695 1116 HG22 VAL 56 HG22 VAL 56 6.272 13.569 -5.513 1117 HG23 VAL 56 HG23 VAL 56 7.929 13.998 -5.939 1118 H THR 57 H THR 57 5.504 11.159 -3.975 1119 HA THR 57 HA THR 57 2.651 11.331 -4.714 1120 HB THR 57 HB THR 57 2.270 10.797 -2.254 1121 HG1 THR 57 HG1 THR 57 4.715 11.419 -1.922 1122 HG21 THR 57 HG21 THR 57 2.838 8.398 -2.433 1123 HG22 THR 57 HG22 THR 57 3.865 8.740 -3.827 1124 HG23 THR 57 HG23 THR 57 2.122 9.003 -3.929 1125 H SER 58 H SER 58 1.432 13.014 -4.156 1126 HA SER 58 HA SER 58 2.301 15.085 -2.255 1127 HB2 SER 58 HB2 SER 58 1.356 15.693 -5.102 1128 HB3 SER 58 HB3 SER 58 1.638 16.901 -3.846 1129 HG SER 58 HG SER 58 3.836 15.453 -3.997 1130 H GLU 59 H GLU 59 0.412 16.551 -1.708 1131 HA GLU 59 HA GLU 59 -2.198 15.169 -2.038 1132 HB2 GLU 59 HB2 GLU 59 -1.259 14.990 0.299 1133 HB3 GLU 59 HB3 GLU 59 -1.332 16.746 0.426 1134 HG2 GLU 59 HG2 GLU 59 -3.787 16.660 0.099 1135 HG3 GLU 59 HG3 GLU 59 -3.704 14.903 -0.028 1136 H VAL 60 H VAL 60 -3.593 16.340 -3.148 1137 HA VAL 60 HA VAL 60 -3.281 19.289 -3.322 1138 HB VAL 60 HB VAL 60 -4.563 17.299 -5.247 1139 HG11 VAL 60 HG11 VAL 60 -5.253 19.225 -6.675 1140 HG12 VAL 60 HG12 VAL 60 -4.802 20.336 -5.380 1141 HG13 VAL 60 HG13 VAL 60 -6.127 19.195 -5.142 1142 HG21 VAL 60 HG21 VAL 60 -2.354 19.364 -5.599 1143 HG22 VAL 60 HG22 VAL 60 -2.946 18.277 -6.860 1144 HG23 VAL 60 HG23 VAL 60 -2.123 17.620 -5.444 1145 H GLU 61 H GLU 61 -4.395 20.140 -1.753 1146 HA GLU 61 HA GLU 61 -6.042 20.855 -0.408 1147 HB2 GLU 61 HB2 GLU 61 -7.793 20.358 -2.844 1148 HB3 GLU 61 HB3 GLU 61 -8.088 21.532 -1.561 1149 HG2 GLU 61 HG2 GLU 61 -5.946 22.694 -2.260 1150 HG3 GLU 61 HG3 GLU 61 -5.847 21.576 -3.613 1151 H GLY 62 H GLY 62 -5.509 18.153 0.093 1152 HA2 GLY 62 HA2 GLY 62 -6.421 16.866 1.844 1153 HA3 GLY 62 HA3 GLY 62 -8.031 17.367 1.384 1154 H GLU 63 H GLU 63 -6.288 16.227 -1.386 1155 HA GLU 63 HA GLU 63 -7.137 13.422 -0.896 1156 HB2 GLU 63 HB2 GLU 63 -8.119 13.183 -3.068 1157 HB3 GLU 63 HB3 GLU 63 -8.825 14.614 -2.328 1158 HG2 GLU 63 HG2 GLU 63 -7.339 16.047 -3.696 1159 HG3 GLU 63 HG3 GLU 63 -6.651 14.606 -4.448 1160 H ILE 64 H ILE 64 -6.197 11.830 -2.358 1161 HA ILE 64 HA ILE 64 -3.336 12.046 -2.383 1162 HB ILE 64 HB ILE 64 -5.125 9.780 -3.397 1163 HG12 ILE 64 HG12 ILE 64 -3.746 10.016 -0.684 1164 HG13 ILE 64 HG13 ILE 64 -5.451 10.365 -0.954 1165 HG21 ILE 64 HG21 ILE 64 -3.131 8.331 -3.142 1166 HG22 ILE 64 HG22 ILE 64 -2.162 9.740 -2.708 1167 HG23 ILE 64 HG23 ILE 64 -2.853 9.610 -4.326 1168 HD11 ILE 64 HD11 ILE 64 -4.110 7.689 -1.358 1169 HD12 ILE 64 HD12 ILE 64 -5.821 8.037 -1.620 1170 HD13 ILE 64 HD13 ILE 64 -5.133 8.157 -0.001 1171 H PHE 65 H PHE 65 -2.326 13.150 -3.960 1172 HA PHE 65 HA PHE 65 -3.067 12.751 -6.813 1173 HB2 PHE 65 HB2 PHE 65 -3.393 15.092 -6.122 1174 HB3 PHE 65 HB3 PHE 65 -1.760 15.166 -5.469 1175 HD1 PHE 65 HD2 PHE 65 -3.700 14.818 -8.648 1176 HD2 PHE 65 HD1 PHE 65 0.100 15.733 -6.903 1177 HE1 PHE 65 HE2 PHE 65 -2.870 15.583 -10.829 1178 HE2 PHE 65 HE1 PHE 65 0.915 16.492 -9.095 1179 HZ PHE 65 HZ PHE 65 -0.567 16.419 -11.057 1180 H VAL 66 H VAL 66 -1.603 11.494 -7.863 1181 HA VAL 66 HA VAL 66 1.223 11.400 -6.920 1182 HB VAL 66 HB VAL 66 -0.349 9.041 -8.065 1183 HG11 VAL 66 HG11 VAL 66 2.090 8.902 -8.457 1184 HG12 VAL 66 HG12 VAL 66 1.569 7.677 -7.303 1185 HG13 VAL 66 HG13 VAL 66 2.390 9.129 -6.731 1186 HG21 VAL 66 HG21 VAL 66 -1.271 9.644 -5.853 1187 HG22 VAL 66 HG22 VAL 66 0.346 9.581 -5.149 1188 HG23 VAL 66 HG23 VAL 66 -0.403 8.110 -5.774 1189 H LYS 67 H LYS 67 2.858 11.170 -8.508 1190 HA LYS 67 HA LYS 67 2.114 10.954 -11.347 1191 HB2 LYS 67 HB2 LYS 67 3.574 12.907 -12.001 1192 HB3 LYS 67 HB3 LYS 67 2.106 13.367 -11.165 1193 HG2 LYS 67 HG2 LYS 67 4.774 13.176 -9.745 1194 HG3 LYS 67 HG3 LYS 67 4.243 14.643 -10.570 1195 HD2 LYS 67 HD2 LYS 67 2.211 14.683 -9.089 1196 HD3 LYS 67 HD3 LYS 67 2.846 13.274 -8.232 1197 HE2 LYS 67 HE2 LYS 67 3.329 15.336 -6.995 1198 HE3 LYS 67 HE3 LYS 67 4.823 14.581 -7.549 1199 HZ1 LYS 67 HZ1 LYS 67 3.469 16.830 -8.930 1200 HZ2 LYS 67 HZ2 LYS 67 4.973 16.163 -9.316 1201 HZ3 LYS 67 HZ3 LYS 67 4.766 17.000 -7.862 1202 H LEU 68 H LEU 68 3.975 10.410 -12.718 1203 HA LEU 68 HA LEU 68 5.804 8.599 -11.481 1204 HB2 LEU 68 HB2 LEU 68 5.991 9.792 -14.280 1205 HB3 LEU 68 HB3 LEU 68 6.803 8.340 -13.711 1206 HG LEU 68 HG LEU 68 3.803 8.682 -14.138 1207 HD11 LEU 68 HD11 LEU 68 4.057 7.049 -15.936 1208 HD12 LEU 68 HD12 LEU 68 5.798 6.960 -15.645 1209 HD13 LEU 68 HD13 LEU 68 5.072 8.461 -16.232 1210 HD21 LEU 68 HD21 LEU 68 3.591 6.284 -13.598 1211 HD22 LEU 68 HD22 LEU 68 4.174 7.211 -12.220 1212 HD23 LEU 68 HD23 LEU 68 5.302 6.226 -13.156 1213 H VAL 69 H VAL 69 8.148 8.750 -11.360 1214 HA VAL 69 HA VAL 69 9.220 11.412 -10.873 1215 HB VAL 69 HB VAL 69 10.696 8.728 -10.804 1216 HG11 VAL 69 HG11 VAL 69 12.276 10.605 -11.059 1217 HG12 VAL 69 HG12 VAL 69 12.402 9.917 -9.437 1218 HG13 VAL 69 HG13 VAL 69 11.538 11.438 -9.688 1219 HG21 VAL 69 HG21 VAL 69 9.467 10.306 -8.512 1220 HG22 VAL 69 HG22 VAL 69 10.446 8.845 -8.344 1221 HG23 VAL 69 HG23 VAL 69 8.880 8.770 -9.152 1222 H LEU 70 H LEU 70 8.812 12.179 -13.089 1223 HA LEU 70 HA LEU 70 10.595 11.421 -15.234 1224 HB2 LEU 70 HB2 LEU 70 9.003 13.988 -14.782 1225 HB3 LEU 70 HB3 LEU 70 9.966 13.677 -16.213 1226 HG LEU 70 HG LEU 70 8.437 11.643 -16.622 1227 HD11 LEU 70 HD11 LEU 70 6.184 11.707 -15.675 1228 HD12 LEU 70 HD12 LEU 70 6.646 13.051 -14.626 1229 HD13 LEU 70 HD13 LEU 70 7.398 11.467 -14.417 1230 HD21 LEU 70 HD21 LEU 70 8.330 13.673 -17.987 1231 HD22 LEU 70 HD22 LEU 70 7.226 14.417 -16.826 1232 HD23 LEU 70 HD23 LEU 70 6.723 12.993 -17.740 1233 H GLU 71 H GLU 71 10.467 13.972 -12.810 1234 HA GLU 71 HA GLU 71 11.909 15.271 -11.746 1235 HB2 GLU 71 HB2 GLU 71 13.149 13.238 -11.204 1236 HB3 GLU 71 HB3 GLU 71 14.031 13.330 -12.720 1237 HG2 GLU 71 HG2 GLU 71 15.401 14.063 -10.810 1238 HG3 GLU 71 HG3 GLU 71 15.178 15.350 -11.991 1239 H HIS 72 H HIS 72 11.798 17.210 -12.641 1240 HA HIS 72 HA HIS 72 14.100 18.163 -14.156 1241 HB2 HIS 72 HB2 HIS 72 12.255 17.456 -15.851 1242 HB3 HIS 72 HB3 HIS 72 11.304 18.794 -15.222 1243 HD1 HIS 72 HD1 HIS 72 14.515 18.095 -17.104 1244 HD2 HIS 72 HD2 HIS 72 11.916 21.252 -16.374 1245 HE1 HIS 72 HE1 HIS 72 15.256 19.937 -18.633 1246 HE2 HIS 72 HE2 HIS 72 13.572 21.770 -18.289 1247 H HIS 73 H HIS 73 12.585 18.379 -11.481 1248 HA HIS 73 HA HIS 73 11.921 21.275 -11.403 1249 HB2 HIS 73 HB2 HIS 73 10.028 19.598 -11.078 1250 HB3 HIS 73 HB3 HIS 73 10.819 19.065 -9.602 1251 HD1 HIS 73 HD1 HIS 73 10.735 20.705 -7.566 1252 HD2 HIS 73 HD2 HIS 73 8.632 22.023 -10.887 1253 HE1 HIS 73 HE1 HIS 73 9.344 22.613 -6.746 1254 HE2 HIS 73 HE2 HIS 73 7.913 23.229 -8.717 1255 H HIS 74 H HIS 74 14.240 19.071 -10.362 1256 HA HIS 74 HA HIS 74 14.520 19.395 -7.633 1257 HB2 HIS 74 HB2 HIS 74 16.936 18.686 -7.952 1258 HB3 HIS 74 HB3 HIS 74 15.735 17.629 -8.669 1259 HD1 HIS 74 HD1 HIS 74 15.672 17.493 -11.271 1260 HD2 HIS 74 HD2 HIS 74 18.732 19.873 -9.784 1261 HE1 HIS 74 HE1 HIS 74 17.227 17.865 -13.196 1262 HE2 HIS 74 HE2 HIS 74 18.995 19.414 -12.322 1263 H HIS 75 H HIS 75 14.295 21.381 -6.808 1264 HA HIS 75 HA HIS 75 16.591 23.197 -6.834 1265 HB2 HIS 75 HB2 HIS 75 13.761 24.153 -7.483 1266 HB3 HIS 75 HB3 HIS 75 15.103 25.217 -7.096 1267 HD1 HIS 75 HD1 HIS 75 13.482 23.527 -9.887 1268 HD2 HIS 75 HD2 HIS 75 17.214 25.179 -9.135 1269 HE1 HIS 75 HE1 HIS 75 14.538 23.820 -12.137 1270 HE2 HIS 75 HE2 HIS 75 16.846 24.686 -11.649 1271 H HIS 76 H HIS 76 16.277 24.930 -5.094 1272 HA HIS 76 HA HIS 76 15.382 23.812 -2.600 1273 HB2 HIS 76 HB2 HIS 76 17.349 25.314 -2.738 1274 HB3 HIS 76 HB3 HIS 76 16.320 26.638 -3.267 1275 HD1 HIS 76 HD1 HIS 76 15.336 28.075 -1.467 1276 HD2 HIS 76 HD2 HIS 76 16.806 24.490 0.029 1277 HE1 HIS 76 HE1 HIS 76 15.159 28.274 1.024 1278 HE2 HIS 76 HE2 HIS 76 16.217 26.169 1.904 1279 H HIS 77 H HIS 77 13.176 23.467 -2.629 1280 HA HIS 77 HA HIS 77 11.244 25.445 -3.457 1281 HB2 HIS 77 HB2 HIS 77 9.528 23.814 -2.665 1282 HB3 HIS 77 HB3 HIS 77 10.709 23.082 -3.742 1283 HD1 HIS 77 HD1 HIS 77 9.804 23.228 -0.067 1284 HD2 HIS 77 HD2 HIS 77 12.012 20.883 -2.689 1285 HE1 HIS 77 HE1 HIS 77 10.495 21.218 1.261 1286 HE2 HIS 77 HE2 HIS 77 12.021 19.952 -0.277 Start of MODEL 11 1 H1 MET 1 H1 MET 1 7.529 17.262 7.941 2 H2 MET 1 H2 MET 1 7.065 15.841 7.147 3 H3 MET 1 H3 MET 1 6.407 16.225 8.657 4 HA MET 1 HA MET 1 5.315 18.161 7.756 5 HB2 MET 1 HB2 MET 1 6.394 17.200 5.071 6 HB3 MET 1 HB3 MET 1 5.321 18.579 5.318 7 HG2 MET 1 HG2 MET 1 8.193 18.315 6.244 8 HG3 MET 1 HG3 MET 1 7.562 19.397 4.995 9 HE1 MET 1 HE1 MET 1 8.829 21.457 6.232 10 HE2 MET 1 HE2 MET 1 9.412 20.364 7.492 11 HE3 MET 1 HE3 MET 1 8.582 21.858 7.930 12 H LYS 2 H LYS 2 5.247 14.930 7.787 13 HA LYS 2 HA LYS 2 3.661 13.339 7.811 14 HB2 LYS 2 HB2 LYS 2 1.793 15.716 7.540 15 HB3 LYS 2 HB3 LYS 2 1.193 14.067 7.679 16 HG2 LYS 2 HG2 LYS 2 2.247 13.832 9.882 17 HG3 LYS 2 HG3 LYS 2 2.925 15.459 9.756 18 HD2 LYS 2 HD2 LYS 2 -0.057 14.818 9.757 19 HD3 LYS 2 HD3 LYS 2 0.858 15.323 11.180 20 HE2 LYS 2 HE2 LYS 2 0.537 16.979 8.646 21 HE3 LYS 2 HE3 LYS 2 -0.406 17.196 10.121 22 HZ1 LYS 2 HZ1 LYS 2 1.636 17.719 11.304 23 HZ2 LYS 2 HZ2 LYS 2 1.420 18.767 9.996 24 HZ3 LYS 2 HZ3 LYS 2 2.543 17.507 9.895 25 H MET 3 H MET 3 4.722 14.507 5.087 26 HA MET 3 HA MET 3 2.829 14.028 3.063 27 HB2 MET 3 HB2 MET 3 5.849 13.659 2.951 28 HB3 MET 3 HB3 MET 3 4.791 13.717 1.546 29 HG2 MET 3 HG2 MET 3 4.162 16.041 2.152 30 HG3 MET 3 HG3 MET 3 5.291 15.962 3.508 31 HE1 MET 3 HE1 MET 3 6.638 15.750 -0.925 32 HE2 MET 3 HE2 MET 3 4.957 15.976 -0.446 33 HE3 MET 3 HE3 MET 3 5.761 14.437 -0.139 34 H LEU 4 H LEU 4 2.560 12.224 1.605 35 HA LEU 4 HA LEU 4 1.850 9.861 2.843 36 HB2 LEU 4 HB2 LEU 4 1.085 10.792 0.600 37 HB3 LEU 4 HB3 LEU 4 2.532 10.114 -0.118 38 HG LEU 4 HG LEU 4 0.500 8.335 1.307 39 HD11 LEU 4 HD11 LEU 4 -0.560 7.877 -0.861 40 HD12 LEU 4 HD12 LEU 4 0.445 9.113 -1.624 41 HD13 LEU 4 HD13 LEU 4 -0.742 9.568 -0.398 42 HD21 LEU 4 HD21 LEU 4 2.539 7.712 -0.867 43 HD22 LEU 4 HD22 LEU 4 1.394 6.558 -0.172 44 HD23 LEU 4 HD23 LEU 4 2.656 7.259 0.835 45 H LYS 5 H LYS 5 4.912 10.547 1.181 46 HA LYS 5 HA LYS 5 5.924 7.877 1.131 47 HB2 LYS 5 HB2 LYS 5 6.646 9.741 -0.413 48 HB3 LYS 5 HB3 LYS 5 7.490 10.484 0.939 49 HG2 LYS 5 HG2 LYS 5 9.141 9.332 -0.337 50 HG3 LYS 5 HG3 LYS 5 8.881 8.366 1.120 51 HD2 LYS 5 HD2 LYS 5 7.418 6.825 -0.177 52 HD3 LYS 5 HD3 LYS 5 7.683 7.798 -1.630 53 HE2 LYS 5 HE2 LYS 5 9.780 6.217 -0.096 54 HE3 LYS 5 HE3 LYS 5 9.120 5.822 -1.682 55 HZ1 LYS 5 HZ1 LYS 5 11.240 6.825 -1.971 56 HZ2 LYS 5 HZ2 LYS 5 10.842 8.135 -0.981 57 HZ3 LYS 5 HZ3 LYS 5 10.088 7.953 -2.480 58 H GLU 6 H GLU 6 6.568 10.673 3.307 59 HA GLU 6 HA GLU 6 8.609 9.339 4.821 60 HB2 GLU 6 HB2 GLU 6 8.658 11.327 6.235 61 HB3 GLU 6 HB3 GLU 6 8.566 11.817 4.548 62 HG2 GLU 6 HG2 GLU 6 6.178 12.301 4.785 63 HG3 GLU 6 HG3 GLU 6 6.201 11.739 6.450 64 H LYS 7 H LYS 7 5.125 9.908 5.357 65 HA LYS 7 HA LYS 7 5.112 8.917 8.054 66 HB2 LYS 7 HB2 LYS 7 2.683 9.166 7.964 67 HB3 LYS 7 HB3 LYS 7 3.454 10.577 7.267 68 HG2 LYS 7 HG2 LYS 7 1.864 10.323 5.646 69 HG3 LYS 7 HG3 LYS 7 3.021 9.177 4.984 70 HD2 LYS 7 HD2 LYS 7 1.094 7.898 4.897 71 HD3 LYS 7 HD3 LYS 7 1.683 7.425 6.486 72 HE2 LYS 7 HE2 LYS 7 -0.485 9.479 5.902 73 HE3 LYS 7 HE3 LYS 7 -0.724 7.863 6.561 74 HZ1 LYS 7 HZ1 LYS 7 0.555 8.562 8.525 75 HZ2 LYS 7 HZ2 LYS 7 -0.838 9.486 8.296 76 HZ3 LYS 7 HZ3 LYS 7 0.671 10.124 7.883 77 H ALA 8 H ALA 8 4.583 7.469 4.871 78 HA ALA 8 HA ALA 8 3.585 4.935 5.624 79 HB1 ALA 8 HB1 ALA 8 4.436 4.139 3.452 80 HB2 ALA 8 HB2 ALA 8 5.403 5.608 3.282 81 HB3 ALA 8 HB3 ALA 8 3.639 5.705 3.285 82 H GLY 9 H GLY 9 6.946 6.091 5.262 83 HA2 GLY 9 HA2 GLY 9 8.303 3.734 6.051 84 HA3 GLY 9 HA3 GLY 9 8.947 5.364 6.102 85 H ALA 10 H ALA 10 7.219 6.555 7.950 86 HA ALA 10 HA ALA 10 8.404 5.876 10.421 87 HB1 ALA 10 HB1 ALA 10 5.904 7.535 9.936 88 HB2 ALA 10 HB2 ALA 10 7.562 8.133 9.891 89 HB3 ALA 10 HB3 ALA 10 6.888 7.538 11.409 90 H LEU 11 H LEU 11 5.122 5.217 9.196 91 HA LEU 11 HA LEU 11 4.128 3.871 11.518 92 HB2 LEU 11 HB2 LEU 11 3.172 3.873 8.630 93 HB3 LEU 11 HB3 LEU 11 2.260 3.185 9.969 94 HG LEU 11 HG LEU 11 3.056 6.126 9.857 95 HD11 LEU 11 HD11 LEU 11 0.772 6.628 9.114 96 HD12 LEU 11 HD12 LEU 11 0.441 4.903 8.944 97 HD13 LEU 11 HD13 LEU 11 1.658 5.676 7.925 98 HD21 LEU 11 HD21 LEU 11 2.536 5.269 12.109 99 HD22 LEU 11 HD22 LEU 11 0.962 4.708 11.542 100 HD23 LEU 11 HD23 LEU 11 1.328 6.435 11.568 101 H ALA 12 H ALA 12 5.929 2.802 8.705 102 HA ALA 12 HA ALA 12 5.384 0.062 8.626 103 HB1 ALA 12 HB1 ALA 12 8.014 1.431 7.980 104 HB2 ALA 12 HB2 ALA 12 6.634 1.286 6.892 105 HB3 ALA 12 HB3 ALA 12 7.496 -0.165 7.412 106 H GLY 13 H GLY 13 7.801 1.786 10.567 107 HA2 GLY 13 HA2 GLY 13 9.380 -0.261 11.537 108 HA3 GLY 13 HA3 GLY 13 9.055 1.222 12.409 109 H GLN 14 H GLN 14 6.500 1.036 13.190 110 HA GLN 14 HA GLN 14 6.653 -0.723 15.432 111 HB2 GLN 14 HB2 GLN 14 4.427 0.215 16.040 112 HB3 GLN 14 HB3 GLN 14 5.611 1.460 15.648 113 HG2 GLN 14 HG2 GLN 14 4.600 1.609 13.353 114 HG3 GLN 14 HG3 GLN 14 3.345 0.488 13.880 115 HE21 GLN 14 HE21 GLN 14 3.139 3.255 12.947 116 HE22 GLN 14 HE22 GLN 14 2.337 4.123 14.202 117 H ILE 15 H ILE 15 4.800 -0.868 12.380 118 HA ILE 15 HA ILE 15 3.059 -3.022 13.059 119 HB ILE 15 HB ILE 15 4.058 -2.193 10.293 120 HG12 ILE 15 HG12 ILE 15 1.496 -1.381 11.750 121 HG13 ILE 15 HG13 ILE 15 2.905 -0.348 11.535 122 HG21 ILE 15 HG21 ILE 15 1.625 -3.879 11.025 123 HG22 ILE 15 HG22 ILE 15 3.098 -4.470 10.253 124 HG23 ILE 15 HG23 ILE 15 2.049 -3.341 9.397 125 HD11 ILE 15 HD11 ILE 15 1.165 0.236 9.968 126 HD12 ILE 15 HD12 ILE 15 1.122 -1.410 9.342 127 HD13 ILE 15 HD13 ILE 15 2.557 -0.410 9.098 128 H TRP 16 H TRP 16 6.196 -2.926 11.387 129 HA TRP 16 HA TRP 16 6.635 -5.657 10.953 130 HB2 TRP 16 HB2 TRP 16 7.994 -3.778 9.971 131 HB3 TRP 16 HB3 TRP 16 8.737 -3.516 11.545 132 HD1 TRP 16 HD1 TRP 16 8.785 -5.920 8.567 133 HE1 TRP 16 HE1 TRP 16 10.827 -7.466 8.759 134 HE3 TRP 16 HE3 TRP 16 10.368 -4.602 13.248 135 HZ2 TRP 16 HZ2 TRP 16 12.845 -8.064 10.643 136 HZ3 TRP 16 HZ3 TRP 16 12.357 -5.712 14.180 137 HH2 TRP 16 HH2 TRP 16 13.565 -7.410 12.909 138 H GLU 17 H GLU 17 7.504 -3.635 13.761 139 HA GLU 17 HA GLU 17 8.771 -5.670 15.314 140 HB2 GLU 17 HB2 GLU 17 7.624 -2.969 16.117 141 HB3 GLU 17 HB3 GLU 17 8.521 -4.011 17.225 142 HG2 GLU 17 HG2 GLU 17 10.496 -3.879 15.774 143 HG3 GLU 17 HG3 GLU 17 9.607 -2.878 14.628 144 H ALA 18 H ALA 18 5.391 -4.747 14.999 145 HA ALA 18 HA ALA 18 4.359 -6.240 17.224 146 HB1 ALA 18 HB1 ALA 18 2.972 -5.451 14.632 147 HB2 ALA 18 HB2 ALA 18 3.046 -4.476 16.101 148 HB3 ALA 18 HB3 ALA 18 2.173 -6.009 16.107 149 H LEU 19 H LEU 19 5.245 -7.071 13.919 150 HA LEU 19 HA LEU 19 4.265 -9.821 14.064 151 HB2 LEU 19 HB2 LEU 19 5.889 -8.329 11.976 152 HB3 LEU 19 HB3 LEU 19 5.287 -9.969 11.775 153 HG LEU 19 HG LEU 19 3.504 -7.521 12.151 154 HD11 LEU 19 HD11 LEU 19 4.180 -8.998 9.582 155 HD12 LEU 19 HD12 LEU 19 4.694 -7.365 10.017 156 HD13 LEU 19 HD13 LEU 19 2.986 -7.708 9.758 157 HD21 LEU 19 HD21 LEU 19 1.681 -9.037 11.463 158 HD22 LEU 19 HD22 LEU 19 2.465 -9.594 12.938 159 HD23 LEU 19 HD23 LEU 19 2.821 -10.386 11.400 160 H ASN 20 H ASN 20 7.237 -8.118 14.755 161 HA ASN 20 HA ASN 20 9.068 -10.280 14.390 162 HB2 ASN 20 HB2 ASN 20 9.765 -7.885 14.422 163 HB3 ASN 20 HB3 ASN 20 9.416 -7.800 16.141 164 HD21 ASN 20 HD21 ASN 20 10.800 -8.902 17.596 165 HD22 ASN 20 HD22 ASN 20 12.380 -9.409 17.123 166 H GLY 21 H GLY 21 9.464 -12.002 15.624 167 HA2 GLY 21 HA2 GLY 21 9.745 -13.272 17.581 168 HA3 GLY 21 HA3 GLY 21 8.849 -12.079 18.500 169 H THR 22 H THR 22 6.820 -12.385 16.069 170 HA THR 22 HA THR 22 5.257 -14.595 17.305 171 HB THR 22 HB THR 22 3.228 -13.492 16.515 172 HG1 THR 22 HG1 THR 22 3.948 -11.170 15.558 173 HG21 THR 22 HG21 THR 22 3.291 -11.356 17.744 174 HG22 THR 22 HG22 THR 22 5.056 -11.404 17.764 175 HG23 THR 22 HG23 THR 22 4.131 -12.620 18.648 176 H GLU 23 H GLU 23 3.663 -15.678 15.719 177 HA GLU 23 HA GLU 23 5.042 -16.491 13.262 178 HB2 GLU 23 HB2 GLU 23 3.348 -18.268 13.122 179 HB3 GLU 23 HB3 GLU 23 4.064 -18.217 14.729 180 HG2 GLU 23 HG2 GLU 23 2.058 -16.985 15.552 181 HG3 GLU 23 HG3 GLU 23 1.340 -17.133 13.949 182 H GLY 24 H GLY 24 3.127 -13.925 13.924 183 HA2 GLY 24 HA2 GLY 24 2.564 -12.470 12.068 184 HA3 GLY 24 HA3 GLY 24 1.931 -13.858 11.205 185 H LEU 25 H LEU 25 0.718 -11.258 11.950 186 HA LEU 25 HA LEU 25 -1.757 -12.230 13.262 187 HB2 LEU 25 HB2 LEU 25 -0.526 -9.449 13.573 188 HB3 LEU 25 HB3 LEU 25 -2.107 -9.910 14.163 189 HG LEU 25 HG LEU 25 -0.745 -9.864 16.078 190 HD11 LEU 25 HD11 LEU 25 -0.659 -12.140 16.925 191 HD12 LEU 25 HD12 LEU 25 -0.832 -12.779 15.289 192 HD13 LEU 25 HD13 LEU 25 -2.145 -11.851 16.017 193 HD21 LEU 25 HD21 LEU 25 1.402 -11.433 14.625 194 HD22 LEU 25 HD22 LEU 25 1.456 -10.912 16.311 195 HD23 LEU 25 HD23 LEU 25 1.443 -9.713 15.023 196 H THR 26 H THR 26 -3.713 -10.932 12.587 197 HA THR 26 HA THR 26 -3.611 -10.022 9.790 198 HB THR 26 HB THR 26 -6.052 -9.712 9.953 199 HG1 THR 26 HG1 THR 26 -7.159 -9.992 11.842 200 HG21 THR 26 HG21 THR 26 -6.763 -12.034 10.353 201 HG22 THR 26 HG22 THR 26 -5.222 -12.381 11.138 202 HG23 THR 26 HG23 THR 26 -5.262 -11.986 9.418 203 H GLN 27 H GLN 27 -4.830 -7.908 9.292 204 HA GLN 27 HA GLN 27 -3.531 -5.683 10.360 205 HB2 GLN 27 HB2 GLN 27 -5.160 -4.304 9.138 206 HB3 GLN 27 HB3 GLN 27 -4.627 -5.666 8.161 207 HG2 GLN 27 HG2 GLN 27 -6.728 -6.854 8.673 208 HG3 GLN 27 HG3 GLN 27 -7.263 -5.492 9.651 209 HE21 GLN 27 HE21 GLN 27 -7.856 -3.544 8.590 210 HE22 GLN 27 HE22 GLN 27 -8.225 -3.520 6.904 211 H LYS 28 H LYS 28 -6.581 -7.135 11.322 212 HA LYS 28 HA LYS 28 -7.665 -5.150 12.995 213 HB2 LYS 28 HB2 LYS 28 -8.938 -7.042 12.098 214 HB3 LYS 28 HB3 LYS 28 -7.948 -8.182 13.002 215 HG2 LYS 28 HG2 LYS 28 -8.871 -7.401 15.110 216 HG3 LYS 28 HG3 LYS 28 -9.771 -6.122 14.290 217 HD2 LYS 28 HD2 LYS 28 -10.197 -9.107 13.857 218 HD3 LYS 28 HD3 LYS 28 -11.193 -8.089 14.895 219 HE2 LYS 28 HE2 LYS 28 -11.901 -6.759 12.950 220 HE3 LYS 28 HE3 LYS 28 -10.842 -7.700 11.902 221 HZ1 LYS 28 HZ1 LYS 28 -13.150 -8.402 11.772 222 HZ2 LYS 28 HZ2 LYS 28 -13.138 -8.794 13.416 223 HZ3 LYS 28 HZ3 LYS 28 -12.156 -9.647 12.340 224 H GLN 29 H GLN 29 -5.524 -7.888 13.719 225 HA GLN 29 HA GLN 29 -5.488 -7.517 16.571 226 HB2 GLN 29 HB2 GLN 29 -3.510 -9.103 14.889 227 HB3 GLN 29 HB3 GLN 29 -3.869 -9.330 16.599 228 HG2 GLN 29 HG2 GLN 29 -5.858 -9.816 14.357 229 HG3 GLN 29 HG3 GLN 29 -4.830 -11.066 15.047 230 HE21 GLN 29 HE21 GLN 29 -6.619 -12.285 15.700 231 HE22 GLN 29 HE22 GLN 29 -7.625 -11.824 17.020 232 H ILE 30 H ILE 30 -3.316 -6.665 13.897 233 HA ILE 30 HA ILE 30 -1.136 -5.665 15.410 234 HB ILE 30 HB ILE 30 -1.982 -5.048 12.548 235 HG12 ILE 30 HG12 ILE 30 0.150 -6.927 13.661 236 HG13 ILE 30 HG13 ILE 30 -1.410 -7.426 13.014 237 HG21 ILE 30 HG21 ILE 30 0.317 -4.200 12.166 238 HG22 ILE 30 HG22 ILE 30 0.668 -4.368 13.887 239 HG23 ILE 30 HG23 ILE 30 -0.547 -3.209 13.344 240 HD11 ILE 30 HD11 ILE 30 -0.741 -6.587 10.808 241 HD12 ILE 30 HD12 ILE 30 0.347 -7.827 11.428 242 HD13 ILE 30 HD13 ILE 30 0.832 -6.132 11.470 243 H LYS 31 H LYS 31 -3.999 -4.005 14.036 244 HA LYS 31 HA LYS 31 -3.377 -1.334 14.583 245 HB2 LYS 31 HB2 LYS 31 -6.056 -2.766 14.531 246 HB3 LYS 31 HB3 LYS 31 -5.939 -1.027 14.786 247 HG2 LYS 31 HG2 LYS 31 -4.999 -0.679 12.600 248 HG3 LYS 31 HG3 LYS 31 -4.803 -2.414 12.342 249 HD2 LYS 31 HD2 LYS 31 -6.739 -1.581 11.088 250 HD3 LYS 31 HD3 LYS 31 -7.257 -2.706 12.345 251 HE2 LYS 31 HE2 LYS 31 -8.796 -0.845 12.311 252 HE3 LYS 31 HE3 LYS 31 -7.841 -0.725 13.786 253 HZ1 LYS 31 HZ1 LYS 31 -7.475 0.837 11.298 254 HZ2 LYS 31 HZ2 LYS 31 -6.444 0.918 12.638 255 HZ3 LYS 31 HZ3 LYS 31 -8.055 1.411 12.779 256 H LYS 32 H LYS 32 -4.593 -3.807 16.816 257 HA LYS 32 HA LYS 32 -5.027 -2.094 19.074 258 HB2 LYS 32 HB2 LYS 32 -4.429 -5.084 19.046 259 HB3 LYS 32 HB3 LYS 32 -5.116 -4.174 20.394 260 HG2 LYS 32 HG2 LYS 32 -6.423 -4.716 17.706 261 HG3 LYS 32 HG3 LYS 32 -6.859 -5.435 19.263 262 HD2 LYS 32 HD2 LYS 32 -7.490 -3.141 20.089 263 HD3 LYS 32 HD3 LYS 32 -7.133 -2.497 18.481 264 HE2 LYS 32 HE2 LYS 32 -9.301 -4.505 19.194 265 HE3 LYS 32 HE3 LYS 32 -9.531 -2.823 18.708 266 HZ1 LYS 32 HZ1 LYS 32 -8.578 -3.382 16.538 267 HZ2 LYS 32 HZ2 LYS 32 -9.957 -4.301 16.868 268 HZ3 LYS 32 HZ3 LYS 32 -8.424 -5.001 17.010 269 H ALA 33 H ALA 33 -2.341 -4.214 18.094 270 HA ALA 33 HA ALA 33 -0.686 -3.843 20.378 271 HB1 ALA 33 HB1 ALA 33 1.033 -5.015 19.055 272 HB2 ALA 33 HB2 ALA 33 0.067 -4.793 17.590 273 HB3 ALA 33 HB3 ALA 33 -0.536 -5.807 18.901 274 H THR 34 H THR 34 -0.900 -2.123 17.327 275 HA THR 34 HA THR 34 1.480 -0.456 17.859 276 HB THR 34 HB THR 34 1.249 0.269 15.475 277 HG1 THR 34 HG1 THR 34 -0.522 -1.706 14.756 278 HG21 THR 34 HG21 THR 34 2.667 -1.692 15.978 279 HG22 THR 34 HG22 THR 34 1.874 -1.860 14.413 280 HG23 THR 34 HG23 THR 34 1.265 -2.758 15.805 281 H LYS 35 H LYS 35 -1.921 -0.324 18.103 282 HA LYS 35 HA LYS 35 -3.372 1.251 18.836 283 HB2 LYS 35 HB2 LYS 35 -1.480 1.873 20.366 284 HB3 LYS 35 HB3 LYS 35 -0.939 3.050 19.181 285 HG2 LYS 35 HG2 LYS 35 -3.014 4.344 19.506 286 HG3 LYS 35 HG3 LYS 35 -3.590 3.142 20.664 287 HD2 LYS 35 HD2 LYS 35 -2.650 5.138 21.788 288 HD3 LYS 35 HD3 LYS 35 -1.751 3.675 22.191 289 HE2 LYS 35 HE2 LYS 35 -0.028 4.323 20.471 290 HE3 LYS 35 HE3 LYS 35 -0.910 5.830 20.206 291 HZ1 LYS 35 HZ1 LYS 35 0.930 6.128 21.709 292 HZ2 LYS 35 HZ2 LYS 35 0.318 4.954 22.759 293 HZ3 LYS 35 HZ3 LYS 35 -0.526 6.400 22.522 294 H LEU 36 H LEU 36 -2.550 0.996 15.989 295 HA LEU 36 HA LEU 36 -2.922 3.595 14.758 296 HB2 LEU 36 HB2 LEU 36 -2.992 0.821 13.501 297 HB3 LEU 36 HB3 LEU 36 -3.001 2.341 12.614 298 HG LEU 36 HG LEU 36 -0.721 1.206 14.279 299 HD11 LEU 36 HD11 LEU 36 -0.953 0.180 12.080 300 HD12 LEU 36 HD12 LEU 36 0.513 1.150 12.170 301 HD13 LEU 36 HD13 LEU 36 -0.899 1.768 11.304 302 HD21 LEU 36 HD21 LEU 36 -0.761 3.608 14.658 303 HD22 LEU 36 HD22 LEU 36 -0.829 3.920 12.922 304 HD23 LEU 36 HD23 LEU 36 0.608 3.181 13.633 305 H LYS 37 H LYS 37 -4.840 4.409 15.438 306 HA LYS 37 HA LYS 37 -7.305 3.125 15.739 307 HB2 LYS 37 HB2 LYS 37 -8.294 5.298 16.040 308 HB3 LYS 37 HB3 LYS 37 -6.684 5.358 16.733 309 HG2 LYS 37 HG2 LYS 37 -7.499 6.553 14.052 310 HG3 LYS 37 HG3 LYS 37 -7.283 7.447 15.560 311 HD2 LYS 37 HD2 LYS 37 -4.883 6.891 15.570 312 HD3 LYS 37 HD3 LYS 37 -5.084 5.913 14.113 313 HE2 LYS 37 HE2 LYS 37 -5.855 8.038 12.938 314 HE3 LYS 37 HE3 LYS 37 -5.325 8.926 14.372 315 HZ1 LYS 37 HZ1 LYS 37 -3.594 8.925 12.746 316 HZ2 LYS 37 HZ2 LYS 37 -3.646 7.244 12.593 317 HZ3 LYS 37 HZ3 LYS 37 -3.096 7.945 14.031 318 H ALA 38 H ALA 38 -5.892 4.640 12.878 319 HA ALA 38 HA ALA 38 -8.299 4.074 11.247 320 HB1 ALA 38 HB1 ALA 38 -7.481 6.400 11.180 321 HB2 ALA 38 HB2 ALA 38 -7.317 5.631 9.600 322 HB3 ALA 38 HB3 ALA 38 -5.899 5.840 10.633 323 H ASP 39 H ASP 39 -8.203 2.647 9.562 324 HA ASP 39 HA ASP 39 -6.056 0.779 9.253 325 HB2 ASP 39 HB2 ASP 39 -8.472 1.350 7.491 326 HB3 ASP 39 HB3 ASP 39 -7.390 -0.032 7.295 327 H LYS 40 H LYS 40 -6.920 3.807 7.734 328 HA LYS 40 HA LYS 40 -5.256 4.015 5.531 329 HB2 LYS 40 HB2 LYS 40 -5.953 6.080 7.654 330 HB3 LYS 40 HB3 LYS 40 -5.145 6.492 6.143 331 HG2 LYS 40 HG2 LYS 40 -7.846 5.114 6.235 332 HG3 LYS 40 HG3 LYS 40 -7.661 6.877 6.234 333 HD2 LYS 40 HD2 LYS 40 -6.388 6.667 4.056 334 HD3 LYS 40 HD3 LYS 40 -6.760 4.939 4.053 335 HE2 LYS 40 HE2 LYS 40 -9.165 5.443 3.943 336 HE3 LYS 40 HE3 LYS 40 -8.825 7.174 4.033 337 HZ1 LYS 40 HZ1 LYS 40 -8.100 5.321 1.844 338 HZ2 LYS 40 HZ2 LYS 40 -7.551 6.913 1.950 339 HZ3 LYS 40 HZ3 LYS 40 -9.203 6.602 1.787 340 H ASP 41 H ASP 41 -4.331 4.294 8.971 341 HA ASP 41 HA ASP 41 -1.598 5.030 8.586 342 HB2 ASP 41 HB2 ASP 41 -2.696 3.397 10.917 343 HB3 ASP 41 HB3 ASP 41 -1.260 4.415 10.917 344 H PHE 42 H PHE 42 -3.315 1.941 8.795 345 HA PHE 42 HA PHE 42 -0.998 0.288 9.061 346 HB2 PHE 42 HB2 PHE 42 -3.172 -0.454 9.955 347 HB3 PHE 42 HB3 PHE 42 -3.855 -0.499 8.329 348 HD1 PHE 42 HD1 PHE 42 -1.301 -2.065 10.554 349 HD2 PHE 42 HD2 PHE 42 -3.512 -2.432 6.906 350 HE1 PHE 42 HE1 PHE 42 -0.473 -4.354 10.270 351 HE2 PHE 42 HE2 PHE 42 -2.676 -4.727 6.641 352 HZ PHE 42 HZ PHE 42 -1.154 -5.691 8.323 353 H PHE 43 H PHE 43 -3.093 1.102 6.242 354 HA PHE 43 HA PHE 43 -2.086 -0.883 4.486 355 HB2 PHE 43 HB2 PHE 43 -3.383 1.780 3.765 356 HB3 PHE 43 HB3 PHE 43 -3.131 0.447 2.644 357 HD1 PHE 43 HD2 PHE 43 -3.942 -1.898 4.311 358 HD2 PHE 43 HD1 PHE 43 -5.740 1.967 3.898 359 HE1 PHE 43 HE2 PHE 43 -6.123 -2.844 4.926 360 HE2 PHE 43 HE1 PHE 43 -7.919 1.019 4.514 361 HZ PHE 43 HZ PHE 43 -8.117 -1.392 5.028 362 H LEU 44 H LEU 44 -1.136 2.509 4.918 363 HA LEU 44 HA LEU 44 0.798 2.539 2.791 364 HB2 LEU 44 HB2 LEU 44 0.131 4.478 5.028 365 HB3 LEU 44 HB3 LEU 44 1.492 4.764 3.957 366 HG LEU 44 HG LEU 44 -0.062 4.807 1.998 367 HD11 LEU 44 HD11 LEU 44 -2.488 4.965 2.282 368 HD12 LEU 44 HD12 LEU 44 -2.324 4.634 4.007 369 HD13 LEU 44 HD13 LEU 44 -1.885 3.400 2.826 370 HD21 LEU 44 HD21 LEU 44 -0.820 6.793 4.158 371 HD22 LEU 44 HD22 LEU 44 -1.048 7.001 2.418 372 HD23 LEU 44 HD23 LEU 44 0.579 6.910 3.087 373 H GLY 45 H GLY 45 0.991 2.093 6.329 374 HA2 GLY 45 HA2 GLY 45 3.815 1.868 6.579 375 HA3 GLY 45 HA3 GLY 45 2.624 1.160 7.662 376 H LEU 46 H LEU 46 1.321 -0.600 6.051 377 HA LEU 46 HA LEU 46 2.931 -2.925 5.959 378 HB2 LEU 46 HB2 LEU 46 0.496 -3.019 6.318 379 HB3 LEU 46 HB3 LEU 46 0.209 -2.337 4.726 380 HG LEU 46 HG LEU 46 1.294 -4.435 3.742 381 HD11 LEU 46 HD11 LEU 46 1.433 -6.437 5.137 382 HD12 LEU 46 HD12 LEU 46 1.024 -5.484 6.566 383 HD13 LEU 46 HD13 LEU 46 2.533 -5.179 5.701 384 HD21 LEU 46 HD21 LEU 46 -1.253 -4.855 5.337 385 HD22 LEU 46 HD22 LEU 46 -0.716 -5.816 3.958 386 HD23 LEU 46 HD23 LEU 46 -1.141 -4.122 3.734 387 H GLY 47 H GLY 47 1.939 -0.601 3.528 388 HA2 GLY 47 HA2 GLY 47 2.743 -1.916 1.158 389 HA3 GLY 47 HA3 GLY 47 2.587 -0.175 1.365 390 H TRP 48 H TRP 48 4.511 0.007 3.515 391 HA TRP 48 HA TRP 48 6.991 0.113 2.064 392 HB2 TRP 48 HB2 TRP 48 6.159 1.719 3.932 393 HB3 TRP 48 HB3 TRP 48 6.700 0.490 5.068 394 HD1 TRP 48 HD1 TRP 48 9.442 0.034 5.130 395 HE1 TRP 48 HE1 TRP 48 11.397 1.583 4.510 396 HE3 TRP 48 HE3 TRP 48 6.867 3.556 2.459 397 HZ2 TRP 48 HZ2 TRP 48 11.793 3.986 3.082 398 HZ3 TRP 48 HZ3 TRP 48 8.104 5.462 1.509 399 HH2 TRP 48 HH2 TRP 48 10.523 5.677 1.822 400 H LEU 49 H LEU 49 5.606 -2.009 4.547 401 HA LEU 49 HA LEU 49 7.811 -3.701 5.017 402 HB2 LEU 49 HB2 LEU 49 4.832 -4.017 5.278 403 HB3 LEU 49 HB3 LEU 49 5.829 -5.439 5.440 404 HG LEU 49 HG LEU 49 6.953 -4.541 7.400 405 HD11 LEU 49 HD11 LEU 49 6.346 -2.398 8.396 406 HD12 LEU 49 HD12 LEU 49 5.310 -2.039 7.009 407 HD13 LEU 49 HD13 LEU 49 7.055 -2.191 6.795 408 HD21 LEU 49 HD21 LEU 49 5.052 -4.436 8.956 409 HD22 LEU 49 HD22 LEU 49 4.811 -5.703 7.753 410 HD23 LEU 49 HD23 LEU 49 3.944 -4.168 7.603 411 H LEU 50 H LEU 50 5.327 -3.834 2.488 412 HA LEU 50 HA LEU 50 6.353 -6.213 1.212 413 HB2 LEU 50 HB2 LEU 50 4.385 -4.086 0.271 414 HB3 LEU 50 HB3 LEU 50 4.780 -5.524 -0.664 415 HG LEU 50 HG LEU 50 3.478 -5.545 2.096 416 HD11 LEU 50 HD11 LEU 50 2.204 -6.071 -0.612 417 HD12 LEU 50 HD12 LEU 50 1.934 -4.661 0.418 418 HD13 LEU 50 HD13 LEU 50 1.424 -6.256 0.964 419 HD21 LEU 50 HD21 LEU 50 4.847 -7.537 1.728 420 HD22 LEU 50 HD22 LEU 50 4.044 -7.843 0.186 421 HD23 LEU 50 HD23 LEU 50 3.135 -7.958 1.696 422 H ARG 51 H ARG 51 6.845 -2.726 0.839 423 HA ARG 51 HA ARG 51 8.116 -2.736 -1.680 424 HB2 ARG 51 HB2 ARG 51 8.265 -0.461 -1.441 425 HB3 ARG 51 HB3 ARG 51 7.167 -0.749 -0.122 426 HG2 ARG 51 HG2 ARG 51 8.584 0.530 1.099 427 HG3 ARG 51 HG3 ARG 51 9.591 -0.909 1.178 428 HD2 ARG 51 HD2 ARG 51 10.802 -0.091 -0.870 429 HD3 ARG 51 HD3 ARG 51 9.855 1.399 -0.772 430 HE ARG 51 HE ARG 51 11.158 0.899 1.698 431 HH11 ARG 51 HH11 ARG 51 11.796 2.090 -1.492 432 HH12 ARG 51 HH12 ARG 51 13.246 2.896 -1.013 433 HH21 ARG 51 HH21 ARG 51 13.032 1.920 2.274 434 HH22 ARG 51 HH22 ARG 51 13.934 2.799 1.089 435 H GLU 52 H GLU 52 9.494 -3.217 1.561 436 HA GLU 52 HA GLU 52 12.211 -3.551 0.419 437 HB2 GLU 52 HB2 GLU 52 11.370 -3.418 3.340 438 HB3 GLU 52 HB3 GLU 52 13.024 -3.412 2.740 439 HG2 GLU 52 HG2 GLU 52 12.505 -1.246 1.584 440 HG3 GLU 52 HG3 GLU 52 10.928 -1.254 2.369 441 H ASP 53 H ASP 53 9.668 -5.563 0.760 442 HA ASP 53 HA ASP 53 9.355 -7.807 0.802 443 HB2 ASP 53 HB2 ASP 53 12.387 -7.951 0.519 444 HB3 ASP 53 HB3 ASP 53 11.292 -9.312 0.293 445 H LYS 54 H LYS 54 9.698 -6.392 3.311 446 HA LYS 54 HA LYS 54 11.262 -7.860 5.216 447 HB2 LYS 54 HB2 LYS 54 8.903 -6.028 5.847 448 HB3 LYS 54 HB3 LYS 54 10.316 -6.358 6.851 449 HG2 LYS 54 HG2 LYS 54 11.735 -5.080 5.325 450 HG3 LYS 54 HG3 LYS 54 10.383 -4.866 4.214 451 HD2 LYS 54 HD2 LYS 54 10.495 -2.804 5.352 452 HD3 LYS 54 HD3 LYS 54 9.182 -3.653 6.167 453 HE2 LYS 54 HE2 LYS 54 10.597 -2.566 7.813 454 HE3 LYS 54 HE3 LYS 54 10.785 -4.315 7.960 455 HZ1 LYS 54 HZ1 LYS 54 12.644 -2.547 6.474 456 HZ2 LYS 54 HZ2 LYS 54 12.848 -4.197 6.796 457 HZ3 LYS 54 HZ3 LYS 54 12.893 -3.080 8.061 458 H VAL 55 H VAL 55 8.059 -8.214 3.899 459 HA VAL 55 HA VAL 55 7.289 -10.286 5.849 460 HB VAL 55 HB VAL 55 5.019 -9.402 6.092 461 HG11 VAL 55 HG11 VAL 55 6.623 -8.682 7.785 462 HG12 VAL 55 HG12 VAL 55 5.431 -7.417 7.490 463 HG13 VAL 55 HG13 VAL 55 7.055 -7.272 6.815 464 HG21 VAL 55 HG21 VAL 55 4.746 -8.283 3.928 465 HG22 VAL 55 HG22 VAL 55 5.911 -7.040 4.390 466 HG23 VAL 55 HG23 VAL 55 4.365 -7.158 5.236 467 H VAL 56 H VAL 56 5.187 -11.327 5.128 468 HA VAL 56 HA VAL 56 4.655 -11.287 2.265 469 HB VAL 56 HB VAL 56 6.008 -13.302 2.626 470 HG11 VAL 56 HG11 VAL 56 3.943 -14.167 4.680 471 HG12 VAL 56 HG12 VAL 56 5.604 -13.675 5.019 472 HG13 VAL 56 HG13 VAL 56 5.292 -15.150 4.100 473 HG21 VAL 56 HG21 VAL 56 4.218 -13.446 0.932 474 HG22 VAL 56 HG22 VAL 56 3.087 -14.033 2.156 475 HG23 VAL 56 HG23 VAL 56 4.481 -15.016 1.700 476 H THR 57 H THR 57 2.515 -11.374 1.716 477 HA THR 57 HA THR 57 0.575 -11.142 3.946 478 HB THR 57 HB THR 57 -0.746 -9.692 2.241 479 HG1 THR 57 HG1 THR 57 0.735 -8.668 0.692 480 HG21 THR 57 HG21 THR 57 0.528 -7.636 2.781 481 HG22 THR 57 HG22 THR 57 1.898 -8.614 3.310 482 HG23 THR 57 HG23 THR 57 0.372 -8.677 4.199 483 H SER 58 H SER 58 -1.542 -11.878 3.591 484 HA SER 58 HA SER 58 -2.173 -13.701 1.404 485 HB2 SER 58 HB2 SER 58 -0.908 -15.145 2.998 486 HB3 SER 58 HB3 SER 58 -1.995 -14.670 4.303 487 HG SER 58 HG SER 58 -2.893 -16.500 3.629 488 H GLU 59 H GLU 59 -4.466 -14.652 1.830 489 HA GLU 59 HA GLU 59 -6.201 -12.522 2.973 490 HB2 GLU 59 HB2 GLU 59 -6.350 -12.797 0.504 491 HB3 GLU 59 HB3 GLU 59 -6.786 -14.489 0.716 492 HG2 GLU 59 HG2 GLU 59 -8.846 -13.760 1.934 493 HG3 GLU 59 HG3 GLU 59 -8.414 -12.081 1.591 494 H VAL 60 H VAL 60 -6.791 -13.184 4.961 495 HA VAL 60 HA VAL 60 -7.904 -15.915 5.367 496 HB VAL 60 HB VAL 60 -6.712 -13.934 7.373 497 HG11 VAL 60 HG11 VAL 60 -8.103 -16.570 8.000 498 HG12 VAL 60 HG12 VAL 60 -8.667 -14.959 8.454 499 HG13 VAL 60 HG13 VAL 60 -7.183 -15.604 9.157 500 HG21 VAL 60 HG21 VAL 60 -5.078 -15.742 7.816 501 HG22 VAL 60 HG22 VAL 60 -5.056 -15.261 6.117 502 HG23 VAL 60 HG23 VAL 60 -5.867 -16.752 6.601 503 H GLU 61 H GLU 61 -10.067 -15.947 5.262 504 HA GLU 61 HA GLU 61 -12.229 -15.366 5.174 505 HB2 GLU 61 HB2 GLU 61 -13.225 -14.508 7.348 506 HB3 GLU 61 HB3 GLU 61 -12.250 -15.964 7.472 507 HG2 GLU 61 HG2 GLU 61 -10.450 -14.795 8.504 508 HG3 GLU 61 HG3 GLU 61 -11.143 -13.221 8.141 509 H GLY 62 H GLY 62 -10.929 -13.598 3.608 510 HA2 GLY 62 HA2 GLY 62 -11.402 -11.711 2.385 511 HA3 GLY 62 HA3 GLY 62 -12.774 -11.420 3.435 512 H GLU 63 H GLU 63 -9.746 -11.685 5.058 513 HA GLU 63 HA GLU 63 -9.407 -8.734 5.198 514 HB2 GLU 63 HB2 GLU 63 -10.527 -9.529 7.243 515 HB3 GLU 63 HB3 GLU 63 -9.294 -10.762 7.493 516 HG2 GLU 63 HG2 GLU 63 -7.619 -9.075 7.980 517 HG3 GLU 63 HG3 GLU 63 -8.726 -7.780 7.524 518 H ILE 64 H ILE 64 -7.230 -7.998 5.637 519 HA ILE 64 HA ILE 64 -5.205 -9.526 4.271 520 HB ILE 64 HB ILE 64 -4.939 -6.883 5.770 521 HG12 ILE 64 HG12 ILE 64 -5.358 -7.362 2.781 522 HG13 ILE 64 HG13 ILE 64 -6.581 -6.756 3.894 523 HG21 ILE 64 HG21 ILE 64 -2.748 -7.961 5.494 524 HG22 ILE 64 HG22 ILE 64 -2.861 -6.541 4.456 525 HG23 ILE 64 HG23 ILE 64 -3.035 -8.154 3.762 526 HD11 ILE 64 HD11 ILE 64 -4.012 -5.344 3.154 527 HD12 ILE 64 HD12 ILE 64 -5.242 -4.736 4.266 528 HD13 ILE 64 HD13 ILE 64 -5.630 -4.963 2.562 529 H PHE 65 H PHE 65 -4.243 -11.185 5.282 530 HA PHE 65 HA PHE 65 -3.274 -10.995 8.068 531 HB2 PHE 65 HB2 PHE 65 -4.405 -13.107 7.432 532 HB3 PHE 65 HB3 PHE 65 -3.281 -13.332 6.097 533 HD1 PHE 65 HD2 PHE 65 -3.523 -13.225 9.819 534 HD2 PHE 65 HD1 PHE 65 -1.148 -14.399 6.461 535 HE1 PHE 65 HE2 PHE 65 -2.003 -14.440 11.314 536 HE2 PHE 65 HE1 PHE 65 0.369 -15.612 7.967 537 HZ PHE 65 HZ PHE 65 -0.055 -15.630 10.392 538 H VAL 66 H VAL 66 -1.073 -10.862 8.514 539 HA VAL 66 HA VAL 66 0.870 -11.059 6.311 540 HB VAL 66 HB VAL 66 0.282 -8.699 6.328 541 HG11 VAL 66 HG11 VAL 66 0.989 -8.642 9.280 542 HG12 VAL 66 HG12 VAL 66 -0.630 -8.488 8.593 543 HG13 VAL 66 HG13 VAL 66 0.579 -7.237 8.291 544 HG21 VAL 66 HG21 VAL 66 3.002 -9.115 7.612 545 HG22 VAL 66 HG22 VAL 66 2.500 -7.681 6.716 546 HG23 VAL 66 HG23 VAL 66 2.634 -9.233 5.889 547 H LYS 67 H LYS 67 2.967 -11.644 6.907 548 HA LYS 67 HA LYS 67 3.792 -11.721 9.716 549 HB2 LYS 67 HB2 LYS 67 4.388 -14.141 9.673 550 HB3 LYS 67 HB3 LYS 67 2.655 -13.879 9.540 551 HG2 LYS 67 HG2 LYS 67 2.796 -14.277 7.093 552 HG3 LYS 67 HG3 LYS 67 4.527 -14.599 7.265 553 HD2 LYS 67 HD2 LYS 67 4.031 -16.511 8.752 554 HD3 LYS 67 HD3 LYS 67 2.299 -16.176 8.615 555 HE2 LYS 67 HE2 LYS 67 2.887 -18.013 7.142 556 HE3 LYS 67 HE3 LYS 67 2.447 -16.614 6.164 557 HZ1 LYS 67 HZ1 LYS 67 4.396 -17.699 5.289 558 HZ2 LYS 67 HZ2 LYS 67 5.214 -17.522 6.761 559 HZ3 LYS 67 HZ3 LYS 67 4.814 -16.163 5.852 560 H LEU 68 H LEU 68 6.138 -12.068 9.940 561 HA LEU 68 HA LEU 68 7.640 -10.765 7.915 562 HB2 LEU 68 HB2 LEU 68 8.716 -12.446 10.218 563 HB3 LEU 68 HB3 LEU 68 9.641 -11.298 9.259 564 HG LEU 68 HG LEU 68 7.468 -10.692 11.299 565 HD11 LEU 68 HD11 LEU 68 9.683 -11.097 12.230 566 HD12 LEU 68 HD12 LEU 68 9.233 -9.404 12.413 567 HD13 LEU 68 HD13 LEU 68 10.387 -9.877 11.162 568 HD21 LEU 68 HD21 LEU 68 8.752 -8.745 9.360 569 HD22 LEU 68 HD22 LEU 68 7.772 -8.293 10.759 570 HD23 LEU 68 HD23 LEU 68 7.049 -9.205 9.438 571 H VAL 69 H VAL 69 9.211 -11.522 6.449 572 HA VAL 69 HA VAL 69 9.101 -14.278 5.554 573 HB VAL 69 HB VAL 69 11.037 -12.057 4.719 574 HG11 VAL 69 HG11 VAL 69 10.525 -14.758 3.392 575 HG12 VAL 69 HG12 VAL 69 11.997 -14.281 4.238 576 HG13 VAL 69 HG13 VAL 69 11.549 -13.473 2.737 577 HG21 VAL 69 HG21 VAL 69 9.635 -11.851 2.684 578 HG22 VAL 69 HG22 VAL 69 8.722 -11.481 4.146 579 HG23 VAL 69 HG23 VAL 69 8.506 -13.038 3.345 580 H LEU 70 H LEU 70 9.732 -15.474 7.390 581 HA LEU 70 HA LEU 70 12.357 -15.157 8.562 582 HB2 LEU 70 HB2 LEU 70 11.816 -17.272 9.799 583 HB3 LEU 70 HB3 LEU 70 10.656 -15.982 10.011 584 HG LEU 70 HG LEU 70 9.247 -17.251 8.189 585 HD11 LEU 70 HD11 LEU 70 10.912 -18.888 7.477 586 HD12 LEU 70 HD12 LEU 70 9.507 -19.691 8.170 587 HD13 LEU 70 HD13 LEU 70 10.994 -19.553 9.112 588 HD21 LEU 70 HD21 LEU 70 8.537 -16.979 10.509 589 HD22 LEU 70 HD22 LEU 70 9.516 -18.365 10.997 590 HD23 LEU 70 HD23 LEU 70 8.134 -18.593 9.921 591 H GLU 71 H GLU 71 14.123 -16.635 8.379 592 HA GLU 71 HA GLU 71 14.684 -17.409 5.683 593 HB2 GLU 71 HB2 GLU 71 16.249 -18.016 8.219 594 HB3 GLU 71 HB3 GLU 71 16.856 -18.198 6.574 595 HG2 GLU 71 HG2 GLU 71 16.587 -15.737 6.255 596 HG3 GLU 71 HG3 GLU 71 16.087 -15.597 7.940 597 H HIS 72 H HIS 72 15.279 -19.469 4.910 598 HA HIS 72 HA HIS 72 14.547 -21.893 6.341 599 HB2 HIS 72 HB2 HIS 72 13.096 -22.608 4.271 600 HB3 HIS 72 HB3 HIS 72 12.378 -21.569 5.489 601 HD1 HIS 72 HD1 HIS 72 12.073 -19.025 4.845 602 HD2 HIS 72 HD2 HIS 72 13.181 -21.510 1.705 603 HE1 HIS 72 HE1 HIS 72 11.600 -17.716 2.760 604 HE2 HIS 72 HE2 HIS 72 12.111 -19.298 0.883 605 H HIS 73 H HIS 73 15.006 -23.857 4.895 606 HA HIS 73 HA HIS 73 17.803 -23.756 4.508 607 HB2 HIS 73 HB2 HIS 73 15.853 -25.991 3.806 608 HB3 HIS 73 HB3 HIS 73 17.605 -26.170 3.884 609 HD1 HIS 73 HD1 HIS 73 15.205 -27.453 5.765 610 HD2 HIS 73 HD2 HIS 73 18.087 -24.641 6.786 611 HE1 HIS 73 HE1 HIS 73 15.415 -27.584 8.258 612 HE2 HIS 73 HE2 HIS 73 17.004 -25.742 8.862 613 H HIS 74 H HIS 74 15.196 -23.671 2.088 614 HA HIS 74 HA HIS 74 17.111 -22.685 0.123 615 HB2 HIS 74 HB2 HIS 74 16.466 -24.240 -1.673 616 HB3 HIS 74 HB3 HIS 74 17.163 -25.117 -0.322 617 HD1 HIS 74 HD1 HIS 74 14.349 -25.184 -2.575 618 HD2 HIS 74 HD2 HIS 74 15.008 -26.421 1.343 619 HE1 HIS 74 HE1 HIS 74 12.510 -26.811 -2.069 620 HE2 HIS 74 HE2 HIS 74 12.899 -27.518 0.311 621 H HIS 75 H HIS 75 16.248 -20.879 -0.723 622 HA HIS 75 HA HIS 75 13.369 -20.384 -0.573 623 HB2 HIS 75 HB2 HIS 75 13.939 -18.059 -1.283 624 HB3 HIS 75 HB3 HIS 75 14.784 -18.565 0.168 625 HD1 HIS 75 HD1 HIS 75 17.360 -18.626 0.074 626 HD2 HIS 75 HD2 HIS 75 15.612 -17.603 -3.556 627 HE1 HIS 75 HE1 HIS 75 19.228 -17.755 -1.345 628 HE2 HIS 75 HE2 HIS 75 18.190 -17.337 -3.589 629 H HIS 76 H HIS 76 11.973 -20.589 -2.234 630 HA HIS 76 HA HIS 76 12.879 -21.657 -4.760 631 HB2 HIS 76 HB2 HIS 76 10.844 -22.511 -3.621 632 HB3 HIS 76 HB3 HIS 76 10.056 -20.955 -3.857 633 HD1 HIS 76 HD1 HIS 76 8.889 -20.590 -6.059 634 HD2 HIS 76 HD2 HIS 76 11.343 -23.939 -6.113 635 HE1 HIS 76 HE1 HIS 76 8.386 -21.752 -8.223 636 HE2 HIS 76 HE2 HIS 76 9.743 -23.864 -8.147 637 H HIS 77 H HIS 77 13.865 -20.206 -6.014 638 HA HIS 77 HA HIS 77 12.710 -17.558 -6.575 639 HB2 HIS 77 HB2 HIS 77 14.941 -17.148 -7.723 640 HB3 HIS 77 HB3 HIS 77 15.050 -17.477 -5.998 641 HD1 HIS 77 HD1 HIS 77 15.810 -19.063 -9.342 642 HD2 HIS 77 HD2 HIS 77 16.492 -19.752 -5.300 643 HE1 HIS 77 HE1 HIS 77 17.463 -20.941 -9.250 644 HE2 HIS 77 HE2 HIS 77 17.735 -21.450 -6.810 645 H1 MET 1 H MET 1 -4.246 -19.875 -7.695 646 HA MET 1 HA MET 1 -2.610 -20.697 -6.157 647 HB2 MET 1 HB2 MET 1 -1.278 -20.476 -8.892 648 HB3 MET 1 HB3 MET 1 -0.782 -21.580 -7.615 649 HG2 MET 1 HG2 MET 1 -2.022 -22.831 -9.229 650 HG3 MET 1 HG3 MET 1 -3.043 -22.675 -7.795 651 HE1 MET 1 HE1 MET 1 -5.576 -22.635 -10.872 652 HE2 MET 1 HE2 MET 1 -5.186 -23.444 -9.354 653 HE3 MET 1 HE3 MET 1 -4.080 -23.561 -10.725 654 H LYS 2 H LYS 2 -1.839 -17.700 -7.715 655 HA LYS 2 HA LYS 2 0.830 -17.382 -6.593 656 HB2 LYS 2 HB2 LYS 2 -0.913 -15.404 -8.123 657 HB3 LYS 2 HB3 LYS 2 0.797 -15.187 -7.743 658 HG2 LYS 2 HG2 LYS 2 1.355 -17.145 -9.146 659 HG3 LYS 2 HG3 LYS 2 -0.356 -17.370 -9.521 660 HD2 LYS 2 HD2 LYS 2 1.322 -14.933 -10.256 661 HD3 LYS 2 HD3 LYS 2 0.859 -16.236 -11.355 662 HE2 LYS 2 HE2 LYS 2 -1.539 -15.640 -11.003 663 HE3 LYS 2 HE3 LYS 2 -1.032 -14.306 -9.964 664 HZ1 LYS 2 HZ1 LYS 2 0.125 -13.337 -11.837 665 HZ2 LYS 2 HZ2 LYS 2 -1.511 -13.567 -12.192 666 HZ3 LYS 2 HZ3 LYS 2 -0.354 -14.620 -12.830 667 H MET 3 H MET 3 1.445 -15.626 -5.222 668 HA MET 3 HA MET 3 -0.337 -15.206 -2.981 669 HB2 MET 3 HB2 MET 3 2.552 -14.350 -3.431 670 HB3 MET 3 HB3 MET 3 1.677 -14.156 -1.919 671 HG2 MET 3 HG2 MET 3 2.273 -16.831 -3.216 672 HG3 MET 3 HG3 MET 3 3.237 -16.098 -1.939 673 HE1 MET 3 HE1 MET 3 0.378 -18.530 -2.707 674 HE2 MET 3 HE2 MET 3 -0.653 -17.099 -2.638 675 HE3 MET 3 HE3 MET 3 -0.767 -18.326 -1.379 676 H LEU 4 H LEU 4 -0.375 -13.084 -1.896 677 HA LEU 4 HA LEU 4 -1.751 -11.132 -3.341 678 HB2 LEU 4 HB2 LEU 4 -1.770 -11.644 -0.827 679 HB3 LEU 4 HB3 LEU 4 -0.312 -10.695 -0.690 680 HG LEU 4 HG LEU 4 -2.445 -9.545 0.048 681 HD11 LEU 4 HD11 LEU 4 -0.977 -8.103 -2.171 682 HD12 LEU 4 HD12 LEU 4 -0.475 -8.205 -0.483 683 HD13 LEU 4 HD13 LEU 4 -1.961 -7.359 -0.906 684 HD21 LEU 4 HD21 LEU 4 -3.994 -8.670 -1.628 685 HD22 LEU 4 HD22 LEU 4 -3.949 -10.432 -1.658 686 HD23 LEU 4 HD23 LEU 4 -3.109 -9.507 -2.906 687 H LYS 5 H LYS 5 1.707 -11.301 -2.562 688 HA LYS 5 HA LYS 5 2.444 -8.648 -3.267 689 HB2 LYS 5 HB2 LYS 5 3.904 -10.043 -1.878 690 HB3 LYS 5 HB3 LYS 5 4.097 -11.201 -3.198 691 HG2 LYS 5 HG2 LYS 5 5.345 -9.597 -4.513 692 HG3 LYS 5 HG3 LYS 5 5.035 -8.316 -3.343 693 HD2 LYS 5 HD2 LYS 5 6.624 -10.832 -2.702 694 HD3 LYS 5 HD3 LYS 5 7.361 -9.337 -3.279 695 HE2 LYS 5 HE2 LYS 5 6.480 -8.145 -1.286 696 HE3 LYS 5 HE3 LYS 5 5.764 -9.651 -0.712 697 HZ1 LYS 5 HZ1 LYS 5 8.006 -10.603 -0.649 698 HZ2 LYS 5 HZ2 LYS 5 7.847 -9.276 0.376 699 HZ3 LYS 5 HZ3 LYS 5 8.654 -9.111 -1.108 700 H GLU 6 H GLU 6 2.196 -11.627 -5.179 701 HA GLU 6 HA GLU 6 3.660 -10.732 -7.453 702 HB2 GLU 6 HB2 GLU 6 1.712 -13.041 -7.090 703 HB3 GLU 6 HB3 GLU 6 2.679 -12.798 -8.547 704 HG2 GLU 6 HG2 GLU 6 4.736 -13.075 -7.282 705 HG3 GLU 6 HG3 GLU 6 3.835 -13.181 -5.769 706 H LYS 7 H LYS 7 0.159 -10.925 -6.759 707 HA LYS 7 HA LYS 7 -0.636 -9.780 -9.272 708 HB2 LYS 7 HB2 LYS 7 -2.913 -9.638 -8.253 709 HB3 LYS 7 HB3 LYS 7 -2.194 -11.232 -8.173 710 HG2 LYS 7 HG2 LYS 7 -3.139 -11.096 -6.067 711 HG3 LYS 7 HG3 LYS 7 -1.509 -10.514 -5.726 712 HD2 LYS 7 HD2 LYS 7 -3.146 -9.098 -4.599 713 HD3 LYS 7 HD3 LYS 7 -2.330 -8.168 -5.858 714 HE2 LYS 7 HE2 LYS 7 -4.269 -8.351 -7.323 715 HE3 LYS 7 HE3 LYS 7 -5.069 -9.457 -6.202 716 HZ1 LYS 7 HZ1 LYS 7 -4.406 -6.620 -5.657 717 HZ2 LYS 7 HZ2 LYS 7 -5.169 -7.680 -4.586 718 HZ3 LYS 7 HZ3 LYS 7 -5.938 -7.232 -6.016 719 H ALA 8 H ALA 8 0.276 -8.403 -6.169 720 HA ALA 8 HA ALA 8 -0.631 -5.734 -6.539 721 HB1 ALA 8 HB1 ALA 8 1.813 -6.708 -5.016 722 HB2 ALA 8 HB2 ALA 8 0.170 -6.610 -4.375 723 HB3 ALA 8 HB3 ALA 8 1.027 -5.133 -4.824 724 H GLY 9 H GLY 9 2.382 -7.376 -7.504 725 HA2 GLY 9 HA2 GLY 9 3.731 -5.199 -8.701 726 HA3 GLY 9 HA3 GLY 9 3.994 -6.896 -9.058 727 H ALA 10 H ALA 10 1.307 -7.436 -10.024 728 HA ALA 10 HA ALA 10 1.449 -6.581 -12.743 729 HB1 ALA 10 HB1 ALA 10 0.433 -8.724 -12.083 730 HB2 ALA 10 HB2 ALA 10 -0.707 -7.744 -13.009 731 HB3 ALA 10 HB3 ALA 10 -0.865 -7.865 -11.254 732 H LEU 11 H LEU 11 -0.690 -5.642 -10.033 733 HA LEU 11 HA LEU 11 -2.280 -3.701 -11.327 734 HB2 LEU 11 HB2 LEU 11 -1.434 -3.866 -8.409 735 HB3 LEU 11 HB3 LEU 11 -2.732 -2.843 -9.015 736 HG LEU 11 HG LEU 11 -2.725 -5.891 -9.137 737 HD11 LEU 11 HD11 LEU 11 -4.224 -4.066 -7.241 738 HD12 LEU 11 HD12 LEU 11 -2.873 -5.128 -6.829 739 HD13 LEU 11 HD13 LEU 11 -4.404 -5.819 -7.360 740 HD21 LEU 11 HD21 LEU 11 -4.041 -4.907 -10.955 741 HD22 LEU 11 HD22 LEU 11 -4.945 -3.924 -9.798 742 HD23 LEU 11 HD23 LEU 11 -5.094 -5.685 -9.771 743 H ALA 12 H ALA 12 0.904 -3.476 -9.828 744 HA ALA 12 HA ALA 12 1.334 -0.727 -9.716 745 HB1 ALA 12 HB1 ALA 12 3.369 -2.866 -10.426 746 HB2 ALA 12 HB2 ALA 12 2.877 -2.419 -8.793 747 HB3 ALA 12 HB3 ALA 12 3.728 -1.247 -9.803 748 H GLY 13 H GLY 13 1.796 -2.936 -12.455 749 HA2 GLY 13 HA2 GLY 13 2.963 -1.209 -14.325 750 HA3 GLY 13 HA3 GLY 13 2.012 -2.630 -14.714 751 H GLN 14 H GLN 14 -0.509 -1.993 -13.923 752 HA GLN 14 HA GLN 14 -1.369 -0.337 -16.092 753 HB2 GLN 14 HB2 GLN 14 -3.657 -0.857 -15.363 754 HB3 GLN 14 HB3 GLN 14 -2.662 -2.307 -15.407 755 HG2 GLN 14 HG2 GLN 14 -2.416 -2.197 -12.943 756 HG3 GLN 14 HG3 GLN 14 -3.433 -0.760 -12.912 757 HE21 GLN 14 HE21 GLN 14 -3.995 -3.637 -14.915 758 HE22 GLN 14 HE22 GLN 14 -5.442 -4.110 -14.113 759 H ILE 15 H ILE 15 -1.087 0.226 -12.601 760 HA ILE 15 HA ILE 15 -2.500 2.704 -12.465 761 HB ILE 15 HB ILE 15 -0.401 1.453 -10.642 762 HG12 ILE 15 HG12 ILE 15 -3.419 1.785 -10.288 763 HG13 ILE 15 HG13 ILE 15 -2.631 0.306 -10.831 764 HG21 ILE 15 HG21 ILE 15 -2.015 3.967 -10.054 765 HG22 ILE 15 HG22 ILE 15 -0.272 3.892 -10.309 766 HG23 ILE 15 HG23 ILE 15 -0.988 3.112 -8.899 767 HD11 ILE 15 HD11 ILE 15 -3.243 0.160 -8.506 768 HD12 ILE 15 HD12 ILE 15 -2.308 1.606 -8.131 769 HD13 ILE 15 HD13 ILE 15 -1.487 0.138 -8.671 770 H TRP 16 H TRP 16 0.972 1.945 -12.817 771 HA TRP 16 HA TRP 16 1.984 4.564 -13.082 772 HB2 TRP 16 HB2 TRP 16 3.358 2.453 -12.779 773 HB3 TRP 16 HB3 TRP 16 3.059 2.060 -14.467 774 HD1 TRP 16 HD1 TRP 16 5.164 4.327 -12.242 775 HE1 TRP 16 HE1 TRP 16 6.936 5.525 -13.662 776 HE3 TRP 16 HE3 TRP 16 3.538 2.988 -16.914 777 HZ2 TRP 16 HZ2 TRP 16 7.578 5.870 -16.377 778 HZ3 TRP 16 HZ3 TRP 16 4.785 3.807 -18.874 779 HH2 TRP 16 HH2 TRP 16 6.764 5.220 -18.611 780 H GLU 17 H GLU 17 0.699 2.308 -15.501 781 HA GLU 17 HA GLU 17 1.291 3.769 -17.853 782 HB2 GLU 17 HB2 GLU 17 0.670 1.274 -17.561 783 HB3 GLU 17 HB3 GLU 17 -1.006 1.790 -17.500 784 HG2 GLU 17 HG2 GLU 17 0.847 2.281 -19.854 785 HG3 GLU 17 HG3 GLU 17 -0.196 0.874 -19.711 786 H ALA 18 H ALA 18 -1.523 3.740 -15.690 787 HA ALA 18 HA ALA 18 -3.292 5.439 -17.082 788 HB1 ALA 18 HB1 ALA 18 -3.961 4.071 -15.139 789 HB2 ALA 18 HB2 ALA 18 -4.385 5.766 -14.894 790 HB3 ALA 18 HB3 ALA 18 -2.976 5.081 -14.077 791 H LEU 19 H LEU 19 -0.644 6.151 -14.848 792 HA LEU 19 HA LEU 19 -1.004 9.007 -14.765 793 HB2 LEU 19 HB2 LEU 19 1.265 7.170 -13.941 794 HB3 LEU 19 HB3 LEU 19 1.302 8.908 -13.677 795 HG LEU 19 HG LEU 19 -0.844 7.088 -12.508 796 HD11 LEU 19 HD11 LEU 19 0.349 7.246 -10.370 797 HD12 LEU 19 HD12 LEU 19 1.672 8.119 -11.151 798 HD13 LEU 19 HD13 LEU 19 1.335 6.440 -11.591 799 HD21 LEU 19 HD21 LEU 19 -1.532 9.427 -12.748 800 HD22 LEU 19 HD22 LEU 19 -0.080 9.969 -11.904 801 HD23 LEU 19 HD23 LEU 19 -1.302 9.031 -11.046 802 H ASN 20 H ASN 20 0.655 6.834 -16.957 803 HA ASN 20 HA ASN 20 2.635 8.693 -17.884 804 HB2 ASN 20 HB2 ASN 20 2.893 6.187 -18.011 805 HB3 ASN 20 HB3 ASN 20 1.661 6.153 -19.268 806 HD21 ASN 20 HD21 ASN 20 3.151 5.278 -20.756 807 HD22 ASN 20 HD22 ASN 20 4.415 6.221 -21.456 808 H GLY 21 H GLY 21 2.569 10.106 -19.561 809 HA2 GLY 21 HA2 GLY 21 1.768 11.222 -21.451 810 HA3 GLY 21 HA3 GLY 21 0.311 10.248 -21.427 811 H THR 22 H THR 22 0.661 11.343 -18.329 812 HA THR 22 HA THR 22 -0.762 13.925 -18.781 813 HB THR 22 HB THR 22 -2.086 13.581 -16.762 814 HG1 THR 22 HG1 THR 22 -1.125 10.959 -16.365 815 HG21 THR 22 HG21 THR 22 -2.206 11.044 -18.437 816 HG22 THR 22 HG22 THR 22 -3.066 12.551 -18.772 817 HG23 THR 22 HG23 THR 22 -3.463 11.610 -17.333 818 H GLU 23 H GLU 23 -0.570 15.413 -16.840 819 HA GLU 23 HA GLU 23 2.152 15.582 -15.822 820 HB2 GLU 23 HB2 GLU 23 1.452 17.742 -14.891 821 HB3 GLU 23 HB3 GLU 23 0.904 17.607 -16.558 822 HG2 GLU 23 HG2 GLU 23 -1.365 16.960 -15.697 823 HG3 GLU 23 HG3 GLU 23 -0.786 17.270 -14.061 824 H GLY 24 H GLY 24 -0.247 13.643 -14.894 825 HA2 GLY 24 HA2 GLY 24 0.106 12.412 -12.756 826 HA3 GLY 24 HA3 GLY 24 0.036 13.981 -11.963 827 H LEU 25 H LEU 25 -1.673 11.716 -11.457 828 HA LEU 25 HA LEU 25 -4.324 12.906 -12.004 829 HB2 LEU 25 HB2 LEU 25 -3.612 9.944 -12.244 830 HB3 LEU 25 HB3 LEU 25 -5.256 10.560 -12.213 831 HG LEU 25 HG LEU 25 -3.193 11.064 -14.396 832 HD11 LEU 25 HD11 LEU 25 -4.107 8.792 -14.429 833 HD12 LEU 25 HD12 LEU 25 -4.677 9.717 -15.815 834 HD13 LEU 25 HD13 LEU 25 -5.755 9.431 -14.442 835 HD21 LEU 25 HD21 LEU 25 -6.066 12.049 -14.232 836 HD22 LEU 25 HD22 LEU 25 -5.004 12.200 -15.637 837 HD23 LEU 25 HD23 LEU 25 -4.610 13.044 -14.142 838 H THR 26 H THR 26 -5.896 12.479 -10.352 839 HA THR 26 HA THR 26 -4.896 11.908 -7.684 840 HB THR 26 HB THR 26 -7.213 12.220 -6.909 841 HG1 THR 26 HG1 THR 26 -8.893 12.574 -8.415 842 HG21 THR 26 HG21 THR 26 -5.899 14.274 -7.313 843 HG22 THR 26 HG22 THR 26 -7.611 14.542 -7.653 844 HG23 THR 26 HG23 THR 26 -6.472 14.322 -8.984 845 H GLN 27 H GLN 27 -6.102 10.251 -6.287 846 HA GLN 27 HA GLN 27 -5.665 7.667 -7.245 847 HB2 GLN 27 HB2 GLN 27 -6.684 6.850 -5.184 848 HB3 GLN 27 HB3 GLN 27 -5.669 8.245 -4.845 849 HG2 GLN 27 HG2 GLN 27 -7.647 9.674 -4.621 850 HG3 GLN 27 HG3 GLN 27 -8.697 8.329 -5.062 851 HE21 GLN 27 HE21 GLN 27 -8.929 6.575 -3.569 852 HE22 GLN 27 HE22 GLN 27 -8.576 6.793 -1.892 853 H LYS 28 H LYS 28 -8.672 9.526 -7.151 854 HA LYS 28 HA LYS 28 -10.460 7.513 -8.043 855 HB2 LYS 28 HB2 LYS 28 -11.043 9.722 -6.918 856 HB3 LYS 28 HB3 LYS 28 -10.748 10.524 -8.452 857 HG2 LYS 28 HG2 LYS 28 -12.822 8.322 -8.164 858 HG3 LYS 28 HG3 LYS 28 -13.190 10.003 -7.786 859 HD2 LYS 28 HD2 LYS 28 -12.658 10.656 -10.114 860 HD3 LYS 28 HD3 LYS 28 -12.247 8.985 -10.500 861 HE2 LYS 28 HE2 LYS 28 -14.489 9.497 -11.310 862 HE3 LYS 28 HE3 LYS 28 -14.585 8.312 -10.005 863 HZ1 LYS 28 HZ1 LYS 28 -15.059 11.231 -9.703 864 HZ2 LYS 28 HZ2 LYS 28 -15.204 10.067 -8.487 865 HZ3 LYS 28 HZ3 LYS 28 -16.262 10.049 -9.798 866 H GLN 29 H GLN 29 -8.523 9.919 -9.874 867 HA GLN 29 HA GLN 29 -9.668 9.342 -12.432 868 HB2 GLN 29 HB2 GLN 29 -6.981 10.597 -11.770 869 HB3 GLN 29 HB3 GLN 29 -7.725 10.593 -13.367 870 HG2 GLN 29 HG2 GLN 29 -8.905 11.926 -10.910 871 HG3 GLN 29 HG3 GLN 29 -7.949 12.748 -12.138 872 HE21 GLN 29 HE21 GLN 29 -9.640 14.160 -12.603 873 HE22 GLN 29 HE22 GLN 29 -11.056 13.678 -13.459 874 H ILE 30 H ILE 30 -6.810 8.108 -10.745 875 HA ILE 30 HA ILE 30 -5.892 6.339 -12.794 876 HB ILE 30 HB ILE 30 -5.505 6.116 -9.771 877 HG12 ILE 30 HG12 ILE 30 -3.629 7.428 -11.796 878 HG13 ILE 30 HG13 ILE 30 -4.752 8.327 -10.784 879 HG21 ILE 30 HG21 ILE 30 -4.953 4.014 -10.931 880 HG22 ILE 30 HG22 ILE 30 -3.490 4.786 -10.319 881 HG23 ILE 30 HG23 ILE 30 -3.883 4.886 -12.037 882 HD11 ILE 30 HD11 ILE 30 -3.582 7.533 -8.782 883 HD12 ILE 30 HD12 ILE 30 -2.510 8.400 -9.880 884 HD13 ILE 30 HD13 ILE 30 -2.450 6.639 -9.802 885 H LYS 31 H LYS 31 -8.037 5.937 -9.991 886 HA LYS 31 HA LYS 31 -8.692 3.233 -9.981 887 HB2 LYS 31 HB2 LYS 31 -9.402 5.048 -8.343 888 HB3 LYS 31 HB3 LYS 31 -10.604 5.564 -9.504 889 HG2 LYS 31 HG2 LYS 31 -11.835 4.294 -7.993 890 HG3 LYS 31 HG3 LYS 31 -11.545 3.156 -9.314 891 HD2 LYS 31 HD2 LYS 31 -9.756 2.071 -8.060 892 HD3 LYS 31 HD3 LYS 31 -9.843 3.298 -6.789 893 HE2 LYS 31 HE2 LYS 31 -11.966 1.240 -7.474 894 HE3 LYS 31 HE3 LYS 31 -10.963 1.295 -6.029 895 HZ1 LYS 31 HZ1 LYS 31 -12.038 3.393 -5.437 896 HZ2 LYS 31 HZ2 LYS 31 -13.144 2.117 -5.551 897 HZ3 LYS 31 HZ3 LYS 31 -13.046 3.258 -6.789 898 H LYS 32 H LYS 32 -10.186 5.861 -11.801 899 HA LYS 32 HA LYS 32 -12.160 4.394 -13.218 900 HB2 LYS 32 HB2 LYS 32 -12.263 6.844 -12.794 901 HB3 LYS 32 HB3 LYS 32 -10.873 7.088 -13.840 902 HG2 LYS 32 HG2 LYS 32 -12.916 7.705 -15.005 903 HG3 LYS 32 HG3 LYS 32 -12.180 6.299 -15.780 904 HD2 LYS 32 HD2 LYS 32 -13.813 4.816 -14.644 905 HD3 LYS 32 HD3 LYS 32 -14.540 6.211 -13.841 906 HE2 LYS 32 HE2 LYS 32 -15.211 7.117 -16.048 907 HE3 LYS 32 HE3 LYS 32 -14.472 5.722 -16.843 908 HZ1 LYS 32 HZ1 LYS 32 -16.875 5.496 -16.581 909 HZ2 LYS 32 HZ2 LYS 32 -16.715 5.577 -14.900 910 HZ3 LYS 32 HZ3 LYS 32 -16.039 4.282 -15.751 911 H ALA 33 H ALA 33 -8.890 5.531 -14.121 912 HA ALA 33 HA ALA 33 -8.963 4.680 -16.851 913 HB1 ALA 33 HB1 ALA 33 -6.568 5.237 -16.864 914 HB2 ALA 33 HB2 ALA 33 -6.561 5.317 -15.097 915 HB3 ALA 33 HB3 ALA 33 -7.499 6.484 -16.032 916 H THR 34 H THR 34 -8.010 3.051 -13.887 917 HA THR 34 HA THR 34 -6.881 0.710 -15.282 918 HB THR 34 HB THR 34 -6.337 -0.137 -13.000 919 HG1 THR 34 HG1 THR 34 -6.858 2.186 -11.648 920 HG21 THR 34 HG21 THR 34 -4.653 1.552 -12.380 921 HG22 THR 34 HG22 THR 34 -5.439 2.743 -13.417 922 HG23 THR 34 HG23 THR 34 -4.679 1.315 -14.131 923 H LYS 35 H LYS 35 -9.850 1.776 -13.956 924 HA LYS 35 HA LYS 35 -11.921 0.919 -13.751 925 HB2 LYS 35 HB2 LYS 35 -11.330 0.021 -16.057 926 HB3 LYS 35 HB3 LYS 35 -10.911 -1.504 -15.290 927 HG2 LYS 35 HG2 LYS 35 -13.246 -1.760 -14.526 928 HG3 LYS 35 HG3 LYS 35 -13.667 -0.221 -15.278 929 HD2 LYS 35 HD2 LYS 35 -14.355 -2.111 -16.693 930 HD3 LYS 35 HD3 LYS 35 -13.120 -1.145 -17.503 931 HE2 LYS 35 HE2 LYS 35 -11.408 -2.816 -16.916 932 HE3 LYS 35 HE3 LYS 35 -12.608 -3.763 -16.033 933 HZ1 LYS 35 HZ1 LYS 35 -12.169 -4.625 -18.258 934 HZ2 LYS 35 HZ2 LYS 35 -12.701 -3.175 -18.938 935 HZ3 LYS 35 HZ3 LYS 35 -13.784 -4.152 -18.081 936 H LEU 36 H LEU 36 -9.872 0.375 -11.747 937 HA LEU 36 HA LEU 36 -10.339 -2.192 -10.528 938 HB2 LEU 36 HB2 LEU 36 -9.089 0.362 -9.455 939 HB3 LEU 36 HB3 LEU 36 -9.229 -1.098 -8.485 940 HG LEU 36 HG LEU 36 -7.650 -0.865 -11.085 941 HD11 LEU 36 HD11 LEU 36 -6.631 -1.019 -8.229 942 HD12 LEU 36 HD12 LEU 36 -6.566 0.388 -9.294 943 HD13 LEU 36 HD13 LEU 36 -5.638 -1.055 -9.691 944 HD21 LEU 36 HD21 LEU 36 -7.857 -3.206 -9.155 945 HD22 LEU 36 HD22 LEU 36 -6.793 -3.116 -10.563 946 HD23 LEU 36 HD23 LEU 36 -8.540 -3.129 -10.783 947 H LYS 37 H LYS 37 -11.806 -2.793 -8.996 948 HA LYS 37 HA LYS 37 -14.134 -1.125 -8.500 949 HB2 LYS 37 HB2 LYS 37 -13.479 -3.943 -7.532 950 HB3 LYS 37 HB3 LYS 37 -15.055 -3.157 -7.412 951 HG2 LYS 37 HG2 LYS 37 -15.169 -3.065 -9.899 952 HG3 LYS 37 HG3 LYS 37 -13.622 -3.914 -9.989 953 HD2 LYS 37 HD2 LYS 37 -16.180 -5.008 -8.741 954 HD3 LYS 37 HD3 LYS 37 -15.560 -5.433 -10.338 955 HE2 LYS 37 HE2 LYS 37 -13.557 -6.436 -9.296 956 HE3 LYS 37 HE3 LYS 37 -14.145 -5.965 -7.700 957 HZ1 LYS 37 HZ1 LYS 37 -15.454 -7.876 -9.553 958 HZ2 LYS 37 HZ2 LYS 37 -16.071 -7.391 -8.054 959 HZ3 LYS 37 HZ3 LYS 37 -14.623 -8.258 -8.129 960 H ALA 38 H ALA 38 -11.668 -2.752 -6.481 961 HA ALA 38 HA ALA 38 -12.445 -1.189 -4.100 962 HB1 ALA 38 HB1 ALA 38 -10.545 -3.553 -4.324 963 HB2 ALA 38 HB2 ALA 38 -12.233 -3.633 -3.818 964 HB3 ALA 38 HB3 ALA 38 -11.058 -2.767 -2.826 965 H ASP 39 H ASP 39 -11.187 0.389 -3.265 966 HA ASP 39 HA ASP 39 -9.012 1.581 -4.658 967 HB2 ASP 39 HB2 ASP 39 -9.856 2.021 -1.763 968 HB3 ASP 39 HB3 ASP 39 -8.832 3.097 -2.718 969 H LYS 40 H LYS 40 -9.158 -0.890 -2.267 970 HA LYS 40 HA LYS 40 -6.589 -0.775 -1.114 971 HB2 LYS 40 HB2 LYS 40 -8.210 -3.307 -1.590 972 HB3 LYS 40 HB3 LYS 40 -7.015 -3.025 -0.322 973 HG2 LYS 40 HG2 LYS 40 -9.703 -1.633 -0.588 974 HG3 LYS 40 HG3 LYS 40 -9.318 -2.930 0.550 975 HD2 LYS 40 HD2 LYS 40 -7.693 -1.465 1.694 976 HD3 LYS 40 HD3 LYS 40 -8.000 -0.178 0.515 977 HE2 LYS 40 HE2 LYS 40 -9.215 0.180 2.657 978 HE3 LYS 40 HE3 LYS 40 -10.303 0.038 1.280 979 HZ1 LYS 40 HZ1 LYS 40 -9.655 -2.219 3.100 980 HZ2 LYS 40 HZ2 LYS 40 -10.846 -2.177 1.907 981 HZ3 LYS 40 HZ3 LYS 40 -11.001 -1.211 3.293 982 H ASP 41 H ASP 41 -7.711 -2.293 -4.122 983 HA ASP 41 HA ASP 41 -5.295 -3.616 -4.864 984 HB2 ASP 41 HB2 ASP 41 -7.587 -2.525 -6.555 985 HB3 ASP 41 HB3 ASP 41 -6.265 -3.486 -7.218 986 H PHE 42 H PHE 42 -6.512 -0.324 -5.403 987 HA PHE 42 HA PHE 42 -4.363 0.654 -6.963 988 HB2 PHE 42 HB2 PHE 42 -6.383 1.956 -6.940 989 HB3 PHE 42 HB3 PHE 42 -6.377 2.079 -5.183 990 HD1 PHE 42 HD2 PHE 42 -4.387 3.077 -8.204 991 HD2 PHE 42 HD1 PHE 42 -5.396 3.989 -4.145 992 HE1 PHE 42 HE2 PHE 42 -3.111 5.162 -8.342 993 HE2 PHE 42 HE1 PHE 42 -4.101 6.071 -4.300 994 HZ PHE 42 HZ PHE 42 -2.959 6.660 -6.402 995 H PHE 43 H PHE 43 -4.866 0.636 -3.400 996 HA PHE 43 HA PHE 43 -2.549 2.144 -2.721 997 HB2 PHE 43 HB2 PHE 43 -4.065 0.114 -1.023 998 HB3 PHE 43 HB3 PHE 43 -2.893 1.275 -0.405 999 HD1 PHE 43 HD1 PHE 43 -3.674 3.773 -1.833 1000 HD2 PHE 43 HD2 PHE 43 -6.123 0.754 -0.044 1001 HE1 PHE 43 HE1 PHE 43 -5.459 5.425 -1.465 1002 HE2 PHE 43 HE2 PHE 43 -7.901 2.407 0.311 1003 HZ PHE 43 HZ PHE 43 -7.573 4.748 -0.397 1004 H LEU 44 H LEU 44 -3.072 -1.324 -3.121 1005 HA LEU 44 HA LEU 44 -0.535 -2.279 -2.242 1006 HB2 LEU 44 HB2 LEU 44 -2.836 -3.402 -3.829 1007 HB3 LEU 44 HB3 LEU 44 -1.329 -4.290 -3.856 1008 HG LEU 44 HG LEU 44 -1.456 -4.873 -1.565 1009 HD11 LEU 44 HD11 LEU 44 -1.919 -2.713 -0.559 1010 HD12 LEU 44 HD12 LEU 44 -3.019 -3.928 0.083 1011 HD13 LEU 44 HD13 LEU 44 -3.590 -2.771 -1.121 1012 HD21 LEU 44 HD21 LEU 44 -4.326 -4.901 -2.565 1013 HD22 LEU 44 HD22 LEU 44 -3.667 -5.906 -1.270 1014 HD23 LEU 44 HD23 LEU 44 -3.084 -6.107 -2.920 1015 H GLY 45 H GLY 45 -1.812 -1.513 -5.496 1016 HA2 GLY 45 HA2 GLY 45 0.535 -2.162 -6.983 1017 HA3 GLY 45 HA3 GLY 45 -0.796 -1.155 -7.529 1018 H LEU 46 H LEU 46 -0.703 0.944 -5.737 1019 HA LEU 46 HA LEU 46 1.341 2.650 -6.729 1020 HB2 LEU 46 HB2 LEU 46 -0.852 3.504 -5.981 1021 HB3 LEU 46 HB3 LEU 46 -0.511 2.995 -4.336 1022 HG LEU 46 HG LEU 46 1.388 4.657 -4.260 1023 HD11 LEU 46 HD11 LEU 46 1.878 4.834 -6.636 1024 HD12 LEU 46 HD12 LEU 46 1.530 6.423 -5.955 1025 HD13 LEU 46 HD13 LEU 46 0.312 5.596 -6.930 1026 HD21 LEU 46 HD21 LEU 46 -1.335 5.872 -4.835 1027 HD22 LEU 46 HD22 LEU 46 -0.008 6.655 -3.972 1028 HD23 LEU 46 HD23 LEU 46 -0.786 5.232 -3.283 1029 H GLY 47 H GLY 47 1.044 0.721 -3.816 1030 HA2 GLY 47 HA2 GLY 47 3.216 1.683 -2.282 1031 HA3 GLY 47 HA3 GLY 47 2.544 0.057 -2.198 1032 H TRP 48 H TRP 48 3.064 -0.581 -4.969 1033 HA TRP 48 HA TRP 48 5.806 -1.422 -4.872 1034 HB2 TRP 48 HB2 TRP 48 3.734 -2.616 -5.982 1035 HB3 TRP 48 HB3 TRP 48 4.084 -1.591 -7.370 1036 HD1 TRP 48 HD1 TRP 48 6.563 -2.026 -8.578 1037 HE1 TRP 48 HE1 TRP 48 8.036 -4.133 -8.624 1038 HE3 TRP 48 HE3 TRP 48 4.350 -4.617 -4.790 1039 HZ2 TRP 48 HZ2 TRP 48 8.234 -6.576 -7.224 1040 HZ3 TRP 48 HZ3 TRP 48 5.219 -6.832 -4.200 1041 HH2 TRP 48 HH2 TRP 48 7.112 -7.808 -5.391 1042 H LEU 49 H LEU 49 4.036 1.164 -6.526 1043 HA LEU 49 HA LEU 49 6.171 2.125 -8.164 1044 HB2 LEU 49 HB2 LEU 49 3.603 3.335 -7.127 1045 HB3 LEU 49 HB3 LEU 49 4.754 4.344 -7.972 1046 HG LEU 49 HG LEU 49 4.467 3.130 -10.042 1047 HD11 LEU 49 HD11 LEU 49 2.727 1.174 -8.544 1048 HD12 LEU 49 HD12 LEU 49 4.343 0.860 -9.189 1049 HD13 LEU 49 HD13 LEU 49 3.010 1.199 -10.288 1050 HD21 LEU 49 HD21 LEU 49 1.738 3.551 -8.770 1051 HD22 LEU 49 HD22 LEU 49 2.085 3.490 -10.505 1052 HD23 LEU 49 HD23 LEU 49 2.726 4.807 -9.526 1053 H LEU 50 H LEU 50 5.228 2.805 -4.815 1054 HA LEU 50 HA LEU 50 7.237 4.770 -4.217 1055 HB2 LEU 50 HB2 LEU 50 5.711 2.869 -2.388 1056 HB3 LEU 50 HB3 LEU 50 6.705 4.208 -1.824 1057 HG LEU 50 HG LEU 50 4.194 4.503 -3.530 1058 HD11 LEU 50 HD11 LEU 50 3.636 3.690 -1.294 1059 HD12 LEU 50 HD12 LEU 50 3.101 5.353 -1.516 1060 HD13 LEU 50 HD13 LEU 50 4.548 5.015 -0.559 1061 HD21 LEU 50 HD21 LEU 50 5.927 6.616 -2.198 1062 HD22 LEU 50 HD22 LEU 50 4.391 6.911 -3.014 1063 HD23 LEU 50 HD23 LEU 50 5.770 6.322 -3.933 1064 H ARG 51 H ARG 51 7.056 1.253 -3.977 1065 HA ARG 51 HA ARG 51 9.499 0.591 -2.815 1066 HB2 ARG 51 HB2 ARG 51 7.865 -1.110 -3.173 1067 HB3 ARG 51 HB3 ARG 51 7.770 -0.780 -4.892 1068 HG2 ARG 51 HG2 ARG 51 9.947 -1.780 -5.266 1069 HG3 ARG 51 HG3 ARG 51 10.187 -1.990 -3.530 1070 HD2 ARG 51 HD2 ARG 51 8.331 -3.590 -3.451 1071 HD3 ARG 51 HD3 ARG 51 8.016 -3.325 -5.172 1072 HE ARG 51 HE ARG 51 10.249 -4.260 -5.612 1073 HH11 ARG 51 HH11 ARG 51 8.724 -5.095 -2.617 1074 HH12 ARG 51 HH12 ARG 51 9.709 -6.493 -2.402 1075 HH21 ARG 51 HH21 ARG 51 11.487 -6.048 -5.301 1076 HH22 ARG 51 HH22 ARG 51 11.259 -7.019 -3.886 1077 H GLU 52 H GLU 52 8.757 1.150 -6.265 1078 HA GLU 52 HA GLU 52 11.492 0.795 -7.127 1079 HB2 GLU 52 HB2 GLU 52 9.140 1.960 -8.678 1080 HB3 GLU 52 HB3 GLU 52 10.651 1.366 -9.360 1081 HG2 GLU 52 HG2 GLU 52 8.508 -0.295 -7.998 1082 HG3 GLU 52 HG3 GLU 52 8.843 -0.233 -9.721 1083 H ASP 53 H ASP 53 9.726 3.425 -5.785 1084 HA ASP 53 HA ASP 53 9.912 5.658 -5.632 1085 HB2 ASP 53 HB2 ASP 53 12.702 4.696 -5.658 1086 HB3 ASP 53 HB3 ASP 53 12.601 6.335 -6.284 1087 H LYS 54 H LYS 54 9.113 4.496 -8.076 1088 HA LYS 54 HA LYS 54 10.257 6.002 -10.297 1089 HB2 LYS 54 HB2 LYS 54 9.759 3.532 -10.368 1090 HB3 LYS 54 HB3 LYS 54 8.044 3.903 -10.255 1091 HG2 LYS 54 HG2 LYS 54 8.048 4.926 -12.438 1092 HG3 LYS 54 HG3 LYS 54 9.810 4.874 -12.525 1093 HD2 LYS 54 HD2 LYS 54 8.674 3.103 -13.905 1094 HD3 LYS 54 HD3 LYS 54 9.811 2.463 -12.718 1095 HE2 LYS 54 HE2 LYS 54 7.996 1.767 -11.264 1096 HE3 LYS 54 HE3 LYS 54 6.803 2.584 -12.271 1097 HZ1 LYS 54 HZ1 LYS 54 8.478 0.309 -13.167 1098 HZ2 LYS 54 HZ2 LYS 54 7.212 1.036 -14.023 1099 HZ3 LYS 54 HZ3 LYS 54 6.889 0.177 -12.602 1100 H VAL 55 H VAL 55 7.817 6.557 -8.029 1101 HA VAL 55 HA VAL 55 6.623 8.667 -9.735 1102 HB VAL 55 HB VAL 55 4.398 8.382 -8.760 1103 HG11 VAL 55 HG11 VAL 55 4.854 7.167 -10.836 1104 HG12 VAL 55 HG12 VAL 55 3.714 6.273 -9.831 1105 HG13 VAL 55 HG13 VAL 55 5.401 5.761 -9.916 1106 HG21 VAL 55 HG21 VAL 55 3.814 6.446 -7.312 1107 HG22 VAL 55 HG22 VAL 55 4.994 7.506 -6.539 1108 HG23 VAL 55 HG23 VAL 55 5.517 5.979 -7.255 1109 H VAL 56 H VAL 56 5.720 10.442 -8.574 1110 HA VAL 56 HA VAL 56 6.697 11.006 -5.872 1111 HB VAL 56 HB VAL 56 5.522 12.959 -7.902 1112 HG11 VAL 56 HG11 VAL 56 6.505 14.734 -6.495 1113 HG12 VAL 56 HG12 VAL 56 7.118 13.524 -5.367 1114 HG13 VAL 56 HG13 VAL 56 5.377 13.748 -5.555 1115 HG21 VAL 56 HG21 VAL 56 7.825 13.695 -8.403 1116 HG22 VAL 56 HG22 VAL 56 7.581 11.999 -8.831 1117 HG23 VAL 56 HG23 VAL 56 8.463 12.420 -7.359 1118 H THR 57 H THR 57 5.197 10.964 -4.207 1119 HA THR 57 HA THR 57 2.309 11.077 -4.875 1120 HB THR 57 HB THR 57 2.000 10.188 -2.482 1121 HG1 THR 57 HG1 THR 57 3.764 9.349 -1.446 1122 HG21 THR 57 HG21 THR 57 2.482 7.850 -3.112 1123 HG22 THR 57 HG22 THR 57 3.460 8.409 -4.470 1124 HG23 THR 57 HG23 THR 57 1.723 8.727 -4.446 1125 H SER 58 H SER 58 0.998 12.554 -4.048 1126 HA SER 58 HA SER 58 1.819 14.610 -2.130 1127 HB2 SER 58 HB2 SER 58 2.588 15.489 -4.333 1128 HB3 SER 58 HB3 SER 58 0.975 15.249 -5.006 1129 HG SER 58 HG SER 58 1.432 17.426 -4.314 1130 H GLU 59 H GLU 59 -0.172 16.143 -1.768 1131 HA GLU 59 HA GLU 59 -2.697 14.566 -1.941 1132 HB2 GLU 59 HB2 GLU 59 -1.758 14.688 0.366 1133 HB3 GLU 59 HB3 GLU 59 -1.818 16.448 0.295 1134 HG2 GLU 59 HG2 GLU 59 -4.299 16.318 0.037 1135 HG3 GLU 59 HG3 GLU 59 -4.199 14.564 0.206 1136 H VAL 60 H VAL 60 -4.180 15.499 -3.229 1137 HA VAL 60 HA VAL 60 -4.522 18.449 -3.248 1138 HB VAL 60 HB VAL 60 -5.303 16.315 -5.277 1139 HG11 VAL 60 HG11 VAL 60 -7.332 17.696 -5.049 1140 HG12 VAL 60 HG12 VAL 60 -6.541 18.048 -6.586 1141 HG13 VAL 60 HG13 VAL 60 -6.379 19.170 -5.233 1142 HG21 VAL 60 HG21 VAL 60 -3.049 17.325 -5.465 1143 HG22 VAL 60 HG22 VAL 60 -3.775 18.933 -5.554 1144 HG23 VAL 60 HG23 VAL 60 -4.059 17.764 -6.848 1145 H GLU 61 H GLU 61 -5.809 18.954 -1.606 1146 HA GLU 61 HA GLU 61 -7.622 19.261 -0.304 1147 HB2 GLU 61 HB2 GLU 61 -9.161 18.176 -2.687 1148 HB3 GLU 61 HB3 GLU 61 -9.804 19.198 -1.403 1149 HG2 GLU 61 HG2 GLU 61 -8.161 20.988 -2.154 1150 HG3 GLU 61 HG3 GLU 61 -7.778 19.957 -3.526 1151 H GLY 62 H GLY 62 -6.338 16.882 0.347 1152 HA2 GLY 62 HA2 GLY 62 -6.796 15.188 1.898 1153 HA3 GLY 62 HA3 GLY 62 -8.494 15.235 1.471 1154 H GLU 63 H GLU 63 -7.797 14.962 -1.458 1155 HA GLU 63 HA GLU 63 -7.620 12.070 -1.591 1156 HB2 GLU 63 HB2 GLU 63 -8.024 14.220 -3.690 1157 HB3 GLU 63 HB3 GLU 63 -7.755 12.544 -4.149 1158 HG2 GLU 63 HG2 GLU 63 -10.138 13.065 -4.146 1159 HG3 GLU 63 HG3 GLU 63 -9.756 11.841 -2.936 1160 H ILE 64 H ILE 64 -6.090 10.825 -2.701 1161 HA ILE 64 HA ILE 64 -3.343 11.717 -2.467 1162 HB ILE 64 HB ILE 64 -4.533 9.091 -3.460 1163 HG12 ILE 64 HG12 ILE 64 -3.248 9.780 -0.779 1164 HG13 ILE 64 HG13 ILE 64 -4.971 9.542 -1.058 1165 HG21 ILE 64 HG21 ILE 64 -2.266 8.112 -3.236 1166 HG22 ILE 64 HG22 ILE 64 -1.614 9.712 -2.887 1167 HG23 ILE 64 HG23 ILE 64 -2.321 9.375 -4.467 1168 HD11 ILE 64 HD11 ILE 64 -2.818 7.434 -1.321 1169 HD12 ILE 64 HD12 ILE 64 -4.541 7.186 -1.620 1170 HD13 ILE 64 HD13 ILE 64 -3.977 7.600 -0.003 1171 H PHE 65 H PHE 65 -2.690 13.152 -4.042 1172 HA PHE 65 HA PHE 65 -3.196 12.611 -6.898 1173 HB2 PHE 65 HB2 PHE 65 -3.458 14.947 -6.045 1174 HB3 PHE 65 HB3 PHE 65 -1.763 14.965 -5.571 1175 HD1 PHE 65 HD2 PHE 65 -4.063 14.781 -8.497 1176 HD2 PHE 65 HD1 PHE 65 -0.036 15.454 -7.202 1177 HE1 PHE 65 HE2 PHE 65 -3.459 15.551 -10.748 1178 HE2 PHE 65 HE1 PHE 65 0.557 16.222 -9.462 1179 HZ PHE 65 HZ PHE 65 -1.155 16.269 -11.236 1180 H VAL 66 H VAL 66 -1.764 11.324 -7.934 1181 HA VAL 66 HA VAL 66 1.085 11.253 -7.085 1182 HB VAL 66 HB VAL 66 -0.402 9.076 -8.638 1183 HG11 VAL 66 HG11 VAL 66 1.518 7.642 -8.001 1184 HG12 VAL 66 HG12 VAL 66 2.282 9.010 -7.190 1185 HG13 VAL 66 HG13 VAL 66 2.050 9.040 -8.940 1186 HG21 VAL 66 HG21 VAL 66 0.153 9.153 -5.646 1187 HG22 VAL 66 HG22 VAL 66 -0.534 7.790 -6.535 1188 HG23 VAL 66 HG23 VAL 66 -1.435 9.302 -6.410 1189 H LYS 67 H LYS 67 2.697 11.440 -8.700 1190 HA LYS 67 HA LYS 67 1.932 11.593 -11.540 1191 HB2 LYS 67 HB2 LYS 67 3.088 13.722 -11.923 1192 HB3 LYS 67 HB3 LYS 67 1.812 13.939 -10.731 1193 HG2 LYS 67 HG2 LYS 67 3.568 13.825 -8.928 1194 HG3 LYS 67 HG3 LYS 67 4.798 13.799 -10.201 1195 HD2 LYS 67 HD2 LYS 67 3.872 16.001 -11.038 1196 HD3 LYS 67 HD3 LYS 67 2.787 16.024 -9.642 1197 HE2 LYS 67 HE2 LYS 67 4.691 17.409 -9.126 1198 HE3 LYS 67 HE3 LYS 67 4.819 15.946 -8.153 1199 HZ1 LYS 67 HZ1 LYS 67 6.940 16.539 -9.110 1200 HZ2 LYS 67 HZ2 LYS 67 6.301 16.489 -10.676 1201 HZ3 LYS 67 HZ3 LYS 67 6.413 15.076 -9.765 1202 H LEU 68 H LEU 68 3.797 11.239 -12.980 1203 HA LEU 68 HA LEU 68 5.609 9.301 -11.876 1204 HB2 LEU 68 HB2 LEU 68 5.629 10.551 -14.651 1205 HB3 LEU 68 HB3 LEU 68 6.512 9.108 -14.166 1206 HG LEU 68 HG LEU 68 3.491 9.400 -14.418 1207 HD11 LEU 68 HD11 LEU 68 3.704 7.695 -16.168 1208 HD12 LEU 68 HD12 LEU 68 5.458 7.691 -15.972 1209 HD13 LEU 68 HD13 LEU 68 4.636 9.141 -16.558 1210 HD21 LEU 68 HD21 LEU 68 3.355 7.007 -13.803 1211 HD22 LEU 68 HD22 LEU 68 3.942 8.010 -12.481 1212 HD23 LEU 68 HD23 LEU 68 5.076 7.019 -13.405 1213 H VAL 69 H VAL 69 7.818 9.406 -11.483 1214 HA VAL 69 HA VAL 69 9.269 11.872 -11.351 1215 HB VAL 69 HB VAL 69 10.248 8.966 -11.369 1216 HG11 VAL 69 HG11 VAL 69 12.093 10.419 -12.136 1217 HG12 VAL 69 HG12 VAL 69 12.425 9.803 -10.518 1218 HG13 VAL 69 HG13 VAL 69 11.873 11.467 -10.732 1219 HG21 VAL 69 HG21 VAL 69 9.932 10.932 -9.059 1220 HG22 VAL 69 HG22 VAL 69 10.547 9.281 -8.933 1221 HG23 VAL 69 HG23 VAL 69 8.870 9.562 -9.400 1222 H LEU 70 H LEU 70 10.627 12.830 -12.879 1223 HA LEU 70 HA LEU 70 9.877 12.584 -15.574 1224 HB2 LEU 70 HB2 LEU 70 12.375 13.930 -14.470 1225 HB3 LEU 70 HB3 LEU 70 11.655 14.225 -16.050 1226 HG LEU 70 HG LEU 70 10.390 14.908 -13.358 1227 HD11 LEU 70 HD11 LEU 70 10.701 17.252 -14.011 1228 HD12 LEU 70 HD12 LEU 70 11.535 16.744 -15.483 1229 HD13 LEU 70 HD13 LEU 70 12.241 16.397 -13.902 1230 HD21 LEU 70 HD21 LEU 70 8.609 16.024 -14.645 1231 HD22 LEU 70 HD22 LEU 70 8.649 14.292 -14.957 1232 HD23 LEU 70 HD23 LEU 70 9.306 15.416 -16.151 1233 H GLU 71 H GLU 71 10.303 10.883 -16.834 1234 HA GLU 71 HA GLU 71 12.637 9.169 -16.489 1235 HB2 GLU 71 HB2 GLU 71 11.467 7.793 -18.314 1236 HB3 GLU 71 HB3 GLU 71 10.618 7.968 -16.790 1237 HG2 GLU 71 HG2 GLU 71 9.011 8.144 -18.584 1238 HG3 GLU 71 HG3 GLU 71 9.161 9.711 -17.805 1239 H HIS 72 H HIS 72 12.287 11.991 -18.085 1240 HA HIS 72 HA HIS 72 13.085 11.603 -20.739 1241 HB2 HIS 72 HB2 HIS 72 12.073 13.709 -19.823 1242 HB3 HIS 72 HB3 HIS 72 13.587 14.059 -18.990 1243 HD1 HIS 72 HD1 HIS 72 12.068 13.903 -22.427 1244 HD2 HIS 72 HD2 HIS 72 15.546 15.241 -20.591 1245 HE1 HIS 72 HE1 HIS 72 13.290 15.210 -24.178 1246 HE2 HIS 72 HE2 HIS 72 15.256 16.208 -22.975 1247 H HIS 73 H HIS 73 14.795 10.190 -20.969 1248 HA HIS 73 HA HIS 73 16.872 9.328 -21.082 1249 HB2 HIS 73 HB2 HIS 73 17.716 12.221 -20.670 1250 HB3 HIS 73 HB3 HIS 73 18.837 10.936 -21.119 1251 HD1 HIS 73 HD1 HIS 73 18.845 10.187 -23.572 1252 HD2 HIS 73 HD2 HIS 73 15.843 12.936 -22.736 1253 HE1 HIS 73 HE1 HIS 73 17.884 10.830 -25.796 1254 HE2 HIS 73 HE2 HIS 73 16.043 12.457 -25.268 1255 H HIS 74 H HIS 74 15.536 9.164 -18.604 1256 HA HIS 74 HA HIS 74 17.799 8.887 -16.691 1257 HB2 HIS 74 HB2 HIS 74 14.813 9.249 -16.187 1258 HB3 HIS 74 HB3 HIS 74 15.932 8.731 -14.932 1259 HD1 HIS 74 HD1 HIS 74 17.278 10.506 -13.769 1260 HD2 HIS 74 HD2 HIS 74 15.236 11.973 -17.068 1261 HE1 HIS 74 HE1 HIS 74 17.482 12.996 -13.628 1262 HE2 HIS 74 HE2 HIS 74 16.077 13.867 -15.519 1263 H HIS 75 H HIS 75 16.565 7.075 -18.947 1264 HA HIS 75 HA HIS 75 15.613 4.731 -17.533 1265 HB2 HIS 75 HB2 HIS 75 14.804 5.361 -19.827 1266 HB3 HIS 75 HB3 HIS 75 16.404 5.013 -20.465 1267 HD1 HIS 75 HD1 HIS 75 17.170 2.432 -20.263 1268 HD2 HIS 75 HD2 HIS 75 13.122 3.188 -19.684 1269 HE1 HIS 75 HE1 HIS 75 16.026 0.226 -20.578 1270 HE2 HIS 75 HE2 HIS 75 13.573 0.744 -20.406 1271 H HIS 76 H HIS 76 17.366 4.318 -16.112 1272 HA HIS 76 HA HIS 76 19.447 2.590 -17.275 1273 HB2 HIS 76 HB2 HIS 76 20.497 4.844 -16.922 1274 HB3 HIS 76 HB3 HIS 76 20.046 4.778 -15.224 1275 HD1 HIS 76 HD1 HIS 76 22.546 3.475 -17.669 1276 HD2 HIS 76 HD2 HIS 76 21.674 3.079 -13.631 1277 HE1 HIS 76 HE1 HIS 76 24.539 2.334 -16.667 1278 HE2 HIS 76 HE2 HIS 76 24.069 2.285 -14.201 1279 H HIS 77 H HIS 77 18.265 0.833 -16.518 1280 HA HIS 77 HA HIS 77 18.625 0.081 -13.747 1281 HB2 HIS 77 HB2 HIS 77 16.487 1.444 -13.677 1282 HB3 HIS 77 HB3 HIS 77 15.759 0.304 -14.807 1283 HD1 HIS 77 HD1 HIS 77 16.584 0.802 -11.228 1284 HD2 HIS 77 HD2 HIS 77 15.169 -2.272 -13.632 1285 HE1 HIS 77 HE1 HIS 77 15.613 -0.884 -9.649 1286 HE2 HIS 77 HE2 HIS 77 14.565 -2.608 -11.140 Start of MODEL 12 1 H1 MET 1 H1 MET 1 15.002 12.982 1.465 2 H2 MET 1 H2 MET 1 14.383 11.899 2.602 3 H3 MET 1 H3 MET 1 16.051 12.030 2.390 4 HA MET 1 HA MET 1 15.346 13.129 4.397 5 HB2 MET 1 HB2 MET 1 16.320 14.993 2.193 6 HB3 MET 1 HB3 MET 1 16.359 15.398 3.907 7 HG2 MET 1 HG2 MET 1 18.547 14.654 3.169 8 HG3 MET 1 HG3 MET 1 17.873 13.486 4.311 9 HE1 MET 1 HE1 MET 1 20.275 12.451 2.818 10 HE2 MET 1 HE2 MET 1 19.731 10.953 2.065 11 HE3 MET 1 HE3 MET 1 19.234 11.341 3.714 12 H LYS 2 H LYS 2 13.306 13.317 5.093 13 HA LYS 2 HA LYS 2 11.260 14.086 5.582 14 HB2 LYS 2 HB2 LYS 2 12.134 16.648 4.199 15 HB3 LYS 2 HB3 LYS 2 10.700 16.482 5.211 16 HG2 LYS 2 HG2 LYS 2 12.158 15.929 7.154 17 HG3 LYS 2 HG3 LYS 2 13.583 16.149 6.128 18 HD2 LYS 2 HD2 LYS 2 12.831 18.527 5.727 19 HD3 LYS 2 HD3 LYS 2 11.532 18.265 6.895 20 HE2 LYS 2 HE2 LYS 2 14.512 18.102 7.487 21 HE3 LYS 2 HE3 LYS 2 13.442 19.436 7.917 22 HZ1 LYS 2 HZ1 LYS 2 13.785 18.015 9.801 23 HZ2 LYS 2 HZ2 LYS 2 13.274 16.651 8.942 24 HZ3 LYS 2 HZ3 LYS 2 12.177 17.883 9.307 25 H MET 3 H MET 3 10.263 12.517 4.301 26 HA MET 3 HA MET 3 8.517 13.559 2.216 27 HB2 MET 3 HB2 MET 3 10.585 12.831 0.979 28 HB3 MET 3 HB3 MET 3 10.381 11.207 1.612 29 HG2 MET 3 HG2 MET 3 8.267 10.990 0.370 30 HG3 MET 3 HG3 MET 3 8.451 12.632 -0.246 31 HE1 MET 3 HE1 MET 3 11.642 12.244 -2.546 32 HE2 MET 3 HE2 MET 3 11.639 12.720 -0.849 33 HE3 MET 3 HE3 MET 3 10.413 13.360 -1.944 34 H LEU 4 H LEU 4 6.680 12.208 1.839 35 HA LEU 4 HA LEU 4 5.709 10.748 4.052 36 HB2 LEU 4 HB2 LEU 4 3.790 10.134 2.416 37 HB3 LEU 4 HB3 LEU 4 4.051 11.812 2.845 38 HG LEU 4 HG LEU 4 5.214 12.176 0.658 39 HD11 LEU 4 HD11 LEU 4 5.988 9.925 0.145 40 HD12 LEU 4 HD12 LEU 4 5.001 10.558 -1.170 41 HD13 LEU 4 HD13 LEU 4 4.323 9.370 -0.054 42 HD21 LEU 4 HD21 LEU 4 2.869 12.784 0.927 43 HD22 LEU 4 HD22 LEU 4 2.362 11.158 0.458 44 HD23 LEU 4 HD23 LEU 4 3.166 12.207 -0.714 45 H LYS 5 H LYS 5 7.588 9.614 1.373 46 HA LYS 5 HA LYS 5 7.151 6.818 1.548 47 HB2 LYS 5 HB2 LYS 5 9.628 8.433 0.838 48 HB3 LYS 5 HB3 LYS 5 9.600 6.675 0.771 49 HG2 LYS 5 HG2 LYS 5 7.837 6.758 -0.950 50 HG3 LYS 5 HG3 LYS 5 7.861 8.527 -0.885 51 HD2 LYS 5 HD2 LYS 5 9.202 7.625 -2.794 52 HD3 LYS 5 HD3 LYS 5 10.177 8.574 -1.672 53 HE2 LYS 5 HE2 LYS 5 10.838 6.330 -0.588 54 HE3 LYS 5 HE3 LYS 5 10.109 5.552 -1.991 55 HZ1 LYS 5 HZ1 LYS 5 11.682 6.687 -3.394 56 HZ2 LYS 5 HZ2 LYS 5 12.506 5.846 -2.187 57 HZ3 LYS 5 HZ3 LYS 5 12.326 7.522 -2.074 58 H GLU 6 H GLU 6 9.421 8.945 3.251 59 HA GLU 6 HA GLU 6 10.649 6.937 4.900 60 HB2 GLU 6 HB2 GLU 6 10.628 9.976 5.104 61 HB3 GLU 6 HB3 GLU 6 11.725 8.911 5.983 62 HG2 GLU 6 HG2 GLU 6 12.905 8.307 4.021 63 HG3 GLU 6 HG3 GLU 6 11.624 8.899 2.961 64 H LYS 7 H LYS 7 7.973 9.201 5.280 65 HA LYS 7 HA LYS 7 7.379 8.729 8.024 66 HB2 LYS 7 HB2 LYS 7 6.515 10.665 6.757 67 HB3 LYS 7 HB3 LYS 7 5.586 9.605 5.717 68 HG2 LYS 7 HG2 LYS 7 5.029 9.568 8.677 69 HG3 LYS 7 HG3 LYS 7 4.466 10.947 7.735 70 HD2 LYS 7 HD2 LYS 7 3.745 8.031 7.206 71 HD3 LYS 7 HD3 LYS 7 2.713 9.210 8.017 72 HE2 LYS 7 HE2 LYS 7 3.660 9.363 5.127 73 HE3 LYS 7 HE3 LYS 7 2.042 8.911 5.669 74 HZ1 LYS 7 HZ1 LYS 7 1.789 11.130 6.623 75 HZ2 LYS 7 HZ2 LYS 7 2.104 11.209 4.965 76 HZ3 LYS 7 HZ3 LYS 7 3.327 11.566 6.073 77 H ALA 8 H ALA 8 6.166 7.235 5.010 78 HA ALA 8 HA ALA 8 4.630 5.131 6.106 79 HB1 ALA 8 HB1 ALA 8 4.559 5.746 3.709 80 HB2 ALA 8 HB2 ALA 8 4.884 4.025 3.915 81 HB3 ALA 8 HB3 ALA 8 6.199 5.129 3.493 82 H GLY 9 H GLY 9 8.102 5.438 5.548 83 HA2 GLY 9 HA2 GLY 9 8.907 2.791 6.224 84 HA3 GLY 9 HA3 GLY 9 9.921 4.223 6.216 85 H ALA 10 H ALA 10 8.342 5.705 8.165 86 HA ALA 10 HA ALA 10 9.353 4.676 10.647 87 HB1 ALA 10 HB1 ALA 10 9.156 7.099 10.248 88 HB2 ALA 10 HB2 ALA 10 8.232 6.622 11.674 89 HB3 ALA 10 HB3 ALA 10 7.402 6.953 10.150 90 H LEU 11 H LEU 11 6.152 4.816 9.112 91 HA LEU 11 HA LEU 11 4.644 3.493 11.132 92 HB2 LEU 11 HB2 LEU 11 4.193 3.626 8.120 93 HB3 LEU 11 HB3 LEU 11 3.000 3.061 9.282 94 HG LEU 11 HG LEU 11 4.120 5.895 9.198 95 HD11 LEU 11 HD11 LEU 11 1.966 6.587 8.266 96 HD12 LEU 11 HD12 LEU 11 1.437 4.904 8.190 97 HD13 LEU 11 HD13 LEU 11 2.791 5.451 7.199 98 HD21 LEU 11 HD21 LEU 11 2.313 6.459 10.769 99 HD22 LEU 11 HD22 LEU 11 3.396 5.249 11.451 100 HD23 LEU 11 HD23 LEU 11 1.816 4.765 10.829 101 H ALA 12 H ALA 12 6.576 2.366 8.408 102 HA ALA 12 HA ALA 12 5.923 -0.347 8.317 103 HB1 ALA 12 HB1 ALA 12 8.595 0.949 7.682 104 HB2 ALA 12 HB2 ALA 12 7.223 0.812 6.582 105 HB3 ALA 12 HB3 ALA 12 8.056 -0.643 7.133 106 H GLY 13 H GLY 13 8.522 1.253 10.155 107 HA2 GLY 13 HA2 GLY 13 9.841 -0.915 11.259 108 HA3 GLY 13 HA3 GLY 13 9.717 0.657 12.026 109 H GLN 14 H GLN 14 7.165 0.891 12.820 110 HA GLN 14 HA GLN 14 7.082 -0.703 15.167 111 HB2 GLN 14 HB2 GLN 14 4.947 0.449 15.679 112 HB3 GLN 14 HB3 GLN 14 6.214 1.573 15.197 113 HG2 GLN 14 HG2 GLN 14 5.207 1.668 12.919 114 HG3 GLN 14 HG3 GLN 14 3.905 0.619 13.479 115 HE21 GLN 14 HE21 GLN 14 3.716 3.307 12.421 116 HE22 GLN 14 HE22 GLN 14 2.972 4.272 13.634 117 H ILE 15 H ILE 15 5.378 -1.035 12.059 118 HA ILE 15 HA ILE 15 3.469 -3.003 12.917 119 HB ILE 15 HB ILE 15 4.453 -2.362 10.100 120 HG12 ILE 15 HG12 ILE 15 1.901 -1.482 11.530 121 HG13 ILE 15 HG13 ILE 15 3.320 -0.467 11.304 122 HG21 ILE 15 HG21 ILE 15 2.419 -3.510 9.267 123 HG22 ILE 15 HG22 ILE 15 2.011 -3.992 10.914 124 HG23 ILE 15 HG23 ILE 15 3.467 -4.626 10.146 125 HD11 ILE 15 HD11 ILE 15 2.994 -0.561 8.878 126 HD12 ILE 15 HD12 ILE 15 1.583 0.085 9.714 127 HD13 ILE 15 HD13 ILE 15 1.564 -1.571 9.112 128 H TRP 16 H TRP 16 6.691 -3.227 11.386 129 HA TRP 16 HA TRP 16 6.876 -6.019 11.124 130 HB2 TRP 16 HB2 TRP 16 8.498 -4.312 10.167 131 HB3 TRP 16 HB3 TRP 16 9.212 -4.159 11.770 132 HD1 TRP 16 HD1 TRP 16 9.196 -6.371 8.702 133 HE1 TRP 16 HE1 TRP 16 10.933 -8.237 8.946 134 HE3 TRP 16 HE3 TRP 16 10.350 -5.791 13.651 135 HZ2 TRP 16 HZ2 TRP 16 12.560 -9.342 10.947 136 HZ3 TRP 16 HZ3 TRP 16 11.987 -7.303 14.661 137 HH2 TRP 16 HH2 TRP 16 13.073 -9.050 13.337 138 H GLU 17 H GLU 17 8.072 -3.963 13.832 139 HA GLU 17 HA GLU 17 8.829 -6.002 15.607 140 HB2 GLU 17 HB2 GLU 17 7.952 -3.146 16.079 141 HB3 GLU 17 HB3 GLU 17 8.226 -4.199 17.453 142 HG2 GLU 17 HG2 GLU 17 10.244 -3.070 17.258 143 HG3 GLU 17 HG3 GLU 17 10.573 -4.610 16.477 144 H ALA 18 H ALA 18 5.600 -4.718 14.965 145 HA ALA 18 HA ALA 18 4.201 -5.923 17.144 146 HB1 ALA 18 HB1 ALA 18 3.165 -5.131 14.398 147 HB2 ALA 18 HB2 ALA 18 3.253 -4.079 15.811 148 HB3 ALA 18 HB3 ALA 18 2.168 -5.472 15.818 149 H LEU 19 H LEU 19 4.913 -7.010 13.833 150 HA LEU 19 HA LEU 19 3.540 -9.550 14.074 151 HB2 LEU 19 HB2 LEU 19 5.433 -8.468 11.956 152 HB3 LEU 19 HB3 LEU 19 4.535 -9.976 11.807 153 HG LEU 19 HG LEU 19 3.302 -7.196 12.021 154 HD11 LEU 19 HD11 LEU 19 4.381 -7.513 9.862 155 HD12 LEU 19 HD12 LEU 19 2.629 -7.497 9.681 156 HD13 LEU 19 HD13 LEU 19 3.507 -9.028 9.612 157 HD21 LEU 19 HD21 LEU 19 1.156 -8.336 11.544 158 HD22 LEU 19 HD22 LEU 19 1.860 -8.844 13.073 159 HD23 LEU 19 HD23 LEU 19 1.967 -9.900 11.661 160 H ASN 20 H ASN 20 6.719 -8.427 14.851 161 HA ASN 20 HA ASN 20 8.087 -10.958 14.799 162 HB2 ASN 20 HB2 ASN 20 9.287 -8.767 14.650 163 HB3 ASN 20 HB3 ASN 20 8.811 -8.398 16.301 164 HD21 ASN 20 HD21 ASN 20 10.841 -10.420 14.296 165 HD22 ASN 20 HD22 ASN 20 11.884 -10.956 15.557 166 H GLY 21 H GLY 21 8.356 -12.459 16.445 167 HA2 GLY 21 HA2 GLY 21 8.174 -13.470 18.528 168 HA3 GLY 21 HA3 GLY 21 7.440 -12.013 19.175 169 H THR 22 H THR 22 5.229 -11.738 17.452 170 HA THR 22 HA THR 22 3.382 -13.690 18.514 171 HB THR 22 HB THR 22 1.621 -12.426 17.357 172 HG1 THR 22 HG1 THR 22 2.971 -10.401 16.253 173 HG21 THR 22 HG21 THR 22 3.686 -10.547 18.579 174 HG22 THR 22 HG22 THR 22 2.441 -11.436 19.462 175 HG23 THR 22 HG23 THR 22 1.979 -10.169 18.326 176 H GLU 23 H GLU 23 1.873 -14.977 17.182 177 HA GLU 23 HA GLU 23 3.034 -16.557 15.143 178 HB2 GLU 23 HB2 GLU 23 0.042 -16.296 15.634 179 HB3 GLU 23 HB3 GLU 23 0.913 -17.701 15.028 180 HG2 GLU 23 HG2 GLU 23 1.005 -16.595 17.859 181 HG3 GLU 23 HG3 GLU 23 0.141 -18.036 17.327 182 H GLY 24 H GLY 24 1.837 -13.446 14.863 183 HA2 GLY 24 HA2 GLY 24 1.763 -12.343 12.674 184 HA3 GLY 24 HA3 GLY 24 0.875 -13.739 12.070 185 H LEU 25 H LEU 25 0.087 -10.842 12.207 186 HA LEU 25 HA LEU 25 -2.323 -11.062 13.919 187 HB2 LEU 25 HB2 LEU 25 -0.524 -8.617 13.640 188 HB3 LEU 25 HB3 LEU 25 -2.056 -8.646 14.500 189 HG LEU 25 HG LEU 25 0.463 -10.166 15.295 190 HD11 LEU 25 HD11 LEU 25 0.679 -7.758 15.649 191 HD12 LEU 25 HD12 LEU 25 0.587 -8.611 17.186 192 HD13 LEU 25 HD13 LEU 25 -0.823 -7.732 16.581 193 HD21 LEU 25 HD21 LEU 25 -2.216 -10.014 16.734 194 HD22 LEU 25 HD22 LEU 25 -0.745 -10.759 17.370 195 HD23 LEU 25 HD23 LEU 25 -1.527 -11.436 15.945 196 H THR 26 H THR 26 -4.134 -9.865 13.204 197 HA THR 26 HA THR 26 -4.326 -9.293 10.344 198 HB THR 26 HB THR 26 -6.715 -9.001 10.722 199 HG1 THR 26 HG1 THR 26 -7.533 -9.128 12.918 200 HG21 THR 26 HG21 THR 26 -7.340 -11.181 11.693 201 HG22 THR 26 HG22 THR 26 -5.727 -11.350 12.390 202 HG23 THR 26 HG23 THR 26 -5.938 -11.356 10.635 203 H GLN 27 H GLN 27 -5.581 -7.155 9.730 204 HA GLN 27 HA GLN 27 -4.053 -4.915 10.502 205 HB2 GLN 27 HB2 GLN 27 -5.527 -3.554 9.133 206 HB3 GLN 27 HB3 GLN 27 -5.227 -5.079 8.328 207 HG2 GLN 27 HG2 GLN 27 -7.463 -4.976 7.916 208 HG3 GLN 27 HG3 GLN 27 -7.564 -5.709 9.510 209 HE21 GLN 27 HE21 GLN 27 -8.014 -2.765 7.678 210 HE22 GLN 27 HE22 GLN 27 -8.941 -1.933 8.872 211 H LYS 28 H LYS 28 -7.013 -6.180 11.847 212 HA LYS 28 HA LYS 28 -7.741 -4.033 13.582 213 HB2 LYS 28 HB2 LYS 28 -8.297 -7.025 13.825 214 HB3 LYS 28 HB3 LYS 28 -9.113 -5.769 14.758 215 HG2 LYS 28 HG2 LYS 28 -10.110 -4.858 12.712 216 HG3 LYS 28 HG3 LYS 28 -9.226 -6.032 11.733 217 HD2 LYS 28 HD2 LYS 28 -11.558 -6.739 12.019 218 HD3 LYS 28 HD3 LYS 28 -10.469 -7.879 12.810 219 HE2 LYS 28 HE2 LYS 28 -10.987 -6.862 15.002 220 HE3 LYS 28 HE3 LYS 28 -12.048 -5.686 14.222 221 HZ1 LYS 28 HZ1 LYS 28 -13.473 -7.488 13.515 222 HZ2 LYS 28 HZ2 LYS 28 -13.271 -7.533 15.194 223 HZ3 LYS 28 HZ3 LYS 28 -12.441 -8.632 14.214 224 H GLN 29 H GLN 29 -5.704 -6.911 14.055 225 HA GLN 29 HA GLN 29 -5.268 -6.487 16.882 226 HB2 GLN 29 HB2 GLN 29 -3.915 -8.373 14.916 227 HB3 GLN 29 HB3 GLN 29 -3.740 -8.444 16.671 228 HG2 GLN 29 HG2 GLN 29 -6.099 -8.974 16.932 229 HG3 GLN 29 HG3 GLN 29 -6.379 -8.764 15.204 230 HE21 GLN 29 HE21 GLN 29 -6.911 -11.091 16.841 231 HE22 GLN 29 HE22 GLN 29 -6.003 -12.390 16.164 232 H ILE 30 H ILE 30 -3.321 -5.988 13.949 233 HA ILE 30 HA ILE 30 -0.963 -4.960 15.132 234 HB ILE 30 HB ILE 30 -2.132 -4.415 12.365 235 HG12 ILE 30 HG12 ILE 30 0.016 -6.407 13.200 236 HG13 ILE 30 HG13 ILE 30 -1.666 -6.823 12.902 237 HG21 ILE 30 HG21 ILE 30 -0.464 -2.684 12.903 238 HG22 ILE 30 HG22 ILE 30 0.150 -3.770 11.658 239 HG23 ILE 30 HG23 ILE 30 0.717 -3.928 13.321 240 HD11 ILE 30 HD11 ILE 30 -0.263 -7.416 11.032 241 HD12 ILE 30 HD12 ILE 30 0.273 -5.745 10.862 242 HD13 ILE 30 HD13 ILE 30 -1.417 -6.167 10.567 243 H LYS 31 H LYS 31 -4.016 -3.437 14.208 244 HA LYS 31 HA LYS 31 -3.504 -0.710 14.448 245 HB2 LYS 31 HB2 LYS 31 -5.742 -2.130 13.966 246 HB3 LYS 31 HB3 LYS 31 -6.032 -1.866 15.671 247 HG2 LYS 31 HG2 LYS 31 -7.135 -0.022 14.913 248 HG3 LYS 31 HG3 LYS 31 -5.527 0.690 14.933 249 HD2 LYS 31 HD2 LYS 31 -6.196 1.288 12.792 250 HD3 LYS 31 HD3 LYS 31 -5.407 -0.247 12.437 251 HE2 LYS 31 HE2 LYS 31 -8.396 0.219 12.759 252 HE3 LYS 31 HE3 LYS 31 -7.542 -0.090 11.248 253 HZ1 LYS 31 HZ1 LYS 31 -7.892 -1.970 13.514 254 HZ2 LYS 31 HZ2 LYS 31 -6.940 -2.285 12.155 255 HZ3 LYS 31 HZ3 LYS 31 -8.607 -2.075 11.985 256 H LYS 32 H LYS 32 -4.373 -3.029 17.016 257 HA LYS 32 HA LYS 32 -4.137 -1.264 19.242 258 HB2 LYS 32 HB2 LYS 32 -4.170 -4.294 19.019 259 HB3 LYS 32 HB3 LYS 32 -4.096 -3.463 20.569 260 HG2 LYS 32 HG2 LYS 32 -6.347 -3.214 18.536 261 HG3 LYS 32 HG3 LYS 32 -6.393 -4.187 20.011 262 HD2 LYS 32 HD2 LYS 32 -6.112 -1.149 19.890 263 HD3 LYS 32 HD3 LYS 32 -7.588 -2.028 20.298 264 HE2 LYS 32 HE2 LYS 32 -6.568 -2.903 22.329 265 HE3 LYS 32 HE3 LYS 32 -5.003 -2.217 21.890 266 HZ1 LYS 32 HZ1 LYS 32 -5.916 -0.024 22.128 267 HZ2 LYS 32 HZ2 LYS 32 -6.168 -0.908 23.548 268 HZ3 LYS 32 HZ3 LYS 32 -7.445 -0.652 22.473 269 H ALA 33 H ALA 33 -1.908 -3.646 17.810 270 HA ALA 33 HA ALA 33 0.064 -3.652 19.831 271 HB1 ALA 33 HB1 ALA 33 1.465 -4.829 18.195 272 HB2 ALA 33 HB2 ALA 33 0.375 -4.346 16.892 273 HB3 ALA 33 HB3 ALA 33 -0.192 -5.440 18.155 274 H THR 34 H THR 34 -0.139 -1.773 16.829 275 HA THR 34 HA THR 34 2.394 -0.387 17.255 276 HB THR 34 HB THR 34 1.929 0.695 15.076 277 HG1 THR 34 HG1 THR 34 -0.287 -0.807 14.460 278 HG21 THR 34 HG21 THR 34 1.382 -2.297 15.000 279 HG22 THR 34 HG22 THR 34 2.981 -1.551 15.074 280 HG23 THR 34 HG23 THR 34 1.962 -1.311 13.655 281 H LYS 35 H LYS 35 -0.780 0.105 18.269 282 HA LYS 35 HA LYS 35 -1.834 1.709 19.454 283 HB2 LYS 35 HB2 LYS 35 0.805 3.221 19.513 284 HB3 LYS 35 HB3 LYS 35 -0.567 3.476 20.588 285 HG2 LYS 35 HG2 LYS 35 1.108 0.943 20.440 286 HG3 LYS 35 HG3 LYS 35 1.275 2.211 21.659 287 HD2 LYS 35 HD2 LYS 35 -0.908 1.726 22.574 288 HD3 LYS 35 HD3 LYS 35 -1.296 0.640 21.234 289 HE2 LYS 35 HE2 LYS 35 -0.698 -0.580 23.311 290 HE3 LYS 35 HE3 LYS 35 0.396 -0.950 21.978 291 HZ1 LYS 35 HZ1 LYS 35 1.978 0.648 22.929 292 HZ2 LYS 35 HZ2 LYS 35 1.633 -0.614 23.994 293 HZ3 LYS 35 HZ3 LYS 35 0.937 0.907 24.238 294 H LEU 36 H LEU 36 -2.441 1.788 16.915 295 HA LEU 36 HA LEU 36 -3.007 4.641 16.448 296 HB2 LEU 36 HB2 LEU 36 -2.775 4.398 13.980 297 HB3 LEU 36 HB3 LEU 36 -1.278 4.259 14.865 298 HG LEU 36 HG LEU 36 -1.579 1.679 14.589 299 HD11 LEU 36 HD11 LEU 36 -3.378 2.575 12.325 300 HD12 LEU 36 HD12 LEU 36 -3.863 1.643 13.745 301 HD13 LEU 36 HD13 LEU 36 -2.746 0.944 12.579 302 HD21 LEU 36 HD21 LEU 36 0.214 2.963 13.532 303 HD22 LEU 36 HD22 LEU 36 -0.852 3.398 12.192 304 HD23 LEU 36 HD23 LEU 36 -0.384 1.711 12.444 305 H LYS 37 H LYS 37 -4.846 4.837 14.698 306 HA LYS 37 HA LYS 37 -6.975 2.855 15.335 307 HB2 LYS 37 HB2 LYS 37 -7.218 4.996 16.619 308 HB3 LYS 37 HB3 LYS 37 -7.289 5.881 15.098 309 HG2 LYS 37 HG2 LYS 37 -9.361 4.532 14.518 310 HG3 LYS 37 HG3 LYS 37 -9.310 3.873 16.154 311 HD2 LYS 37 HD2 LYS 37 -10.908 5.716 16.041 312 HD3 LYS 37 HD3 LYS 37 -9.549 6.173 17.072 313 HE2 LYS 37 HE2 LYS 37 -8.580 7.497 15.238 314 HE3 LYS 37 HE3 LYS 37 -9.873 6.980 14.154 315 HZ1 LYS 37 HZ1 LYS 37 -10.197 8.633 16.592 316 HZ2 LYS 37 HZ2 LYS 37 -11.455 8.113 15.592 317 HZ3 LYS 37 HZ3 LYS 37 -10.285 9.174 14.995 318 H ALA 38 H ALA 38 -5.553 5.040 12.967 319 HA ALA 38 HA ALA 38 -7.496 4.421 10.880 320 HB1 ALA 38 HB1 ALA 38 -4.968 6.106 10.755 321 HB2 ALA 38 HB2 ALA 38 -6.596 6.711 11.070 322 HB3 ALA 38 HB3 ALA 38 -6.212 5.994 9.505 323 H ASP 39 H ASP 39 -7.308 2.394 10.076 324 HA ASP 39 HA ASP 39 -5.016 0.868 9.498 325 HB2 ASP 39 HB2 ASP 39 -6.539 -0.298 7.803 326 HB3 ASP 39 HB3 ASP 39 -7.124 -0.245 9.461 327 H LYS 40 H LYS 40 -6.392 3.558 7.778 328 HA LYS 40 HA LYS 40 -5.282 3.478 5.254 329 HB2 LYS 40 HB2 LYS 40 -5.535 5.901 7.091 330 HB3 LYS 40 HB3 LYS 40 -5.304 5.981 5.344 331 HG2 LYS 40 HG2 LYS 40 -7.701 4.662 6.667 332 HG3 LYS 40 HG3 LYS 40 -7.668 6.350 6.137 333 HD2 LYS 40 HD2 LYS 40 -7.228 5.582 3.803 334 HD3 LYS 40 HD3 LYS 40 -7.318 3.904 4.348 335 HE2 LYS 40 HE2 LYS 40 -9.659 4.127 4.887 336 HE3 LYS 40 HE3 LYS 40 -9.608 5.878 4.663 337 HZ1 LYS 40 HZ1 LYS 40 -9.189 3.866 2.526 338 HZ2 LYS 40 HZ2 LYS 40 -9.181 5.546 2.324 339 HZ3 LYS 40 HZ3 LYS 40 -10.604 4.753 2.779 340 H ASP 41 H ASP 41 -3.686 4.553 8.264 341 HA ASP 41 HA ASP 41 -1.129 5.194 7.109 342 HB2 ASP 41 HB2 ASP 41 -2.001 4.656 9.984 343 HB3 ASP 41 HB3 ASP 41 -0.369 5.164 9.543 344 H PHE 42 H PHE 42 -2.541 2.349 8.639 345 HA PHE 42 HA PHE 42 -0.293 0.691 8.877 346 HB2 PHE 42 HB2 PHE 42 -2.242 -0.024 10.028 347 HB3 PHE 42 HB3 PHE 42 -3.258 0.124 8.602 348 HD1 PHE 42 HD1 PHE 42 -0.441 -1.887 10.013 349 HD2 PHE 42 HD2 PHE 42 -3.731 -1.800 7.283 350 HE1 PHE 42 HE1 PHE 42 -0.128 -4.268 9.548 351 HE2 PHE 42 HE2 PHE 42 -3.416 -4.202 6.841 352 HZ PHE 42 HZ PHE 42 -1.609 -5.431 7.977 353 H PHE 43 H PHE 43 -2.417 1.231 6.037 354 HA PHE 43 HA PHE 43 -1.363 -0.879 4.422 355 HB2 PHE 43 HB2 PHE 43 -2.803 1.678 3.581 356 HB3 PHE 43 HB3 PHE 43 -2.475 0.318 2.509 357 HD1 PHE 43 HD2 PHE 43 -3.200 -2.059 3.887 358 HD2 PHE 43 HD1 PHE 43 -5.086 1.772 4.139 359 HE1 PHE 43 HE2 PHE 43 -5.298 -3.130 4.587 360 HE2 PHE 43 HE1 PHE 43 -7.181 0.688 4.834 361 HZ PHE 43 HZ PHE 43 -7.290 -1.763 5.060 362 H LEU 44 H LEU 44 -0.449 2.538 4.768 363 HA LEU 44 HA LEU 44 1.573 2.668 2.781 364 HB2 LEU 44 HB2 LEU 44 0.976 4.255 5.282 365 HB3 LEU 44 HB3 LEU 44 2.492 4.533 4.448 366 HG LEU 44 HG LEU 44 1.292 5.223 2.411 367 HD11 LEU 44 HD11 LEU 44 -1.126 5.566 2.344 368 HD12 LEU 44 HD12 LEU 44 -1.292 4.833 3.940 369 HD13 LEU 44 HD13 LEU 44 -0.730 3.864 2.577 370 HD21 LEU 44 HD21 LEU 44 1.895 6.932 4.072 371 HD22 LEU 44 HD22 LEU 44 0.327 6.736 4.862 372 HD23 LEU 44 HD23 LEU 44 0.417 7.365 3.215 373 H GLY 45 H GLY 45 1.727 1.812 6.242 374 HA2 GLY 45 HA2 GLY 45 4.547 1.411 6.411 375 HA3 GLY 45 HA3 GLY 45 3.344 0.829 7.549 376 H LEU 46 H LEU 46 1.861 -0.920 6.082 377 HA LEU 46 HA LEU 46 3.422 -3.291 6.117 378 HB2 LEU 46 HB2 LEU 46 0.979 -3.264 6.624 379 HB3 LEU 46 HB3 LEU 46 0.639 -2.857 4.949 380 HG LEU 46 HG LEU 46 1.705 -5.054 4.270 381 HD11 LEU 46 HD11 LEU 46 2.017 -6.804 5.958 382 HD12 LEU 46 HD12 LEU 46 1.675 -5.643 7.241 383 HD13 LEU 46 HD13 LEU 46 3.102 -5.440 6.221 384 HD21 LEU 46 HD21 LEU 46 -0.734 -4.830 4.369 385 HD22 LEU 46 HD22 LEU 46 -0.725 -5.309 6.066 386 HD23 LEU 46 HD23 LEU 46 -0.224 -6.455 4.824 387 H GLY 47 H GLY 47 2.313 -1.181 3.541 388 HA2 GLY 47 HA2 GLY 47 3.005 -2.702 1.253 389 HA3 GLY 47 HA3 GLY 47 2.871 -0.947 1.323 390 H TRP 48 H TRP 48 4.870 -0.630 3.390 391 HA TRP 48 HA TRP 48 7.269 -0.658 1.809 392 HB2 TRP 48 HB2 TRP 48 6.523 1.121 3.588 393 HB3 TRP 48 HB3 TRP 48 7.234 0.018 4.765 394 HD1 TRP 48 HD1 TRP 48 9.944 -0.356 4.594 395 HE1 TRP 48 HE1 TRP 48 11.786 1.096 3.521 396 HE3 TRP 48 HE3 TRP 48 7.018 2.706 1.733 397 HZ2 TRP 48 HZ2 TRP 48 11.969 3.257 1.736 398 HZ3 TRP 48 HZ3 TRP 48 8.103 4.442 0.365 399 HH2 TRP 48 HH2 TRP 48 10.534 4.706 0.375 400 H LEU 49 H LEU 49 5.987 -2.605 4.475 401 HA LEU 49 HA LEU 49 8.249 -4.247 4.953 402 HB2 LEU 49 HB2 LEU 49 5.282 -4.593 5.377 403 HB3 LEU 49 HB3 LEU 49 6.322 -5.984 5.580 404 HG LEU 49 HG LEU 49 7.471 -4.990 7.450 405 HD11 LEU 49 HD11 LEU 49 6.988 -2.751 8.280 406 HD12 LEU 49 HD12 LEU 49 5.935 -2.456 6.889 407 HD13 LEU 49 HD13 LEU 49 7.667 -2.716 6.656 408 HD21 LEU 49 HD21 LEU 49 5.649 -4.677 9.059 409 HD22 LEU 49 HD22 LEU 49 5.278 -6.005 7.963 410 HD23 LEU 49 HD23 LEU 49 4.496 -4.437 7.739 411 H LEU 50 H LEU 50 5.669 -4.436 2.533 412 HA LEU 50 HA LEU 50 6.368 -6.946 1.399 413 HB2 LEU 50 HB2 LEU 50 4.860 -4.577 0.237 414 HB3 LEU 50 HB3 LEU 50 5.034 -6.111 -0.605 415 HG LEU 50 HG LEU 50 3.608 -5.718 2.062 416 HD11 LEU 50 HD11 LEU 50 2.433 -6.221 -0.693 417 HD12 LEU 50 HD12 LEU 50 2.334 -4.722 0.236 418 HD13 LEU 50 HD13 LEU 50 1.531 -6.173 0.827 419 HD21 LEU 50 HD21 LEU 50 4.619 -7.941 1.942 420 HD22 LEU 50 HD22 LEU 50 3.880 -8.229 0.364 421 HD23 LEU 50 HD23 LEU 50 2.866 -8.061 1.802 422 H ARG 51 H ARG 51 7.339 -3.581 0.529 423 HA ARG 51 HA ARG 51 8.691 -4.306 -1.855 424 HB2 ARG 51 HB2 ARG 51 9.561 -2.021 -1.920 425 HB3 ARG 51 HB3 ARG 51 7.854 -2.064 -1.546 426 HG2 ARG 51 HG2 ARG 51 8.577 -0.382 -0.147 427 HG3 ARG 51 HG3 ARG 51 8.634 -1.767 0.930 428 HD2 ARG 51 HD2 ARG 51 10.607 -0.459 1.299 429 HD3 ARG 51 HD3 ARG 51 11.098 -1.938 0.469 430 HE ARG 51 HE ARG 51 10.636 0.180 -1.369 431 HH11 ARG 51 HH11 ARG 51 13.000 -0.961 0.891 432 HH12 ARG 51 HH12 ARG 51 14.302 -0.181 0.076 433 HH21 ARG 51 HH21 ARG 51 12.325 1.147 -2.396 434 HH22 ARG 51 HH22 ARG 51 13.925 1.000 -1.765 435 H GLU 52 H GLU 52 9.863 -4.417 1.452 436 HA GLU 52 HA GLU 52 12.603 -5.022 0.490 437 HB2 GLU 52 HB2 GLU 52 11.639 -4.710 3.361 438 HB3 GLU 52 HB3 GLU 52 13.307 -4.946 2.852 439 HG2 GLU 52 HG2 GLU 52 13.045 -2.747 1.559 440 HG3 GLU 52 HG3 GLU 52 11.553 -2.513 2.466 441 H ASP 53 H ASP 53 9.772 -6.677 1.081 442 HA ASP 53 HA ASP 53 9.146 -8.818 1.286 443 HB2 ASP 53 HB2 ASP 53 10.835 -9.169 -0.555 444 HB3 ASP 53 HB3 ASP 53 12.045 -9.550 0.665 445 H LYS 54 H LYS 54 9.502 -7.522 3.567 446 HA LYS 54 HA LYS 54 11.081 -8.973 5.516 447 HB2 LYS 54 HB2 LYS 54 8.971 -6.889 6.183 448 HB3 LYS 54 HB3 LYS 54 10.425 -7.314 7.088 449 HG2 LYS 54 HG2 LYS 54 11.758 -6.325 5.160 450 HG3 LYS 54 HG3 LYS 54 10.227 -5.744 4.508 451 HD2 LYS 54 HD2 LYS 54 11.067 -3.884 5.683 452 HD3 LYS 54 HD3 LYS 54 9.903 -4.579 6.813 453 HE2 LYS 54 HE2 LYS 54 11.958 -3.961 7.995 454 HE3 LYS 54 HE3 LYS 54 11.789 -5.720 7.994 455 HZ1 LYS 54 HZ1 LYS 54 13.487 -4.162 6.113 456 HZ2 LYS 54 HZ2 LYS 54 13.370 -5.850 6.184 457 HZ3 LYS 54 HZ3 LYS 54 14.055 -4.995 7.472 458 H VAL 55 H VAL 55 7.853 -9.049 4.264 459 HA VAL 55 HA VAL 55 6.879 -10.823 6.420 460 HB VAL 55 HB VAL 55 4.671 -9.706 6.429 461 HG11 VAL 55 HG11 VAL 55 6.312 -9.088 8.138 462 HG12 VAL 55 HG12 VAL 55 5.294 -7.711 7.721 463 HG13 VAL 55 HG13 VAL 55 6.943 -7.806 7.099 464 HG21 VAL 55 HG21 VAL 55 4.658 -8.734 4.167 465 HG22 VAL 55 HG22 VAL 55 5.933 -7.602 4.621 466 HG23 VAL 55 HG23 VAL 55 4.340 -7.483 5.372 467 H VAL 56 H VAL 56 5.125 -12.175 5.889 468 HA VAL 56 HA VAL 56 4.363 -12.426 3.067 469 HB VAL 56 HB VAL 56 5.710 -14.380 3.711 470 HG11 VAL 56 HG11 VAL 56 4.982 -15.982 5.445 471 HG12 VAL 56 HG12 VAL 56 3.649 -14.910 5.880 472 HG13 VAL 56 HG13 VAL 56 5.316 -14.389 6.133 473 HG21 VAL 56 HG21 VAL 56 4.149 -16.191 3.044 474 HG22 VAL 56 HG22 VAL 56 3.923 -14.747 2.055 475 HG23 VAL 56 HG23 VAL 56 2.778 -15.118 3.345 476 H THR 57 H THR 57 2.240 -12.495 2.568 477 HA THR 57 HA THR 57 0.281 -11.930 4.707 478 HB THR 57 HB THR 57 -1.147 -11.031 2.824 479 HG1 THR 57 HG1 THR 57 -0.139 -12.264 1.135 480 HG21 THR 57 HG21 THR 57 0.156 -8.971 2.395 481 HG22 THR 57 HG22 THR 57 1.614 -9.757 3.004 482 HG23 THR 57 HG23 THR 57 0.259 -9.445 4.093 483 H SER 58 H SER 58 -1.431 -13.228 5.031 484 HA SER 58 HA SER 58 -1.918 -15.603 3.326 485 HB2 SER 58 HB2 SER 58 -2.080 -15.413 6.371 486 HB3 SER 58 HB3 SER 58 -2.528 -16.833 5.422 487 HG SER 58 HG SER 58 0.046 -15.692 5.206 488 H GLU 59 H GLU 59 -4.068 -16.088 2.900 489 HA GLU 59 HA GLU 59 -6.006 -13.921 3.420 490 HB2 GLU 59 HB2 GLU 59 -5.554 -14.559 1.048 491 HB3 GLU 59 HB3 GLU 59 -6.114 -16.192 1.384 492 HG2 GLU 59 HG2 GLU 59 -8.362 -15.168 2.011 493 HG3 GLU 59 HG3 GLU 59 -7.753 -13.639 1.383 494 H VAL 60 H VAL 60 -7.038 -14.353 5.342 495 HA VAL 60 HA VAL 60 -8.478 -16.951 5.598 496 HB VAL 60 HB VAL 60 -7.531 -15.078 7.817 497 HG11 VAL 60 HG11 VAL 60 -9.229 -17.599 8.086 498 HG12 VAL 60 HG12 VAL 60 -9.763 -15.947 8.406 499 HG13 VAL 60 HG13 VAL 60 -8.531 -16.685 9.428 500 HG21 VAL 60 HG21 VAL 60 -5.750 -16.526 6.907 501 HG22 VAL 60 HG22 VAL 60 -6.756 -17.953 7.177 502 HG23 VAL 60 HG23 VAL 60 -6.167 -17.016 8.554 503 H GLU 61 H GLU 61 -10.431 -16.598 4.786 504 HA GLU 61 HA GLU 61 -12.533 -15.852 4.396 505 HB2 GLU 61 HB2 GLU 61 -12.420 -14.906 7.286 506 HB3 GLU 61 HB3 GLU 61 -13.851 -15.407 6.383 507 HG2 GLU 61 HG2 GLU 61 -12.681 -17.710 6.181 508 HG3 GLU 61 HG3 GLU 61 -11.578 -17.117 7.411 509 H GLY 62 H GLY 62 -10.676 -13.989 3.450 510 HA2 GLY 62 HA2 GLY 62 -10.863 -11.918 2.396 511 HA3 GLY 62 HA3 GLY 62 -12.215 -11.512 3.431 512 H GLU 63 H GLU 63 -10.446 -12.247 5.844 513 HA GLU 63 HA GLU 63 -9.538 -9.607 6.453 514 HB2 GLU 63 HB2 GLU 63 -9.060 -12.247 7.925 515 HB3 GLU 63 HB3 GLU 63 -8.735 -10.646 8.586 516 HG2 GLU 63 HG2 GLU 63 -11.484 -11.627 7.749 517 HG3 GLU 63 HG3 GLU 63 -10.856 -11.704 9.394 518 H ILE 64 H ILE 64 -7.525 -8.722 6.365 519 HA ILE 64 HA ILE 64 -5.313 -10.058 5.086 520 HB ILE 64 HB ILE 64 -5.347 -7.387 6.575 521 HG12 ILE 64 HG12 ILE 64 -5.692 -7.907 3.586 522 HG13 ILE 64 HG13 ILE 64 -6.967 -7.414 4.695 523 HG21 ILE 64 HG21 ILE 64 -3.296 -6.832 5.296 524 HG22 ILE 64 HG22 ILE 64 -3.291 -8.450 4.593 525 HG23 ILE 64 HG23 ILE 64 -3.056 -8.242 6.329 526 HD11 ILE 64 HD11 ILE 64 -4.544 -5.768 3.943 527 HD12 ILE 64 HD12 ILE 64 -5.820 -5.275 5.061 528 HD13 ILE 64 HD13 ILE 64 -6.193 -5.546 3.361 529 H PHE 65 H PHE 65 -4.782 -11.832 6.394 530 HA PHE 65 HA PHE 65 -3.711 -11.346 9.108 531 HB2 PHE 65 HB2 PHE 65 -5.219 -13.299 8.845 532 HB3 PHE 65 HB3 PHE 65 -4.187 -13.955 7.581 533 HD1 PHE 65 HD2 PHE 65 -4.360 -13.208 11.231 534 HD2 PHE 65 HD1 PHE 65 -2.232 -15.286 8.153 535 HE1 PHE 65 HE2 PHE 65 -3.062 -14.422 12.929 536 HE2 PHE 65 HE1 PHE 65 -0.940 -16.494 9.865 537 HZ PHE 65 HZ PHE 65 -1.351 -16.059 12.254 538 H VAL 66 H VAL 66 -1.703 -10.485 8.928 539 HA VAL 66 HA VAL 66 0.218 -11.674 6.994 540 HB VAL 66 HB VAL 66 -0.388 -9.374 6.339 541 HG11 VAL 66 HG11 VAL 66 0.659 -8.487 9.050 542 HG12 VAL 66 HG12 VAL 66 -1.029 -8.471 8.532 543 HG13 VAL 66 HG13 VAL 66 0.145 -7.417 7.740 544 HG21 VAL 66 HG21 VAL 66 1.880 -8.417 6.136 545 HG22 VAL 66 HG22 VAL 66 1.910 -10.157 5.854 546 HG23 VAL 66 HG23 VAL 66 2.466 -9.505 7.396 547 H LYS 67 H LYS 67 2.388 -11.892 7.654 548 HA LYS 67 HA LYS 67 3.217 -11.309 10.405 549 HB2 LYS 67 HB2 LYS 67 3.891 -13.633 10.901 550 HB3 LYS 67 HB3 LYS 67 2.155 -13.544 10.620 551 HG2 LYS 67 HG2 LYS 67 2.477 -14.401 8.326 552 HG3 LYS 67 HG3 LYS 67 4.219 -14.515 8.624 553 HD2 LYS 67 HD2 LYS 67 3.762 -16.126 10.474 554 HD3 LYS 67 HD3 LYS 67 2.037 -16.040 10.098 555 HE2 LYS 67 HE2 LYS 67 2.542 -16.913 7.810 556 HE3 LYS 67 HE3 LYS 67 4.240 -17.074 8.280 557 HZ1 LYS 67 HZ1 LYS 67 3.523 -18.571 10.054 558 HZ2 LYS 67 HZ2 LYS 67 3.123 -19.155 8.519 559 HZ3 LYS 67 HZ3 LYS 67 1.929 -18.461 9.503 560 H LEU 68 H LEU 68 5.646 -12.215 10.590 561 HA LEU 68 HA LEU 68 7.161 -11.097 8.437 562 HB2 LEU 68 HB2 LEU 68 8.162 -12.907 10.669 563 HB3 LEU 68 HB3 LEU 68 9.146 -11.856 9.658 564 HG LEU 68 HG LEU 68 7.178 -11.034 11.827 565 HD11 LEU 68 HD11 LEU 68 10.153 -10.537 11.539 566 HD12 LEU 68 HD12 LEU 68 9.387 -11.710 12.618 567 HD13 LEU 68 HD13 LEU 68 9.121 -9.987 12.864 568 HD21 LEU 68 HD21 LEU 68 8.589 -9.196 9.865 569 HD22 LEU 68 HD22 LEU 68 7.691 -8.683 11.297 570 HD23 LEU 68 HD23 LEU 68 6.850 -9.487 9.976 571 H VAL 69 H VAL 69 8.908 -12.293 7.239 572 HA VAL 69 HA VAL 69 8.121 -14.566 5.796 573 HB VAL 69 HB VAL 69 10.943 -13.518 6.323 574 HG11 VAL 69 HG11 VAL 69 11.677 -14.782 4.312 575 HG12 VAL 69 HG12 VAL 69 10.080 -15.530 4.202 576 HG13 VAL 69 HG13 VAL 69 11.117 -15.865 5.591 577 HG21 VAL 69 HG21 VAL 69 10.732 -12.479 4.087 578 HG22 VAL 69 HG22 VAL 69 9.472 -11.904 5.178 579 HG23 VAL 69 HG23 VAL 69 9.087 -13.106 3.945 580 H LEU 70 H LEU 70 9.773 -14.331 8.900 581 HA LEU 70 HA LEU 70 10.618 -16.919 9.444 582 HB2 LEU 70 HB2 LEU 70 9.227 -15.025 11.380 583 HB3 LEU 70 HB3 LEU 70 10.219 -16.400 11.840 584 HG LEU 70 HG LEU 70 11.193 -13.860 10.468 585 HD11 LEU 70 HD11 LEU 70 11.649 -14.839 13.308 586 HD12 LEU 70 HD12 LEU 70 10.624 -13.489 12.813 587 HD13 LEU 70 HD13 LEU 70 12.366 -13.398 12.577 588 HD21 LEU 70 HD21 LEU 70 12.807 -16.288 11.341 589 HD22 LEU 70 HD22 LEU 70 13.476 -14.765 10.748 590 HD23 LEU 70 HD23 LEU 70 12.502 -15.767 9.680 591 H GLU 71 H GLU 71 9.404 -18.642 8.823 592 HA GLU 71 HA GLU 71 6.555 -18.633 8.756 593 HB2 GLU 71 HB2 GLU 71 7.843 -19.837 7.057 594 HB3 GLU 71 HB3 GLU 71 8.522 -20.903 8.279 595 HG2 GLU 71 HG2 GLU 71 6.663 -21.907 6.884 596 HG3 GLU 71 HG3 GLU 71 6.449 -22.012 8.627 597 H HIS 72 H HIS 72 5.294 -18.859 10.444 598 HA HIS 72 HA HIS 72 5.585 -21.062 12.332 599 HB2 HIS 72 HB2 HIS 72 6.751 -18.814 13.195 600 HB3 HIS 72 HB3 HIS 72 5.104 -18.332 13.560 601 HD1 HIS 72 HD1 HIS 72 4.066 -19.298 15.666 602 HD2 HIS 72 HD2 HIS 72 7.667 -21.109 14.660 603 HE1 HIS 72 HE1 HIS 72 4.650 -20.760 17.606 604 HE2 HIS 72 HE2 HIS 72 6.936 -21.647 17.078 605 H HIS 73 H HIS 73 3.677 -22.011 11.883 606 HA HIS 73 HA HIS 73 1.511 -22.489 11.538 607 HB2 HIS 73 HB2 HIS 73 1.096 -20.056 13.302 608 HB3 HIS 73 HB3 HIS 73 -0.242 -21.045 12.729 609 HD1 HIS 73 HD1 HIS 73 1.220 -20.630 15.718 610 HD2 HIS 73 HD2 HIS 73 0.898 -24.021 13.353 611 HE1 HIS 73 HE1 HIS 73 1.461 -22.563 17.295 612 HE2 HIS 73 HE2 HIS 73 1.018 -24.589 15.872 613 H HIS 74 H HIS 74 1.690 -22.238 9.286 614 HA HIS 74 HA HIS 74 0.777 -19.796 7.985 615 HB2 HIS 74 HB2 HIS 74 2.529 -21.509 7.056 616 HB3 HIS 74 HB3 HIS 74 1.143 -22.483 6.595 617 HD1 HIS 74 HD1 HIS 74 3.409 -20.426 5.022 618 HD2 HIS 74 HD2 HIS 74 -0.747 -20.400 5.064 619 HE1 HIS 74 HE1 HIS 74 2.726 -19.198 2.947 620 HE2 HIS 74 HE2 HIS 74 0.221 -19.352 2.911 621 H HIS 75 H HIS 75 -1.310 -19.355 7.408 622 HA HIS 75 HA HIS 75 -3.364 -21.502 7.522 623 HB2 HIS 75 HB2 HIS 75 -3.683 -18.641 8.545 624 HB3 HIS 75 HB3 HIS 75 -4.938 -19.874 8.546 625 HD1 HIS 75 HD1 HIS 75 -4.597 -21.884 10.252 626 HD2 HIS 75 HD2 HIS 75 -1.966 -18.705 10.735 627 HE1 HIS 75 HE1 HIS 75 -3.581 -22.197 12.515 628 HE2 HIS 75 HE2 HIS 75 -2.198 -20.136 12.883 629 H HIS 76 H HIS 76 -5.137 -21.302 6.092 630 HA HIS 76 HA HIS 76 -5.492 -18.952 4.421 631 HB2 HIS 76 HB2 HIS 76 -5.421 -20.203 2.258 632 HB3 HIS 76 HB3 HIS 76 -3.854 -20.132 3.046 633 HD1 HIS 76 HD1 HIS 76 -2.683 -22.326 3.444 634 HD2 HIS 76 HD2 HIS 76 -6.669 -22.838 2.383 635 HE1 HIS 76 HE1 HIS 76 -2.972 -24.787 3.077 636 HE2 HIS 76 HE2 HIS 76 -5.426 -25.093 2.668 637 H HIS 77 H HIS 77 -7.516 -18.988 3.210 638 HA HIS 77 HA HIS 77 -9.448 -21.119 3.735 639 HB2 HIS 77 HB2 HIS 77 -9.457 -19.476 5.752 640 HB3 HIS 77 HB3 HIS 77 -10.153 -18.293 4.655 641 HD1 HIS 77 HD1 HIS 77 -12.540 -19.107 3.540 642 HD2 HIS 77 HD2 HIS 77 -11.286 -21.104 6.964 643 HE1 HIS 77 HE1 HIS 77 -14.590 -20.221 4.455 644 HE2 HIS 77 HE2 HIS 77 -13.784 -21.534 6.443 645 H1 MET 1 H MET 1 6.664 -17.793 -4.792 646 HA MET 1 HA MET 1 6.571 -16.735 -6.832 647 HB2 MET 1 HB2 MET 1 5.574 -19.406 -7.900 648 HB3 MET 1 HB3 MET 1 5.914 -17.999 -8.897 649 HG2 MET 1 HG2 MET 1 7.982 -19.472 -7.243 650 HG3 MET 1 HG3 MET 1 7.690 -19.726 -8.959 651 HE1 MET 1 HE1 MET 1 8.710 -16.913 -6.295 652 HE2 MET 1 HE2 MET 1 10.203 -16.401 -7.083 653 HE3 MET 1 HE3 MET 1 10.022 -18.068 -6.541 654 H LYS 2 H LYS 2 5.022 -15.430 -7.766 655 HA LYS 2 HA LYS 2 3.082 -14.338 -8.125 656 HB2 LYS 2 HB2 LYS 2 1.981 -17.165 -8.217 657 HB3 LYS 2 HB3 LYS 2 1.019 -15.747 -8.622 658 HG2 LYS 2 HG2 LYS 2 3.536 -16.656 -10.055 659 HG3 LYS 2 HG3 LYS 2 1.877 -16.846 -10.632 660 HD2 LYS 2 HD2 LYS 2 1.643 -14.360 -10.692 661 HD3 LYS 2 HD3 LYS 2 3.325 -14.204 -10.173 662 HE2 LYS 2 HE2 LYS 2 4.053 -15.368 -12.234 663 HE3 LYS 2 HE3 LYS 2 2.369 -15.496 -12.751 664 HZ1 LYS 2 HZ1 LYS 2 2.250 -13.071 -12.747 665 HZ2 LYS 2 HZ2 LYS 2 3.434 -13.646 -13.804 666 HZ3 LYS 2 HZ3 LYS 2 3.884 -12.986 -12.316 667 H MET 3 H MET 3 3.907 -14.518 -5.443 668 HA MET 3 HA MET 3 1.796 -14.814 -3.580 669 HB2 MET 3 HB2 MET 3 4.266 -14.587 -3.067 670 HB3 MET 3 HB3 MET 3 4.157 -12.879 -3.457 671 HG2 MET 3 HG2 MET 3 2.591 -12.566 -1.566 672 HG3 MET 3 HG3 MET 3 2.736 -14.278 -1.172 673 HE1 MET 3 HE1 MET 3 5.034 -15.408 -0.298 674 HE2 MET 3 HE2 MET 3 6.542 -14.509 -0.118 675 HE3 MET 3 HE3 MET 3 5.874 -14.795 -1.724 676 H LEU 4 H LEU 4 0.704 -12.947 -2.379 677 HA LEU 4 HA LEU 4 -0.863 -11.273 -3.951 678 HB2 LEU 4 HB2 LEU 4 -0.090 -10.926 -1.026 679 HB3 LEU 4 HB3 LEU 4 -1.305 -9.949 -1.829 680 HG LEU 4 HG LEU 4 -2.542 -12.193 -2.296 681 HD11 LEU 4 HD11 LEU 4 -2.153 -14.026 -0.736 682 HD12 LEU 4 HD12 LEU 4 -0.763 -13.183 -0.050 683 HD13 LEU 4 HD13 LEU 4 -0.721 -13.738 -1.725 684 HD21 LEU 4 HD21 LEU 4 -3.676 -12.126 -0.114 685 HD22 LEU 4 HD22 LEU 4 -3.381 -10.506 -0.739 686 HD23 LEU 4 HD23 LEU 4 -2.360 -11.151 0.549 687 H LYS 5 H LYS 5 2.328 -10.661 -2.639 688 HA LYS 5 HA LYS 5 2.597 -7.895 -3.248 689 HB2 LYS 5 HB2 LYS 5 4.069 -9.131 -1.669 690 HB3 LYS 5 HB3 LYS 5 4.697 -10.085 -3.008 691 HG2 LYS 5 HG2 LYS 5 5.561 -7.910 -4.012 692 HG3 LYS 5 HG3 LYS 5 5.108 -7.123 -2.498 693 HD2 LYS 5 HD2 LYS 5 7.489 -7.672 -2.485 694 HD3 LYS 5 HD3 LYS 5 6.645 -8.625 -1.262 695 HE2 LYS 5 HE2 LYS 5 6.688 -10.589 -2.732 696 HE3 LYS 5 HE3 LYS 5 7.425 -9.637 -4.021 697 HZ1 LYS 5 HZ1 LYS 5 9.056 -10.953 -2.861 698 HZ2 LYS 5 HZ2 LYS 5 8.649 -10.233 -1.387 699 HZ3 LYS 5 HZ3 LYS 5 9.357 -9.307 -2.615 700 H GLU 6 H GLU 6 3.623 -10.846 -5.037 701 HA GLU 6 HA GLU 6 4.963 -9.611 -7.175 702 HB2 GLU 6 HB2 GLU 6 5.252 -11.981 -6.639 703 HB3 GLU 6 HB3 GLU 6 3.576 -12.318 -7.038 704 HG2 GLU 6 HG2 GLU 6 4.972 -13.132 -8.819 705 HG3 GLU 6 HG3 GLU 6 4.052 -11.756 -9.419 706 H LYS 7 H LYS 7 1.600 -10.813 -7.040 707 HA LYS 7 HA LYS 7 0.815 -10.021 -9.661 708 HB2 LYS 7 HB2 LYS 7 -1.501 -10.414 -8.860 709 HB3 LYS 7 HB3 LYS 7 -0.406 -11.739 -8.477 710 HG2 LYS 7 HG2 LYS 7 -0.310 -11.149 -6.173 711 HG3 LYS 7 HG3 LYS 7 -1.047 -9.574 -6.460 712 HD2 LYS 7 HD2 LYS 7 -2.593 -11.177 -5.397 713 HD3 LYS 7 HD3 LYS 7 -3.176 -10.592 -6.956 714 HE2 LYS 7 HE2 LYS 7 -3.564 -13.032 -6.678 715 HE3 LYS 7 HE3 LYS 7 -2.486 -12.699 -8.032 716 HZ1 LYS 7 HZ1 LYS 7 -0.607 -13.241 -6.571 717 HZ2 LYS 7 HZ2 LYS 7 -1.671 -14.539 -6.740 718 HZ3 LYS 7 HZ3 LYS 7 -1.684 -13.617 -5.326 719 H ALA 8 H ALA 8 0.727 -8.323 -6.573 720 HA ALA 8 HA ALA 8 -0.765 -6.042 -7.206 721 HB1 ALA 8 HB1 ALA 8 0.420 -4.950 -5.355 722 HB2 ALA 8 HB2 ALA 8 1.673 -6.199 -5.404 723 HB3 ALA 8 HB3 ALA 8 0.019 -6.623 -4.940 724 H GLY 9 H GLY 9 2.477 -6.912 -8.161 725 HA2 GLY 9 HA2 GLY 9 3.444 -4.463 -9.190 726 HA3 GLY 9 HA3 GLY 9 3.927 -6.063 -9.726 727 H ALA 10 H ALA 10 1.238 -6.858 -10.625 728 HA ALA 10 HA ALA 10 1.177 -5.828 -13.285 729 HB1 ALA 10 HB1 ALA 10 0.339 -8.083 -12.728 730 HB2 ALA 10 HB2 ALA 10 -0.899 -7.127 -13.548 731 HB3 ALA 10 HB3 ALA 10 -0.982 -7.370 -11.801 732 H LEU 11 H LEU 11 -0.790 -5.148 -10.388 733 HA LEU 11 HA LEU 11 -2.547 -3.215 -11.518 734 HB2 LEU 11 HB2 LEU 11 -1.601 -3.456 -8.629 735 HB3 LEU 11 HB3 LEU 11 -3.003 -2.542 -9.172 736 HG LEU 11 HG LEU 11 -2.689 -5.574 -9.260 737 HD11 LEU 11 HD11 LEU 11 -4.492 -3.855 -7.527 738 HD12 LEU 11 HD12 LEU 11 -3.056 -4.737 -6.997 739 HD13 LEU 11 HD13 LEU 11 -4.466 -5.621 -7.573 740 HD21 LEU 11 HD21 LEU 11 -5.058 -3.890 -10.153 741 HD22 LEU 11 HD22 LEU 11 -5.024 -5.652 -10.044 742 HD23 LEU 11 HD23 LEU 11 -3.982 -4.826 -11.195 743 H ALA 12 H ALA 12 0.622 -2.973 -9.963 744 HA ALA 12 HA ALA 12 0.994 -0.208 -9.844 745 HB1 ALA 12 HB1 ALA 12 2.470 -1.845 -8.760 746 HB2 ALA 12 HB2 ALA 12 3.398 -0.710 -9.747 747 HB3 ALA 12 HB3 ALA 12 3.088 -2.350 -10.335 748 H GLY 13 H GLY 13 1.842 -2.457 -12.458 749 HA2 GLY 13 HA2 GLY 13 3.209 -0.771 -14.194 750 HA3 GLY 13 HA3 GLY 13 2.313 -2.198 -14.684 751 H GLN 14 H GLN 14 -0.251 -1.617 -14.326 752 HA GLN 14 HA GLN 14 -0.890 0.063 -16.532 753 HB2 GLN 14 HB2 GLN 14 -3.292 -0.418 -15.905 754 HB3 GLN 14 HB3 GLN 14 -2.289 -1.845 -16.144 755 HG2 GLN 14 HG2 GLN 14 -2.053 -2.082 -13.693 756 HG3 GLN 14 HG3 GLN 14 -3.069 -0.657 -13.466 757 HE21 GLN 14 HE21 GLN 14 -4.487 -1.943 -12.229 758 HE22 GLN 14 HE22 GLN 14 -5.603 -3.025 -12.974 759 H ILE 15 H ILE 15 -1.036 0.658 -13.002 760 HA ILE 15 HA ILE 15 -2.473 3.121 -13.089 761 HB ILE 15 HB ILE 15 -0.550 2.006 -11.005 762 HG12 ILE 15 HG12 ILE 15 -3.587 2.328 -11.006 763 HG13 ILE 15 HG13 ILE 15 -2.721 0.819 -11.269 764 HG21 ILE 15 HG21 ILE 15 -1.302 3.771 -9.425 765 HG22 ILE 15 HG22 ILE 15 -2.185 4.560 -10.732 766 HG23 ILE 15 HG23 ILE 15 -0.426 4.455 -10.797 767 HD11 ILE 15 HD11 ILE 15 -2.749 2.429 -8.716 768 HD12 ILE 15 HD12 ILE 15 -1.869 0.920 -8.974 769 HD13 ILE 15 HD13 ILE 15 -3.630 0.935 -9.030 770 H TRP 16 H TRP 16 1.031 2.441 -13.104 771 HA TRP 16 HA TRP 16 2.029 5.052 -13.336 772 HB2 TRP 16 HB2 TRP 16 3.407 2.987 -12.883 773 HB3 TRP 16 HB3 TRP 16 3.206 2.511 -14.565 774 HD1 TRP 16 HD1 TRP 16 5.224 4.846 -12.332 775 HE1 TRP 16 HE1 TRP 16 7.056 5.998 -13.717 776 HE3 TRP 16 HE3 TRP 16 3.777 3.362 -17.028 777 HZ2 TRP 16 HZ2 TRP 16 7.799 6.254 -16.426 778 HZ3 TRP 16 HZ3 TRP 16 5.103 4.112 -18.962 779 HH2 TRP 16 HH2 TRP 16 7.069 5.531 -18.666 780 H GLU 17 H GLU 17 0.951 2.765 -15.860 781 HA GLU 17 HA GLU 17 1.571 4.337 -18.152 782 HB2 GLU 17 HB2 GLU 17 -0.392 2.032 -17.779 783 HB3 GLU 17 HB3 GLU 17 0.009 2.727 -19.350 784 HG2 GLU 17 HG2 GLU 17 2.348 2.071 -19.077 785 HG3 GLU 17 HG3 GLU 17 2.007 1.440 -17.468 786 H ALA 18 H ALA 18 -1.277 4.239 -16.063 787 HA ALA 18 HA ALA 18 -3.006 5.886 -17.647 788 HB1 ALA 18 HB1 ALA 18 -3.881 4.472 -15.830 789 HB2 ALA 18 HB2 ALA 18 -4.321 6.162 -15.571 790 HB3 ALA 18 HB3 ALA 18 -3.007 5.437 -14.638 791 H LEU 19 H LEU 19 -0.536 6.557 -15.224 792 HA LEU 19 HA LEU 19 -0.916 9.416 -15.102 793 HB2 LEU 19 HB2 LEU 19 1.323 7.588 -14.164 794 HB3 LEU 19 HB3 LEU 19 1.272 9.313 -13.820 795 HG LEU 19 HG LEU 19 -0.835 7.316 -12.897 796 HD11 LEU 19 HD11 LEU 19 1.299 6.844 -11.799 797 HD12 LEU 19 HD12 LEU 19 0.143 7.523 -10.657 798 HD13 LEU 19 HD13 LEU 19 1.444 8.533 -11.298 799 HD21 LEU 19 HD21 LEU 19 -1.621 9.156 -11.457 800 HD22 LEU 19 HD22 LEU 19 -1.727 9.577 -13.163 801 HD23 LEU 19 HD23 LEU 19 -0.421 10.238 -12.173 802 H ASN 20 H ASN 20 0.929 7.266 -17.165 803 HA ASN 20 HA ASN 20 3.122 8.949 -17.765 804 HB2 ASN 20 HB2 ASN 20 3.090 6.464 -18.126 805 HB3 ASN 20 HB3 ASN 20 2.030 6.706 -19.512 806 HD21 ASN 20 HD21 ASN 20 3.434 6.008 -21.095 807 HD22 ASN 20 HD22 ASN 20 4.936 6.773 -21.459 808 H GLY 21 H GLY 21 3.338 10.646 -19.090 809 HA2 GLY 21 HA2 GLY 21 3.050 11.962 -21.012 810 HA3 GLY 21 HA3 GLY 21 1.577 11.093 -21.402 811 H THR 22 H THR 22 0.353 11.462 -18.760 812 HA THR 22 HA THR 22 -0.704 14.165 -19.098 813 HB THR 22 HB THR 22 -2.366 13.578 -17.382 814 HG1 THR 22 HG1 THR 22 -1.073 11.047 -17.134 815 HG21 THR 22 HG21 THR 22 -3.485 11.672 -18.488 816 HG22 THR 22 HG22 THR 22 -1.996 11.306 -19.363 817 HG23 THR 22 HG23 THR 22 -2.850 12.821 -19.670 818 H GLU 23 H GLU 23 -1.088 15.555 -17.170 819 HA GLU 23 HA GLU 23 1.256 15.842 -15.453 820 HB2 GLU 23 HB2 GLU 23 -1.199 17.539 -16.001 821 HB3 GLU 23 HB3 GLU 23 -0.120 17.926 -14.663 822 HG2 GLU 23 HG2 GLU 23 0.853 17.668 -17.531 823 HG3 GLU 23 HG3 GLU 23 0.257 19.187 -16.856 824 H GLY 24 H GLY 24 -0.440 13.504 -15.035 825 HA2 GLY 24 HA2 GLY 24 -0.639 12.259 -13.092 826 HA3 GLY 24 HA3 GLY 24 -0.654 13.733 -12.136 827 H LEU 25 H LEU 25 -2.389 11.596 -11.682 828 HA LEU 25 HA LEU 25 -5.046 12.727 -12.265 829 HB2 LEU 25 HB2 LEU 25 -4.265 9.798 -12.595 830 HB3 LEU 25 HB3 LEU 25 -5.915 10.391 -12.637 831 HG LEU 25 HG LEU 25 -3.744 11.020 -14.682 832 HD11 LEU 25 HD11 LEU 25 -4.522 8.705 -14.830 833 HD12 LEU 25 HD12 LEU 25 -5.062 9.633 -16.225 834 HD13 LEU 25 HD13 LEU 25 -6.200 9.247 -14.928 835 HD21 LEU 25 HD21 LEU 25 -6.671 11.855 -14.690 836 HD22 LEU 25 HD22 LEU 25 -5.515 12.114 -16.002 837 HD23 LEU 25 HD23 LEU 25 -5.281 12.920 -14.454 838 H THR 26 H THR 26 -6.661 12.143 -10.675 839 HA THR 26 HA THR 26 -5.746 11.599 -7.982 840 HB THR 26 HB THR 26 -8.098 11.743 -7.300 841 HG1 THR 26 HG1 THR 26 -9.562 12.225 -9.322 842 HG21 THR 26 HG21 THR 26 -7.010 13.911 -7.768 843 HG22 THR 26 HG22 THR 26 -8.730 13.968 -8.163 844 HG23 THR 26 HG23 THR 26 -7.535 13.818 -9.452 845 H GLN 27 H GLN 27 -6.880 9.823 -6.631 846 HA GLN 27 HA GLN 27 -6.483 7.218 -7.554 847 HB2 GLN 27 HB2 GLN 27 -6.674 7.707 -5.164 848 HB3 GLN 27 HB3 GLN 27 -8.349 8.217 -5.352 849 HG2 GLN 27 HG2 GLN 27 -9.056 5.947 -5.827 850 HG3 GLN 27 HG3 GLN 27 -7.387 5.387 -5.896 851 HE21 GLN 27 HE21 GLN 27 -7.770 3.827 -4.305 852 HE22 GLN 27 HE22 GLN 27 -8.023 4.221 -2.649 853 H LYS 28 H LYS 28 -9.432 9.182 -7.591 854 HA LYS 28 HA LYS 28 -11.293 7.355 -8.635 855 HB2 LYS 28 HB2 LYS 28 -11.904 9.542 -7.651 856 HB3 LYS 28 HB3 LYS 28 -11.130 10.378 -8.987 857 HG2 LYS 28 HG2 LYS 28 -13.511 10.447 -9.318 858 HG3 LYS 28 HG3 LYS 28 -12.811 9.394 -10.546 859 HD2 LYS 28 HD2 LYS 28 -14.900 8.450 -9.652 860 HD3 LYS 28 HD3 LYS 28 -13.529 7.406 -9.273 861 HE2 LYS 28 HE2 LYS 28 -15.121 7.665 -7.370 862 HE3 LYS 28 HE3 LYS 28 -13.495 8.216 -6.975 863 HZ1 LYS 28 HZ1 LYS 28 -14.219 10.495 -7.328 864 HZ2 LYS 28 HZ2 LYS 28 -15.185 9.740 -6.163 865 HZ3 LYS 28 HZ3 LYS 28 -15.775 9.968 -7.731 866 H GLN 29 H GLN 29 -9.269 9.749 -10.382 867 HA GLN 29 HA GLN 29 -10.246 9.188 -12.999 868 HB2 GLN 29 HB2 GLN 29 -7.693 10.573 -12.088 869 HB3 GLN 29 HB3 GLN 29 -8.261 10.559 -13.755 870 HG2 GLN 29 HG2 GLN 29 -9.791 11.739 -11.416 871 HG3 GLN 29 HG3 GLN 29 -8.788 12.662 -12.533 872 HE21 GLN 29 HE21 GLN 29 -11.693 12.822 -11.951 873 HE22 GLN 29 HE22 GLN 29 -12.469 12.648 -13.477 874 H ILE 30 H ILE 30 -7.402 8.030 -11.232 875 HA ILE 30 HA ILE 30 -6.252 6.461 -13.311 876 HB ILE 30 HB ILE 30 -6.007 6.266 -10.279 877 HG12 ILE 30 HG12 ILE 30 -4.067 7.339 -12.373 878 HG13 ILE 30 HG13 ILE 30 -5.122 8.338 -11.382 879 HG21 ILE 30 HG21 ILE 30 -5.501 4.044 -11.212 880 HG22 ILE 30 HG22 ILE 30 -4.036 4.816 -10.607 881 HG23 ILE 30 HG23 ILE 30 -4.352 4.765 -12.344 882 HD11 ILE 30 HD11 ILE 30 -2.872 6.604 -10.384 883 HD12 ILE 30 HD12 ILE 30 -3.934 7.598 -9.382 884 HD13 ILE 30 HD13 ILE 30 -2.862 8.357 -10.557 885 H LYS 31 H LYS 31 -8.518 5.632 -10.648 886 HA LYS 31 HA LYS 31 -8.849 2.896 -11.285 887 HB2 LYS 31 HB2 LYS 31 -10.587 4.849 -9.753 888 HB3 LYS 31 HB3 LYS 31 -11.159 3.217 -10.075 889 HG2 LYS 31 HG2 LYS 31 -9.164 2.308 -8.894 890 HG3 LYS 31 HG3 LYS 31 -8.657 3.955 -8.520 891 HD2 LYS 31 HD2 LYS 31 -9.805 2.868 -6.602 892 HD3 LYS 31 HD3 LYS 31 -10.662 4.308 -7.158 893 HE2 LYS 31 HE2 LYS 31 -12.216 2.448 -6.631 894 HE3 LYS 31 HE3 LYS 31 -12.310 2.903 -8.327 895 HZ1 LYS 31 HZ1 LYS 31 -12.325 0.510 -7.984 896 HZ2 LYS 31 HZ2 LYS 31 -10.790 0.587 -7.272 897 HZ3 LYS 31 HZ3 LYS 31 -10.991 1.000 -8.899 898 H LYS 32 H LYS 32 -10.333 5.761 -12.728 899 HA LYS 32 HA LYS 32 -12.268 4.363 -14.322 900 HB2 LYS 32 HB2 LYS 32 -10.951 7.080 -14.736 901 HB3 LYS 32 HB3 LYS 32 -12.285 6.472 -15.712 902 HG2 LYS 32 HG2 LYS 32 -12.356 7.117 -12.746 903 HG3 LYS 32 HG3 LYS 32 -13.090 8.057 -14.046 904 HD2 LYS 32 HD2 LYS 32 -13.898 5.266 -13.131 905 HD3 LYS 32 HD3 LYS 32 -14.798 6.762 -12.881 906 HE2 LYS 32 HE2 LYS 32 -14.269 5.394 -15.542 907 HE3 LYS 32 HE3 LYS 32 -15.812 5.485 -14.693 908 HZ1 LYS 32 HZ1 LYS 32 -15.703 7.085 -16.484 909 HZ2 LYS 32 HZ2 LYS 32 -14.313 7.790 -15.831 910 HZ3 LYS 32 HZ3 LYS 32 -15.782 7.891 -15.001 911 H ALA 33 H ALA 33 -8.998 5.638 -15.072 912 HA ALA 33 HA ALA 33 -8.943 4.846 -17.802 913 HB1 ALA 33 HB1 ALA 33 -6.562 5.460 -17.732 914 HB2 ALA 33 HB2 ALA 33 -6.609 5.490 -15.966 915 HB3 ALA 33 HB3 ALA 33 -7.548 6.660 -16.893 916 H THR 34 H THR 34 -7.896 3.191 -14.874 917 HA THR 34 HA THR 34 -6.727 0.913 -16.354 918 HB THR 34 HB THR 34 -5.820 0.171 -14.183 919 HG1 THR 34 HG1 THR 34 -6.509 2.409 -12.745 920 HG21 THR 34 HG21 THR 34 -4.301 2.042 -13.676 921 HG22 THR 34 HG22 THR 34 -5.333 3.147 -14.587 922 HG23 THR 34 HG23 THR 34 -4.481 1.844 -15.421 923 H LYS 35 H LYS 35 -9.607 1.815 -14.783 924 HA LYS 35 HA LYS 35 -11.443 0.881 -14.006 925 HB2 LYS 35 HB2 LYS 35 -12.562 -0.807 -15.312 926 HB3 LYS 35 HB3 LYS 35 -11.714 0.302 -16.375 927 HG2 LYS 35 HG2 LYS 35 -9.919 -1.442 -16.652 928 HG3 LYS 35 HG3 LYS 35 -10.910 -2.546 -15.695 929 HD2 LYS 35 HD2 LYS 35 -11.650 -1.303 -18.378 930 HD3 LYS 35 HD3 LYS 35 -11.210 -2.988 -18.089 931 HE2 LYS 35 HE2 LYS 35 -13.686 -1.585 -17.007 932 HE3 LYS 35 HE3 LYS 35 -13.646 -2.728 -18.348 933 HZ1 LYS 35 HZ1 LYS 35 -12.955 -3.338 -15.524 934 HZ2 LYS 35 HZ2 LYS 35 -12.862 -4.434 -16.803 935 HZ3 LYS 35 HZ3 LYS 35 -14.361 -3.811 -16.332 936 H LEU 36 H LEU 36 -9.574 0.536 -12.253 937 HA LEU 36 HA LEU 36 -9.229 -2.048 -11.124 938 HB2 LEU 36 HB2 LEU 36 -9.251 0.693 -9.796 939 HB3 LEU 36 HB3 LEU 36 -8.788 -0.783 -8.963 940 HG LEU 36 HG LEU 36 -7.335 0.367 -11.369 941 HD11 LEU 36 HD11 LEU 36 -5.554 1.009 -9.807 942 HD12 LEU 36 HD12 LEU 36 -6.550 0.492 -8.444 943 HD13 LEU 36 HD13 LEU 36 -7.067 1.845 -9.455 944 HD21 LEU 36 HD21 LEU 36 -5.573 -1.270 -10.860 945 HD22 LEU 36 HD22 LEU 36 -7.097 -2.064 -11.242 946 HD23 LEU 36 HD23 LEU 36 -6.563 -1.947 -9.563 947 H LYS 37 H LYS 37 -10.346 -3.145 -9.486 948 HA LYS 37 HA LYS 37 -13.207 -2.902 -9.565 949 HB2 LYS 37 HB2 LYS 37 -12.143 -5.105 -9.523 950 HB3 LYS 37 HB3 LYS 37 -11.361 -4.740 -7.988 951 HG2 LYS 37 HG2 LYS 37 -13.617 -4.649 -6.905 952 HG3 LYS 37 HG3 LYS 37 -14.342 -5.111 -8.447 953 HD2 LYS 37 HD2 LYS 37 -14.127 -7.058 -6.964 954 HD3 LYS 37 HD3 LYS 37 -13.115 -7.251 -8.397 955 HE2 LYS 37 HE2 LYS 37 -11.124 -6.591 -7.086 956 HE3 LYS 37 HE3 LYS 37 -12.133 -6.364 -5.655 957 HZ1 LYS 37 HZ1 LYS 37 -12.631 -8.681 -5.622 958 HZ2 LYS 37 HZ2 LYS 37 -10.951 -8.504 -5.720 959 HZ3 LYS 37 HZ3 LYS 37 -11.836 -8.942 -7.092 960 H ALA 38 H ALA 38 -10.870 -2.683 -6.846 961 HA ALA 38 HA ALA 38 -12.927 -1.286 -5.206 962 HB1 ALA 38 HB1 ALA 38 -12.564 -3.607 -4.437 963 HB2 ALA 38 HB2 ALA 38 -12.041 -2.440 -3.221 964 HB3 ALA 38 HB3 ALA 38 -10.844 -3.274 -4.217 965 H ASP 39 H ASP 39 -11.969 -0.179 -3.309 966 HA ASP 39 HA ASP 39 -10.227 1.932 -3.878 967 HB2 ASP 39 HB2 ASP 39 -11.972 1.873 -2.097 968 HB3 ASP 39 HB3 ASP 39 -11.030 0.681 -1.214 969 H LYS 40 H LYS 40 -9.621 -1.228 -2.477 970 HA LYS 40 HA LYS 40 -7.019 -0.782 -1.402 971 HB2 LYS 40 HB2 LYS 40 -8.383 -3.399 -2.138 972 HB3 LYS 40 HB3 LYS 40 -6.978 -3.234 -1.083 973 HG2 LYS 40 HG2 LYS 40 -9.697 -2.005 -0.531 974 HG3 LYS 40 HG3 LYS 40 -9.148 -3.550 0.132 975 HD2 LYS 40 HD2 LYS 40 -7.267 -2.335 1.271 976 HD3 LYS 40 HD3 LYS 40 -7.899 -0.809 0.639 977 HE2 LYS 40 HE2 LYS 40 -8.601 -1.123 2.964 978 HE3 LYS 40 HE3 LYS 40 -10.009 -1.189 1.902 979 HZ1 LYS 40 HZ1 LYS 40 -10.068 -2.939 3.563 980 HZ2 LYS 40 HZ2 LYS 40 -8.581 -3.540 3.025 981 HZ3 LYS 40 HZ3 LYS 40 -9.930 -3.597 2.012 982 H ASP 41 H ASP 41 -8.154 -1.978 -4.509 983 HA ASP 41 HA ASP 41 -5.935 -3.155 -5.688 984 HB2 ASP 41 HB2 ASP 41 -8.019 -1.356 -7.015 985 HB3 ASP 41 HB3 ASP 41 -6.917 -2.420 -7.883 986 H PHE 42 H PHE 42 -6.658 0.253 -5.268 987 HA PHE 42 HA PHE 42 -4.652 1.293 -7.008 988 HB2 PHE 42 HB2 PHE 42 -6.688 2.568 -6.436 989 HB3 PHE 42 HB3 PHE 42 -6.174 2.657 -4.755 990 HD1 PHE 42 HD2 PHE 42 -4.931 3.487 -8.188 991 HD2 PHE 42 HD1 PHE 42 -5.010 4.608 -4.059 992 HE1 PHE 42 HE2 PHE 42 -3.697 5.530 -8.711 993 HE2 PHE 42 HE1 PHE 42 -3.767 6.662 -4.606 994 HZ PHE 42 HZ PHE 42 -3.116 7.125 -6.940 995 H PHE 43 H PHE 43 -4.781 0.733 -3.490 996 HA PHE 43 HA PHE 43 -2.346 2.093 -2.848 997 HB2 PHE 43 HB2 PHE 43 -3.782 -0.054 -1.230 998 HB3 PHE 43 HB3 PHE 43 -2.574 1.074 -0.614 999 HD1 PHE 43 HD1 PHE 43 -3.168 3.676 -1.104 1000 HD2 PHE 43 HD2 PHE 43 -6.026 0.495 -0.863 1001 HE1 PHE 43 HE1 PHE 43 -4.951 5.285 -0.594 1002 HE2 PHE 43 HE2 PHE 43 -7.778 2.106 -0.348 1003 HZ PHE 43 HZ PHE 43 -7.255 4.510 -0.216 1004 H LEU 44 H LEU 44 -3.061 -1.294 -3.631 1005 HA LEU 44 HA LEU 44 -0.505 -2.422 -3.126 1006 HB2 LEU 44 HB2 LEU 44 -2.842 -3.222 -4.871 1007 HB3 LEU 44 HB3 LEU 44 -1.329 -4.091 -5.026 1008 HG LEU 44 HG LEU 44 -1.449 -4.709 -2.608 1009 HD11 LEU 44 HD11 LEU 44 -4.223 -3.496 -2.628 1010 HD12 LEU 44 HD12 LEU 44 -2.826 -2.890 -1.738 1011 HD13 LEU 44 HD13 LEU 44 -3.512 -4.458 -1.328 1012 HD21 LEU 44 HD21 LEU 44 -3.190 -6.432 -2.853 1013 HD22 LEU 44 HD22 LEU 44 -2.215 -6.281 -4.314 1014 HD23 LEU 44 HD23 LEU 44 -3.838 -5.586 -4.263 1015 H GLY 45 H GLY 45 -1.868 -0.794 -5.961 1016 HA2 GLY 45 HA2 GLY 45 0.377 -1.196 -7.710 1017 HA3 GLY 45 HA3 GLY 45 -0.966 -0.095 -7.959 1018 H LEU 46 H LEU 46 -0.884 1.787 -6.206 1019 HA LEU 46 HA LEU 46 1.168 3.529 -6.948 1020 HB2 LEU 46 HB2 LEU 46 -1.074 4.263 -6.155 1021 HB3 LEU 46 HB3 LEU 46 -0.671 3.730 -4.530 1022 HG LEU 46 HG LEU 46 1.226 5.420 -4.530 1023 HD11 LEU 46 HD11 LEU 46 -0.078 6.429 -7.074 1024 HD12 LEU 46 HD12 LEU 46 1.526 5.703 -6.925 1025 HD13 LEU 46 HD13 LEU 46 1.189 7.252 -6.160 1026 HD21 LEU 46 HD21 LEU 46 -1.559 6.587 -4.820 1027 HD22 LEU 46 HD22 LEU 46 -0.184 7.347 -4.015 1028 HD23 LEU 46 HD23 LEU 46 -0.881 5.869 -3.356 1029 H GLY 47 H GLY 47 0.888 1.473 -4.095 1030 HA2 GLY 47 HA2 GLY 47 3.018 2.524 -2.513 1031 HA3 GLY 47 HA3 GLY 47 2.335 0.907 -2.380 1032 H TRP 48 H TRP 48 2.888 0.163 -5.095 1033 HA TRP 48 HA TRP 48 5.612 -0.725 -4.977 1034 HB2 TRP 48 HB2 TRP 48 3.595 -1.944 -6.001 1035 HB3 TRP 48 HB3 TRP 48 3.714 -0.833 -7.357 1036 HD1 TRP 48 HD1 TRP 48 6.147 -1.001 -8.784 1037 HE1 TRP 48 HE1 TRP 48 7.561 -3.081 -9.269 1038 HE3 TRP 48 HE3 TRP 48 4.246 -4.117 -5.211 1039 HZ2 TRP 48 HZ2 TRP 48 7.849 -5.667 -8.272 1040 HZ3 TRP 48 HZ3 TRP 48 5.137 -6.399 -5.055 1041 HH2 TRP 48 HH2 TRP 48 6.893 -7.176 -6.561 1042 H LEU 49 H LEU 49 3.866 1.810 -6.765 1043 HA LEU 49 HA LEU 49 6.015 2.719 -8.409 1044 HB2 LEU 49 HB2 LEU 49 3.410 3.934 -7.469 1045 HB3 LEU 49 HB3 LEU 49 4.560 4.932 -8.331 1046 HG LEU 49 HG LEU 49 4.329 3.644 -10.355 1047 HD11 LEU 49 HD11 LEU 49 2.646 1.670 -8.827 1048 HD12 LEU 49 HD12 LEU 49 4.279 1.405 -9.445 1049 HD13 LEU 49 HD13 LEU 49 2.948 1.660 -10.568 1050 HD21 LEU 49 HD21 LEU 49 1.944 3.898 -10.872 1051 HD22 LEU 49 HD22 LEU 49 2.523 5.275 -9.938 1052 HD23 LEU 49 HD23 LEU 49 1.566 4.019 -9.149 1053 H LEU 50 H LEU 50 4.989 3.540 -5.134 1054 HA LEU 50 HA LEU 50 6.932 5.564 -4.584 1055 HB2 LEU 50 HB2 LEU 50 5.211 3.820 -2.797 1056 HB3 LEU 50 HB3 LEU 50 6.341 4.992 -2.132 1057 HG LEU 50 HG LEU 50 4.036 5.701 -3.993 1058 HD11 LEU 50 HD11 LEU 50 4.183 6.013 -0.976 1059 HD12 LEU 50 HD12 LEU 50 3.159 4.882 -1.865 1060 HD13 LEU 50 HD13 LEU 50 2.895 6.615 -2.027 1061 HD21 LEU 50 HD21 LEU 50 5.922 7.482 -2.403 1062 HD22 LEU 50 HD22 LEU 50 4.531 8.032 -3.339 1063 HD23 LEU 50 HD23 LEU 50 5.894 7.282 -4.158 1064 H ARG 51 H ARG 51 6.927 2.015 -4.223 1065 HA ARG 51 HA ARG 51 9.194 1.726 -2.591 1066 HB2 ARG 51 HB2 ARG 51 9.028 -0.538 -2.898 1067 HB3 ARG 51 HB3 ARG 51 7.436 -0.092 -3.474 1068 HG2 ARG 51 HG2 ARG 51 8.116 -0.443 -5.780 1069 HG3 ARG 51 HG3 ARG 51 9.802 -0.597 -5.318 1070 HD2 ARG 51 HD2 ARG 51 9.147 -2.663 -4.010 1071 HD3 ARG 51 HD3 ARG 51 7.549 -2.536 -4.759 1072 HE ARG 51 HE ARG 51 8.696 -2.750 -6.946 1073 HH11 ARG 51 HH11 ARG 51 10.401 -3.893 -4.148 1074 HH12 ARG 51 HH12 ARG 51 11.303 -5.051 -5.056 1075 HH21 ARG 51 HH21 ARG 51 9.871 -4.234 -8.069 1076 HH22 ARG 51 HH22 ARG 51 11.007 -5.239 -7.247 1077 H GLU 52 H GLU 52 9.004 2.371 -6.005 1078 HA GLU 52 HA GLU 52 11.954 2.269 -6.309 1079 HB2 GLU 52 HB2 GLU 52 9.741 2.131 -8.406 1080 HB3 GLU 52 HB3 GLU 52 11.462 2.158 -8.780 1081 HG2 GLU 52 HG2 GLU 52 11.810 0.001 -7.804 1082 HG3 GLU 52 HG3 GLU 52 10.221 0.012 -7.049 1083 H ASP 53 H ASP 53 9.461 4.466 -5.784 1084 HA ASP 53 HA ASP 53 8.983 6.593 -6.132 1085 HB2 ASP 53 HB2 ASP 53 10.809 8.287 -5.803 1086 HB3 ASP 53 HB3 ASP 53 10.679 7.070 -4.550 1087 H LYS 54 H LYS 54 8.664 5.405 -8.385 1088 HA LYS 54 HA LYS 54 9.722 7.006 -10.593 1089 HB2 LYS 54 HB2 LYS 54 7.602 4.810 -10.499 1090 HB3 LYS 54 HB3 LYS 54 8.199 5.563 -11.980 1091 HG2 LYS 54 HG2 LYS 54 10.426 4.682 -11.603 1092 HG3 LYS 54 HG3 LYS 54 9.967 4.058 -10.018 1093 HD2 LYS 54 HD2 LYS 54 8.819 3.105 -12.676 1094 HD3 LYS 54 HD3 LYS 54 10.104 2.292 -11.777 1095 HE2 LYS 54 HE2 LYS 54 8.423 2.121 -9.833 1096 HE3 LYS 54 HE3 LYS 54 7.188 2.613 -10.997 1097 HZ1 LYS 54 HZ1 LYS 54 8.923 0.203 -11.163 1098 HZ2 LYS 54 HZ2 LYS 54 7.821 0.678 -12.355 1099 HZ3 LYS 54 HZ3 LYS 54 7.264 0.235 -10.823 1100 H VAL 55 H VAL 55 7.396 7.433 -8.237 1101 HA VAL 55 HA VAL 55 5.892 9.447 -9.806 1102 HB VAL 55 HB VAL 55 3.848 8.949 -8.491 1103 HG11 VAL 55 HG11 VAL 55 4.097 7.913 -10.693 1104 HG12 VAL 55 HG12 VAL 55 3.219 6.841 -9.602 1105 HG13 VAL 55 HG13 VAL 55 4.915 6.522 -9.973 1106 HG21 VAL 55 HG21 VAL 55 3.673 6.896 -7.103 1107 HG22 VAL 55 HG22 VAL 55 4.867 8.016 -6.447 1108 HG23 VAL 55 HG23 VAL 55 5.397 6.588 -7.339 1109 H VAL 56 H VAL 56 5.116 11.261 -8.632 1110 HA VAL 56 HA VAL 56 5.993 11.557 -5.826 1111 HB VAL 56 HB VAL 56 7.099 13.267 -7.150 1112 HG11 VAL 56 HG11 VAL 56 5.890 14.950 -8.515 1113 HG12 VAL 56 HG12 VAL 56 4.377 14.092 -8.222 1114 HG13 VAL 56 HG13 VAL 56 5.667 13.311 -9.136 1115 HG21 VAL 56 HG21 VAL 56 6.311 15.330 -6.030 1116 HG22 VAL 56 HG22 VAL 56 6.323 13.965 -4.911 1117 HG23 VAL 56 HG23 VAL 56 4.798 14.525 -5.599 1118 H THR 57 H THR 57 4.409 11.582 -4.335 1119 HA THR 57 HA THR 57 1.595 11.603 -5.279 1120 HB THR 57 HB THR 57 1.052 10.315 -3.222 1121 HG1 THR 57 HG1 THR 57 2.605 9.778 -1.770 1122 HG21 THR 57 HG21 THR 57 2.162 8.195 -3.801 1123 HG22 THR 57 HG22 THR 57 3.348 9.065 -4.774 1124 HG23 THR 57 HG23 THR 57 1.654 9.044 -5.263 1125 H SER 58 H SER 58 0.017 12.730 -4.158 1126 HA SER 58 HA SER 58 0.741 14.632 -2.037 1127 HB2 SER 58 HB2 SER 58 -0.518 15.478 -4.696 1128 HB3 SER 58 HB3 SER 58 -0.348 16.524 -3.284 1129 HG SER 58 HG SER 58 1.783 15.321 -4.744 1130 H GLU 59 H GLU 59 -1.233 15.711 -1.167 1131 HA GLU 59 HA GLU 59 -3.683 14.052 -1.404 1132 HB2 GLU 59 HB2 GLU 59 -2.568 13.793 0.799 1133 HB3 GLU 59 HB3 GLU 59 -2.638 15.533 1.054 1134 HG2 GLU 59 HG2 GLU 59 -5.101 15.430 1.072 1135 HG3 GLU 59 HG3 GLU 59 -5.034 13.692 0.786 1136 H VAL 60 H VAL 60 -5.320 15.114 -2.282 1137 HA VAL 60 HA VAL 60 -5.597 18.063 -2.008 1138 HB VAL 60 HB VAL 60 -6.586 16.230 -4.250 1139 HG11 VAL 60 HG11 VAL 60 -7.235 19.182 -3.852 1140 HG12 VAL 60 HG12 VAL 60 -8.384 17.843 -3.776 1141 HG13 VAL 60 HG13 VAL 60 -7.603 18.246 -5.304 1142 HG21 VAL 60 HG21 VAL 60 -4.227 16.908 -4.443 1143 HG22 VAL 60 HG22 VAL 60 -4.697 18.607 -4.298 1144 HG23 VAL 60 HG23 VAL 60 -5.202 17.669 -5.706 1145 H GLU 61 H GLU 61 -6.832 18.307 -0.286 1146 HA GLU 61 HA GLU 61 -8.588 18.358 1.135 1147 HB2 GLU 61 HB2 GLU 61 -10.288 18.106 -1.365 1148 HB3 GLU 61 HB3 GLU 61 -10.622 19.057 0.081 1149 HG2 GLU 61 HG2 GLU 61 -8.505 19.599 -2.029 1150 HG3 GLU 61 HG3 GLU 61 -9.964 20.529 -1.750 1151 H GLY 62 H GLY 62 -7.676 15.920 1.417 1152 HA2 GLY 62 HA2 GLY 62 -8.398 14.039 2.595 1153 HA3 GLY 62 HA3 GLY 62 -10.017 14.256 1.970 1154 H GLU 63 H GLU 63 -8.920 14.396 -0.875 1155 HA GLU 63 HA GLU 63 -8.749 11.500 -1.364 1156 HB2 GLU 63 HB2 GLU 63 -9.141 13.827 -3.309 1157 HB3 GLU 63 HB3 GLU 63 -9.060 12.129 -3.781 1158 HG2 GLU 63 HG2 GLU 63 -11.052 11.738 -2.230 1159 HG3 GLU 63 HG3 GLU 63 -11.195 13.493 -2.120 1160 H ILE 64 H ILE 64 -7.160 10.550 -2.742 1161 HA ILE 64 HA ILE 64 -4.481 11.720 -2.544 1162 HB ILE 64 HB ILE 64 -5.401 9.009 -3.604 1163 HG12 ILE 64 HG12 ILE 64 -4.197 9.761 -0.904 1164 HG13 ILE 64 HG13 ILE 64 -5.873 9.304 -1.189 1165 HG21 ILE 64 HG21 ILE 64 -3.036 8.302 -3.427 1166 HG22 ILE 64 HG22 ILE 64 -2.578 9.950 -2.991 1167 HG23 ILE 64 HG23 ILE 64 -3.235 9.615 -4.594 1168 HD11 ILE 64 HD11 ILE 64 -3.464 7.515 -1.531 1169 HD12 ILE 64 HD12 ILE 64 -5.143 7.053 -1.830 1170 HD13 ILE 64 HD13 ILE 64 -4.622 7.485 -0.202 1171 H PHE 65 H PHE 65 -3.622 12.907 -4.126 1172 HA PHE 65 HA PHE 65 -4.278 12.394 -6.983 1173 HB2 PHE 65 HB2 PHE 65 -5.154 14.611 -6.409 1174 HB3 PHE 65 HB3 PHE 65 -3.637 15.067 -5.642 1175 HD1 PHE 65 HD2 PHE 65 -5.118 14.149 -8.962 1176 HD2 PHE 65 HD1 PHE 65 -1.928 16.152 -6.930 1177 HE1 PHE 65 HE2 PHE 65 -4.297 15.031 -11.102 1178 HE2 PHE 65 HE1 PHE 65 -1.114 17.029 -9.083 1179 HZ PHE 65 HZ PHE 65 -2.296 16.465 -11.169 1180 H VAL 66 H VAL 66 -2.522 11.806 -8.193 1181 HA VAL 66 HA VAL 66 0.205 12.196 -7.078 1182 HB VAL 66 HB VAL 66 0.834 9.904 -7.574 1183 HG11 VAL 66 HG11 VAL 66 -1.794 9.905 -6.040 1184 HG12 VAL 66 HG12 VAL 66 -0.206 10.285 -5.374 1185 HG13 VAL 66 HG13 VAL 66 -0.546 8.657 -5.958 1186 HG21 VAL 66 HG21 VAL 66 -0.780 8.201 -8.398 1187 HG22 VAL 66 HG22 VAL 66 -0.496 9.476 -9.582 1188 HG23 VAL 66 HG23 VAL 66 -1.985 9.474 -8.636 1189 H LYS 67 H LYS 67 1.931 12.161 -8.585 1190 HA LYS 67 HA LYS 67 1.310 12.274 -11.487 1191 HB2 LYS 67 HB2 LYS 67 3.226 14.131 -9.985 1192 HB3 LYS 67 HB3 LYS 67 3.073 14.044 -11.736 1193 HG2 LYS 67 HG2 LYS 67 0.667 14.800 -11.457 1194 HG3 LYS 67 HG3 LYS 67 1.027 15.075 -9.751 1195 HD2 LYS 67 HD2 LYS 67 1.209 17.169 -11.060 1196 HD3 LYS 67 HD3 LYS 67 2.765 16.718 -10.361 1197 HE2 LYS 67 HE2 LYS 67 3.533 15.859 -12.521 1198 HE3 LYS 67 HE3 LYS 67 1.944 16.130 -13.234 1199 HZ1 LYS 67 HZ1 LYS 67 3.387 17.870 -13.896 1200 HZ2 LYS 67 HZ2 LYS 67 3.853 18.187 -12.299 1201 HZ3 LYS 67 HZ3 LYS 67 2.273 18.520 -12.799 1202 H LEU 68 H LEU 68 3.499 12.037 -12.769 1203 HA LEU 68 HA LEU 68 5.283 10.061 -11.557 1204 HB2 LEU 68 HB2 LEU 68 5.429 11.440 -14.275 1205 HB3 LEU 68 HB3 LEU 68 6.469 10.122 -13.750 1206 HG LEU 68 HG LEU 68 3.481 9.975 -14.335 1207 HD11 LEU 68 HD11 LEU 68 4.128 8.417 -16.109 1208 HD12 LEU 68 HD12 LEU 68 5.833 8.626 -15.701 1209 HD13 LEU 68 HD13 LEU 68 4.899 9.986 -16.333 1210 HD21 LEU 68 HD21 LEU 68 3.627 7.560 -13.829 1211 HD22 LEU 68 HD22 LEU 68 3.928 8.554 -12.408 1212 HD23 LEU 68 HD23 LEU 68 5.280 7.782 -13.243 1213 H VAL 69 H VAL 69 7.638 10.413 -11.388 1214 HA VAL 69 HA VAL 69 8.476 13.010 -10.492 1215 HB VAL 69 HB VAL 69 10.207 10.604 -11.249 1216 HG11 VAL 69 HG11 VAL 69 10.975 13.096 -9.667 1217 HG12 VAL 69 HG12 VAL 69 11.553 12.664 -11.278 1218 HG13 VAL 69 HG13 VAL 69 11.998 11.672 -9.890 1219 HG21 VAL 69 HG21 VAL 69 9.197 11.482 -8.512 1220 HG22 VAL 69 HG22 VAL 69 10.306 10.142 -8.814 1221 HG23 VAL 69 HG23 VAL 69 8.651 10.067 -9.417 1222 H LEU 70 H LEU 70 9.085 14.709 -11.702 1223 HA LEU 70 HA LEU 70 9.110 14.454 -14.617 1224 HB2 LEU 70 HB2 LEU 70 9.082 16.945 -12.872 1225 HB3 LEU 70 HB3 LEU 70 8.832 16.903 -14.613 1226 HG LEU 70 HG LEU 70 6.970 15.685 -12.525 1227 HD11 LEU 70 HD11 LEU 70 5.396 17.461 -13.129 1228 HD12 LEU 70 HD12 LEU 70 6.588 18.170 -14.221 1229 HD13 LEU 70 HD13 LEU 70 6.897 18.122 -12.484 1230 HD21 LEU 70 HD21 LEU 70 6.905 14.377 -14.593 1231 HD22 LEU 70 HD22 LEU 70 6.622 15.837 -15.544 1232 HD23 LEU 70 HD23 LEU 70 5.404 15.280 -14.391 1233 H GLU 71 H GLU 71 11.276 13.319 -14.283 1234 HA GLU 71 HA GLU 71 13.682 14.749 -13.745 1235 HB2 GLU 71 HB2 GLU 71 13.248 12.214 -15.386 1236 HB3 GLU 71 HB3 GLU 71 14.801 12.770 -14.765 1237 HG2 GLU 71 HG2 GLU 71 14.030 12.451 -12.468 1238 HG3 GLU 71 HG3 GLU 71 12.428 11.987 -13.045 1239 H HIS 72 H HIS 72 11.853 14.123 -16.717 1240 HA HIS 72 HA HIS 72 13.695 15.224 -18.607 1241 HB2 HIS 72 HB2 HIS 72 10.704 14.684 -18.716 1242 HB3 HIS 72 HB3 HIS 72 11.570 15.374 -20.082 1243 HD1 HIS 72 HD1 HIS 72 10.913 12.164 -18.358 1244 HD2 HIS 72 HD2 HIS 72 13.411 13.594 -21.348 1245 HE1 HIS 72 HE1 HIS 72 11.785 10.127 -19.523 1246 HE2 HIS 72 HE2 HIS 72 13.130 11.025 -21.449 1247 H HIS 73 H HIS 73 11.890 16.839 -16.227 1248 HA HIS 73 HA HIS 73 11.903 19.409 -17.729 1249 HB2 HIS 73 HB2 HIS 73 10.061 18.601 -15.430 1250 HB3 HIS 73 HB3 HIS 73 10.024 20.138 -16.298 1251 HD1 HIS 73 HD1 HIS 73 9.566 19.809 -19.005 1252 HD2 HIS 73 HD2 HIS 73 8.333 16.757 -16.469 1253 HE1 HIS 73 HE1 HIS 73 7.916 18.470 -20.323 1254 HE2 HIS 73 HE2 HIS 73 7.075 16.722 -18.729 1255 H HIS 74 H HIS 74 12.731 21.238 -16.725 1256 HA HIS 74 HA HIS 74 14.697 20.880 -14.664 1257 HB2 HIS 74 HB2 HIS 74 14.968 22.516 -16.555 1258 HB3 HIS 74 HB3 HIS 74 13.674 23.493 -15.876 1259 HD1 HIS 74 HD1 HIS 74 17.288 23.048 -15.786 1260 HD2 HIS 74 HD2 HIS 74 14.415 24.613 -13.218 1261 HE1 HIS 74 HE1 HIS 74 18.551 24.457 -14.139 1262 HE2 HIS 74 HE2 HIS 74 16.818 25.249 -12.500 1263 H HIS 75 H HIS 75 13.554 20.161 -12.847 1264 HA HIS 75 HA HIS 75 11.808 22.045 -11.407 1265 HB2 HIS 75 HB2 HIS 75 11.750 20.193 -9.659 1266 HB3 HIS 75 HB3 HIS 75 11.096 19.751 -11.229 1267 HD1 HIS 75 HD1 HIS 75 12.245 17.862 -12.506 1268 HD2 HIS 75 HD2 HIS 75 14.220 18.877 -8.988 1269 HE1 HIS 75 HE1 HIS 75 13.912 16.035 -12.123 1270 HE2 HIS 75 HE2 HIS 75 15.176 16.727 -10.066 1271 H HIS 76 H HIS 76 12.419 22.289 -8.953 1272 HA HIS 76 HA HIS 76 14.910 23.693 -8.815 1273 HB2 HIS 76 HB2 HIS 76 14.289 24.263 -6.528 1274 HB3 HIS 76 HB3 HIS 76 12.863 24.384 -7.547 1275 HD1 HIS 76 HD1 HIS 76 14.150 22.799 -4.522 1276 HD2 HIS 76 HD2 HIS 76 10.963 22.187 -7.122 1277 HE1 HIS 76 HE1 HIS 76 12.573 21.286 -3.298 1278 HE2 HIS 76 HE2 HIS 76 10.725 20.816 -4.932 1279 H HIS 77 H HIS 77 16.809 23.221 -7.736 1280 HA HIS 77 HA HIS 77 17.288 20.392 -6.962 1281 HB2 HIS 77 HB2 HIS 77 19.225 22.451 -8.109 1282 HB3 HIS 77 HB3 HIS 77 19.702 20.848 -7.561 1283 HD1 HIS 77 HD1 HIS 77 19.661 19.059 -9.297 1284 HD2 HIS 77 HD2 HIS 77 17.344 22.325 -10.397 1285 HE1 HIS 77 HE1 HIS 77 18.969 18.623 -11.672 1286 HE2 HIS 77 HE2 HIS 77 17.454 20.536 -12.260 Start of MODEL 13 1 H1 MET 1 H1 MET 1 12.050 17.345 4.431 2 H2 MET 1 H2 MET 1 12.218 18.872 5.139 3 H3 MET 1 H3 MET 1 10.767 18.022 5.300 4 HA MET 1 HA MET 1 13.386 17.178 6.392 5 HB2 MET 1 HB2 MET 1 10.961 18.366 7.806 6 HB3 MET 1 HB3 MET 1 12.353 17.680 8.638 7 HG2 MET 1 HG2 MET 1 13.796 19.402 7.593 8 HG3 MET 1 HG3 MET 1 12.373 20.110 6.828 9 HE1 MET 1 HE1 MET 1 10.157 19.846 9.175 10 HE2 MET 1 HE2 MET 1 10.388 21.300 8.202 11 HE3 MET 1 HE3 MET 1 10.355 21.412 9.961 12 H LYS 2 H LYS 2 9.869 16.656 7.059 13 HA LYS 2 HA LYS 2 10.380 13.742 7.236 14 HB2 LYS 2 HB2 LYS 2 9.282 14.857 9.195 15 HB3 LYS 2 HB3 LYS 2 7.937 15.316 8.155 16 HG2 LYS 2 HG2 LYS 2 7.503 12.864 7.739 17 HG3 LYS 2 HG3 LYS 2 8.772 12.491 8.905 18 HD2 LYS 2 HD2 LYS 2 6.628 12.309 10.019 19 HD3 LYS 2 HD3 LYS 2 7.471 13.723 10.657 20 HE2 LYS 2 HE2 LYS 2 6.108 15.185 9.182 21 HE3 LYS 2 HE3 LYS 2 5.262 13.762 8.566 22 HZ1 LYS 2 HZ1 LYS 2 4.478 13.325 10.817 23 HZ2 LYS 2 HZ2 LYS 2 3.984 14.847 10.268 24 HZ3 LYS 2 HZ3 LYS 2 5.258 14.723 11.370 25 H MET 3 H MET 3 10.317 13.053 5.132 26 HA MET 3 HA MET 3 8.440 13.837 3.140 27 HB2 MET 3 HB2 MET 3 10.099 11.284 3.314 28 HB3 MET 3 HB3 MET 3 9.304 11.891 1.867 29 HG2 MET 3 HG2 MET 3 10.781 13.817 1.807 30 HG3 MET 3 HG3 MET 3 11.524 13.343 3.336 31 HE1 MET 3 HE1 MET 3 11.786 10.161 3.004 32 HE2 MET 3 HE2 MET 3 13.100 11.171 3.613 33 HE3 MET 3 HE3 MET 3 13.397 10.026 2.305 34 H LEU 4 H LEU 4 6.787 12.443 2.118 35 HA LEU 4 HA LEU 4 5.032 11.054 3.881 36 HB2 LEU 4 HB2 LEU 4 5.166 10.985 0.843 37 HB3 LEU 4 HB3 LEU 4 3.832 10.363 1.806 38 HG LEU 4 HG LEU 4 4.677 13.284 1.566 39 HD11 LEU 4 HD11 LEU 4 2.156 11.901 0.602 40 HD12 LEU 4 HD12 LEU 4 3.492 12.457 -0.408 41 HD13 LEU 4 HD13 LEU 4 2.516 13.627 0.475 42 HD21 LEU 4 HD21 LEU 4 3.913 12.857 3.849 43 HD22 LEU 4 HD22 LEU 4 2.432 12.111 3.244 44 HD23 LEU 4 HD23 LEU 4 2.732 13.831 2.977 45 H LYS 5 H LYS 5 7.701 10.012 1.860 46 HA LYS 5 HA LYS 5 7.507 7.196 2.267 47 HB2 LYS 5 HB2 LYS 5 9.867 9.012 1.668 48 HB3 LYS 5 HB3 LYS 5 9.987 7.256 1.692 49 HG2 LYS 5 HG2 LYS 5 8.423 7.096 -0.194 50 HG3 LYS 5 HG3 LYS 5 8.206 8.851 -0.187 51 HD2 LYS 5 HD2 LYS 5 9.792 8.083 -1.957 52 HD3 LYS 5 HD3 LYS 5 10.537 9.194 -0.809 53 HE2 LYS 5 HE2 LYS 5 11.568 7.264 0.362 54 HE3 LYS 5 HE3 LYS 5 10.843 6.168 -0.813 55 HZ1 LYS 5 HZ1 LYS 5 13.163 6.685 -1.302 56 HZ2 LYS 5 HZ2 LYS 5 12.778 8.323 -1.469 57 HZ3 LYS 5 HZ3 LYS 5 12.131 7.188 -2.544 58 H GLU 6 H GLU 6 9.018 9.817 4.120 59 HA GLU 6 HA GLU 6 10.599 8.274 5.891 60 HB2 GLU 6 HB2 GLU 6 10.978 10.686 5.508 61 HB3 GLU 6 HB3 GLU 6 9.438 11.063 6.270 62 HG2 GLU 6 HG2 GLU 6 11.211 11.537 7.831 63 HG3 GLU 6 HG3 GLU 6 10.296 10.152 8.418 64 H LYS 7 H LYS 7 7.373 9.818 6.420 65 HA LYS 7 HA LYS 7 6.956 8.648 8.979 66 HB2 LYS 7 HB2 LYS 7 4.592 9.415 8.784 67 HB3 LYS 7 HB3 LYS 7 5.759 10.673 8.439 68 HG2 LYS 7 HG2 LYS 7 4.009 11.007 6.893 69 HG3 LYS 7 HG3 LYS 7 5.307 10.260 5.958 70 HD2 LYS 7 HD2 LYS 7 4.163 8.126 5.951 71 HD3 LYS 7 HD3 LYS 7 2.963 8.697 7.111 72 HE2 LYS 7 HE2 LYS 7 3.299 9.847 4.322 73 HE3 LYS 7 HE3 LYS 7 2.153 8.571 4.730 74 HZ1 LYS 7 HZ1 LYS 7 1.120 10.750 4.726 75 HZ2 LYS 7 HZ2 LYS 7 2.190 11.283 5.922 76 HZ3 LYS 7 HZ3 LYS 7 1.075 10.062 6.270 77 H ALA 8 H ALA 8 6.205 7.498 5.715 78 HA ALA 8 HA ALA 8 4.632 5.235 6.372 79 HB1 ALA 8 HB1 ALA 8 4.854 6.095 4.071 80 HB2 ALA 8 HB2 ALA 8 5.252 4.378 4.146 81 HB3 ALA 8 HB3 ALA 8 6.541 5.581 4.030 82 H GLY 9 H GLY 9 8.150 5.674 6.154 83 HA2 GLY 9 HA2 GLY 9 8.942 3.027 6.836 84 HA3 GLY 9 HA3 GLY 9 9.924 4.477 6.967 85 H ALA 10 H ALA 10 8.127 5.861 8.793 86 HA ALA 10 HA ALA 10 9.052 4.925 11.317 87 HB1 ALA 10 HB1 ALA 10 6.862 6.938 10.703 88 HB2 ALA 10 HB2 ALA 10 8.577 7.299 10.884 89 HB3 ALA 10 HB3 ALA 10 7.654 6.718 12.270 90 H LEU 11 H LEU 11 5.903 4.735 9.685 91 HA LEU 11 HA LEU 11 4.537 3.299 11.781 92 HB2 LEU 11 HB2 LEU 11 3.776 3.596 8.850 93 HB3 LEU 11 HB3 LEU 11 2.701 3.118 10.161 94 HG LEU 11 HG LEU 11 3.998 5.854 9.828 95 HD11 LEU 11 HD11 LEU 11 1.756 6.684 9.367 96 HD12 LEU 11 HD12 LEU 11 1.113 5.042 9.466 97 HD13 LEU 11 HD13 LEU 11 2.253 5.471 8.189 98 HD21 LEU 11 HD21 LEU 11 2.626 6.593 11.723 99 HD22 LEU 11 HD22 LEU 11 3.754 5.329 12.201 100 HD23 LEU 11 HD23 LEU 11 2.050 4.943 11.966 101 H ALA 12 H ALA 12 6.306 2.469 8.865 102 HA ALA 12 HA ALA 12 5.768 -0.238 8.546 103 HB1 ALA 12 HB1 ALA 12 8.420 1.170 8.074 104 HB2 ALA 12 HB2 ALA 12 7.075 1.081 6.936 105 HB3 ALA 12 HB3 ALA 12 7.934 -0.391 7.394 106 H GLY 13 H GLY 13 8.495 1.173 10.371 107 HA2 GLY 13 HA2 GLY 13 9.622 -1.107 11.475 108 HA3 GLY 13 HA3 GLY 13 9.662 0.477 12.231 109 H GLN 14 H GLN 14 6.755 0.604 12.576 110 HA GLN 14 HA GLN 14 6.522 -0.682 15.136 111 HB2 GLN 14 HB2 GLN 14 4.470 0.886 13.520 112 HB3 GLN 14 HB3 GLN 14 4.274 0.399 15.204 113 HG2 GLN 14 HG2 GLN 14 6.233 1.783 15.824 114 HG3 GLN 14 HG3 GLN 14 6.408 2.283 14.140 115 HE21 GLN 14 HE21 GLN 14 4.974 3.798 13.302 116 HE22 GLN 14 HE22 GLN 14 3.892 4.705 14.288 117 H ILE 15 H ILE 15 4.828 -1.110 11.985 118 HA ILE 15 HA ILE 15 3.184 -3.297 12.774 119 HB ILE 15 HB ILE 15 4.165 -2.605 9.961 120 HG12 ILE 15 HG12 ILE 15 1.601 -1.803 11.418 121 HG13 ILE 15 HG13 ILE 15 2.925 -0.726 10.990 122 HG21 ILE 15 HG21 ILE 15 2.220 -3.905 9.133 123 HG22 ILE 15 HG22 ILE 15 1.822 -4.369 10.785 124 HG23 ILE 15 HG23 ILE 15 3.327 -4.927 10.055 125 HD11 ILE 15 HD11 ILE 15 2.416 -1.139 8.595 126 HD12 ILE 15 HD12 ILE 15 1.087 -0.400 9.484 127 HD13 ILE 15 HD13 ILE 15 1.033 -2.118 9.093 128 H TRP 16 H TRP 16 6.363 -3.173 11.204 129 HA TRP 16 HA TRP 16 6.978 -5.842 10.799 130 HB2 TRP 16 HB2 TRP 16 8.375 -3.909 10.023 131 HB3 TRP 16 HB3 TRP 16 8.880 -3.611 11.685 132 HD1 TRP 16 HD1 TRP 16 9.524 -5.936 8.720 133 HE1 TRP 16 HE1 TRP 16 11.589 -7.383 9.202 134 HE3 TRP 16 HE3 TRP 16 10.312 -4.655 13.619 135 HZ2 TRP 16 HZ2 TRP 16 13.315 -7.937 11.364 136 HZ3 TRP 16 HZ3 TRP 16 12.185 -5.697 14.827 137 HH2 TRP 16 HH2 TRP 16 13.654 -7.307 13.723 138 H GLU 17 H GLU 17 7.603 -3.851 13.671 139 HA GLU 17 HA GLU 17 8.816 -5.881 15.253 140 HB2 GLU 17 HB2 GLU 17 9.094 -3.365 15.544 141 HB3 GLU 17 HB3 GLU 17 7.510 -3.345 16.312 142 HG2 GLU 17 HG2 GLU 17 8.362 -4.900 18.052 143 HG3 GLU 17 HG3 GLU 17 9.944 -4.870 17.280 144 H ALA 18 H ALA 18 5.461 -4.862 14.865 145 HA ALA 18 HA ALA 18 4.309 -6.363 17.006 146 HB1 ALA 18 HB1 ALA 18 3.040 -5.475 14.389 147 HB2 ALA 18 HB2 ALA 18 3.112 -4.526 15.873 148 HB3 ALA 18 HB3 ALA 18 2.171 -6.016 15.831 149 H LEU 19 H LEU 19 5.109 -7.149 13.642 150 HA LEU 19 HA LEU 19 4.016 -9.842 13.697 151 HB2 LEU 19 HB2 LEU 19 5.903 -8.543 11.691 152 HB3 LEU 19 HB3 LEU 19 5.027 -10.049 11.451 153 HG LEU 19 HG LEU 19 3.764 -7.292 11.715 154 HD11 LEU 19 HD11 LEU 19 4.981 -7.552 9.609 155 HD12 LEU 19 HD12 LEU 19 3.242 -7.486 9.338 156 HD13 LEU 19 HD13 LEU 19 4.086 -9.034 9.255 157 HD21 LEU 19 HD21 LEU 19 2.278 -9.015 12.615 158 HD22 LEU 19 HD22 LEU 19 2.440 -9.964 11.134 159 HD23 LEU 19 HD23 LEU 19 1.646 -8.387 11.094 160 H ASN 20 H ASN 20 7.071 -8.341 14.442 161 HA ASN 20 HA ASN 20 8.853 -10.496 14.113 162 HB2 ASN 20 HB2 ASN 20 9.555 -8.129 14.370 163 HB3 ASN 20 HB3 ASN 20 9.032 -8.142 16.048 164 HD21 ASN 20 HD21 ASN 20 11.052 -7.688 16.887 165 HD22 ASN 20 HD22 ASN 20 12.373 -8.797 16.822 166 H GLY 21 H GLY 21 9.005 -12.366 15.179 167 HA2 GLY 21 HA2 GLY 21 9.161 -13.751 17.112 168 HA3 GLY 21 HA3 GLY 21 8.119 -12.648 17.994 169 H THR 22 H THR 22 6.130 -12.491 15.792 170 HA THR 22 HA THR 22 4.576 -14.863 16.576 171 HB THR 22 HB THR 22 2.598 -13.698 15.830 172 HG1 THR 22 HG1 THR 22 4.330 -11.767 14.654 173 HG21 THR 22 HG21 THR 22 4.436 -11.662 17.142 174 HG22 THR 22 HG22 THR 22 3.462 -12.868 17.985 175 HG23 THR 22 HG23 THR 22 2.670 -11.571 17.088 176 H GLU 23 H GLU 23 3.002 -15.778 14.922 177 HA GLU 23 HA GLU 23 4.339 -16.477 12.409 178 HB2 GLU 23 HB2 GLU 23 1.713 -17.496 13.572 179 HB3 GLU 23 HB3 GLU 23 2.525 -18.138 12.146 180 HG2 GLU 23 HG2 GLU 23 4.472 -18.735 13.645 181 HG3 GLU 23 HG3 GLU 23 3.469 -18.282 15.023 182 H GLY 24 H GLY 24 2.500 -13.903 13.267 183 HA2 GLY 24 HA2 GLY 24 1.926 -12.415 11.384 184 HA3 GLY 24 HA3 GLY 24 1.040 -13.757 10.680 185 H LEU 25 H LEU 25 0.203 -11.046 11.424 186 HA LEU 25 HA LEU 25 -2.162 -11.740 13.083 187 HB2 LEU 25 HB2 LEU 25 -0.715 -9.053 12.955 188 HB3 LEU 25 HB3 LEU 25 -2.275 -9.295 13.715 189 HG LEU 25 HG LEU 25 -1.066 -10.923 15.325 190 HD11 LEU 25 HD11 LEU 25 1.407 -9.539 14.253 191 HD12 LEU 25 HD12 LEU 25 1.014 -11.251 14.082 192 HD13 LEU 25 HD13 LEU 25 1.332 -10.581 15.678 193 HD21 LEU 25 HD21 LEU 25 -0.321 -9.097 16.800 194 HD22 LEU 25 HD22 LEU 25 -1.853 -8.707 16.023 195 HD23 LEU 25 HD23 LEU 25 -0.359 -7.974 15.438 196 H THR 26 H THR 26 -4.148 -10.589 12.461 197 HA THR 26 HA THR 26 -4.333 -9.913 9.604 198 HB THR 26 HB THR 26 -6.782 -9.808 9.936 199 HG1 THR 26 HG1 THR 26 -7.647 -9.691 11.864 200 HG21 THR 26 HG21 THR 26 -7.227 -12.157 10.508 201 HG22 THR 26 HG22 THR 26 -5.610 -12.314 11.197 202 HG23 THR 26 HG23 THR 26 -5.808 -12.028 9.466 203 H GLN 27 H GLN 27 -5.889 -7.960 9.141 204 HA GLN 27 HA GLN 27 -4.522 -5.619 9.641 205 HB2 GLN 27 HB2 GLN 27 -6.044 -5.833 7.757 206 HB3 GLN 27 HB3 GLN 27 -7.432 -5.986 8.827 207 HG2 GLN 27 HG2 GLN 27 -7.209 -3.662 9.528 208 HG3 GLN 27 HG3 GLN 27 -5.714 -3.495 8.609 209 HE21 GLN 27 HE21 GLN 27 -6.550 -1.765 7.422 210 HE22 GLN 27 HE22 GLN 27 -7.745 -1.976 6.197 211 H LYS 28 H LYS 28 -7.543 -6.651 11.285 212 HA LYS 28 HA LYS 28 -7.757 -4.302 12.901 213 HB2 LYS 28 HB2 LYS 28 -9.718 -5.646 12.273 214 HB3 LYS 28 HB3 LYS 28 -9.114 -7.003 13.215 215 HG2 LYS 28 HG2 LYS 28 -9.476 -5.834 15.292 216 HG3 LYS 28 HG3 LYS 28 -9.813 -4.320 14.452 217 HD2 LYS 28 HD2 LYS 28 -11.884 -5.398 15.309 218 HD3 LYS 28 HD3 LYS 28 -11.902 -5.230 13.553 219 HE2 LYS 28 HE2 LYS 28 -12.784 -7.421 14.282 220 HE3 LYS 28 HE3 LYS 28 -11.335 -7.602 13.296 221 HZ1 LYS 28 HZ1 LYS 28 -11.431 -7.743 16.259 222 HZ2 LYS 28 HZ2 LYS 28 -10.050 -7.955 15.304 223 HZ3 LYS 28 HZ3 LYS 28 -11.325 -9.062 15.212 224 H GLN 29 H GLN 29 -6.186 -7.427 13.473 225 HA GLN 29 HA GLN 29 -5.632 -7.089 16.254 226 HB2 GLN 29 HB2 GLN 29 -4.244 -8.737 14.107 227 HB3 GLN 29 HB3 GLN 29 -3.757 -8.775 15.800 228 HG2 GLN 29 HG2 GLN 29 -5.987 -9.606 16.431 229 HG3 GLN 29 HG3 GLN 29 -6.489 -9.558 14.742 230 HE21 GLN 29 HE21 GLN 29 -5.757 -11.159 13.341 231 HE22 GLN 29 HE22 GLN 29 -4.944 -12.578 13.884 232 H ILE 30 H ILE 30 -3.750 -6.294 13.329 233 HA ILE 30 HA ILE 30 -1.498 -5.151 14.668 234 HB ILE 30 HB ILE 30 -2.458 -4.685 11.809 235 HG12 ILE 30 HG12 ILE 30 -0.385 -6.667 12.846 236 HG13 ILE 30 HG13 ILE 30 -2.033 -7.094 12.408 237 HG21 ILE 30 HG21 ILE 30 -0.838 -2.947 12.490 238 HG22 ILE 30 HG22 ILE 30 -0.117 -4.035 11.304 239 HG23 ILE 30 HG23 ILE 30 0.299 -4.195 13.012 240 HD11 ILE 30 HD11 ILE 30 0.074 -6.026 10.536 241 HD12 ILE 30 HD12 ILE 30 -1.581 -6.455 10.094 242 HD13 ILE 30 HD13 ILE 30 -0.472 -7.698 10.671 243 H LYS 31 H LYS 31 -4.556 -3.803 13.488 244 HA LYS 31 HA LYS 31 -4.186 -1.064 13.771 245 HB2 LYS 31 HB2 LYS 31 -6.599 -2.841 14.201 246 HB3 LYS 31 HB3 LYS 31 -6.724 -1.121 14.540 247 HG2 LYS 31 HG2 LYS 31 -5.885 -2.249 11.848 248 HG3 LYS 31 HG3 LYS 31 -7.546 -1.815 12.269 249 HD2 LYS 31 HD2 LYS 31 -6.630 0.521 12.817 250 HD3 LYS 31 HD3 LYS 31 -5.138 0.016 12.022 251 HE2 LYS 31 HE2 LYS 31 -6.290 -0.248 9.908 252 HE3 LYS 31 HE3 LYS 31 -7.861 -0.004 10.677 253 HZ1 LYS 31 HZ1 LYS 31 -5.705 2.017 10.437 254 HZ2 LYS 31 HZ2 LYS 31 -7.169 2.246 11.254 255 HZ3 LYS 31 HZ3 LYS 31 -7.165 1.991 9.582 256 H LYS 32 H LYS 32 -4.967 -3.435 16.312 257 HA LYS 32 HA LYS 32 -5.133 -1.571 18.470 258 HB2 LYS 32 HB2 LYS 32 -6.166 -3.835 18.557 259 HB3 LYS 32 HB3 LYS 32 -4.568 -4.567 18.546 260 HG2 LYS 32 HG2 LYS 32 -5.528 -4.570 20.804 261 HG3 LYS 32 HG3 LYS 32 -4.068 -3.582 20.740 262 HD2 LYS 32 HD2 LYS 32 -5.784 -2.469 22.090 263 HD3 LYS 32 HD3 LYS 32 -5.460 -1.530 20.632 264 HE2 LYS 32 HE2 LYS 32 -7.867 -1.612 21.105 265 HE3 LYS 32 HE3 LYS 32 -7.509 -2.444 19.592 266 HZ1 LYS 32 HZ1 LYS 32 -7.615 -4.553 20.810 267 HZ2 LYS 32 HZ2 LYS 32 -9.073 -3.704 20.895 268 HZ3 LYS 32 HZ3 LYS 32 -8.026 -3.722 22.224 269 H ALA 33 H ALA 33 -2.507 -3.699 17.310 270 HA ALA 33 HA ALA 33 -0.641 -3.214 19.380 271 HB1 ALA 33 HB1 ALA 33 0.995 -4.296 17.888 272 HB2 ALA 33 HB2 ALA 33 -0.120 -4.122 16.530 273 HB3 ALA 33 HB3 ALA 33 -0.541 -5.166 17.887 274 H THR 34 H THR 34 -1.006 -1.658 16.205 275 HA THR 34 HA THR 34 1.283 0.146 16.666 276 HB THR 34 HB THR 34 1.147 0.662 14.256 277 HG1 THR 34 HG1 THR 34 -0.704 -1.321 13.673 278 HG21 THR 34 HG21 THR 34 2.484 -1.302 14.940 279 HG22 THR 34 HG22 THR 34 1.747 -1.559 13.359 280 HG23 THR 34 HG23 THR 34 1.060 -2.334 14.786 281 H LYS 35 H LYS 35 -2.149 0.197 16.726 282 HA LYS 35 HA LYS 35 -3.674 1.762 17.284 283 HB2 LYS 35 HB2 LYS 35 -1.271 3.477 18.016 284 HB3 LYS 35 HB3 LYS 35 -2.938 3.825 18.475 285 HG2 LYS 35 HG2 LYS 35 -3.022 1.762 19.816 286 HG3 LYS 35 HG3 LYS 35 -1.370 1.362 19.335 287 HD2 LYS 35 HD2 LYS 35 -2.210 3.808 20.946 288 HD3 LYS 35 HD3 LYS 35 -1.456 2.356 21.608 289 HE2 LYS 35 HE2 LYS 35 0.594 2.804 20.358 290 HE3 LYS 35 HE3 LYS 35 -0.160 4.173 19.543 291 HZ1 LYS 35 HZ1 LYS 35 1.220 4.955 21.295 292 HZ2 LYS 35 HZ2 LYS 35 0.467 3.960 22.430 293 HZ3 LYS 35 HZ3 LYS 35 -0.389 5.239 21.732 294 H LEU 36 H LEU 36 -2.760 1.621 14.545 295 HA LEU 36 HA LEU 36 -2.634 4.290 13.428 296 HB2 LEU 36 HB2 LEU 36 -3.024 1.588 12.081 297 HB3 LEU 36 HB3 LEU 36 -2.805 3.104 11.213 298 HG LEU 36 HG LEU 36 -0.756 1.785 13.042 299 HD11 LEU 36 HD11 LEU 36 0.563 1.460 10.989 300 HD12 LEU 36 HD12 LEU 36 -0.776 2.102 10.030 301 HD13 LEU 36 HD13 LEU 36 -0.976 0.599 10.935 302 HD21 LEU 36 HD21 LEU 36 0.800 3.558 12.327 303 HD22 LEU 36 HD22 LEU 36 -0.572 4.215 13.213 304 HD23 LEU 36 HD23 LEU 36 -0.508 4.363 11.454 305 H LYS 37 H LYS 37 -4.319 5.588 13.114 306 HA LYS 37 HA LYS 37 -6.994 4.801 13.717 307 HB2 LYS 37 HB2 LYS 37 -5.968 7.406 12.520 308 HB3 LYS 37 HB3 LYS 37 -7.575 7.157 13.202 309 HG2 LYS 37 HG2 LYS 37 -6.571 6.727 15.420 310 HG3 LYS 37 HG3 LYS 37 -4.959 6.964 14.738 311 HD2 LYS 37 HD2 LYS 37 -5.696 8.986 15.920 312 HD3 LYS 37 HD3 LYS 37 -5.531 9.314 14.194 313 HE2 LYS 37 HE2 LYS 37 -7.565 10.359 15.091 314 HE3 LYS 37 HE3 LYS 37 -7.989 9.103 13.928 315 HZ1 LYS 37 HZ1 LYS 37 -8.014 8.805 16.882 316 HZ2 LYS 37 HZ2 LYS 37 -8.453 7.613 15.767 317 HZ3 LYS 37 HZ3 LYS 37 -9.373 9.022 15.904 318 H ALA 38 H ALA 38 -5.466 5.882 10.667 319 HA ALA 38 HA ALA 38 -7.919 5.263 9.147 320 HB1 ALA 38 HB1 ALA 38 -5.416 6.724 8.235 321 HB2 ALA 38 HB2 ALA 38 -6.892 7.490 8.816 322 HB3 ALA 38 HB3 ALA 38 -6.919 6.552 7.323 323 H ASP 39 H ASP 39 -7.858 4.048 7.248 324 HA ASP 39 HA ASP 39 -6.495 1.597 7.267 325 HB2 ASP 39 HB2 ASP 39 -7.556 1.241 5.061 326 HB3 ASP 39 HB3 ASP 39 -8.697 1.952 6.192 327 H LYS 40 H LYS 40 -5.836 4.605 5.626 328 HA LYS 40 HA LYS 40 -4.049 3.896 3.602 329 HB2 LYS 40 HB2 LYS 40 -4.065 6.476 5.229 330 HB3 LYS 40 HB3 LYS 40 -3.438 6.280 3.594 331 HG2 LYS 40 HG2 LYS 40 -6.344 5.755 4.262 332 HG3 LYS 40 HG3 LYS 40 -5.750 7.384 3.890 333 HD2 LYS 40 HD2 LYS 40 -4.954 6.509 1.671 334 HD3 LYS 40 HD3 LYS 40 -5.677 4.945 2.073 335 HE2 LYS 40 HE2 LYS 40 -7.221 7.562 1.904 336 HE3 LYS 40 HE3 LYS 40 -7.131 6.364 0.614 337 HZ1 LYS 40 HZ1 LYS 40 -9.148 6.072 1.860 338 HZ2 LYS 40 HZ2 LYS 40 -8.292 5.948 3.316 339 HZ3 LYS 40 HZ3 LYS 40 -8.135 4.742 2.144 340 H ASP 41 H ASP 41 -3.314 5.089 6.870 341 HA ASP 41 HA ASP 41 -0.534 5.016 6.894 342 HB2 ASP 41 HB2 ASP 41 -2.453 4.487 9.205 343 HB3 ASP 41 HB3 ASP 41 -0.747 4.899 9.384 344 H PHE 42 H PHE 42 -2.810 2.393 7.553 345 HA PHE 42 HA PHE 42 -0.963 0.404 8.354 346 HB2 PHE 42 HB2 PHE 42 -3.361 0.226 8.826 347 HB3 PHE 42 HB3 PHE 42 -3.730 0.165 7.109 348 HD1 PHE 42 HD1 PHE 42 -1.634 -1.684 9.629 349 HD2 PHE 42 HD2 PHE 42 -4.184 -1.958 6.203 350 HE1 PHE 42 HE1 PHE 42 -1.509 -4.133 9.723 351 HE2 PHE 42 HE2 PHE 42 -4.051 -4.414 6.311 352 HZ PHE 42 HZ PHE 42 -2.713 -5.503 8.073 353 H PHE 43 H PHE 43 -2.345 1.170 5.140 354 HA PHE 43 HA PHE 43 -1.074 -0.964 3.718 355 HB2 PHE 43 HB2 PHE 43 -2.137 1.641 2.558 356 HB3 PHE 43 HB3 PHE 43 -1.824 0.155 1.662 357 HD1 PHE 43 HD2 PHE 43 -3.049 -1.944 3.303 358 HD2 PHE 43 HD1 PHE 43 -4.432 2.017 2.495 359 HE1 PHE 43 HE2 PHE 43 -5.365 -2.652 3.734 360 HE2 PHE 43 HE1 PHE 43 -6.728 1.309 2.930 361 HZ PHE 43 HZ PHE 43 -7.208 -1.034 3.544 362 H LEU 44 H LEU 44 -0.146 2.442 4.202 363 HA LEU 44 HA LEU 44 2.209 2.369 2.557 364 HB2 LEU 44 HB2 LEU 44 1.101 4.321 4.585 365 HB3 LEU 44 HB3 LEU 44 2.762 4.503 4.051 366 HG LEU 44 HG LEU 44 1.975 4.739 1.693 367 HD11 LEU 44 HD11 LEU 44 -0.380 5.130 1.160 368 HD12 LEU 44 HD12 LEU 44 -0.838 4.737 2.817 369 HD13 LEU 44 HD13 LEU 44 -0.129 3.498 1.781 370 HD21 LEU 44 HD21 LEU 44 2.416 6.734 3.045 371 HD22 LEU 44 HD22 LEU 44 0.742 6.744 3.605 372 HD23 LEU 44 HD23 LEU 44 1.104 7.019 1.900 373 H GLY 45 H GLY 45 1.532 1.706 5.958 374 HA2 GLY 45 HA2 GLY 45 4.194 1.440 6.914 375 HA3 GLY 45 HA3 GLY 45 2.762 0.711 7.624 376 H LEU 46 H LEU 46 1.860 -1.186 6.130 377 HA LEU 46 HA LEU 46 3.860 -3.239 6.164 378 HB2 LEU 46 HB2 LEU 46 2.142 -4.787 5.817 379 HB3 LEU 46 HB3 LEU 46 1.321 -3.473 6.622 380 HG LEU 46 HG LEU 46 0.761 -2.765 4.061 381 HD11 LEU 46 HD11 LEU 46 1.976 -4.600 3.007 382 HD12 LEU 46 HD12 LEU 46 0.252 -4.702 2.660 383 HD13 LEU 46 HD13 LEU 46 0.978 -5.782 3.856 384 HD21 LEU 46 HD21 LEU 46 -0.903 -3.118 5.814 385 HD22 LEU 46 HD22 LEU 46 -0.811 -4.864 5.574 386 HD23 LEU 46 HD23 LEU 46 -1.421 -3.823 4.284 387 H GLY 47 H GLY 47 2.626 -1.134 3.680 388 HA2 GLY 47 HA2 GLY 47 3.495 -2.516 1.349 389 HA3 GLY 47 HA3 GLY 47 3.185 -0.789 1.484 390 H TRP 48 H TRP 48 5.111 -0.327 3.603 391 HA TRP 48 HA TRP 48 7.592 -0.191 2.147 392 HB2 TRP 48 HB2 TRP 48 6.694 1.478 3.930 393 HB3 TRP 48 HB3 TRP 48 7.296 0.333 5.124 394 HD1 TRP 48 HD1 TRP 48 10.027 0.041 5.256 395 HE1 TRP 48 HE1 TRP 48 11.928 1.594 4.486 396 HE3 TRP 48 HE3 TRP 48 7.349 3.142 2.202 397 HZ2 TRP 48 HZ2 TRP 48 12.246 3.854 2.807 398 HZ3 TRP 48 HZ3 TRP 48 8.522 4.969 1.044 399 HH2 TRP 48 HH2 TRP 48 10.924 5.313 1.346 400 H LEU 49 H LEU 49 6.239 -2.303 4.635 401 HA LEU 49 HA LEU 49 8.513 -3.941 5.109 402 HB2 LEU 49 HB2 LEU 49 5.538 -4.348 5.386 403 HB3 LEU 49 HB3 LEU 49 6.592 -5.731 5.551 404 HG LEU 49 HG LEU 49 7.634 -4.841 7.515 405 HD11 LEU 49 HD11 LEU 49 7.101 -2.679 8.481 406 HD12 LEU 49 HD12 LEU 49 6.101 -2.291 7.076 407 HD13 LEU 49 HD13 LEU 49 7.842 -2.522 6.891 408 HD21 LEU 49 HD21 LEU 49 5.457 -5.929 7.879 409 HD22 LEU 49 HD22 LEU 49 4.643 -4.372 7.720 410 HD23 LEU 49 HD23 LEU 49 5.744 -4.661 9.069 411 H LEU 50 H LEU 50 6.033 -4.016 2.563 412 HA LEU 50 HA LEU 50 7.034 -6.351 1.217 413 HB2 LEU 50 HB2 LEU 50 5.212 -4.099 0.289 414 HB3 LEU 50 HB3 LEU 50 5.616 -5.478 -0.724 415 HG LEU 50 HG LEU 50 4.109 -5.615 1.923 416 HD11 LEU 50 HD11 LEU 50 2.142 -6.213 0.575 417 HD12 LEU 50 HD12 LEU 50 3.062 -5.945 -0.909 418 HD13 LEU 50 HD13 LEU 50 2.735 -4.599 0.185 419 HD21 LEU 50 HD21 LEU 50 5.442 -7.635 1.570 420 HD22 LEU 50 HD22 LEU 50 4.754 -7.841 -0.044 421 HD23 LEU 50 HD23 LEU 50 3.726 -7.985 1.382 422 H ARG 51 H ARG 51 7.687 -2.883 1.058 423 HA ARG 51 HA ARG 51 8.899 -2.713 -1.459 424 HB2 ARG 51 HB2 ARG 51 9.204 -0.482 -1.022 425 HB3 ARG 51 HB3 ARG 51 8.131 -0.837 0.307 426 HG2 ARG 51 HG2 ARG 51 9.658 0.228 1.586 427 HG3 ARG 51 HG3 ARG 51 10.583 -1.263 1.484 428 HD2 ARG 51 HD2 ARG 51 12.100 0.494 0.964 429 HD3 ARG 51 HD3 ARG 51 11.715 -0.273 -0.584 430 HE ARG 51 HE ARG 51 10.091 2.015 0.132 431 HH11 ARG 51 HH11 ARG 51 12.837 0.933 -1.698 432 HH12 ARG 51 HH12 ARG 51 12.895 2.402 -2.612 433 HH21 ARG 51 HH21 ARG 51 10.222 3.825 -1.030 434 HH22 ARG 51 HH22 ARG 51 11.430 3.991 -2.248 435 H GLU 52 H GLU 52 10.424 -3.384 1.674 436 HA GLU 52 HA GLU 52 13.020 -3.957 0.367 437 HB2 GLU 52 HB2 GLU 52 12.296 -3.497 3.284 438 HB3 GLU 52 HB3 GLU 52 13.906 -3.971 2.745 439 HG2 GLU 52 HG2 GLU 52 14.126 -1.899 1.466 440 HG3 GLU 52 HG3 GLU 52 12.482 -1.431 1.899 441 H ASP 53 H ASP 53 10.329 -5.656 0.983 442 HA ASP 53 HA ASP 53 9.772 -7.820 1.110 443 HB2 ASP 53 HB2 ASP 53 12.687 -8.267 0.355 444 HB3 ASP 53 HB3 ASP 53 11.447 -9.519 0.318 445 H LYS 54 H LYS 54 10.381 -6.515 3.481 446 HA LYS 54 HA LYS 54 11.750 -8.134 5.389 447 HB2 LYS 54 HB2 LYS 54 9.495 -6.125 5.843 448 HB3 LYS 54 HB3 LYS 54 10.636 -6.700 7.057 449 HG2 LYS 54 HG2 LYS 54 12.472 -5.547 5.915 450 HG3 LYS 54 HG3 LYS 54 11.377 -5.032 4.625 451 HD2 LYS 54 HD2 LYS 54 10.061 -3.723 6.299 452 HD3 LYS 54 HD3 LYS 54 11.193 -4.224 7.559 453 HE2 LYS 54 HE2 LYS 54 11.895 -2.552 5.119 454 HE3 LYS 54 HE3 LYS 54 11.676 -1.944 6.760 455 HZ1 LYS 54 HZ1 LYS 54 13.763 -3.890 5.922 456 HZ2 LYS 54 HZ2 LYS 54 13.557 -3.268 7.479 457 HZ3 LYS 54 HZ3 LYS 54 14.013 -2.242 6.213 458 H VAL 55 H VAL 55 8.604 -8.348 3.885 459 HA VAL 55 HA VAL 55 7.709 -10.398 5.805 460 HB VAL 55 HB VAL 55 5.415 -9.555 5.878 461 HG11 VAL 55 HG11 VAL 55 6.911 -8.838 7.663 462 HG12 VAL 55 HG12 VAL 55 5.732 -7.576 7.303 463 HG13 VAL 55 HG13 VAL 55 7.393 -7.420 6.726 464 HG21 VAL 55 HG21 VAL 55 5.261 -8.440 3.701 465 HG22 VAL 55 HG22 VAL 55 6.374 -7.181 4.234 466 HG23 VAL 55 HG23 VAL 55 4.785 -7.324 4.985 467 H VAL 56 H VAL 56 5.935 -11.641 5.101 468 HA VAL 56 HA VAL 56 5.279 -11.728 2.260 469 HB VAL 56 HB VAL 56 6.755 -13.622 2.691 470 HG11 VAL 56 HG11 VAL 56 4.863 -14.469 4.905 471 HG12 VAL 56 HG12 VAL 56 6.503 -13.851 5.112 472 HG13 VAL 56 HG13 VAL 56 6.241 -15.408 4.322 473 HG21 VAL 56 HG21 VAL 56 5.318 -15.497 1.944 474 HG22 VAL 56 HG22 VAL 56 4.922 -14.006 1.087 475 HG23 VAL 56 HG23 VAL 56 3.882 -14.574 2.394 476 H THR 57 H THR 57 3.114 -12.072 1.783 477 HA THR 57 HA THR 57 1.280 -11.443 4.019 478 HB THR 57 HB THR 57 -0.233 -10.567 2.234 479 HG1 THR 57 HG1 THR 57 1.009 -10.353 0.093 480 HG21 THR 57 HG21 THR 57 1.115 -8.615 1.535 481 HG22 THR 57 HG22 THR 57 2.593 -9.454 2.007 482 HG23 THR 57 HG23 THR 57 1.409 -8.997 3.231 483 H SER 58 H SER 58 -0.984 -12.266 3.752 484 HA SER 58 HA SER 58 -1.584 -14.480 2.000 485 HB2 SER 58 HB2 SER 58 -0.437 -15.724 3.836 486 HB3 SER 58 HB3 SER 58 -1.537 -15.014 5.015 487 HG SER 58 HG SER 58 -2.765 -16.669 4.589 488 H GLU 59 H GLU 59 -3.858 -15.216 2.337 489 HA GLU 59 HA GLU 59 -5.611 -13.008 3.261 490 HB2 GLU 59 HB2 GLU 59 -5.771 -13.365 0.866 491 HB3 GLU 59 HB3 GLU 59 -5.957 -15.098 1.065 492 HG2 GLU 59 HG2 GLU 59 -8.055 -13.294 2.255 493 HG3 GLU 59 HG3 GLU 59 -8.023 -13.486 0.506 494 H VAL 60 H VAL 60 -6.531 -13.466 5.222 495 HA VAL 60 HA VAL 60 -7.688 -16.182 5.627 496 HB VAL 60 HB VAL 60 -6.733 -14.172 7.723 497 HG11 VAL 60 HG11 VAL 60 -8.268 -16.758 8.224 498 HG12 VAL 60 HG12 VAL 60 -8.847 -15.122 8.546 499 HG13 VAL 60 HG13 VAL 60 -7.494 -15.775 9.469 500 HG21 VAL 60 HG21 VAL 60 -4.951 -15.577 6.762 501 HG22 VAL 60 HG22 VAL 60 -5.864 -17.032 7.169 502 HG23 VAL 60 HG23 VAL 60 -5.236 -15.998 8.454 503 H GLU 61 H GLU 61 -9.752 -16.107 5.062 504 HA GLU 61 HA GLU 61 -11.972 -15.689 5.071 505 HB2 GLU 61 HB2 GLU 61 -11.263 -14.067 7.549 506 HB3 GLU 61 HB3 GLU 61 -12.906 -14.498 7.083 507 HG2 GLU 61 HG2 GLU 61 -10.730 -16.535 7.633 508 HG3 GLU 61 HG3 GLU 61 -11.844 -15.964 8.865 509 H GLY 62 H GLY 62 -10.437 -14.062 3.321 510 HA2 GLY 62 HA2 GLY 62 -10.700 -12.294 1.891 511 HA3 GLY 62 HA3 GLY 62 -12.181 -11.872 2.729 512 H GLU 63 H GLU 63 -9.380 -12.084 4.730 513 HA GLU 63 HA GLU 63 -9.206 -9.121 4.939 514 HB2 GLU 63 HB2 GLU 63 -8.769 -11.173 7.161 515 HB3 GLU 63 HB3 GLU 63 -8.765 -9.417 7.341 516 HG2 GLU 63 HG2 GLU 63 -11.141 -9.316 6.784 517 HG3 GLU 63 HG3 GLU 63 -11.171 -11.049 6.462 518 H ILE 64 H ILE 64 -7.173 -8.184 5.382 519 HA ILE 64 HA ILE 64 -4.906 -9.433 4.144 520 HB ILE 64 HB ILE 64 -5.068 -6.808 5.693 521 HG12 ILE 64 HG12 ILE 64 -5.256 -7.309 2.681 522 HG13 ILE 64 HG13 ILE 64 -6.600 -6.865 3.728 523 HG21 ILE 64 HG21 ILE 64 -2.742 -7.600 5.531 524 HG22 ILE 64 HG22 ILE 64 -2.982 -6.167 4.531 525 HG23 ILE 64 HG23 ILE 64 -2.903 -7.764 3.780 526 HD11 ILE 64 HD11 ILE 64 -4.203 -5.145 3.081 527 HD12 ILE 64 HD12 ILE 64 -5.522 -4.697 4.165 528 HD13 ILE 64 HD13 ILE 64 -5.840 -4.964 2.453 529 H PHE 65 H PHE 65 -3.768 -10.945 5.128 530 HA PHE 65 HA PHE 65 -3.104 -10.815 8.022 531 HB2 PHE 65 HB2 PHE 65 -4.603 -12.702 7.495 532 HB3 PHE 65 HB3 PHE 65 -3.535 -13.236 6.205 533 HD1 PHE 65 HD2 PHE 65 -3.817 -12.878 9.907 534 HD2 PHE 65 HD1 PHE 65 -1.701 -14.719 6.681 535 HE1 PHE 65 HE2 PHE 65 -2.687 -14.373 11.491 536 HE2 PHE 65 HE1 PHE 65 -0.576 -16.212 8.278 537 HZ PHE 65 HZ PHE 65 -1.068 -16.041 10.684 538 H VAL 66 H VAL 66 -1.060 -9.961 8.058 539 HA VAL 66 HA VAL 66 0.958 -10.895 6.073 540 HB VAL 66 HB VAL 66 2.177 -8.773 6.440 541 HG11 VAL 66 HG11 VAL 66 0.610 -7.242 5.300 542 HG12 VAL 66 HG12 VAL 66 -0.742 -8.296 5.722 543 HG13 VAL 66 HG13 VAL 66 0.512 -8.869 4.622 544 HG21 VAL 66 HG21 VAL 66 1.179 -6.906 7.725 545 HG22 VAL 66 HG22 VAL 66 1.513 -8.292 8.763 546 HG23 VAL 66 HG23 VAL 66 -0.139 -7.965 8.239 547 H LYS 67 H LYS 67 3.101 -11.354 6.761 548 HA LYS 67 HA LYS 67 3.799 -11.378 9.610 549 HB2 LYS 67 HB2 LYS 67 4.507 -13.822 9.535 550 HB3 LYS 67 HB3 LYS 67 2.782 -13.552 9.591 551 HG2 LYS 67 HG2 LYS 67 4.143 -14.072 6.946 552 HG3 LYS 67 HG3 LYS 67 3.734 -15.406 8.028 553 HD2 LYS 67 HD2 LYS 67 1.346 -14.607 8.012 554 HD3 LYS 67 HD3 LYS 67 1.798 -13.397 6.809 555 HE2 LYS 67 HE2 LYS 67 2.045 -16.404 6.445 556 HE3 LYS 67 HE3 LYS 67 0.744 -15.406 5.798 557 HZ1 LYS 67 HZ1 LYS 67 3.617 -15.204 5.098 558 HZ2 LYS 67 HZ2 LYS 67 2.403 -14.197 4.497 559 HZ3 LYS 67 HZ3 LYS 67 2.395 -15.847 4.123 560 H LEU 68 H LEU 68 6.173 -11.833 9.910 561 HA LEU 68 HA LEU 68 7.792 -10.645 7.911 562 HB2 LEU 68 HB2 LEU 68 8.691 -12.484 10.163 563 HB3 LEU 68 HB3 LEU 68 9.752 -11.463 9.206 564 HG LEU 68 HG LEU 68 7.735 -10.621 11.315 565 HD11 LEU 68 HD11 LEU 68 9.659 -9.523 12.350 566 HD12 LEU 68 HD12 LEU 68 10.704 -10.055 11.030 567 HD13 LEU 68 HD13 LEU 68 9.967 -11.241 12.111 568 HD21 LEU 68 HD21 LEU 68 9.095 -8.770 9.330 569 HD22 LEU 68 HD22 LEU 68 8.205 -8.260 10.769 570 HD23 LEU 68 HD23 LEU 68 7.363 -9.090 9.465 571 H VAL 69 H VAL 69 9.653 -11.683 6.709 572 HA VAL 69 HA VAL 69 8.923 -14.063 5.297 573 HB VAL 69 HB VAL 69 11.632 -12.661 5.392 574 HG11 VAL 69 HG11 VAL 69 10.647 -14.764 3.418 575 HG12 VAL 69 HG12 VAL 69 11.924 -14.977 4.618 576 HG13 VAL 69 HG13 VAL 69 12.155 -13.854 3.280 577 HG21 VAL 69 HG21 VAL 69 9.380 -12.437 3.357 578 HG22 VAL 69 HG22 VAL 69 10.958 -11.654 3.232 579 HG23 VAL 69 HG23 VAL 69 9.853 -11.204 4.529 580 H LEU 70 H LEU 70 8.530 -15.592 6.841 581 HA LEU 70 HA LEU 70 10.846 -16.849 8.189 582 HB2 LEU 70 HB2 LEU 70 9.188 -17.693 9.895 583 HB3 LEU 70 HB3 LEU 70 9.441 -15.963 9.896 584 HG LEU 70 HG LEU 70 7.215 -15.938 8.421 585 HD11 LEU 70 HD11 LEU 70 6.918 -18.337 8.190 586 HD12 LEU 70 HD12 LEU 70 5.572 -17.626 9.075 587 HD13 LEU 70 HD13 LEU 70 6.821 -18.525 9.943 588 HD21 LEU 70 HD21 LEU 70 7.443 -14.799 10.566 589 HD22 LEU 70 HD22 LEU 70 7.150 -16.309 11.434 590 HD23 LEU 70 HD23 LEU 70 5.871 -15.588 10.450 591 H GLU 71 H GLU 71 11.209 -18.988 7.769 592 HA GLU 71 HA GLU 71 9.829 -20.114 5.484 593 HB2 GLU 71 HB2 GLU 71 11.582 -21.896 5.583 594 HB3 GLU 71 HB3 GLU 71 12.214 -20.260 5.455 595 HG2 GLU 71 HG2 GLU 71 12.761 -20.266 7.850 596 HG3 GLU 71 HG3 GLU 71 12.110 -21.898 8.003 597 H HIS 72 H HIS 72 7.780 -20.572 6.236 598 HA HIS 72 HA HIS 72 7.536 -23.190 7.570 599 HB2 HIS 72 HB2 HIS 72 6.086 -20.649 8.341 600 HB3 HIS 72 HB3 HIS 72 5.239 -22.184 8.493 601 HD1 HIS 72 HD1 HIS 72 8.499 -20.604 9.704 602 HD2 HIS 72 HD2 HIS 72 5.712 -23.473 10.822 603 HE1 HIS 72 HE1 HIS 72 9.235 -21.411 11.957 604 HE2 HIS 72 HE2 HIS 72 7.674 -23.302 12.493 605 H HIS 73 H HIS 73 6.974 -24.435 5.926 606 HA HIS 73 HA HIS 73 5.460 -23.798 3.641 607 HB2 HIS 73 HB2 HIS 73 6.932 -25.784 3.806 608 HB3 HIS 73 HB3 HIS 73 5.867 -26.496 5.009 609 HD1 HIS 73 HD1 HIS 73 6.328 -26.091 1.352 610 HD2 HIS 73 HD2 HIS 73 3.411 -27.535 3.934 611 HE1 HIS 73 HE1 HIS 73 4.798 -27.469 -0.070 612 HE2 HIS 73 HE2 HIS 73 3.151 -28.470 1.540 613 H HIS 74 H HIS 74 3.494 -22.879 3.871 614 HA HIS 74 HA HIS 74 1.485 -24.089 5.690 615 HB2 HIS 74 HB2 HIS 74 2.341 -21.695 6.191 616 HB3 HIS 74 HB3 HIS 74 1.494 -21.192 4.736 617 HD1 HIS 74 HD1 HIS 74 0.989 -22.136 8.278 618 HD2 HIS 74 HD2 HIS 74 -1.380 -21.264 4.970 619 HE1 HIS 74 HE1 HIS 74 -1.311 -21.739 9.188 620 HE2 HIS 74 HE2 HIS 74 -2.713 -21.135 7.190 621 H HIS 75 H HIS 75 -0.119 -25.111 4.622 622 HA HIS 75 HA HIS 75 -0.526 -24.949 1.804 623 HB2 HIS 75 HB2 HIS 75 -0.968 -27.023 3.053 624 HB3 HIS 75 HB3 HIS 75 -2.251 -26.232 3.964 625 HD1 HIS 75 HD1 HIS 75 -1.465 -27.003 0.304 626 HD2 HIS 75 HD2 HIS 75 -4.726 -26.667 2.866 627 HE1 HIS 75 HE1 HIS 75 -3.469 -27.605 -1.079 628 HE2 HIS 75 HE2 HIS 75 -5.413 -27.491 0.510 629 H HIS 76 H HIS 76 -0.953 -22.802 1.300 630 HA HIS 76 HA HIS 76 -3.760 -22.100 1.309 631 HB2 HIS 76 HB2 HIS 76 -2.846 -21.036 3.440 632 HB3 HIS 76 HB3 HIS 76 -1.792 -20.045 2.433 633 HD1 HIS 76 HD1 HIS 76 -3.144 -18.445 0.659 634 HD2 HIS 76 HD2 HIS 76 -5.348 -19.993 3.828 635 HE1 HIS 76 HE1 HIS 76 -5.265 -17.112 0.716 636 HE2 HIS 76 HE2 HIS 76 -6.520 -17.982 2.707 637 H HIS 77 H HIS 77 -4.167 -21.567 -0.758 638 HA HIS 77 HA HIS 77 -2.126 -20.960 -2.677 639 HB2 HIS 77 HB2 HIS 77 -4.036 -20.719 -4.293 640 HB3 HIS 77 HB3 HIS 77 -4.033 -22.237 -3.407 641 HD1 HIS 77 HD1 HIS 77 -5.804 -18.869 -3.342 642 HD2 HIS 77 HD2 HIS 77 -6.407 -22.811 -2.182 643 HE1 HIS 77 HE1 HIS 77 -8.179 -18.978 -2.561 644 HE2 HIS 77 HE2 HIS 77 -8.487 -21.336 -1.758 645 H1 MET 1 H MET 1 1.221 -19.216 -8.301 646 HA MET 1 HA MET 1 -1.105 -19.426 -6.645 647 HB2 MET 1 HB2 MET 1 1.611 -19.850 -5.315 648 HB3 MET 1 HB3 MET 1 0.103 -19.585 -4.446 649 HG2 MET 1 HG2 MET 1 0.698 -21.950 -6.237 650 HG3 MET 1 HG3 MET 1 0.768 -21.948 -4.474 651 HE1 MET 1 HE1 MET 1 -0.932 -24.175 -5.880 652 HE2 MET 1 HE2 MET 1 -2.445 -24.091 -4.976 653 HE3 MET 1 HE3 MET 1 -0.904 -23.945 -4.131 654 H LYS 2 H LYS 2 -1.598 -17.280 -7.183 655 HA LYS 2 HA LYS 2 0.315 -15.122 -6.822 656 HB2 LYS 2 HB2 LYS 2 -2.664 -15.070 -7.471 657 HB3 LYS 2 HB3 LYS 2 -1.662 -13.625 -7.330 658 HG2 LYS 2 HG2 LYS 2 -0.223 -14.526 -9.177 659 HG3 LYS 2 HG3 LYS 2 -1.384 -15.841 -9.382 660 HD2 LYS 2 HD2 LYS 2 -3.151 -14.231 -9.939 661 HD3 LYS 2 HD3 LYS 2 -2.054 -12.878 -9.638 662 HE2 LYS 2 HE2 LYS 2 -2.299 -13.314 -12.052 663 HE3 LYS 2 HE3 LYS 2 -0.641 -13.598 -11.520 664 HZ1 LYS 2 HZ1 LYS 2 -1.043 -15.954 -11.520 665 HZ2 LYS 2 HZ2 LYS 2 -1.484 -15.327 -13.026 666 HZ3 LYS 2 HZ3 LYS 2 -2.675 -15.732 -11.898 667 H MET 3 H MET 3 0.686 -14.084 -4.977 668 HA MET 3 HA MET 3 -1.181 -14.301 -2.695 669 HB2 MET 3 HB2 MET 3 1.369 -14.975 -2.626 670 HB3 MET 3 HB3 MET 3 1.666 -13.249 -2.532 671 HG2 MET 3 HG2 MET 3 1.725 -13.919 -0.309 672 HG3 MET 3 HG3 MET 3 0.075 -13.330 -0.467 673 HE1 MET 3 HE1 MET 3 -2.077 -14.859 -0.016 674 HE2 MET 3 HE2 MET 3 -2.054 -16.617 -0.158 675 HE3 MET 3 HE3 MET 3 -1.767 -15.616 -1.582 676 H LEU 4 H LEU 4 -1.144 -12.251 -1.239 677 HA LEU 4 HA LEU 4 -2.273 -10.046 -2.576 678 HB2 LEU 4 HB2 LEU 4 -1.158 -10.296 0.239 679 HB3 LEU 4 HB3 LEU 4 -1.929 -8.831 -0.330 680 HG LEU 4 HG LEU 4 -4.066 -10.080 -0.626 681 HD11 LEU 4 HD11 LEU 4 -4.368 -12.322 0.317 682 HD12 LEU 4 HD12 LEU 4 -2.635 -12.432 0.640 683 HD13 LEU 4 HD13 LEU 4 -3.220 -12.342 -1.022 684 HD21 LEU 4 HD21 LEU 4 -3.646 -8.856 1.460 685 HD22 LEU 4 HD22 LEU 4 -2.887 -10.284 2.166 686 HD23 LEU 4 HD23 LEU 4 -4.607 -10.303 1.771 687 H LYS 5 H LYS 5 1.030 -10.762 -1.767 688 HA LYS 5 HA LYS 5 2.242 -8.218 -2.219 689 HB2 LYS 5 HB2 LYS 5 3.439 -9.919 -0.968 690 HB3 LYS 5 HB3 LYS 5 3.288 -11.070 -2.295 691 HG2 LYS 5 HG2 LYS 5 4.780 -9.614 -3.674 692 HG3 LYS 5 HG3 LYS 5 5.003 -8.564 -2.273 693 HD2 LYS 5 HD2 LYS 5 6.181 -10.265 -1.066 694 HD3 LYS 5 HD3 LYS 5 5.669 -11.528 -2.189 695 HE2 LYS 5 HE2 LYS 5 8.042 -10.912 -2.517 696 HE3 LYS 5 HE3 LYS 5 7.075 -10.566 -3.952 697 HZ1 LYS 5 HZ1 LYS 5 8.009 -8.602 -1.929 698 HZ2 LYS 5 HZ2 LYS 5 6.978 -8.236 -3.215 699 HZ3 LYS 5 HZ3 LYS 5 8.552 -8.756 -3.524 700 H GLU 6 H GLU 6 1.782 -11.111 -4.298 701 HA GLU 6 HA GLU 6 3.300 -10.164 -6.486 702 HB2 GLU 6 HB2 GLU 6 2.790 -12.585 -6.093 703 HB3 GLU 6 HB3 GLU 6 1.112 -12.286 -6.544 704 HG2 GLU 6 HG2 GLU 6 1.888 -11.545 -8.800 705 HG3 GLU 6 HG3 GLU 6 3.538 -11.941 -8.343 706 H LYS 7 H LYS 7 -0.242 -10.289 -5.969 707 HA LYS 7 HA LYS 7 -0.959 -9.091 -8.443 708 HB2 LYS 7 HB2 LYS 7 -3.237 -8.933 -7.543 709 HB3 LYS 7 HB3 LYS 7 -2.531 -10.504 -7.227 710 HG2 LYS 7 HG2 LYS 7 -3.555 -10.138 -5.206 711 HG3 LYS 7 HG3 LYS 7 -1.976 -9.433 -4.849 712 HD2 LYS 7 HD2 LYS 7 -2.881 -7.173 -5.303 713 HD3 LYS 7 HD3 LYS 7 -4.447 -7.873 -5.726 714 HE2 LYS 7 HE2 LYS 7 -4.655 -8.743 -3.404 715 HE3 LYS 7 HE3 LYS 7 -3.112 -7.991 -3.000 716 HZ1 LYS 7 HZ1 LYS 7 -4.084 -5.837 -3.497 717 HZ2 LYS 7 HZ2 LYS 7 -4.963 -6.637 -2.296 718 HZ3 LYS 7 HZ3 LYS 7 -5.560 -6.568 -3.874 719 H ALA 8 H ALA 8 -0.066 -7.701 -5.340 720 HA ALA 8 HA ALA 8 -0.850 -5.011 -5.747 721 HB1 ALA 8 HB1 ALA 8 1.584 -6.042 -4.243 722 HB2 ALA 8 HB2 ALA 8 -0.039 -5.857 -3.576 723 HB3 ALA 8 HB3 ALA 8 0.868 -4.432 -4.084 724 H GLY 9 H GLY 9 2.119 -6.745 -6.651 725 HA2 GLY 9 HA2 GLY 9 3.464 -4.598 -7.960 726 HA3 GLY 9 HA3 GLY 9 3.825 -6.308 -8.120 727 H ALA 10 H ALA 10 1.223 -7.087 -9.106 728 HA ALA 10 HA ALA 10 1.463 -6.638 -11.896 729 HB1 ALA 10 HB1 ALA 10 0.422 -8.663 -10.967 730 HB2 ALA 10 HB2 ALA 10 -0.683 -7.844 -12.074 731 HB3 ALA 10 HB3 ALA 10 -0.913 -7.702 -10.329 732 H LEU 11 H LEU 11 -0.972 -5.435 -9.551 733 HA LEU 11 HA LEU 11 -2.391 -3.701 -11.274 734 HB2 LEU 11 HB2 LEU 11 -2.050 -3.558 -8.252 735 HB3 LEU 11 HB3 LEU 11 -3.249 -2.653 -9.166 736 HG LEU 11 HG LEU 11 -3.135 -5.685 -8.918 737 HD11 LEU 11 HD11 LEU 11 -5.056 -3.721 -7.642 738 HD12 LEU 11 HD12 LEU 11 -3.795 -4.647 -6.824 739 HD13 LEU 11 HD13 LEU 11 -5.161 -5.482 -7.558 740 HD21 LEU 11 HD21 LEU 11 -4.044 -5.057 -11.091 741 HD22 LEU 11 HD22 LEU 11 -5.196 -3.959 -10.331 742 HD23 LEU 11 HD23 LEU 11 -5.321 -5.700 -10.060 743 H ALA 12 H ALA 12 0.502 -3.204 -9.300 744 HA ALA 12 HA ALA 12 0.799 -0.433 -9.366 745 HB1 ALA 12 HB1 ALA 12 2.227 -1.932 -8.036 746 HB2 ALA 12 HB2 ALA 12 3.199 -0.831 -9.015 747 HB3 ALA 12 HB3 ALA 12 3.003 -2.520 -9.509 748 H GLY 13 H GLY 13 1.694 -2.819 -11.830 749 HA2 GLY 13 HA2 GLY 13 3.081 -1.212 -13.651 750 HA3 GLY 13 HA3 GLY 13 2.167 -2.654 -14.066 751 H GLN 14 H GLN 14 -0.432 -1.951 -13.613 752 HA GLN 14 HA GLN 14 -1.007 -0.333 -15.925 753 HB2 GLN 14 HB2 GLN 14 -3.359 -0.913 -15.562 754 HB3 GLN 14 HB3 GLN 14 -2.350 -2.347 -15.405 755 HG2 GLN 14 HG2 GLN 14 -2.490 -2.112 -12.921 756 HG3 GLN 14 HG3 GLN 14 -3.592 -0.757 -13.143 757 HE21 GLN 14 HE21 GLN 14 -3.587 -3.755 -15.033 758 HE22 GLN 14 HE22 GLN 14 -5.115 -4.314 -14.464 759 H ILE 15 H ILE 15 -1.212 0.231 -12.415 760 HA ILE 15 HA ILE 15 -2.636 2.696 -12.473 761 HB ILE 15 HB ILE 15 -0.628 1.647 -10.424 762 HG12 ILE 15 HG12 ILE 15 -3.683 1.692 -10.326 763 HG13 ILE 15 HG13 ILE 15 -2.722 0.276 -10.733 764 HG21 ILE 15 HG21 ILE 15 -2.526 4.011 -10.134 765 HG22 ILE 15 HG22 ILE 15 -0.764 4.091 -10.196 766 HG23 ILE 15 HG23 ILE 15 -1.563 3.312 -8.831 767 HD11 ILE 15 HD11 ILE 15 -2.704 1.710 -8.075 768 HD12 ILE 15 HD12 ILE 15 -1.762 0.273 -8.483 769 HD13 ILE 15 HD13 ILE 15 -3.523 0.193 -8.442 770 H TRP 16 H TRP 16 0.860 1.972 -12.492 771 HA TRP 16 HA TRP 16 1.876 4.587 -12.718 772 HB2 TRP 16 HB2 TRP 16 3.280 2.570 -12.222 773 HB3 TRP 16 HB3 TRP 16 3.070 2.035 -13.894 774 HD1 TRP 16 HD1 TRP 16 4.698 4.901 -11.877 775 HE1 TRP 16 HE1 TRP 16 6.636 5.880 -13.255 776 HE3 TRP 16 HE3 TRP 16 4.016 2.287 -16.222 777 HZ2 TRP 16 HZ2 TRP 16 7.718 5.617 -15.837 778 HZ3 TRP 16 HZ3 TRP 16 5.540 2.723 -18.111 779 HH2 TRP 16 HH2 TRP 16 7.346 4.360 -17.921 780 H GLU 17 H GLU 17 0.857 2.263 -15.187 781 HA GLU 17 HA GLU 17 1.654 3.611 -17.521 782 HB2 GLU 17 HB2 GLU 17 1.014 1.196 -17.312 783 HB3 GLU 17 HB3 GLU 17 -0.667 1.665 -17.140 784 HG2 GLU 17 HG2 GLU 17 0.896 2.424 -19.604 785 HG3 GLU 17 HG3 GLU 17 0.243 0.801 -19.434 786 H ALA 18 H ALA 18 -1.353 3.829 -15.633 787 HA ALA 18 HA ALA 18 -2.812 5.598 -17.302 788 HB1 ALA 18 HB1 ALA 18 -3.842 4.345 -15.441 789 HB2 ALA 18 HB2 ALA 18 -4.162 6.075 -15.299 790 HB3 ALA 18 HB3 ALA 18 -2.937 5.315 -14.278 791 H LEU 19 H LEU 19 -0.361 6.181 -14.809 792 HA LEU 19 HA LEU 19 -0.593 9.078 -14.808 793 HB2 LEU 19 HB2 LEU 19 1.527 7.267 -13.593 794 HB3 LEU 19 HB3 LEU 19 1.304 8.972 -13.223 795 HG LEU 19 HG LEU 19 -0.682 6.755 -12.572 796 HD11 LEU 19 HD11 LEU 19 1.339 6.569 -11.210 797 HD12 LEU 19 HD12 LEU 19 -0.028 7.089 -10.229 798 HD13 LEU 19 HD13 LEU 19 1.197 8.261 -10.723 799 HD21 LEU 19 HD21 LEU 19 -1.876 8.477 -11.266 800 HD22 LEU 19 HD22 LEU 19 -1.832 8.870 -12.982 801 HD23 LEU 19 HD23 LEU 19 -0.758 9.707 -11.857 802 H ASN 20 H ASN 20 1.172 6.701 -16.603 803 HA ASN 20 HA ASN 20 3.483 8.234 -17.284 804 HB2 ASN 20 HB2 ASN 20 3.533 5.769 -17.336 805 HB3 ASN 20 HB3 ASN 20 2.321 5.745 -18.607 806 HD21 ASN 20 HD21 ASN 20 5.624 6.640 -17.850 807 HD22 ASN 20 HD22 ASN 20 6.205 6.589 -19.472 808 H GLY 21 H GLY 21 3.792 9.699 -18.853 809 HA2 GLY 21 HA2 GLY 21 3.517 10.994 -20.732 810 HA3 GLY 21 HA3 GLY 21 2.290 9.879 -21.296 811 H THR 22 H THR 22 1.445 10.941 -18.215 812 HA THR 22 HA THR 22 -0.321 13.092 -19.262 813 HB THR 22 HB THR 22 -2.041 12.448 -17.663 814 HG1 THR 22 HG1 THR 22 -1.350 10.220 -16.558 815 HG21 THR 22 HG21 THR 22 -1.006 9.936 -19.039 816 HG22 THR 22 HG22 THR 22 -2.066 11.147 -19.765 817 HG23 THR 22 HG23 THR 22 -2.639 10.172 -18.412 818 H GLU 23 H GLU 23 -1.078 14.627 -17.528 819 HA GLU 23 HA GLU 23 0.962 15.725 -15.890 820 HB2 GLU 23 HB2 GLU 23 -0.826 17.271 -15.128 821 HB3 GLU 23 HB3 GLU 23 -0.800 17.100 -16.879 822 HG2 GLU 23 HG2 GLU 23 -2.688 15.421 -16.650 823 HG3 GLU 23 HG3 GLU 23 -2.780 15.856 -14.945 824 H GLY 24 H GLY 24 -0.871 12.981 -15.329 825 HA2 GLY 24 HA2 GLY 24 -0.768 11.648 -13.377 826 HA3 GLY 24 HA3 GLY 24 -0.529 13.094 -12.402 827 H LEU 25 H LEU 25 -2.420 11.051 -11.845 828 HA LEU 25 HA LEU 25 -5.013 12.439 -12.205 829 HB2 LEU 25 HB2 LEU 25 -4.535 9.426 -12.369 830 HB3 LEU 25 HB3 LEU 25 -6.114 10.177 -12.282 831 HG LEU 25 HG LEU 25 -5.461 11.355 -14.519 832 HD11 LEU 25 HD11 LEU 25 -3.436 9.102 -14.605 833 HD12 LEU 25 HD12 LEU 25 -3.081 10.830 -14.558 834 HD13 LEU 25 HD13 LEU 25 -3.893 10.140 -15.958 835 HD21 LEU 25 HD21 LEU 25 -7.208 9.647 -14.355 836 HD22 LEU 25 HD22 LEU 25 -6.000 8.366 -14.490 837 HD23 LEU 25 HD23 LEU 25 -6.289 9.457 -15.848 838 H THR 26 H THR 26 -6.563 12.034 -10.483 839 HA THR 26 HA THR 26 -5.446 11.495 -7.849 840 HB THR 26 HB THR 26 -7.720 11.916 -6.972 841 HG1 THR 26 HG1 THR 26 -9.355 12.548 -8.579 842 HG21 THR 26 HG21 THR 26 -6.313 13.891 -7.434 843 HG22 THR 26 HG22 THR 26 -8.019 14.252 -7.713 844 HG23 THR 26 HG23 THR 26 -6.944 13.963 -9.082 845 H GLN 27 H GLN 27 -6.662 9.937 -6.366 846 HA GLN 27 HA GLN 27 -6.449 7.274 -7.067 847 HB2 GLN 27 HB2 GLN 27 -6.574 7.941 -4.745 848 HB3 GLN 27 HB3 GLN 27 -8.161 8.662 -4.965 849 HG2 GLN 27 HG2 GLN 27 -9.074 6.343 -5.370 850 HG3 GLN 27 HG3 GLN 27 -7.489 5.705 -4.936 851 HE21 GLN 27 HE21 GLN 27 -10.088 5.316 -3.647 852 HE22 GLN 27 HE22 GLN 27 -9.875 5.797 -2.005 853 H LYS 28 H LYS 28 -9.416 9.216 -6.963 854 HA LYS 28 HA LYS 28 -11.290 7.300 -7.797 855 HB2 LYS 28 HB2 LYS 28 -11.847 9.406 -6.650 856 HB3 LYS 28 HB3 LYS 28 -11.321 10.329 -8.052 857 HG2 LYS 28 HG2 LYS 28 -13.170 9.465 -9.374 858 HG3 LYS 28 HG3 LYS 28 -13.666 8.402 -8.051 859 HD2 LYS 28 HD2 LYS 28 -14.254 10.322 -6.663 860 HD3 LYS 28 HD3 LYS 28 -13.601 11.442 -7.865 861 HE2 LYS 28 HE2 LYS 28 -15.977 9.600 -8.321 862 HE3 LYS 28 HE3 LYS 28 -16.085 11.315 -7.913 863 HZ1 LYS 28 HZ1 LYS 28 -14.896 11.837 -9.954 864 HZ2 LYS 28 HZ2 LYS 28 -16.311 10.970 -10.282 865 HZ3 LYS 28 HZ3 LYS 28 -14.807 10.194 -10.353 866 H GLN 29 H GLN 29 -9.406 9.647 -9.725 867 HA GLN 29 HA GLN 29 -10.590 9.106 -12.265 868 HB2 GLN 29 HB2 GLN 29 -7.879 10.281 -11.562 869 HB3 GLN 29 HB3 GLN 29 -8.537 10.237 -13.197 870 HG2 GLN 29 HG2 GLN 29 -10.387 11.683 -12.517 871 HG3 GLN 29 HG3 GLN 29 -9.793 11.691 -10.854 872 HE21 GLN 29 HE21 GLN 29 -9.484 13.921 -10.827 873 HE22 GLN 29 HE22 GLN 29 -8.240 14.705 -11.727 874 H ILE 30 H ILE 30 -7.690 7.802 -10.656 875 HA ILE 30 HA ILE 30 -6.722 6.218 -12.803 876 HB ILE 30 HB ILE 30 -6.289 5.844 -9.807 877 HG12 ILE 30 HG12 ILE 30 -4.483 7.162 -11.884 878 HG13 ILE 30 HG13 ILE 30 -5.490 8.031 -10.735 879 HG21 ILE 30 HG21 ILE 30 -5.783 3.732 -10.971 880 HG22 ILE 30 HG22 ILE 30 -4.301 4.480 -10.384 881 HG23 ILE 30 HG23 ILE 30 -4.720 4.585 -12.095 882 HD11 ILE 30 HD11 ILE 30 -3.186 8.000 -10.025 883 HD12 ILE 30 HD12 ILE 30 -3.165 6.237 -10.048 884 HD13 ILE 30 HD13 ILE 30 -4.184 7.094 -8.887 885 H LYS 31 H LYS 31 -8.995 5.490 -10.147 886 HA LYS 31 HA LYS 31 -9.392 2.749 -10.580 887 HB2 LYS 31 HB2 LYS 31 -11.342 4.873 -9.630 888 HB3 LYS 31 HB3 LYS 31 -11.722 3.154 -9.620 889 HG2 LYS 31 HG2 LYS 31 -9.865 2.743 -8.042 890 HG3 LYS 31 HG3 LYS 31 -9.459 4.462 -8.069 891 HD2 LYS 31 HD2 LYS 31 -10.769 3.918 -6.056 892 HD3 LYS 31 HD3 LYS 31 -11.671 5.012 -7.108 893 HE2 LYS 31 HE2 LYS 31 -12.895 2.980 -8.019 894 HE3 LYS 31 HE3 LYS 31 -12.103 2.019 -6.769 895 HZ1 LYS 31 HZ1 LYS 31 -13.868 4.346 -6.273 896 HZ2 LYS 31 HZ2 LYS 31 -13.176 3.348 -5.095 897 HZ3 LYS 31 HZ3 LYS 31 -14.334 2.726 -6.161 898 H LYS 32 H LYS 32 -10.882 5.520 -12.268 899 HA LYS 32 HA LYS 32 -12.579 3.964 -13.976 900 HB2 LYS 32 HB2 LYS 32 -13.013 6.363 -13.497 901 HB3 LYS 32 HB3 LYS 32 -11.538 6.804 -14.346 902 HG2 LYS 32 HG2 LYS 32 -13.479 7.219 -15.764 903 HG3 LYS 32 HG3 LYS 32 -12.485 5.939 -16.460 904 HD2 LYS 32 HD2 LYS 32 -14.799 5.287 -16.689 905 HD3 LYS 32 HD3 LYS 32 -14.071 4.247 -15.465 906 HE2 LYS 32 HE2 LYS 32 -16.278 4.927 -14.721 907 HE3 LYS 32 HE3 LYS 32 -15.075 5.712 -13.697 908 HZ1 LYS 32 HZ1 LYS 32 -16.447 6.989 -16.005 909 HZ2 LYS 32 HZ2 LYS 32 -15.368 7.745 -14.945 910 HZ3 LYS 32 HZ3 LYS 32 -16.872 7.211 -14.383 911 H ALA 33 H ALA 33 -9.309 5.344 -14.357 912 HA ALA 33 HA ALA 33 -8.967 4.787 -17.126 913 HB1 ALA 33 HB1 ALA 33 -6.604 5.356 -16.738 914 HB2 ALA 33 HB2 ALA 33 -6.853 5.238 -14.992 915 HB3 ALA 33 HB3 ALA 33 -7.673 6.496 -15.916 916 H THR 34 H THR 34 -8.011 2.983 -14.237 917 HA THR 34 HA THR 34 -6.700 0.832 -15.728 918 HB THR 34 HB THR 34 -6.030 -0.040 -13.508 919 HG1 THR 34 HG1 THR 34 -6.898 2.132 -12.050 920 HG21 THR 34 HG21 THR 34 -4.589 1.823 -12.766 921 HG22 THR 34 HG22 THR 34 -5.528 2.953 -13.743 922 HG23 THR 34 HG23 THR 34 -4.580 1.684 -14.524 923 H LYS 35 H LYS 35 -9.739 1.520 -14.301 924 HA LYS 35 HA LYS 35 -11.680 0.436 -14.003 925 HB2 LYS 35 HB2 LYS 35 -10.437 -1.986 -15.369 926 HB3 LYS 35 HB3 LYS 35 -12.153 -1.751 -15.052 927 HG2 LYS 35 HG2 LYS 35 -10.436 -0.098 -16.937 928 HG3 LYS 35 HG3 LYS 35 -11.619 -1.325 -17.402 929 HD2 LYS 35 HD2 LYS 35 -13.437 0.054 -16.451 930 HD3 LYS 35 HD3 LYS 35 -12.260 1.270 -15.939 931 HE2 LYS 35 HE2 LYS 35 -12.882 0.477 -18.808 932 HE3 LYS 35 HE3 LYS 35 -13.366 1.972 -18.005 933 HZ1 LYS 35 HZ1 LYS 35 -11.437 2.337 -19.374 934 HZ2 LYS 35 HZ2 LYS 35 -10.579 1.118 -18.587 935 HZ3 LYS 35 HZ3 LYS 35 -11.007 2.528 -17.751 936 H LEU 36 H LEU 36 -9.731 0.478 -11.899 937 HA LEU 36 HA LEU 36 -9.970 -2.017 -10.435 938 HB2 LEU 36 HB2 LEU 36 -8.983 0.731 -9.578 939 HB3 LEU 36 HB3 LEU 36 -9.025 -0.658 -8.500 940 HG LEU 36 HG LEU 36 -7.360 -0.413 -11.031 941 HD11 LEU 36 HD11 LEU 36 -6.495 0.939 -9.193 942 HD12 LEU 36 HD12 LEU 36 -5.424 -0.415 -9.543 943 HD13 LEU 36 HD13 LEU 36 -6.485 -0.472 -8.131 944 HD21 LEU 36 HD21 LEU 36 -7.536 -2.753 -9.101 945 HD22 LEU 36 HD22 LEU 36 -6.366 -2.587 -10.413 946 HD23 LEU 36 HD23 LEU 36 -8.081 -2.725 -10.781 947 H LYS 37 H LYS 37 -11.705 -2.666 -9.397 948 HA LYS 37 HA LYS 37 -14.044 -1.114 -8.881 949 HB2 LYS 37 HB2 LYS 37 -14.155 -3.526 -9.343 950 HB3 LYS 37 HB3 LYS 37 -13.204 -3.874 -7.904 951 HG2 LYS 37 HG2 LYS 37 -15.115 -2.878 -6.532 952 HG3 LYS 37 HG3 LYS 37 -16.051 -2.816 -8.026 953 HD2 LYS 37 HD2 LYS 37 -16.620 -4.829 -6.741 954 HD3 LYS 37 HD3 LYS 37 -15.842 -5.273 -8.263 955 HE2 LYS 37 HE2 LYS 37 -13.707 -5.634 -7.069 956 HE3 LYS 37 HE3 LYS 37 -14.468 -5.163 -5.549 957 HZ1 LYS 37 HZ1 LYS 37 -14.303 -7.557 -5.810 958 HZ2 LYS 37 HZ2 LYS 37 -15.251 -7.492 -7.207 959 HZ3 LYS 37 HZ3 LYS 37 -15.916 -7.060 -5.714 960 H ALA 38 H ALA 38 -11.734 -2.684 -6.629 961 HA ALA 38 HA ALA 38 -12.690 -1.029 -4.389 962 HB1 ALA 38 HB1 ALA 38 -10.876 -3.461 -4.351 963 HB2 ALA 38 HB2 ALA 38 -12.604 -3.452 -3.997 964 HB3 ALA 38 HB3 ALA 38 -11.482 -2.597 -2.932 965 H ASP 39 H ASP 39 -11.582 0.635 -3.694 966 HA ASP 39 HA ASP 39 -9.071 1.532 -4.635 967 HB2 ASP 39 HB2 ASP 39 -9.273 3.265 -2.918 968 HB3 ASP 39 HB3 ASP 39 -10.808 3.043 -3.744 969 H LYS 40 H LYS 40 -9.973 -0.557 -1.971 970 HA LYS 40 HA LYS 40 -7.710 -0.587 -0.348 971 HB2 LYS 40 HB2 LYS 40 -9.436 -2.969 -1.134 972 HB3 LYS 40 HB3 LYS 40 -8.402 -2.884 0.285 973 HG2 LYS 40 HG2 LYS 40 -10.779 -1.037 -0.146 974 HG3 LYS 40 HG3 LYS 40 -10.902 -2.598 0.661 975 HD2 LYS 40 HD2 LYS 40 -10.695 -1.154 2.481 976 HD3 LYS 40 HD3 LYS 40 -9.025 -1.662 2.248 977 HE2 LYS 40 HE2 LYS 40 -9.052 0.715 2.655 978 HE3 LYS 40 HE3 LYS 40 -8.634 0.464 0.961 979 HZ1 LYS 40 HZ1 LYS 40 -10.216 2.245 1.197 980 HZ2 LYS 40 HZ2 LYS 40 -11.299 1.233 2.007 981 HZ3 LYS 40 HZ3 LYS 40 -10.938 0.952 0.382 982 H ASP 41 H ASP 41 -8.250 -2.266 -3.428 983 HA ASP 41 HA ASP 41 -5.728 -3.674 -3.500 984 HB2 ASP 41 HB2 ASP 41 -7.813 -3.092 -5.644 985 HB3 ASP 41 HB3 ASP 41 -6.381 -4.083 -5.919 986 H PHE 42 H PHE 42 -6.978 -0.635 -4.824 987 HA PHE 42 HA PHE 42 -4.859 0.176 -6.454 988 HB2 PHE 42 HB2 PHE 42 -6.908 1.420 -6.555 989 HB3 PHE 42 HB3 PHE 42 -6.869 1.779 -4.834 990 HD1 PHE 42 HD2 PHE 42 -5.145 2.525 -8.068 991 HD2 PHE 42 HD1 PHE 42 -5.823 3.782 -4.039 992 HE1 PHE 42 HE2 PHE 42 -3.998 4.646 -8.524 993 HE2 PHE 42 HE1 PHE 42 -4.663 5.900 -4.507 994 HZ PHE 42 HZ PHE 42 -3.750 6.332 -6.753 995 H PHE 43 H PHE 43 -5.248 0.635 -2.930 996 HA PHE 43 HA PHE 43 -3.013 2.335 -2.523 997 HB2 PHE 43 HB2 PHE 43 -4.344 0.497 -0.495 998 HB3 PHE 43 HB3 PHE 43 -3.281 1.850 -0.111 999 HD1 PHE 43 HD1 PHE 43 -4.247 3.974 -1.903 1000 HD2 PHE 43 HD2 PHE 43 -6.462 1.097 0.345 1001 HE1 PHE 43 HE1 PHE 43 -6.183 5.478 -1.872 1002 HE2 PHE 43 HE2 PHE 43 -8.394 2.612 0.366 1003 HZ PHE 43 HZ PHE 43 -8.257 4.796 -0.750 1004 H LEU 44 H LEU 44 -3.259 -1.197 -2.512 1005 HA LEU 44 HA LEU 44 -0.580 -1.713 -1.625 1006 HB2 LEU 44 HB2 LEU 44 -2.748 -3.370 -2.913 1007 HB3 LEU 44 HB3 LEU 44 -1.117 -4.010 -2.886 1008 HG LEU 44 HG LEU 44 -1.094 -3.856 -0.401 1009 HD11 LEU 44 HD11 LEU 44 -2.676 -2.029 -0.039 1010 HD12 LEU 44 HD12 LEU 44 -3.145 -3.455 0.881 1011 HD13 LEU 44 HD13 LEU 44 -4.007 -3.044 -0.603 1012 HD21 LEU 44 HD21 LEU 44 -2.571 -5.761 0.040 1013 HD22 LEU 44 HD22 LEU 44 -1.715 -5.971 -1.485 1014 HD23 LEU 44 HD23 LEU 44 -3.412 -5.484 -1.487 1015 H GLY 45 H GLY 45 -2.075 -1.234 -4.815 1016 HA2 GLY 45 HA2 GLY 45 0.234 -1.747 -6.425 1017 HA3 GLY 45 HA3 GLY 45 -1.182 -0.819 -6.903 1018 H LEU 46 H LEU 46 -1.148 1.285 -5.173 1019 HA LEU 46 HA LEU 46 0.802 3.067 -6.233 1020 HB2 LEU 46 HB2 LEU 46 -1.480 3.797 -5.628 1021 HB3 LEU 46 HB3 LEU 46 -1.174 3.418 -3.942 1022 HG LEU 46 HG LEU 46 0.563 5.220 -3.873 1023 HD11 LEU 46 HD11 LEU 46 1.236 5.255 -6.213 1024 HD12 LEU 46 HD12 LEU 46 0.736 6.858 -5.685 1025 HD13 LEU 46 HD13 LEU 46 -0.346 5.887 -6.686 1026 HD21 LEU 46 HD21 LEU 46 -2.180 6.183 -4.748 1027 HD22 LEU 46 HD22 LEU 46 -0.990 7.122 -3.843 1028 HD23 LEU 46 HD23 LEU 46 -1.722 5.696 -3.114 1029 H GLY 47 H GLY 47 0.543 1.234 -3.291 1030 HA2 GLY 47 HA2 GLY 47 2.693 2.415 -1.791 1031 HA3 GLY 47 HA3 GLY 47 1.968 0.832 -1.510 1032 H TRP 48 H TRP 48 2.423 -0.171 -4.154 1033 HA TRP 48 HA TRP 48 5.140 -1.047 -4.067 1034 HB2 TRP 48 HB2 TRP 48 3.023 -2.296 -4.983 1035 HB3 TRP 48 HB3 TRP 48 3.301 -1.386 -6.463 1036 HD1 TRP 48 HD1 TRP 48 5.681 -1.939 -7.780 1037 HE1 TRP 48 HE1 TRP 48 7.106 -4.069 -7.787 1038 HE3 TRP 48 HE3 TRP 48 3.721 -4.232 -3.659 1039 HZ2 TRP 48 HZ2 TRP 48 7.365 -6.420 -6.261 1040 HZ3 TRP 48 HZ3 TRP 48 4.606 -6.431 -2.995 1041 HH2 TRP 48 HH2 TRP 48 6.390 -7.505 -4.279 1042 H LEU 49 H LEU 49 3.371 1.411 -5.921 1043 HA LEU 49 HA LEU 49 5.431 2.241 -7.678 1044 HB2 LEU 49 HB2 LEU 49 2.932 3.476 -6.574 1045 HB3 LEU 49 HB3 LEU 49 4.095 4.570 -7.271 1046 HG LEU 49 HG LEU 49 3.896 3.549 -9.457 1047 HD11 LEU 49 HD11 LEU 49 2.068 1.520 -8.192 1048 HD12 LEU 49 HD12 LEU 49 3.697 1.235 -8.820 1049 HD13 LEU 49 HD13 LEU 49 2.403 1.699 -9.922 1050 HD21 LEU 49 HD21 LEU 49 1.132 3.949 -8.253 1051 HD22 LEU 49 HD22 LEU 49 1.537 4.011 -9.972 1052 HD23 LEU 49 HD23 LEU 49 2.183 5.227 -8.875 1053 H LEU 50 H LEU 50 4.659 3.249 -4.350 1054 HA LEU 50 HA LEU 50 6.819 5.058 -3.958 1055 HB2 LEU 50 HB2 LEU 50 5.115 3.462 -2.022 1056 HB3 LEU 50 HB3 LEU 50 6.375 4.554 -1.464 1057 HG LEU 50 HG LEU 50 3.957 5.388 -3.120 1058 HD11 LEU 50 HD11 LEU 50 4.475 5.815 -0.159 1059 HD12 LEU 50 HD12 LEU 50 3.273 4.735 -0.868 1060 HD13 LEU 50 HD13 LEU 50 3.124 6.476 -1.086 1061 HD21 LEU 50 HD21 LEU 50 4.691 7.703 -2.629 1062 HD22 LEU 50 HD22 LEU 50 5.875 6.819 -3.586 1063 HD23 LEU 50 HD23 LEU 50 6.155 7.075 -1.860 1064 H ARG 51 H ARG 51 6.535 1.549 -3.515 1065 HA ARG 51 HA ARG 51 9.056 0.950 -2.422 1066 HB2 ARG 51 HB2 ARG 51 7.597 -0.896 -2.482 1067 HB3 ARG 51 HB3 ARG 51 7.076 -0.572 -4.127 1068 HG2 ARG 51 HG2 ARG 51 9.142 -1.459 -5.024 1069 HG3 ARG 51 HG3 ARG 51 9.817 -1.645 -3.409 1070 HD2 ARG 51 HD2 ARG 51 8.271 -3.435 -2.908 1071 HD3 ARG 51 HD3 ARG 51 7.377 -3.140 -4.404 1072 HE ARG 51 HE ARG 51 9.369 -3.850 -5.635 1073 HH11 ARG 51 HH11 ARG 51 9.206 -4.877 -2.332 1074 HH12 ARG 51 HH12 ARG 51 10.310 -6.176 -2.581 1075 HH21 ARG 51 HH21 ARG 51 10.768 -5.522 -5.904 1076 HH22 ARG 51 HH22 ARG 51 11.170 -6.543 -4.572 1077 H GLU 52 H GLU 52 8.082 1.349 -5.839 1078 HA GLU 52 HA GLU 52 10.711 0.697 -6.859 1079 HB2 GLU 52 HB2 GLU 52 8.309 1.858 -8.311 1080 HB3 GLU 52 HB3 GLU 52 9.741 1.176 -9.069 1081 HG2 GLU 52 HG2 GLU 52 7.664 -0.334 -7.457 1082 HG3 GLU 52 HG3 GLU 52 7.851 -0.356 -9.204 1083 H ASP 53 H ASP 53 9.208 3.555 -5.722 1084 HA ASP 53 HA ASP 53 9.687 5.755 -5.643 1085 HB2 ASP 53 HB2 ASP 53 12.470 4.807 -6.424 1086 HB3 ASP 53 HB3 ASP 53 12.107 6.435 -5.855 1087 H LYS 54 H LYS 54 8.708 4.630 -8.127 1088 HA LYS 54 HA LYS 54 9.836 6.267 -10.278 1089 HB2 LYS 54 HB2 LYS 54 8.176 5.004 -11.717 1090 HB3 LYS 54 HB3 LYS 54 9.378 4.009 -10.905 1091 HG2 LYS 54 HG2 LYS 54 7.725 3.349 -9.204 1092 HG3 LYS 54 HG3 LYS 54 6.511 4.380 -9.960 1093 HD2 LYS 54 HD2 LYS 54 6.304 1.922 -10.499 1094 HD3 LYS 54 HD3 LYS 54 6.405 2.972 -11.905 1095 HE2 LYS 54 HE2 LYS 54 8.749 2.366 -12.237 1096 HE3 LYS 54 HE3 LYS 54 8.736 1.397 -10.764 1097 HZ1 LYS 54 HZ1 LYS 54 8.483 -0.018 -12.646 1098 HZ2 LYS 54 HZ2 LYS 54 7.187 0.888 -13.234 1099 HZ3 LYS 54 HZ3 LYS 54 7.016 0.002 -11.805 1100 H VAL 55 H VAL 55 7.466 6.719 -7.905 1101 HA VAL 55 HA VAL 55 6.211 8.885 -9.486 1102 HB VAL 55 HB VAL 55 3.982 8.495 -8.647 1103 HG11 VAL 55 HG11 VAL 55 4.548 7.272 -10.692 1104 HG12 VAL 55 HG12 VAL 55 3.374 6.372 -9.733 1105 HG13 VAL 55 HG13 VAL 55 5.068 5.879 -9.741 1106 HG21 VAL 55 HG21 VAL 55 4.474 7.694 -6.395 1107 HG22 VAL 55 HG22 VAL 55 5.093 6.170 -7.034 1108 HG23 VAL 55 HG23 VAL 55 3.380 6.560 -7.196 1109 H VAL 56 H VAL 56 5.262 10.572 -8.255 1110 HA VAL 56 HA VAL 56 5.999 10.800 -5.427 1111 HB VAL 56 HB VAL 56 5.744 13.277 -5.657 1112 HG11 VAL 56 HG11 VAL 56 7.864 13.680 -6.852 1113 HG12 VAL 56 HG12 VAL 56 7.781 12.069 -7.568 1114 HG13 VAL 56 HG13 VAL 56 7.982 12.252 -5.824 1115 HG21 VAL 56 HG21 VAL 56 5.481 12.723 -8.649 1116 HG22 VAL 56 HG22 VAL 56 5.639 14.320 -7.912 1117 HG23 VAL 56 HG23 VAL 56 4.204 13.345 -7.601 1118 H THR 57 H THR 57 4.450 10.989 -3.929 1119 HA THR 57 HA THR 57 1.614 11.017 -4.776 1120 HB THR 57 HB THR 57 1.094 10.082 -2.522 1121 HG1 THR 57 HG1 THR 57 2.554 10.253 -1.007 1122 HG21 THR 57 HG21 THR 57 3.219 8.473 -3.979 1123 HG22 THR 57 HG22 THR 57 1.496 8.495 -4.362 1124 HG23 THR 57 HG23 THR 57 2.050 7.830 -2.824 1125 H SER 58 H SER 58 0.189 12.493 -3.913 1126 HA SER 58 HA SER 58 1.001 14.395 -1.847 1127 HB2 SER 58 HB2 SER 58 0.471 16.400 -3.181 1128 HB3 SER 58 HB3 SER 58 1.738 15.484 -3.996 1129 HG SER 58 HG SER 58 0.056 14.584 -5.321 1130 H GLU 59 H GLU 59 -0.850 15.880 -1.346 1131 HA GLU 59 HA GLU 59 -3.492 14.566 -1.635 1132 HB2 GLU 59 HB2 GLU 59 -2.711 14.473 0.699 1133 HB3 GLU 59 HB3 GLU 59 -2.361 16.198 0.689 1134 HG2 GLU 59 HG2 GLU 59 -4.835 16.608 0.336 1135 HG3 GLU 59 HG3 GLU 59 -5.091 14.876 0.571 1136 H VAL 60 H VAL 60 -4.800 15.722 -2.920 1137 HA VAL 60 HA VAL 60 -4.675 18.689 -2.907 1138 HB VAL 60 HB VAL 60 -5.690 16.823 -5.097 1139 HG11 VAL 60 HG11 VAL 60 -5.926 19.864 -4.997 1140 HG12 VAL 60 HG12 VAL 60 -7.265 18.714 -4.951 1141 HG13 VAL 60 HG13 VAL 60 -6.279 18.860 -6.406 1142 HG21 VAL 60 HG21 VAL 60 -3.458 18.889 -5.073 1143 HG22 VAL 60 HG22 VAL 60 -3.935 17.915 -6.467 1144 HG23 VAL 60 HG23 VAL 60 -3.248 17.133 -5.043 1145 H GLU 61 H GLU 61 -6.019 19.347 -1.432 1146 HA GLU 61 HA GLU 61 -7.860 19.878 -0.258 1147 HB2 GLU 61 HB2 GLU 61 -9.274 19.268 -2.880 1148 HB3 GLU 61 HB3 GLU 61 -9.837 20.359 -1.613 1149 HG2 GLU 61 HG2 GLU 61 -7.761 21.759 -2.022 1150 HG3 GLU 61 HG3 GLU 61 -7.407 20.719 -3.392 1151 H GLY 62 H GLY 62 -7.143 17.252 0.313 1152 HA2 GLY 62 HA2 GLY 62 -8.124 15.752 1.848 1153 HA3 GLY 62 HA3 GLY 62 -9.711 16.123 1.202 1154 H GLU 63 H GLU 63 -8.011 15.566 -1.530 1155 HA GLU 63 HA GLU 63 -8.543 12.634 -1.556 1156 HB2 GLU 63 HB2 GLU 63 -8.483 14.592 -3.903 1157 HB3 GLU 63 HB3 GLU 63 -8.684 12.846 -4.055 1158 HG2 GLU 63 HG2 GLU 63 -10.774 13.077 -2.627 1159 HG3 GLU 63 HG3 GLU 63 -10.606 14.825 -2.801 1160 H ILE 64 H ILE 64 -7.041 11.246 -2.653 1161 HA ILE 64 HA ILE 64 -4.250 12.038 -2.491 1162 HB ILE 64 HB ILE 64 -5.470 9.417 -3.482 1163 HG12 ILE 64 HG12 ILE 64 -4.346 10.108 -0.729 1164 HG13 ILE 64 HG13 ILE 64 -6.045 9.852 -1.107 1165 HG21 ILE 64 HG21 ILE 64 -3.218 8.436 -3.131 1166 HG22 ILE 64 HG22 ILE 64 -2.591 10.033 -2.721 1167 HG23 ILE 64 HG23 ILE 64 -3.192 9.715 -4.349 1168 HD11 ILE 64 HD11 ILE 64 -3.867 7.759 -1.257 1169 HD12 ILE 64 HD12 ILE 64 -5.575 7.504 -1.627 1170 HD13 ILE 64 HD13 ILE 64 -5.082 7.926 0.010 1171 H PHE 65 H PHE 65 -3.292 13.112 -4.131 1172 HA PHE 65 HA PHE 65 -3.935 12.438 -6.957 1173 HB2 PHE 65 HB2 PHE 65 -4.424 14.813 -6.497 1174 HB3 PHE 65 HB3 PHE 65 -2.814 15.049 -5.822 1175 HD1 PHE 65 HD2 PHE 65 -4.676 14.348 -8.976 1176 HD2 PHE 65 HD1 PHE 65 -0.927 15.512 -7.279 1177 HE1 PHE 65 HE2 PHE 65 -3.833 14.916 -11.209 1178 HE2 PHE 65 HE1 PHE 65 -0.089 16.075 -9.524 1179 HZ PHE 65 HZ PHE 65 -1.542 15.774 -11.490 1180 H VAL 66 H VAL 66 -2.284 11.562 -8.133 1181 HA VAL 66 HA VAL 66 0.486 11.647 -7.098 1182 HB VAL 66 HB VAL 66 0.784 9.215 -7.472 1183 HG11 VAL 66 HG11 VAL 66 0.171 9.980 -5.208 1184 HG12 VAL 66 HG12 VAL 66 -0.482 8.377 -5.527 1185 HG13 VAL 66 HG13 VAL 66 -1.540 9.788 -5.592 1186 HG21 VAL 66 HG21 VAL 66 -1.157 7.723 -7.863 1187 HG22 VAL 66 HG22 VAL 66 -0.921 8.844 -9.205 1188 HG23 VAL 66 HG23 VAL 66 -2.205 9.134 -8.032 1189 H LYS 67 H LYS 67 2.131 11.211 -8.647 1190 HA LYS 67 HA LYS 67 1.524 10.679 -11.431 1191 HB2 LYS 67 HB2 LYS 67 2.430 12.773 -12.367 1192 HB3 LYS 67 HB3 LYS 67 0.990 13.080 -11.407 1193 HG2 LYS 67 HG2 LYS 67 2.334 13.940 -9.565 1194 HG3 LYS 67 HG3 LYS 67 3.830 13.538 -10.418 1195 HD2 LYS 67 HD2 LYS 67 1.741 15.577 -11.309 1196 HD3 LYS 67 HD3 LYS 67 3.322 15.950 -10.612 1197 HE2 LYS 67 HE2 LYS 67 4.434 14.922 -12.550 1198 HE3 LYS 67 HE3 LYS 67 2.869 14.480 -13.234 1199 HZ1 LYS 67 HZ1 LYS 67 3.809 17.244 -12.753 1200 HZ2 LYS 67 HZ2 LYS 67 2.333 16.805 -13.450 1201 HZ3 LYS 67 HZ3 LYS 67 3.785 16.457 -14.246 1202 H LEU 68 H LEU 68 3.847 11.263 -12.709 1203 HA LEU 68 HA LEU 68 5.647 9.354 -11.493 1204 HB2 LEU 68 HB2 LEU 68 6.111 10.987 -14.011 1205 HB3 LEU 68 HB3 LEU 68 6.939 9.509 -13.545 1206 HG LEU 68 HG LEU 68 4.116 9.840 -14.599 1207 HD11 LEU 68 HD11 LEU 68 4.806 8.181 -16.250 1208 HD12 LEU 68 HD12 LEU 68 6.397 8.055 -15.498 1209 HD13 LEU 68 HD13 LEU 68 5.894 9.569 -16.260 1210 HD21 LEU 68 HD21 LEU 68 3.704 7.444 -14.152 1211 HD22 LEU 68 HD22 LEU 68 3.850 8.396 -12.679 1212 HD23 LEU 68 HD23 LEU 68 5.193 7.375 -13.203 1213 H VAL 69 H VAL 69 8.142 9.878 -11.731 1214 HA VAL 69 HA VAL 69 8.806 12.611 -10.753 1215 HB VAL 69 HB VAL 69 10.697 10.224 -10.602 1216 HG11 VAL 69 HG11 VAL 69 11.731 12.430 -10.236 1217 HG12 VAL 69 HG12 VAL 69 11.768 11.474 -8.755 1218 HG13 VAL 69 HG13 VAL 69 10.583 12.770 -8.937 1219 HG21 VAL 69 HG21 VAL 69 10.000 9.802 -8.265 1220 HG22 VAL 69 HG22 VAL 69 8.694 9.495 -9.410 1221 HG23 VAL 69 HG23 VAL 69 8.692 10.974 -8.450 1222 H LEU 70 H LEU 70 8.621 11.071 -13.619 1223 HA LEU 70 HA LEU 70 11.210 11.964 -14.731 1224 HB2 LEU 70 HB2 LEU 70 11.464 9.806 -15.915 1225 HB3 LEU 70 HB3 LEU 70 11.549 9.626 -14.175 1226 HG LEU 70 HG LEU 70 8.901 9.088 -15.549 1227 HD11 LEU 70 HD11 LEU 70 9.508 6.740 -15.972 1228 HD12 LEU 70 HD12 LEU 70 11.173 7.074 -15.487 1229 HD13 LEU 70 HD13 LEU 70 10.501 7.846 -16.924 1230 HD21 LEU 70 HD21 LEU 70 8.615 7.434 -13.741 1231 HD22 LEU 70 HD22 LEU 70 8.939 9.043 -13.099 1232 HD23 LEU 70 HD23 LEU 70 10.221 7.829 -13.116 1233 H GLU 71 H GLU 71 8.840 13.376 -15.156 1234 HA GLU 71 HA GLU 71 7.539 12.692 -17.605 1235 HB2 GLU 71 HB2 GLU 71 7.858 15.471 -16.381 1236 HB3 GLU 71 HB3 GLU 71 6.750 15.045 -17.675 1237 HG2 GLU 71 HG2 GLU 71 5.327 15.049 -15.853 1238 HG3 GLU 71 HG3 GLU 71 5.761 13.346 -15.931 1239 H HIS 72 H HIS 72 8.553 12.456 -19.488 1240 HA HIS 72 HA HIS 72 11.196 13.403 -19.993 1241 HB2 HIS 72 HB2 HIS 72 9.192 12.080 -21.867 1242 HB3 HIS 72 HB3 HIS 72 10.893 12.346 -22.252 1243 HD1 HIS 72 HD1 HIS 72 12.620 10.818 -21.137 1244 HD2 HIS 72 HD2 HIS 72 8.716 9.995 -19.987 1245 HE1 HIS 72 HE1 HIS 72 12.733 8.651 -19.896 1246 HE2 HIS 72 HE2 HIS 72 10.390 8.230 -19.107 1247 H HIS 73 H HIS 73 11.643 15.464 -20.364 1248 HA HIS 73 HA HIS 73 9.849 17.393 -21.511 1249 HB2 HIS 73 HB2 HIS 73 12.845 17.594 -20.949 1250 HB3 HIS 73 HB3 HIS 73 11.778 18.952 -21.308 1251 HD1 HIS 73 HD1 HIS 73 12.345 16.318 -18.623 1252 HD2 HIS 73 HD2 HIS 73 10.542 20.024 -19.088 1253 HE1 HIS 73 HE1 HIS 73 11.640 17.001 -16.326 1254 HE2 HIS 73 HE2 HIS 73 10.713 19.323 -16.609 1255 H HIS 74 H HIS 74 9.314 16.488 -23.576 1256 HA HIS 74 HA HIS 74 11.339 15.814 -25.527 1257 HB2 HIS 74 HB2 HIS 74 9.178 14.576 -25.376 1258 HB3 HIS 74 HB3 HIS 74 8.318 16.034 -25.857 1259 HD1 HIS 74 HD1 HIS 74 11.414 14.454 -27.418 1260 HD2 HIS 74 HD2 HIS 74 7.501 15.445 -28.395 1261 HE1 HIS 74 HE1 HIS 74 11.185 13.938 -29.862 1262 HE2 HIS 74 HE2 HIS 74 8.750 14.310 -30.346 1263 H HIS 75 H HIS 75 12.406 17.839 -25.430 1264 HA HIS 75 HA HIS 75 11.571 19.770 -27.463 1265 HB2 HIS 75 HB2 HIS 75 12.198 20.541 -24.573 1266 HB3 HIS 75 HB3 HIS 75 12.279 21.692 -25.902 1267 HD1 HIS 75 HD1 HIS 75 9.966 20.325 -23.460 1268 HD2 HIS 75 HD2 HIS 75 9.664 22.058 -27.221 1269 HE1 HIS 75 HE1 HIS 75 7.570 21.024 -23.678 1270 HE2 HIS 75 HE2 HIS 75 7.373 21.868 -26.037 1271 H HIS 76 H HIS 76 13.351 20.720 -28.498 1272 HA HIS 76 HA HIS 76 15.922 19.366 -28.139 1273 HB2 HIS 76 HB2 HIS 76 14.771 19.640 -30.384 1274 HB3 HIS 76 HB3 HIS 76 15.083 21.369 -30.282 1275 HD1 HIS 76 HD1 HIS 76 16.959 18.073 -30.449 1276 HD2 HIS 76 HD2 HIS 76 17.559 22.102 -31.266 1277 HE1 HIS 76 HE1 HIS 76 19.185 18.195 -31.594 1278 HE2 HIS 76 HE2 HIS 76 19.589 20.651 -31.959 1279 H HIS 77 H HIS 77 14.506 22.356 -27.211 1280 HA HIS 77 HA HIS 77 17.006 23.868 -27.001 1281 HB2 HIS 77 HB2 HIS 77 14.951 25.056 -27.618 1282 HB3 HIS 77 HB3 HIS 77 14.155 24.526 -26.144 1283 HD1 HIS 77 HD1 HIS 77 14.225 26.136 -24.270 1284 HD2 HIS 77 HD2 HIS 77 17.253 26.864 -27.023 1285 HE1 HIS 77 HE1 HIS 77 15.328 28.250 -23.507 1286 HE2 HIS 77 HE2 HIS 77 17.264 28.567 -25.072 Start of MODEL 14 1 H1 MET 1 H1 MET 1 5.998 14.342 9.325 2 H2 MET 1 H2 MET 1 6.500 12.922 8.555 3 H3 MET 1 H3 MET 1 5.404 12.844 9.839 4 HA MET 1 HA MET 1 4.343 12.521 7.683 5 HB2 MET 1 HB2 MET 1 2.508 14.234 8.070 6 HB3 MET 1 HB3 MET 1 2.953 13.290 9.484 7 HG2 MET 1 HG2 MET 1 2.600 15.559 10.180 8 HG3 MET 1 HG3 MET 1 4.329 15.231 10.283 9 HE1 MET 1 HE1 MET 1 3.020 18.195 10.345 10 HE2 MET 1 HE2 MET 1 4.126 19.071 9.290 11 HE3 MET 1 HE3 MET 1 4.759 17.924 10.472 12 H LYS 2 H LYS 2 6.880 13.992 7.019 13 HA LYS 2 HA LYS 2 6.515 16.438 5.726 14 HB2 LYS 2 HB2 LYS 2 8.717 15.391 6.327 15 HB3 LYS 2 HB3 LYS 2 8.532 14.280 4.972 16 HG2 LYS 2 HG2 LYS 2 8.589 16.190 3.397 17 HG3 LYS 2 HG3 LYS 2 8.743 17.304 4.761 18 HD2 LYS 2 HD2 LYS 2 10.898 16.118 5.378 19 HD3 LYS 2 HD3 LYS 2 10.757 15.203 3.872 20 HE2 LYS 2 HE2 LYS 2 12.280 17.091 3.571 21 HE3 LYS 2 HE3 LYS 2 10.831 17.344 2.598 22 HZ1 LYS 2 HZ1 LYS 2 9.992 18.853 4.278 23 HZ2 LYS 2 HZ2 LYS 2 11.526 19.353 3.768 24 HZ3 LYS 2 HZ3 LYS 2 11.344 18.573 5.256 25 H MET 3 H MET 3 6.818 13.264 4.039 26 HA MET 3 HA MET 3 4.839 14.173 2.004 27 HB2 MET 3 HB2 MET 3 7.183 12.264 1.527 28 HB3 MET 3 HB3 MET 3 5.985 12.745 0.329 29 HG2 MET 3 HG2 MET 3 8.046 14.546 1.627 30 HG3 MET 3 HG3 MET 3 8.081 13.929 -0.025 31 HE1 MET 3 HE1 MET 3 4.998 14.271 -0.958 32 HE2 MET 3 HE2 MET 3 6.380 14.736 -1.954 33 HE3 MET 3 HE3 MET 3 5.070 15.883 -1.671 34 H LEU 4 H LEU 4 3.529 12.386 1.071 35 HA LEU 4 HA LEU 4 2.563 10.538 3.027 36 HB2 LEU 4 HB2 LEU 4 1.948 10.891 0.086 37 HB3 LEU 4 HB3 LEU 4 1.260 9.559 0.995 38 HG LEU 4 HG LEU 4 0.130 11.178 2.517 39 HD11 LEU 4 HD11 LEU 4 0.003 13.566 1.965 40 HD12 LEU 4 HD12 LEU 4 1.187 13.343 0.676 41 HD13 LEU 4 HD13 LEU 4 1.655 13.086 2.358 42 HD21 LEU 4 HD21 LEU 4 -1.078 10.278 0.575 43 HD22 LEU 4 HD22 LEU 4 -0.497 11.614 -0.423 44 HD23 LEU 4 HD23 LEU 4 -1.592 11.930 0.926 45 H LYS 5 H LYS 5 5.053 10.324 0.681 46 HA LYS 5 HA LYS 5 5.432 7.476 0.625 47 HB2 LYS 5 HB2 LYS 5 6.287 8.952 -1.158 48 HB3 LYS 5 HB3 LYS 5 7.285 9.817 0.008 49 HG2 LYS 5 HG2 LYS 5 8.603 7.739 0.382 50 HG3 LYS 5 HG3 LYS 5 7.638 6.927 -0.857 51 HD2 LYS 5 HD2 LYS 5 8.493 8.418 -2.580 52 HD3 LYS 5 HD3 LYS 5 9.297 9.429 -1.372 53 HE2 LYS 5 HE2 LYS 5 10.004 6.547 -2.046 54 HE3 LYS 5 HE3 LYS 5 10.918 7.984 -2.511 55 HZ1 LYS 5 HZ1 LYS 5 10.510 6.929 0.231 56 HZ2 LYS 5 HZ2 LYS 5 11.193 8.439 -0.090 57 HZ3 LYS 5 HZ3 LYS 5 11.965 7.030 -0.629 58 H GLU 6 H GLU 6 6.836 10.178 2.486 59 HA GLU 6 HA GLU 6 8.846 8.625 3.804 60 HB2 GLU 6 HB2 GLU 6 7.829 11.400 4.542 61 HB3 GLU 6 HB3 GLU 6 9.335 10.663 5.089 62 HG2 GLU 6 HG2 GLU 6 8.623 11.561 2.282 63 HG3 GLU 6 HG3 GLU 6 9.847 12.248 3.347 64 H LYS 7 H LYS 7 5.673 9.897 4.842 65 HA LYS 7 HA LYS 7 5.674 8.981 7.507 66 HB2 LYS 7 HB2 LYS 7 3.225 9.136 7.437 67 HB3 LYS 7 HB3 LYS 7 3.957 10.538 6.656 68 HG2 LYS 7 HG2 LYS 7 3.411 9.772 4.488 69 HG3 LYS 7 HG3 LYS 7 3.063 8.139 5.039 70 HD2 LYS 7 HD2 LYS 7 1.404 10.582 5.686 71 HD3 LYS 7 HD3 LYS 7 1.050 9.403 4.420 72 HE2 LYS 7 HE2 LYS 7 0.866 7.636 6.160 73 HE3 LYS 7 HE3 LYS 7 1.146 8.854 7.404 74 HZ1 LYS 7 HZ1 LYS 7 -1.116 8.837 5.493 75 HZ2 LYS 7 HZ2 LYS 7 -0.864 9.968 6.710 76 HZ3 LYS 7 HZ3 LYS 7 -1.190 8.344 7.106 77 H ALA 8 H ALA 8 4.846 7.332 4.481 78 HA ALA 8 HA ALA 8 3.668 4.985 5.486 79 HB1 ALA 8 HB1 ALA 8 4.147 4.015 3.265 80 HB2 ALA 8 HB2 ALA 8 5.253 5.348 2.916 81 HB3 ALA 8 HB3 ALA 8 3.528 5.663 3.122 82 H GLY 9 H GLY 9 7.013 5.925 4.995 83 HA2 GLY 9 HA2 GLY 9 8.284 3.427 5.624 84 HA3 GLY 9 HA3 GLY 9 9.041 5.009 5.613 85 H ALA 10 H ALA 10 7.388 6.269 7.568 86 HA ALA 10 HA ALA 10 8.542 5.417 10.038 87 HB1 ALA 10 HB1 ALA 10 6.226 7.329 9.572 88 HB2 ALA 10 HB2 ALA 10 7.935 7.767 9.611 89 HB3 ALA 10 HB3 ALA 10 7.146 7.167 11.072 90 H LEU 11 H LEU 11 5.334 5.001 8.592 91 HA LEU 11 HA LEU 11 4.047 3.603 10.708 92 HB2 LEU 11 HB2 LEU 11 3.521 3.571 7.711 93 HB3 LEU 11 HB3 LEU 11 2.441 2.877 8.918 94 HG LEU 11 HG LEU 11 3.164 5.830 8.749 95 HD11 LEU 11 HD11 LEU 11 0.630 4.440 7.839 96 HD12 LEU 11 HD12 LEU 11 1.860 5.163 6.796 97 HD13 LEU 11 HD13 LEU 11 0.909 6.184 7.872 98 HD21 LEU 11 HD21 LEU 11 1.322 6.145 10.357 99 HD22 LEU 11 HD22 LEU 11 2.602 5.138 11.028 100 HD23 LEU 11 HD23 LEU 11 1.104 4.395 10.460 101 H ALA 12 H ALA 12 5.986 2.595 7.932 102 HA ALA 12 HA ALA 12 5.737 -0.186 8.116 103 HB1 ALA 12 HB1 ALA 12 8.187 1.373 7.234 104 HB2 ALA 12 HB2 ALA 12 6.802 0.974 6.217 105 HB3 ALA 12 HB3 ALA 12 7.821 -0.317 6.855 106 H GLY 13 H GLY 13 7.694 2.045 10.015 107 HA2 GLY 13 HA2 GLY 13 9.385 0.231 11.350 108 HA3 GLY 13 HA3 GLY 13 8.862 1.787 11.967 109 H GLN 14 H GLN 14 6.237 1.564 12.432 110 HA GLN 14 HA GLN 14 6.209 0.017 14.858 111 HB2 GLN 14 HB2 GLN 14 3.988 1.049 15.257 112 HB3 GLN 14 HB3 GLN 14 5.227 2.232 14.861 113 HG2 GLN 14 HG2 GLN 14 4.337 2.305 12.514 114 HG3 GLN 14 HG3 GLN 14 3.039 1.223 13.014 115 HE21 GLN 14 HE21 GLN 14 4.336 3.880 14.961 116 HE22 GLN 14 HE22 GLN 14 2.905 4.836 14.922 117 H ILE 15 H ILE 15 4.551 -0.315 11.730 118 HA ILE 15 HA ILE 15 2.732 -2.379 12.502 119 HB ILE 15 HB ILE 15 3.737 -1.546 9.743 120 HG12 ILE 15 HG12 ILE 15 1.097 -0.962 11.176 121 HG13 ILE 15 HG13 ILE 15 2.424 0.181 11.000 122 HG21 ILE 15 HG21 ILE 15 1.427 -3.429 10.368 123 HG22 ILE 15 HG22 ILE 15 2.953 -3.882 9.611 124 HG23 ILE 15 HG23 ILE 15 1.840 -2.807 8.767 125 HD11 ILE 15 HD11 ILE 15 2.088 0.173 8.568 126 HD12 ILE 15 HD12 ILE 15 0.639 0.658 9.445 127 HD13 ILE 15 HD13 ILE 15 0.749 -0.963 8.765 128 H TRP 16 H TRP 16 5.947 -2.470 10.938 129 HA TRP 16 HA TRP 16 6.236 -5.286 10.846 130 HB2 TRP 16 HB2 TRP 16 7.673 -3.670 9.589 131 HB3 TRP 16 HB3 TRP 16 8.417 -3.173 11.103 132 HD1 TRP 16 HD1 TRP 16 8.403 -6.029 8.568 133 HE1 TRP 16 HE1 TRP 16 10.405 -7.580 9.040 134 HE3 TRP 16 HE3 TRP 16 9.984 -3.990 12.970 135 HZ2 TRP 16 HZ2 TRP 16 12.381 -7.904 11.025 136 HZ3 TRP 16 HZ3 TRP 16 11.926 -4.973 14.101 137 HH2 TRP 16 HH2 TRP 16 13.105 -6.891 13.150 138 H GLU 17 H GLU 17 7.120 -2.901 13.382 139 HA GLU 17 HA GLU 17 8.311 -4.691 15.219 140 HB2 GLU 17 HB2 GLU 17 7.047 -1.966 15.482 141 HB3 GLU 17 HB3 GLU 17 7.504 -2.838 16.937 142 HG2 GLU 17 HG2 GLU 17 9.443 -2.215 14.694 143 HG3 GLU 17 HG3 GLU 17 9.187 -1.160 16.083 144 H ALA 18 H ALA 18 4.901 -3.948 14.640 145 HA ALA 18 HA ALA 18 3.763 -5.293 16.870 146 HB1 ALA 18 HB1 ALA 18 2.639 -4.924 14.067 147 HB2 ALA 18 HB2 ALA 18 2.474 -3.787 15.407 148 HB3 ALA 18 HB3 ALA 18 1.707 -5.371 15.502 149 H LEU 19 H LEU 19 4.844 -6.398 13.700 150 HA LEU 19 HA LEU 19 4.010 -9.162 13.983 151 HB2 LEU 19 HB2 LEU 19 5.830 -7.804 11.964 152 HB3 LEU 19 HB3 LEU 19 5.195 -9.437 11.811 153 HG LEU 19 HG LEU 19 3.424 -6.956 11.902 154 HD11 LEU 19 HD11 LEU 19 4.381 -8.461 9.448 155 HD12 LEU 19 HD12 LEU 19 4.852 -6.825 9.921 156 HD13 LEU 19 HD13 LEU 19 3.183 -7.163 9.473 157 HD21 LEU 19 HD21 LEU 19 2.291 -9.027 12.567 158 HD22 LEU 19 HD22 LEU 19 2.812 -9.815 11.076 159 HD23 LEU 19 HD23 LEU 19 1.689 -8.454 11.015 160 H ASN 20 H ASN 20 6.827 -7.314 14.827 161 HA ASN 20 HA ASN 20 8.835 -9.325 14.577 162 HB2 ASN 20 HB2 ASN 20 9.350 -6.909 14.500 163 HB3 ASN 20 HB3 ASN 20 8.857 -6.736 16.181 164 HD21 ASN 20 HD21 ASN 20 10.904 -5.964 16.781 165 HD22 ASN 20 HD22 ASN 20 12.287 -6.995 16.881 166 H GLY 21 H GLY 21 9.582 -10.798 16.006 167 HA2 GLY 21 HA2 GLY 21 9.803 -12.118 17.865 168 HA3 GLY 21 HA3 GLY 21 9.130 -10.819 18.836 169 H THR 22 H THR 22 7.107 -11.725 16.240 170 HA THR 22 HA THR 22 5.423 -13.495 17.936 171 HB THR 22 HB THR 22 4.272 -11.408 16.016 172 HG1 THR 22 HG1 THR 22 5.118 -10.064 17.488 173 HG21 THR 22 HG21 THR 22 2.207 -11.699 17.335 174 HG22 THR 22 HG22 THR 22 3.018 -12.868 18.378 175 HG23 THR 22 HG23 THR 22 2.741 -13.250 16.676 176 H GLU 23 H GLU 23 3.960 -14.905 16.714 177 HA GLU 23 HA GLU 23 5.017 -16.308 14.538 178 HB2 GLU 23 HB2 GLU 23 2.794 -17.424 14.446 179 HB3 GLU 23 HB3 GLU 23 3.398 -17.290 16.095 180 HG2 GLU 23 HG2 GLU 23 1.881 -15.481 16.593 181 HG3 GLU 23 HG3 GLU 23 1.399 -15.337 14.906 182 H GLY 24 H GLY 24 2.974 -13.448 14.515 183 HA2 GLY 24 HA2 GLY 24 2.894 -12.293 12.239 184 HA3 GLY 24 HA3 GLY 24 2.225 -13.812 11.660 185 H LEU 25 H LEU 25 1.014 -11.054 11.751 186 HA LEU 25 HA LEU 25 -1.284 -11.491 13.585 187 HB2 LEU 25 HB2 LEU 25 0.223 -8.898 13.043 188 HB3 LEU 25 HB3 LEU 25 -1.353 -8.936 13.798 189 HG LEU 25 HG LEU 25 -0.293 -10.317 15.684 190 HD11 LEU 25 HD11 LEU 25 2.288 -9.422 14.392 191 HD12 LEU 25 HD12 LEU 25 1.728 -11.082 14.600 192 HD13 LEU 25 HD13 LEU 25 2.132 -10.112 16.009 193 HD21 LEU 25 HD21 LEU 25 0.706 -7.474 15.289 194 HD22 LEU 25 HD22 LEU 25 0.652 -8.343 16.827 195 HD23 LEU 25 HD23 LEU 25 -0.845 -7.949 15.986 196 H THR 26 H THR 26 -3.326 -10.696 12.891 197 HA THR 26 HA THR 26 -3.760 -10.246 10.034 198 HB THR 26 HB THR 26 -6.151 -10.219 10.555 199 HG1 THR 26 HG1 THR 26 -6.913 -9.824 12.507 200 HG21 THR 26 HG21 THR 26 -6.482 -12.410 11.630 201 HG22 THR 26 HG22 THR 26 -4.815 -12.391 12.211 202 HG23 THR 26 HG23 THR 26 -5.146 -12.476 10.477 203 H GLN 27 H GLN 27 -5.570 -8.345 9.638 204 HA GLN 27 HA GLN 27 -4.429 -5.823 10.076 205 HB2 GLN 27 HB2 GLN 27 -7.262 -6.634 9.385 206 HB3 GLN 27 HB3 GLN 27 -6.858 -4.941 9.638 207 HG2 GLN 27 HG2 GLN 27 -5.159 -5.109 7.830 208 HG3 GLN 27 HG3 GLN 27 -5.677 -6.767 7.535 209 HE21 GLN 27 HE21 GLN 27 -6.810 -3.413 7.571 210 HE22 GLN 27 HE22 GLN 27 -8.046 -3.636 6.386 211 H LYS 28 H LYS 28 -7.136 -7.350 11.888 212 HA LYS 28 HA LYS 28 -7.629 -5.312 13.761 213 HB2 LYS 28 HB2 LYS 28 -7.993 -8.324 14.001 214 HB3 LYS 28 HB3 LYS 28 -8.557 -7.191 15.231 215 HG2 LYS 28 HG2 LYS 28 -10.039 -6.122 13.587 216 HG3 LYS 28 HG3 LYS 28 -9.468 -7.235 12.337 217 HD2 LYS 28 HD2 LYS 28 -10.417 -9.141 13.543 218 HD3 LYS 28 HD3 LYS 28 -10.878 -8.099 14.895 219 HE2 LYS 28 HE2 LYS 28 -11.988 -7.903 12.067 220 HE3 LYS 28 HE3 LYS 28 -12.811 -8.631 13.450 221 HZ1 LYS 28 HZ1 LYS 28 -13.548 -6.363 13.038 222 HZ2 LYS 28 HZ2 LYS 28 -11.976 -5.787 13.260 223 HZ3 LYS 28 HZ3 LYS 28 -12.810 -6.490 14.552 224 H GLN 29 H GLN 29 -5.345 -8.019 13.932 225 HA GLN 29 HA GLN 29 -4.563 -7.672 16.644 226 HB2 GLN 29 HB2 GLN 29 -3.167 -9.079 14.342 227 HB3 GLN 29 HB3 GLN 29 -2.657 -9.194 16.024 228 HG2 GLN 29 HG2 GLN 29 -5.401 -10.054 15.066 229 HG3 GLN 29 HG3 GLN 29 -4.010 -11.134 15.105 230 HE21 GLN 29 HE21 GLN 29 -4.968 -12.516 16.578 231 HE22 GLN 29 HE22 GLN 29 -5.187 -12.111 18.242 232 H ILE 30 H ILE 30 -3.007 -6.613 13.576 233 HA ILE 30 HA ILE 30 -0.826 -5.207 14.788 234 HB ILE 30 HB ILE 30 -2.102 -4.717 12.052 235 HG12 ILE 30 HG12 ILE 30 0.347 -6.405 12.750 236 HG13 ILE 30 HG13 ILE 30 -1.241 -7.054 12.358 237 HG21 ILE 30 HG21 ILE 30 -0.752 -2.782 12.758 238 HG22 ILE 30 HG22 ILE 30 0.042 -3.629 11.432 239 HG23 ILE 30 HG23 ILE 30 0.627 -3.837 13.083 240 HD11 ILE 30 HD11 ILE 30 0.529 -5.471 10.492 241 HD12 ILE 30 HD12 ILE 30 -1.060 -6.130 10.098 242 HD13 ILE 30 HD13 ILE 30 0.276 -7.218 10.473 243 H LYS 31 H LYS 31 -4.043 -4.233 13.724 244 HA LYS 31 HA LYS 31 -4.017 -1.453 13.999 245 HB2 LYS 31 HB2 LYS 31 -5.783 -2.984 12.976 246 HB3 LYS 31 HB3 LYS 31 -6.362 -3.295 14.604 247 HG2 LYS 31 HG2 LYS 31 -6.975 -0.929 14.842 248 HG3 LYS 31 HG3 LYS 31 -6.321 -0.596 13.231 249 HD2 LYS 31 HD2 LYS 31 -7.989 -2.367 12.356 250 HD3 LYS 31 HD3 LYS 31 -8.753 -2.279 13.950 251 HE2 LYS 31 HE2 LYS 31 -9.942 -0.844 12.396 252 HE3 LYS 31 HE3 LYS 31 -9.111 0.173 13.572 253 HZ1 LYS 31 HZ1 LYS 31 -8.903 0.961 11.281 254 HZ2 LYS 31 HZ2 LYS 31 -8.101 -0.468 10.862 255 HZ3 LYS 31 HZ3 LYS 31 -7.399 0.597 11.967 256 H LYS 32 H LYS 32 -4.624 -3.964 16.387 257 HA LYS 32 HA LYS 32 -5.183 -2.379 18.671 258 HB2 LYS 32 HB2 LYS 32 -5.660 -4.810 18.515 259 HB3 LYS 32 HB3 LYS 32 -3.941 -5.155 18.434 260 HG2 LYS 32 HG2 LYS 32 -4.696 -5.670 20.649 261 HG3 LYS 32 HG3 LYS 32 -3.686 -4.226 20.749 262 HD2 LYS 32 HD2 LYS 32 -5.728 -2.814 20.868 263 HD3 LYS 32 HD3 LYS 32 -6.734 -4.264 20.761 264 HE2 LYS 32 HE2 LYS 32 -5.654 -5.075 22.896 265 HE3 LYS 32 HE3 LYS 32 -4.837 -3.514 23.016 266 HZ1 LYS 32 HZ1 LYS 32 -7.001 -2.447 23.104 267 HZ2 LYS 32 HZ2 LYS 32 -6.835 -3.584 24.344 268 HZ3 LYS 32 HZ3 LYS 32 -7.774 -3.947 22.988 269 H ALA 33 H ALA 33 -2.119 -3.834 17.481 270 HA ALA 33 HA ALA 33 -0.531 -2.951 19.719 271 HB1 ALA 33 HB1 ALA 33 1.343 -4.013 18.534 272 HB2 ALA 33 HB2 ALA 33 0.353 -4.168 17.079 273 HB3 ALA 33 HB3 ALA 33 -0.076 -5.061 18.538 274 H THR 34 H THR 34 -1.280 -1.515 16.638 275 HA THR 34 HA THR 34 0.884 0.501 16.869 276 HB THR 34 HB THR 34 0.453 1.028 14.482 277 HG1 THR 34 HG1 THR 34 -1.079 -1.171 13.912 278 HG21 THR 34 HG21 THR 34 2.136 -0.708 14.983 279 HG22 THR 34 HG22 THR 34 1.287 -1.066 13.478 280 HG23 THR 34 HG23 THR 34 0.877 -1.949 14.950 281 H LYS 35 H LYS 35 -2.560 0.101 17.030 282 HA LYS 35 HA LYS 35 -4.255 1.440 17.688 283 HB2 LYS 35 HB2 LYS 35 -2.063 3.465 18.295 284 HB3 LYS 35 HB3 LYS 35 -3.758 3.726 18.691 285 HG2 LYS 35 HG2 LYS 35 -1.991 1.512 19.795 286 HG3 LYS 35 HG3 LYS 35 -2.467 2.989 20.645 287 HD2 LYS 35 HD2 LYS 35 -4.879 2.252 20.417 288 HD3 LYS 35 HD3 LYS 35 -4.299 0.728 19.732 289 HE2 LYS 35 HE2 LYS 35 -3.696 1.782 22.518 290 HE3 LYS 35 HE3 LYS 35 -4.813 0.477 22.117 291 HZ1 LYS 35 HZ1 LYS 35 -1.878 0.460 21.687 292 HZ2 LYS 35 HZ2 LYS 35 -2.929 -0.782 21.242 293 HZ3 LYS 35 HZ3 LYS 35 -2.718 -0.401 22.874 294 H LEU 36 H LEU 36 -3.453 1.312 14.908 295 HA LEU 36 HA LEU 36 -4.067 3.943 13.776 296 HB2 LEU 36 HB2 LEU 36 -3.603 1.291 12.354 297 HB3 LEU 36 HB3 LEU 36 -3.766 2.861 11.575 298 HG LEU 36 HG LEU 36 -1.467 1.881 13.312 299 HD11 LEU 36 HD11 LEU 36 -0.099 2.301 11.319 300 HD12 LEU 36 HD12 LEU 36 -1.533 2.825 10.429 301 HD13 LEU 36 HD13 LEU 36 -1.394 1.152 10.980 302 HD21 LEU 36 HD21 LEU 36 -1.884 4.183 13.987 303 HD22 LEU 36 HD22 LEU 36 -1.898 4.714 12.303 304 HD23 LEU 36 HD23 LEU 36 -0.409 4.099 13.025 305 H LYS 37 H LYS 37 -6.162 4.440 14.234 306 HA LYS 37 HA LYS 37 -8.404 2.715 14.240 307 HB2 LYS 37 HB2 LYS 37 -8.178 5.740 14.052 308 HB3 LYS 37 HB3 LYS 37 -9.743 4.951 13.992 309 HG2 LYS 37 HG2 LYS 37 -9.404 5.705 16.231 310 HG3 LYS 37 HG3 LYS 37 -9.284 3.948 16.235 311 HD2 LYS 37 HD2 LYS 37 -7.580 4.934 17.697 312 HD3 LYS 37 HD3 LYS 37 -6.816 4.107 16.338 313 HE2 LYS 37 HE2 LYS 37 -5.735 6.274 16.864 314 HE3 LYS 37 HE3 LYS 37 -6.398 6.246 15.232 315 HZ1 LYS 37 HZ1 LYS 37 -6.848 8.325 16.403 316 HZ2 LYS 37 HZ2 LYS 37 -7.727 7.485 17.582 317 HZ3 LYS 37 HZ3 LYS 37 -8.272 7.521 15.980 318 H ALA 38 H ALA 38 -7.086 4.794 11.685 319 HA ALA 38 HA ALA 38 -9.065 3.892 9.716 320 HB1 ALA 38 HB1 ALA 38 -8.036 5.586 8.246 321 HB2 ALA 38 HB2 ALA 38 -6.806 5.921 9.470 322 HB3 ALA 38 HB3 ALA 38 -8.500 6.297 9.793 323 H ASP 39 H ASP 39 -8.644 2.089 8.573 324 HA ASP 39 HA ASP 39 -6.104 0.804 8.446 325 HB2 ASP 39 HB2 ASP 39 -8.587 0.342 6.755 326 HB3 ASP 39 HB3 ASP 39 -7.187 -0.726 6.802 327 H LYS 40 H LYS 40 -7.625 3.224 6.415 328 HA LYS 40 HA LYS 40 -6.214 3.145 4.013 329 HB2 LYS 40 HB2 LYS 40 -6.908 5.625 5.660 330 HB3 LYS 40 HB3 LYS 40 -6.516 5.629 3.941 331 HG2 LYS 40 HG2 LYS 40 -8.899 4.169 5.116 332 HG3 LYS 40 HG3 LYS 40 -8.966 5.828 4.509 333 HD2 LYS 40 HD2 LYS 40 -8.235 4.986 2.262 334 HD3 LYS 40 HD3 LYS 40 -8.277 3.336 2.892 335 HE2 LYS 40 HE2 LYS 40 -10.691 3.530 3.302 336 HE3 LYS 40 HE3 LYS 40 -10.670 5.213 2.772 337 HZ1 LYS 40 HZ1 LYS 40 -11.468 3.763 1.041 338 HZ2 LYS 40 HZ2 LYS 40 -10.040 2.858 1.084 339 HZ3 LYS 40 HZ3 LYS 40 -10.003 4.470 0.572 340 H ASP 41 H ASP 41 -5.201 4.481 7.125 341 HA ASP 41 HA ASP 41 -2.643 5.513 6.355 342 HB2 ASP 41 HB2 ASP 41 -4.024 6.275 8.335 343 HB3 ASP 41 HB3 ASP 41 -3.703 4.732 9.119 344 H PHE 42 H PHE 42 -3.787 2.545 7.914 345 HA PHE 42 HA PHE 42 -1.396 1.196 8.466 346 HB2 PHE 42 HB2 PHE 42 -3.394 0.403 9.485 347 HB3 PHE 42 HB3 PHE 42 -4.236 0.265 7.950 348 HD1 PHE 42 HD1 PHE 42 -1.460 -1.263 9.951 349 HD2 PHE 42 HD2 PHE 42 -4.315 -1.827 6.814 350 HE1 PHE 42 HE1 PHE 42 -0.882 -3.645 9.835 351 HE2 PHE 42 HE2 PHE 42 -3.726 -4.211 6.719 352 HZ PHE 42 HZ PHE 42 -2.007 -5.121 8.227 353 H PHE 43 H PHE 43 -3.334 1.105 5.450 354 HA PHE 43 HA PHE 43 -1.970 -1.021 4.174 355 HB2 PHE 43 HB2 PHE 43 -3.547 1.246 2.893 356 HB3 PHE 43 HB3 PHE 43 -3.042 -0.223 2.064 357 HD1 PHE 43 HD2 PHE 43 -3.667 -2.348 4.010 358 HD2 PHE 43 HD1 PHE 43 -5.893 1.159 2.997 359 HE1 PHE 43 HE2 PHE 43 -5.749 -3.459 4.710 360 HE2 PHE 43 HE1 PHE 43 -7.970 0.042 3.694 361 HZ PHE 43 HZ PHE 43 -7.896 -2.270 4.551 362 H LEU 44 H LEU 44 -1.299 2.458 4.203 363 HA LEU 44 HA LEU 44 0.731 2.499 2.206 364 HB2 LEU 44 HB2 LEU 44 -0.023 4.331 4.480 365 HB3 LEU 44 HB3 LEU 44 1.524 4.583 3.696 366 HG LEU 44 HG LEU 44 0.415 4.965 1.531 367 HD11 LEU 44 HD11 LEU 44 -2.015 5.171 1.314 368 HD12 LEU 44 HD12 LEU 44 -2.224 4.624 2.978 369 HD13 LEU 44 HD13 LEU 44 -1.555 3.531 1.767 370 HD21 LEU 44 HD21 LEU 44 0.829 6.892 3.001 371 HD22 LEU 44 HD22 LEU 44 -0.767 6.687 3.731 372 HD23 LEU 44 HD23 LEU 44 -0.625 7.127 2.028 373 H GLY 45 H GLY 45 0.875 1.998 5.742 374 HA2 GLY 45 HA2 GLY 45 3.709 1.722 5.972 375 HA3 GLY 45 HA3 GLY 45 2.514 1.165 7.130 376 H LEU 46 H LEU 46 1.124 -0.738 5.795 377 HA LEU 46 HA LEU 46 2.779 -3.046 5.852 378 HB2 LEU 46 HB2 LEU 46 0.355 -3.079 6.408 379 HB3 LEU 46 HB3 LEU 46 -0.034 -2.710 4.735 380 HG LEU 46 HG LEU 46 1.001 -4.897 4.044 381 HD11 LEU 46 HD11 LEU 46 1.489 -6.606 5.731 382 HD12 LEU 46 HD12 LEU 46 1.214 -5.431 7.019 383 HD13 LEU 46 HD13 LEU 46 2.556 -5.213 5.891 384 HD21 LEU 46 HD21 LEU 46 -1.265 -5.172 6.050 385 HD22 LEU 46 HD22 LEU 46 -0.839 -6.339 4.796 386 HD23 LEU 46 HD23 LEU 46 -1.434 -4.744 4.346 387 H GLY 47 H GLY 47 1.611 -1.013 3.259 388 HA2 GLY 47 HA2 GLY 47 2.393 -2.588 1.003 389 HA3 GLY 47 HA3 GLY 47 2.087 -0.854 1.006 390 H TRP 48 H TRP 48 4.032 -0.227 3.042 391 HA TRP 48 HA TRP 48 6.463 -0.111 1.524 392 HB2 TRP 48 HB2 TRP 48 5.564 1.637 3.219 393 HB3 TRP 48 HB3 TRP 48 6.215 0.588 4.473 394 HD1 TRP 48 HD1 TRP 48 8.943 0.420 4.619 395 HE1 TRP 48 HE1 TRP 48 10.792 1.968 3.736 396 HE3 TRP 48 HE3 TRP 48 6.175 3.203 1.342 397 HZ2 TRP 48 HZ2 TRP 48 11.051 4.093 1.910 398 HZ3 TRP 48 HZ3 TRP 48 7.299 4.981 0.061 399 HH2 TRP 48 HH2 TRP 48 9.693 5.419 0.341 400 H LEU 49 H LEU 49 5.259 -2.195 4.136 401 HA LEU 49 HA LEU 49 7.658 -3.623 4.695 402 HB2 LEU 49 HB2 LEU 49 4.725 -4.228 5.026 403 HB3 LEU 49 HB3 LEU 49 5.851 -5.555 5.193 404 HG LEU 49 HG LEU 49 6.903 -4.572 7.124 405 HD11 LEU 49 HD11 LEU 49 6.260 -2.400 8.038 406 HD12 LEU 49 HD12 LEU 49 5.219 -2.118 6.635 407 HD13 LEU 49 HD13 LEU 49 6.968 -2.254 6.431 408 HD21 LEU 49 HD21 LEU 49 3.901 -4.198 7.388 409 HD22 LEU 49 HD22 LEU 49 5.050 -4.424 8.712 410 HD23 LEU 49 HD23 LEU 49 4.765 -5.729 7.563 411 H LEU 50 H LEU 50 5.141 -4.136 2.216 412 HA LEU 50 HA LEU 50 6.359 -6.405 0.960 413 HB2 LEU 50 HB2 LEU 50 4.354 -4.354 -0.043 414 HB3 LEU 50 HB3 LEU 50 4.917 -5.679 -1.053 415 HG LEU 50 HG LEU 50 3.394 -5.977 1.569 416 HD11 LEU 50 HD11 LEU 50 1.548 -6.819 0.175 417 HD12 LEU 50 HD12 LEU 50 2.471 -6.463 -1.286 418 HD13 LEU 50 HD13 LEU 50 1.951 -5.150 -0.226 419 HD21 LEU 50 HD21 LEU 50 4.384 -8.112 -0.364 420 HD22 LEU 50 HD22 LEU 50 3.337 -8.395 1.027 421 HD23 LEU 50 HD23 LEU 50 4.979 -7.822 1.273 422 H ARG 51 H ARG 51 6.674 -2.913 0.534 423 HA ARG 51 HA ARG 51 8.291 -2.832 -1.768 424 HB2 ARG 51 HB2 ARG 51 7.903 -0.609 -1.437 425 HB3 ARG 51 HB3 ARG 51 7.247 -0.944 0.145 426 HG2 ARG 51 HG2 ARG 51 8.856 0.674 0.610 427 HG3 ARG 51 HG3 ARG 51 9.716 -0.819 0.976 428 HD2 ARG 51 HD2 ARG 51 10.575 -0.649 -1.486 429 HD3 ARG 51 HD3 ARG 51 10.062 1.037 -1.382 430 HE ARG 51 HE ARG 51 11.561 0.986 0.743 431 HH11 ARG 51 HH11 ARG 51 12.277 -0.656 -2.230 432 HH12 ARG 51 HH12 ARG 51 13.977 -0.629 -1.946 433 HH21 ARG 51 HH21 ARG 51 13.712 0.968 1.080 434 HH22 ARG 51 HH22 ARG 51 14.782 0.280 -0.090 435 H GLU 52 H GLU 52 9.163 -3.183 1.655 436 HA GLU 52 HA GLU 52 12.029 -3.266 1.173 437 HB2 GLU 52 HB2 GLU 52 10.408 -3.871 3.678 438 HB3 GLU 52 HB3 GLU 52 12.158 -3.721 3.619 439 HG2 GLU 52 HG2 GLU 52 10.220 -1.475 2.989 440 HG3 GLU 52 HG3 GLU 52 10.958 -1.736 4.566 441 H ASP 53 H ASP 53 9.518 -5.526 0.933 442 HA ASP 53 HA ASP 53 9.329 -7.741 0.578 443 HB2 ASP 53 HB2 ASP 53 12.374 -7.810 0.561 444 HB3 ASP 53 HB3 ASP 53 11.339 -9.153 0.087 445 H LYS 54 H LYS 54 9.655 -6.556 3.349 446 HA LYS 54 HA LYS 54 10.962 -8.557 4.979 447 HB2 LYS 54 HB2 LYS 54 9.302 -6.127 5.731 448 HB3 LYS 54 HB3 LYS 54 10.110 -7.165 6.908 449 HG2 LYS 54 HG2 LYS 54 12.295 -6.599 5.846 450 HG3 LYS 54 HG3 LYS 54 11.452 -5.490 4.761 451 HD2 LYS 54 HD2 LYS 54 11.597 -5.288 7.798 452 HD3 LYS 54 HD3 LYS 54 12.471 -4.276 6.645 453 HE2 LYS 54 HE2 LYS 54 10.323 -3.348 5.835 454 HE3 LYS 54 HE3 LYS 54 9.446 -4.382 6.963 455 HZ1 LYS 54 HZ1 LYS 54 10.552 -3.251 8.786 456 HZ2 LYS 54 HZ2 LYS 54 9.686 -2.164 7.823 457 HZ3 LYS 54 HZ3 LYS 54 11.365 -2.253 7.691 458 H VAL 55 H VAL 55 7.754 -8.391 3.684 459 HA VAL 55 HA VAL 55 6.836 -10.373 5.686 460 HB VAL 55 HB VAL 55 4.572 -9.463 5.811 461 HG11 VAL 55 HG11 VAL 55 6.649 -7.371 6.543 462 HG12 VAL 55 HG12 VAL 55 6.175 -8.761 7.525 463 HG13 VAL 55 HG13 VAL 55 5.011 -7.476 7.198 464 HG21 VAL 55 HG21 VAL 55 5.560 -7.139 4.103 465 HG22 VAL 55 HG22 VAL 55 3.986 -7.223 4.898 466 HG23 VAL 55 HG23 VAL 55 4.387 -8.367 3.617 467 H VAL 56 H VAL 56 5.268 -11.812 5.066 468 HA VAL 56 HA VAL 56 4.750 -12.136 2.196 469 HB VAL 56 HB VAL 56 5.866 -14.091 3.154 470 HG11 VAL 56 HG11 VAL 56 3.556 -14.315 5.121 471 HG12 VAL 56 HG12 VAL 56 5.215 -13.863 5.517 472 HG13 VAL 56 HG13 VAL 56 4.862 -15.489 4.930 473 HG21 VAL 56 HG21 VAL 56 4.223 -14.510 1.360 474 HG22 VAL 56 HG22 VAL 56 2.943 -14.710 2.559 475 HG23 VAL 56 HG23 VAL 56 4.273 -15.868 2.488 476 H THR 57 H THR 57 2.701 -11.912 1.439 477 HA THR 57 HA THR 57 0.600 -11.178 3.373 478 HB THR 57 HB THR 57 -0.554 -10.225 1.251 479 HG1 THR 57 HG1 THR 57 1.063 -9.684 -0.407 480 HG21 THR 57 HG21 THR 57 0.453 -8.746 2.922 481 HG22 THR 57 HG22 THR 57 0.784 -8.141 1.300 482 HG23 THR 57 HG23 THR 57 2.049 -8.978 2.202 483 H SER 58 H SER 58 -1.186 -12.238 3.573 484 HA SER 58 HA SER 58 -2.281 -14.057 1.564 485 HB2 SER 58 HB2 SER 58 -0.898 -15.535 3.036 486 HB3 SER 58 HB3 SER 58 -1.751 -14.931 4.455 487 HG SER 58 HG SER 58 -2.861 -16.720 3.988 488 H GLU 59 H GLU 59 -4.563 -14.775 2.415 489 HA GLU 59 HA GLU 59 -5.796 -12.618 4.045 490 HB2 GLU 59 HB2 GLU 59 -6.285 -12.271 1.616 491 HB3 GLU 59 HB3 GLU 59 -7.036 -13.863 1.545 492 HG2 GLU 59 HG2 GLU 59 -8.737 -13.132 3.185 493 HG3 GLU 59 HG3 GLU 59 -7.976 -11.545 3.267 494 H VAL 60 H VAL 60 -6.709 -13.412 5.775 495 HA VAL 60 HA VAL 60 -7.581 -16.242 5.929 496 HB VAL 60 HB VAL 60 -6.660 -14.316 8.112 497 HG11 VAL 60 HG11 VAL 60 -7.108 -16.115 9.778 498 HG12 VAL 60 HG12 VAL 60 -7.914 -17.067 8.529 499 HG13 VAL 60 HG13 VAL 60 -8.598 -15.523 9.041 500 HG21 VAL 60 HG21 VAL 60 -4.880 -15.478 6.854 501 HG22 VAL 60 HG22 VAL 60 -5.622 -17.036 7.233 502 HG23 VAL 60 HG23 VAL 60 -4.943 -16.046 8.526 503 H GLU 61 H GLU 61 -9.630 -16.377 5.471 504 HA GLU 61 HA GLU 61 -11.879 -16.242 5.496 505 HB2 GLU 61 HB2 GLU 61 -11.433 -15.405 8.387 506 HB3 GLU 61 HB3 GLU 61 -12.874 -16.185 7.733 507 HG2 GLU 61 HG2 GLU 61 -11.468 -18.196 7.192 508 HG3 GLU 61 HG3 GLU 61 -10.100 -17.401 7.954 509 H GLY 62 H GLY 62 -10.858 -13.930 4.353 510 HA2 GLY 62 HA2 GLY 62 -12.027 -12.146 3.370 511 HA3 GLY 62 HA3 GLY 62 -13.116 -12.101 4.741 512 H GLU 63 H GLU 63 -9.898 -12.115 5.849 513 HA GLU 63 HA GLU 63 -9.579 -9.171 5.673 514 HB2 GLU 63 HB2 GLU 63 -10.596 -9.856 7.899 515 HB3 GLU 63 HB3 GLU 63 -9.130 -10.774 8.236 516 HG2 GLU 63 HG2 GLU 63 -7.806 -8.676 8.098 517 HG3 GLU 63 HG3 GLU 63 -9.285 -7.773 7.783 518 H ILE 64 H ILE 64 -7.329 -8.426 6.027 519 HA ILE 64 HA ILE 64 -5.457 -10.157 4.636 520 HB ILE 64 HB ILE 64 -5.007 -7.356 5.776 521 HG12 ILE 64 HG12 ILE 64 -5.714 -8.164 2.914 522 HG13 ILE 64 HG13 ILE 64 -6.840 -7.442 4.057 523 HG21 ILE 64 HG21 ILE 64 -2.874 -8.537 5.407 524 HG22 ILE 64 HG22 ILE 64 -3.067 -7.239 4.228 525 HG23 ILE 64 HG23 ILE 64 -3.349 -8.914 3.748 526 HD11 ILE 64 HD11 ILE 64 -4.360 -6.125 2.940 527 HD12 ILE 64 HD12 ILE 64 -5.487 -5.396 4.090 528 HD13 ILE 64 HD13 ILE 64 -6.028 -5.808 2.464 529 H PHE 65 H PHE 65 -3.876 -11.345 5.518 530 HA PHE 65 HA PHE 65 -2.988 -10.956 8.318 531 HB2 PHE 65 HB2 PHE 65 -4.454 -12.898 8.321 532 HB3 PHE 65 HB3 PHE 65 -3.666 -13.570 6.899 533 HD1 PHE 65 HD2 PHE 65 -3.100 -12.759 10.508 534 HD2 PHE 65 HD1 PHE 65 -1.798 -15.055 7.148 535 HE1 PHE 65 HE2 PHE 65 -1.604 -14.046 11.962 536 HE2 PHE 65 HE1 PHE 65 -0.299 -16.334 8.616 537 HZ PHE 65 HZ PHE 65 -0.203 -15.832 11.021 538 H VAL 66 H VAL 66 -0.799 -10.856 8.540 539 HA VAL 66 HA VAL 66 0.957 -11.693 6.299 540 HB VAL 66 HB VAL 66 2.310 -9.591 6.608 541 HG11 VAL 66 HG11 VAL 66 0.782 -8.103 5.358 542 HG12 VAL 66 HG12 VAL 66 -0.587 -9.126 5.794 543 HG13 VAL 66 HG13 VAL 66 0.693 -9.760 4.757 544 HG21 VAL 66 HG21 VAL 66 1.605 -8.994 8.900 545 HG22 VAL 66 HG22 VAL 66 -0.033 -8.670 8.331 546 HG23 VAL 66 HG23 VAL 66 1.305 -7.652 7.793 547 H LYS 67 H LYS 67 3.097 -12.219 6.815 548 HA LYS 67 HA LYS 67 3.901 -12.344 9.678 549 HB2 LYS 67 HB2 LYS 67 4.211 -14.618 7.659 550 HB3 LYS 67 HB3 LYS 67 4.904 -14.607 9.280 551 HG2 LYS 67 HG2 LYS 67 2.593 -14.553 10.217 552 HG3 LYS 67 HG3 LYS 67 1.950 -14.670 8.575 553 HD2 LYS 67 HD2 LYS 67 3.768 -16.728 9.900 554 HD3 LYS 67 HD3 LYS 67 2.012 -16.866 9.773 555 HE2 LYS 67 HE2 LYS 67 3.906 -16.698 7.399 556 HE3 LYS 67 HE3 LYS 67 3.228 -18.192 8.047 557 HZ1 LYS 67 HZ1 LYS 67 1.013 -17.324 7.580 558 HZ2 LYS 67 HZ2 LYS 67 1.947 -17.449 6.177 559 HZ3 LYS 67 HZ3 LYS 67 1.688 -15.937 6.889 560 H LEU 68 H LEU 68 6.308 -12.567 9.917 561 HA LEU 68 HA LEU 68 7.725 -10.925 8.003 562 HB2 LEU 68 HB2 LEU 68 8.797 -12.431 10.420 563 HB3 LEU 68 HB3 LEU 68 9.673 -11.214 9.500 564 HG LEU 68 HG LEU 68 7.246 -10.777 11.281 565 HD11 LEU 68 HD11 LEU 68 9.374 -10.976 12.479 566 HD12 LEU 68 HD12 LEU 68 8.741 -9.335 12.574 567 HD13 LEU 68 HD13 LEU 68 10.078 -9.699 11.479 568 HD21 LEU 68 HD21 LEU 68 8.596 -8.775 9.439 569 HD22 LEU 68 HD22 LEU 68 7.415 -8.370 10.689 570 HD23 LEU 68 HD23 LEU 68 6.938 -9.377 9.325 571 H VAL 69 H VAL 69 9.109 -11.550 6.399 572 HA VAL 69 HA VAL 69 9.551 -14.351 5.774 573 HB VAL 69 HB VAL 69 10.758 -11.887 4.422 574 HG11 VAL 69 HG11 VAL 69 11.210 -13.391 2.488 575 HG12 VAL 69 HG12 VAL 69 10.622 -14.769 3.421 576 HG13 VAL 69 HG13 VAL 69 12.079 -13.917 3.934 577 HG21 VAL 69 HG21 VAL 69 9.019 -12.164 2.690 578 HG22 VAL 69 HG22 VAL 69 8.297 -11.861 4.271 579 HG23 VAL 69 HG23 VAL 69 8.304 -13.495 3.607 580 H LEU 70 H LEU 70 10.543 -14.791 7.855 581 HA LEU 70 HA LEU 70 13.362 -14.060 8.214 582 HB2 LEU 70 HB2 LEU 70 11.614 -15.934 9.867 583 HB3 LEU 70 HB3 LEU 70 13.196 -15.310 10.323 584 HG LEU 70 HG LEU 70 10.651 -13.657 10.010 585 HD11 LEU 70 HD11 LEU 70 12.149 -14.420 12.533 586 HD12 LEU 70 HD12 LEU 70 10.587 -15.055 12.011 587 HD13 LEU 70 HD13 LEU 70 10.742 -13.353 12.437 588 HD21 LEU 70 HD21 LEU 70 13.422 -12.754 10.871 589 HD22 LEU 70 HD22 LEU 70 11.957 -11.767 10.920 590 HD23 LEU 70 HD23 LEU 70 12.591 -12.322 9.374 591 H GLU 71 H GLU 71 11.522 -16.421 6.632 592 HA GLU 71 HA GLU 71 13.851 -18.182 6.197 593 HB2 GLU 71 HB2 GLU 71 12.360 -19.289 7.815 594 HB3 GLU 71 HB3 GLU 71 10.980 -19.057 6.754 595 HG2 GLU 71 HG2 GLU 71 11.771 -21.370 6.703 596 HG3 GLU 71 HG3 GLU 71 11.924 -20.605 5.122 597 H HIS 72 H HIS 72 14.148 -18.800 4.083 598 HA HIS 72 HA HIS 72 12.383 -17.552 2.051 599 HB2 HIS 72 HB2 HIS 72 15.383 -18.103 2.019 600 HB3 HIS 72 HB3 HIS 72 14.482 -17.582 0.596 601 HD1 HIS 72 HD1 HIS 72 14.789 -15.157 0.213 602 HD2 HIS 72 HD2 HIS 72 14.788 -16.031 4.279 603 HE1 HIS 72 HE1 HIS 72 15.073 -12.947 1.367 604 HE2 HIS 72 HE2 HIS 72 15.210 -13.516 3.811 605 H HIS 73 H HIS 73 11.001 -19.136 1.437 606 HA HIS 73 HA HIS 73 11.974 -21.186 -0.331 607 HB2 HIS 73 HB2 HIS 73 10.761 -23.095 0.803 608 HB3 HIS 73 HB3 HIS 73 12.171 -22.515 1.672 609 HD1 HIS 73 HD1 HIS 73 11.448 -23.340 3.942 610 HD2 HIS 73 HD2 HIS 73 8.585 -20.873 2.216 611 HE1 HIS 73 HE1 HIS 73 9.744 -22.935 5.739 612 HE2 HIS 73 HE2 HIS 73 7.968 -21.557 4.637 613 H HIS 74 H HIS 74 10.152 -22.320 -1.497 614 HA HIS 74 HA HIS 74 7.968 -20.489 -2.071 615 HB2 HIS 74 HB2 HIS 74 8.605 -23.226 -3.235 616 HB3 HIS 74 HB3 HIS 74 7.292 -22.197 -3.790 617 HD1 HIS 74 HD1 HIS 74 10.490 -23.147 -4.828 618 HD2 HIS 74 HD2 HIS 74 8.573 -19.472 -4.548 619 HE1 HIS 74 HE1 HIS 74 11.691 -21.643 -6.443 620 HE2 HIS 74 HE2 HIS 74 10.426 -19.471 -6.350 621 H HIS 75 H HIS 75 6.905 -20.539 0.019 622 HA HIS 75 HA HIS 75 5.299 -22.917 0.660 623 HB2 HIS 75 HB2 HIS 75 6.408 -21.267 2.390 624 HB3 HIS 75 HB3 HIS 75 5.041 -20.214 2.047 625 HD1 HIS 75 HD1 HIS 75 5.122 -20.961 4.847 626 HD2 HIS 75 HD2 HIS 75 3.450 -23.572 2.076 627 HE1 HIS 75 HE1 HIS 75 3.667 -22.514 6.177 628 HE2 HIS 75 HE2 HIS 75 2.736 -24.131 4.496 629 H HIS 76 H HIS 76 5.132 -20.387 -1.486 630 HA HIS 76 HA HIS 76 2.210 -20.654 -1.864 631 HB2 HIS 76 HB2 HIS 76 3.831 -18.076 -1.992 632 HB3 HIS 76 HB3 HIS 76 2.182 -18.224 -2.581 633 HD1 HIS 76 HD1 HIS 76 0.305 -18.196 -0.854 634 HD2 HIS 76 HD2 HIS 76 4.098 -18.015 0.837 635 HE1 HIS 76 HE1 HIS 76 -0.058 -17.522 1.521 636 HE2 HIS 76 HE2 HIS 76 2.215 -17.611 2.578 637 H HIS 77 H HIS 77 1.555 -20.019 -4.100 638 HA HIS 77 HA HIS 77 3.572 -20.675 -6.166 639 HB2 HIS 77 HB2 HIS 77 1.540 -22.113 -6.083 640 HB3 HIS 77 HB3 HIS 77 0.515 -20.698 -6.291 641 HD1 HIS 77 HD1 HIS 77 -0.069 -20.116 -8.644 642 HD2 HIS 77 HD2 HIS 77 3.217 -22.649 -8.470 643 HE1 HIS 77 HE1 HIS 77 0.430 -20.720 -11.021 644 HE2 HIS 77 HE2 HIS 77 2.339 -22.347 -10.888 645 H1 MET 1 H MET 1 -2.633 -20.261 -9.433 646 HA MET 1 HA MET 1 -3.515 -18.701 -8.037 647 HB2 MET 1 HB2 MET 1 -2.074 -20.273 -5.862 648 HB3 MET 1 HB3 MET 1 -3.260 -19.007 -5.565 649 HG2 MET 1 HG2 MET 1 -3.832 -21.618 -6.998 650 HG3 MET 1 HG3 MET 1 -4.195 -21.278 -5.309 651 HE1 MET 1 HE1 MET 1 -4.936 -19.748 -9.003 652 HE2 MET 1 HE2 MET 1 -6.687 -19.946 -8.944 653 HE3 MET 1 HE3 MET 1 -5.639 -21.359 -8.835 654 H LYS 2 H LYS 2 -2.652 -16.754 -8.531 655 HA LYS 2 HA LYS 2 0.096 -16.016 -7.833 656 HB2 LYS 2 HB2 LYS 2 -2.071 -14.449 -9.310 657 HB3 LYS 2 HB3 LYS 2 -0.382 -13.955 -9.141 658 HG2 LYS 2 HG2 LYS 2 0.325 -15.982 -10.387 659 HG3 LYS 2 HG3 LYS 2 -1.370 -16.450 -10.572 660 HD2 LYS 2 HD2 LYS 2 -1.782 -14.389 -11.894 661 HD3 LYS 2 HD3 LYS 2 -0.084 -13.932 -11.713 662 HE2 LYS 2 HE2 LYS 2 0.580 -15.997 -12.933 663 HE3 LYS 2 HE3 LYS 2 -1.122 -16.421 -13.127 664 HZ1 LYS 2 HZ1 LYS 2 -1.423 -14.391 -14.414 665 HZ2 LYS 2 HZ2 LYS 2 -0.256 -15.398 -15.108 666 HZ3 LYS 2 HZ3 LYS 2 0.221 -14.022 -14.249 667 H MET 3 H MET 3 0.662 -14.610 -6.199 668 HA MET 3 HA MET 3 -1.290 -14.474 -4.046 669 HB2 MET 3 HB2 MET 3 1.697 -13.944 -4.088 670 HB3 MET 3 HB3 MET 3 0.707 -13.920 -2.633 671 HG2 MET 3 HG2 MET 3 1.059 -16.349 -4.411 672 HG3 MET 3 HG3 MET 3 2.001 -16.022 -2.960 673 HE1 MET 3 HE1 MET 3 -1.897 -16.276 -4.078 674 HE2 MET 3 HE2 MET 3 -2.297 -17.672 -3.077 675 HE3 MET 3 HE3 MET 3 -1.079 -17.819 -4.343 676 H LEU 4 H LEU 4 -0.891 -12.599 -2.405 677 HA LEU 4 HA LEU 4 -2.144 -10.314 -3.545 678 HB2 LEU 4 HB2 LEU 4 -1.093 -10.821 -0.738 679 HB3 LEU 4 HB3 LEU 4 -1.969 -9.372 -1.190 680 HG LEU 4 HG LEU 4 -3.949 -10.872 -1.788 681 HD11 LEU 4 HD11 LEU 4 -4.077 -13.117 -0.821 682 HD12 LEU 4 HD12 LEU 4 -2.394 -13.009 -0.299 683 HD13 LEU 4 HD13 LEU 4 -2.786 -13.026 -2.020 684 HD21 LEU 4 HD21 LEU 4 -4.698 -11.100 0.545 685 HD22 LEU 4 HD22 LEU 4 -3.890 -9.556 0.283 686 HD23 LEU 4 HD23 LEU 4 -3.040 -10.865 1.110 687 H LYS 5 H LYS 5 1.197 -11.002 -2.681 688 HA LYS 5 HA LYS 5 2.174 -8.296 -2.958 689 HB2 LYS 5 HB2 LYS 5 3.440 -10.036 -1.693 690 HB3 LYS 5 HB3 LYS 5 3.671 -10.942 -3.185 691 HG2 LYS 5 HG2 LYS 5 4.898 -8.859 -4.076 692 HG3 LYS 5 HG3 LYS 5 4.886 -8.274 -2.410 693 HD2 LYS 5 HD2 LYS 5 6.181 -10.260 -1.700 694 HD3 LYS 5 HD3 LYS 5 6.139 -10.885 -3.352 695 HE2 LYS 5 HE2 LYS 5 8.309 -9.859 -2.925 696 HE3 LYS 5 HE3 LYS 5 7.436 -8.885 -4.107 697 HZ1 LYS 5 HZ1 LYS 5 8.541 -7.539 -2.420 698 HZ2 LYS 5 HZ2 LYS 5 7.631 -8.285 -1.203 699 HZ3 LYS 5 HZ3 LYS 5 6.864 -7.326 -2.365 700 H GLU 6 H GLU 6 1.727 -11.059 -5.135 701 HA GLU 6 HA GLU 6 3.289 -9.958 -7.288 702 HB2 GLU 6 HB2 GLU 6 3.175 -12.381 -6.898 703 HB3 GLU 6 HB3 GLU 6 1.446 -12.376 -7.229 704 HG2 GLU 6 HG2 GLU 6 1.775 -11.958 -9.545 705 HG3 GLU 6 HG3 GLU 6 3.448 -11.456 -9.296 706 H LYS 7 H LYS 7 -0.257 -10.236 -6.696 707 HA LYS 7 HA LYS 7 -1.060 -9.131 -9.191 708 HB2 LYS 7 HB2 LYS 7 -3.275 -8.623 -8.053 709 HB3 LYS 7 HB3 LYS 7 -2.760 -10.296 -8.027 710 HG2 LYS 7 HG2 LYS 7 -3.722 -9.887 -5.913 711 HG3 LYS 7 HG3 LYS 7 -1.985 -9.939 -5.647 712 HD2 LYS 7 HD2 LYS 7 -2.956 -8.162 -4.306 713 HD3 LYS 7 HD3 LYS 7 -1.946 -7.446 -5.557 714 HE2 LYS 7 HE2 LYS 7 -3.994 -6.157 -5.311 715 HE3 LYS 7 HE3 LYS 7 -4.002 -6.954 -6.883 716 HZ1 LYS 7 HZ1 LYS 7 -5.424 -7.941 -4.469 717 HZ2 LYS 7 HZ2 LYS 7 -5.493 -8.614 -6.017 718 HZ3 LYS 7 HZ3 LYS 7 -6.142 -7.080 -5.735 719 H ALA 8 H ALA 8 0.101 -7.644 -6.270 720 HA ALA 8 HA ALA 8 -0.596 -4.953 -6.633 721 HB1 ALA 8 HB1 ALA 8 0.489 -5.837 -4.595 722 HB2 ALA 8 HB2 ALA 8 1.355 -4.436 -5.228 723 HB3 ALA 8 HB3 ALA 8 1.995 -6.061 -5.490 724 H GLY 9 H GLY 9 2.116 -6.817 -7.982 725 HA2 GLY 9 HA2 GLY 9 3.424 -4.681 -9.350 726 HA3 GLY 9 HA3 GLY 9 3.681 -6.394 -9.605 727 H ALA 10 H ALA 10 0.981 -7.051 -10.400 728 HA ALA 10 HA ALA 10 1.037 -6.440 -13.184 729 HB1 ALA 10 HB1 ALA 10 0.056 -8.523 -12.317 730 HB2 ALA 10 HB2 ALA 10 -1.119 -7.637 -13.293 731 HB3 ALA 10 HB3 ALA 10 -1.228 -7.603 -11.530 732 H LEU 11 H LEU 11 -1.099 -5.323 -10.549 733 HA LEU 11 HA LEU 11 -2.612 -3.436 -12.070 734 HB2 LEU 11 HB2 LEU 11 -2.129 -3.569 -9.068 735 HB3 LEU 11 HB3 LEU 11 -3.371 -2.597 -9.855 736 HG LEU 11 HG LEU 11 -3.240 -5.645 -9.862 737 HD11 LEU 11 HD11 LEU 11 -3.825 -4.766 -7.669 738 HD12 LEU 11 HD12 LEU 11 -5.206 -5.561 -8.419 739 HD13 LEU 11 HD13 LEU 11 -5.123 -3.797 -8.379 740 HD21 LEU 11 HD21 LEU 11 -5.363 -3.808 -11.025 741 HD22 LEU 11 HD22 LEU 11 -5.472 -5.566 -10.911 742 HD23 LEU 11 HD23 LEU 11 -4.247 -4.829 -11.938 743 H ALA 12 H ALA 12 0.412 -3.247 -10.286 744 HA ALA 12 HA ALA 12 0.855 -0.473 -10.193 745 HB1 ALA 12 HB1 ALA 12 2.268 -2.095 -9.015 746 HB2 ALA 12 HB2 ALA 12 3.253 -1.044 -10.032 747 HB3 ALA 12 HB3 ALA 12 2.896 -2.696 -10.549 748 H GLY 13 H GLY 13 1.531 -2.831 -12.768 749 HA2 GLY 13 HA2 GLY 13 2.764 -1.222 -14.694 750 HA3 GLY 13 HA3 GLY 13 1.742 -2.608 -15.044 751 H GLN 14 H GLN 14 -0.715 -1.771 -14.143 752 HA GLN 14 HA GLN 14 -1.710 -0.151 -16.266 753 HB2 GLN 14 HB2 GLN 14 -3.081 -0.949 -13.659 754 HB3 GLN 14 HB3 GLN 14 -3.893 -0.346 -15.103 755 HG2 GLN 14 HG2 GLN 14 -3.190 -2.348 -16.346 756 HG3 GLN 14 HG3 GLN 14 -2.341 -2.946 -14.919 757 HE21 GLN 14 HE21 GLN 14 -4.560 -4.157 -16.428 758 HE22 GLN 14 HE22 GLN 14 -5.812 -4.428 -15.271 759 H ILE 15 H ILE 15 -1.356 0.495 -12.770 760 HA ILE 15 HA ILE 15 -2.456 3.089 -12.678 761 HB ILE 15 HB ILE 15 -0.459 1.732 -10.808 762 HG12 ILE 15 HG12 ILE 15 -3.482 2.123 -10.556 763 HG13 ILE 15 HG13 ILE 15 -2.689 0.617 -11.007 764 HG21 ILE 15 HG21 ILE 15 -0.268 4.166 -10.481 765 HG22 ILE 15 HG22 ILE 15 -1.045 3.421 -9.087 766 HG23 ILE 15 HG23 ILE 15 -2.016 4.295 -10.270 767 HD11 ILE 15 HD11 ILE 15 -3.406 0.554 -8.707 768 HD12 ILE 15 HD12 ILE 15 -2.491 2.015 -8.338 769 HD13 ILE 15 HD13 ILE 15 -1.644 0.529 -8.778 770 H TRP 16 H TRP 16 0.950 2.060 -12.983 771 HA TRP 16 HA TRP 16 2.115 4.624 -13.087 772 HB2 TRP 16 HB2 TRP 16 3.397 2.490 -12.706 773 HB3 TRP 16 HB3 TRP 16 3.196 2.095 -14.413 774 HD1 TRP 16 HD1 TRP 16 5.086 4.506 -12.090 775 HE1 TRP 16 HE1 TRP 16 6.996 5.613 -13.411 776 HE3 TRP 16 HE3 TRP 16 3.962 2.767 -16.763 777 HZ2 TRP 16 HZ2 TRP 16 7.903 5.749 -16.078 778 HZ3 TRP 16 HZ3 TRP 16 5.382 3.440 -18.649 779 HH2 TRP 16 HH2 TRP 16 7.317 4.903 -18.317 780 H GLU 17 H GLU 17 0.938 2.496 -15.740 781 HA GLU 17 HA GLU 17 1.672 4.202 -17.895 782 HB2 GLU 17 HB2 GLU 17 -0.470 2.055 -17.745 783 HB3 GLU 17 HB3 GLU 17 -0.113 2.937 -19.227 784 HG2 GLU 17 HG2 GLU 17 1.818 1.170 -17.703 785 HG3 GLU 17 HG3 GLU 17 0.965 0.734 -19.178 786 H ALA 18 H ALA 18 -1.169 4.243 -15.795 787 HA ALA 18 HA ALA 18 -2.732 6.156 -17.225 788 HB1 ALA 18 HB1 ALA 18 -2.630 5.630 -14.230 789 HB2 ALA 18 HB2 ALA 18 -3.646 4.776 -15.391 790 HB3 ALA 18 HB3 ALA 18 -3.914 6.492 -15.085 791 H LEU 19 H LEU 19 -0.145 6.462 -14.827 792 HA LEU 19 HA LEU 19 -0.165 9.358 -14.659 793 HB2 LEU 19 HB2 LEU 19 1.844 7.277 -13.714 794 HB3 LEU 19 HB3 LEU 19 1.919 8.986 -13.305 795 HG LEU 19 HG LEU 19 -0.375 7.141 -12.502 796 HD11 LEU 19 HD11 LEU 19 0.583 7.161 -10.239 797 HD12 LEU 19 HD12 LEU 19 1.981 8.070 -10.823 798 HD13 LEU 19 HD13 LEU 19 1.691 6.424 -11.395 799 HD21 LEU 19 HD21 LEU 19 -1.035 9.497 -12.652 800 HD22 LEU 19 HD22 LEU 19 0.315 9.968 -11.618 801 HD23 LEU 19 HD23 LEU 19 -0.995 8.979 -10.968 802 H ASN 20 H ASN 20 1.379 6.975 -16.674 803 HA ASN 20 HA ASN 20 3.731 8.372 -17.433 804 HB2 ASN 20 HB2 ASN 20 3.503 5.922 -17.631 805 HB3 ASN 20 HB3 ASN 20 2.255 6.116 -18.857 806 HD21 ASN 20 HD21 ASN 20 3.459 4.940 -20.371 807 HD22 ASN 20 HD22 ASN 20 4.874 5.580 -21.128 808 H GLY 21 H GLY 21 4.060 9.931 -18.915 809 HA2 GLY 21 HA2 GLY 21 3.704 11.473 -20.589 810 HA3 GLY 21 HA3 GLY 21 2.356 10.506 -21.165 811 H THR 22 H THR 22 2.112 11.310 -17.849 812 HA THR 22 HA THR 22 0.233 13.552 -18.387 813 HB THR 22 HB THR 22 -0.240 11.397 -16.262 814 HG1 THR 22 HG1 THR 22 -1.141 10.155 -17.719 815 HG21 THR 22 HG21 THR 22 -2.138 13.405 -17.547 816 HG22 THR 22 HG22 THR 22 -1.486 13.507 -15.909 817 HG23 THR 22 HG23 THR 22 -2.583 12.195 -16.345 818 H GLU 23 H GLU 23 -0.129 14.992 -16.587 819 HA GLU 23 HA GLU 23 2.096 15.814 -15.050 820 HB2 GLU 23 HB2 GLU 23 0.479 17.427 -14.054 821 HB3 GLU 23 HB3 GLU 23 0.340 17.354 -15.808 822 HG2 GLU 23 HG2 GLU 23 -1.637 15.856 -15.569 823 HG3 GLU 23 HG3 GLU 23 -1.522 16.004 -13.817 824 H GLY 24 H GLY 24 -0.379 13.462 -14.337 825 HA2 GLY 24 HA2 GLY 24 -0.031 12.053 -12.314 826 HA3 GLY 24 HA3 GLY 24 0.152 13.549 -11.410 827 H LEU 25 H LEU 25 -1.804 11.343 -11.082 828 HA LEU 25 HA LEU 25 -4.341 12.859 -11.386 829 HB2 LEU 25 HB2 LEU 25 -4.036 9.845 -11.721 830 HB3 LEU 25 HB3 LEU 25 -5.552 10.719 -11.721 831 HG LEU 25 HG LEU 25 -4.612 11.930 -13.843 832 HD11 LEU 25 HD11 LEU 25 -2.291 11.181 -13.696 833 HD12 LEU 25 HD12 LEU 25 -3.033 10.636 -15.196 834 HD13 LEU 25 HD13 LEU 25 -2.804 9.499 -13.866 835 HD21 LEU 25 HD21 LEU 25 -5.464 10.150 -15.326 836 HD22 LEU 25 HD22 LEU 25 -6.505 10.374 -13.924 837 HD23 LEU 25 HD23 LEU 25 -5.400 8.999 -13.987 838 H THR 26 H THR 26 -6.006 12.297 -9.798 839 HA THR 26 HA THR 26 -5.013 11.632 -7.141 840 HB THR 26 HB THR 26 -7.342 11.985 -6.364 841 HG1 THR 26 HG1 THR 26 -8.972 12.482 -7.852 842 HG21 THR 26 HG21 THR 26 -5.906 13.988 -6.625 843 HG22 THR 26 HG22 THR 26 -7.601 14.359 -6.943 844 HG23 THR 26 HG23 THR 26 -6.476 14.175 -8.289 845 H GLN 27 H GLN 27 -6.461 10.036 -5.815 846 HA GLN 27 HA GLN 27 -5.928 7.468 -6.752 847 HB2 GLN 27 HB2 GLN 27 -6.982 6.628 -4.736 848 HB3 GLN 27 HB3 GLN 27 -6.072 8.075 -4.361 849 HG2 GLN 27 HG2 GLN 27 -7.896 8.770 -3.224 850 HG3 GLN 27 HG3 GLN 27 -8.617 9.093 -4.795 851 HE21 GLN 27 HE21 GLN 27 -8.503 6.886 -2.110 852 HE22 GLN 27 HE22 GLN 27 -9.947 6.030 -2.493 853 H LYS 28 H LYS 28 -9.095 9.133 -6.637 854 HA LYS 28 HA LYS 28 -10.647 6.989 -7.650 855 HB2 LYS 28 HB2 LYS 28 -11.555 8.931 -6.383 856 HB3 LYS 28 HB3 LYS 28 -11.242 9.974 -7.758 857 HG2 LYS 28 HG2 LYS 28 -13.033 7.577 -8.149 858 HG3 LYS 28 HG3 LYS 28 -13.673 8.962 -7.270 859 HD2 LYS 28 HD2 LYS 28 -12.554 9.036 -10.107 860 HD3 LYS 28 HD3 LYS 28 -14.270 9.011 -9.689 861 HE2 LYS 28 HE2 LYS 28 -13.994 11.190 -8.519 862 HE3 LYS 28 HE3 LYS 28 -12.287 11.206 -8.973 863 HZ1 LYS 28 HZ1 LYS 28 -13.555 12.556 -10.456 864 HZ2 LYS 28 HZ2 LYS 28 -14.604 11.283 -10.814 865 HZ3 LYS 28 HZ3 LYS 28 -12.987 11.206 -11.297 866 H GLN 29 H GLN 29 -9.055 9.714 -9.315 867 HA GLN 29 HA GLN 29 -10.061 9.342 -11.915 868 HB2 GLN 29 HB2 GLN 29 -7.417 10.509 -10.970 869 HB3 GLN 29 HB3 GLN 29 -7.900 10.506 -12.665 870 HG2 GLN 29 HG2 GLN 29 -9.908 11.842 -12.071 871 HG3 GLN 29 HG3 GLN 29 -9.353 11.902 -10.398 872 HE21 GLN 29 HE21 GLN 29 -7.605 13.248 -9.882 873 HE22 GLN 29 HE22 GLN 29 -7.001 14.444 -10.969 874 H ILE 30 H ILE 30 -7.189 7.904 -10.383 875 HA ILE 30 HA ILE 30 -6.338 6.385 -12.664 876 HB ILE 30 HB ILE 30 -5.653 6.068 -9.713 877 HG12 ILE 30 HG12 ILE 30 -4.128 7.424 -11.983 878 HG13 ILE 30 HG13 ILE 30 -5.005 8.257 -10.706 879 HG21 ILE 30 HG21 ILE 30 -3.697 4.741 -10.441 880 HG22 ILE 30 HG22 ILE 30 -4.269 4.799 -12.109 881 HG23 ILE 30 HG23 ILE 30 -5.210 3.948 -10.881 882 HD11 ILE 30 HD11 ILE 30 -3.434 7.361 -9.061 883 HD12 ILE 30 HD12 ILE 30 -2.634 8.304 -10.315 884 HD13 ILE 30 HD13 ILE 30 -2.553 6.543 -10.355 885 H LYS 31 H LYS 31 -8.167 5.521 -9.703 886 HA LYS 31 HA LYS 31 -8.514 2.773 -10.161 887 HB2 LYS 31 HB2 LYS 31 -10.227 4.791 -8.678 888 HB3 LYS 31 HB3 LYS 31 -10.623 3.075 -8.695 889 HG2 LYS 31 HG2 LYS 31 -8.641 2.499 -7.481 890 HG3 LYS 31 HG3 LYS 31 -7.937 4.098 -7.733 891 HD2 LYS 31 HD2 LYS 31 -8.764 3.829 -5.419 892 HD3 LYS 31 HD3 LYS 31 -9.615 5.119 -6.272 893 HE2 LYS 31 HE2 LYS 31 -11.479 3.437 -6.725 894 HE3 LYS 31 HE3 LYS 31 -10.651 2.336 -5.621 895 HZ1 LYS 31 HZ1 LYS 31 -12.367 3.559 -4.489 896 HZ2 LYS 31 HZ2 LYS 31 -11.690 5.035 -4.957 897 HZ3 LYS 31 HZ3 LYS 31 -10.855 4.019 -3.894 898 H LYS 32 H LYS 32 -10.356 5.512 -11.442 899 HA LYS 32 HA LYS 32 -12.383 4.011 -12.782 900 HB2 LYS 32 HB2 LYS 32 -12.693 6.390 -12.280 901 HB3 LYS 32 HB3 LYS 32 -11.325 6.819 -13.299 902 HG2 LYS 32 HG2 LYS 32 -13.415 7.315 -14.448 903 HG3 LYS 32 HG3 LYS 32 -12.549 6.030 -15.294 904 HD2 LYS 32 HD2 LYS 32 -14.048 4.354 -14.132 905 HD3 LYS 32 HD3 LYS 32 -14.966 5.710 -13.466 906 HE2 LYS 32 HE2 LYS 32 -14.627 5.024 -16.409 907 HE3 LYS 32 HE3 LYS 32 -16.092 4.826 -15.447 908 HZ1 LYS 32 HZ1 LYS 32 -16.120 7.257 -15.146 909 HZ2 LYS 32 HZ2 LYS 32 -16.251 6.806 -16.767 910 HZ3 LYS 32 HZ3 LYS 32 -14.783 7.393 -16.174 911 H ALA 33 H ALA 33 -9.349 5.508 -13.962 912 HA ALA 33 HA ALA 33 -9.595 4.818 -16.694 913 HB1 ALA 33 HB1 ALA 33 -8.101 6.592 -15.854 914 HB2 ALA 33 HB2 ALA 33 -7.219 5.445 -16.863 915 HB3 ALA 33 HB3 ALA 33 -7.065 5.376 -15.105 916 H THR 34 H THR 34 -7.764 3.238 -14.105 917 HA THR 34 HA THR 34 -6.853 1.008 -15.726 918 HB THR 34 HB THR 34 -5.682 0.258 -13.704 919 HG1 THR 34 HG1 THR 34 -6.385 2.368 -12.087 920 HG21 THR 34 HG21 THR 34 -4.274 2.235 -13.246 921 HG22 THR 34 HG22 THR 34 -5.477 3.282 -14.004 922 HG23 THR 34 HG23 THR 34 -4.602 2.089 -14.972 923 H LYS 35 H LYS 35 -9.594 1.709 -13.836 924 HA LYS 35 HA LYS 35 -11.501 0.670 -13.382 925 HB2 LYS 35 HB2 LYS 35 -10.799 -0.415 -15.774 926 HB3 LYS 35 HB3 LYS 35 -10.842 -1.885 -14.813 927 HG2 LYS 35 HG2 LYS 35 -12.988 -1.582 -15.885 928 HG3 LYS 35 HG3 LYS 35 -13.178 -1.345 -14.149 929 HD2 LYS 35 HD2 LYS 35 -14.469 0.390 -15.145 930 HD3 LYS 35 HD3 LYS 35 -12.997 1.184 -14.597 931 HE2 LYS 35 HE2 LYS 35 -13.548 0.311 -17.463 932 HE3 LYS 35 HE3 LYS 35 -13.740 1.949 -16.849 933 HZ1 LYS 35 HZ1 LYS 35 -11.211 0.422 -17.080 934 HZ2 LYS 35 HZ2 LYS 35 -11.338 1.941 -16.349 935 HZ3 LYS 35 HZ3 LYS 35 -11.678 1.761 -17.996 936 H LEU 36 H LEU 36 -9.449 0.494 -11.491 937 HA LEU 36 HA LEU 36 -9.225 -2.032 -10.207 938 HB2 LEU 36 HB2 LEU 36 -9.044 0.775 -9.044 939 HB3 LEU 36 HB3 LEU 36 -8.580 -0.684 -8.179 940 HG LEU 36 HG LEU 36 -7.251 0.283 -10.741 941 HD11 LEU 36 HD11 LEU 36 -6.273 0.572 -7.890 942 HD12 LEU 36 HD12 LEU 36 -6.816 1.874 -8.954 943 HD13 LEU 36 HD13 LEU 36 -5.357 0.972 -9.347 944 HD21 LEU 36 HD21 LEU 36 -6.406 -1.914 -8.821 945 HD22 LEU 36 HD22 LEU 36 -5.493 -1.360 -10.227 946 HD23 LEU 36 HD23 LEU 36 -7.054 -2.143 -10.447 947 H LYS 37 H LYS 37 -10.323 -2.859 -8.344 948 HA LYS 37 HA LYS 37 -13.179 -2.149 -8.203 949 HB2 LYS 37 HB2 LYS 37 -11.679 -4.538 -7.039 950 HB3 LYS 37 HB3 LYS 37 -13.431 -4.332 -7.054 951 HG2 LYS 37 HG2 LYS 37 -11.639 -4.643 -9.489 952 HG3 LYS 37 HG3 LYS 37 -12.711 -5.875 -8.814 953 HD2 LYS 37 HD2 LYS 37 -14.675 -4.443 -9.332 954 HD3 LYS 37 HD3 LYS 37 -13.602 -3.210 -10.002 955 HE2 LYS 37 HE2 LYS 37 -12.872 -4.814 -11.746 956 HE3 LYS 37 HE3 LYS 37 -13.970 -6.027 -11.080 957 HZ1 LYS 37 HZ1 LYS 37 -14.902 -4.877 -12.991 958 HZ2 LYS 37 HZ2 LYS 37 -14.785 -3.394 -12.188 959 HZ3 LYS 37 HZ3 LYS 37 -15.828 -4.593 -11.602 960 H ALA 38 H ALA 38 -10.463 -2.766 -5.993 961 HA ALA 38 HA ALA 38 -11.865 -1.382 -3.778 962 HB1 ALA 38 HB1 ALA 38 -9.510 -3.312 -3.684 963 HB2 ALA 38 HB2 ALA 38 -11.183 -3.692 -3.270 964 HB3 ALA 38 HB3 ALA 38 -10.269 -2.548 -2.281 965 H ASP 39 H ASP 39 -10.742 0.157 -2.523 966 HA ASP 39 HA ASP 39 -8.695 1.791 -3.601 967 HB2 ASP 39 HB2 ASP 39 -9.455 1.327 -0.686 968 HB3 ASP 39 HB3 ASP 39 -8.446 2.650 -1.267 969 H LYS 40 H LYS 40 -8.648 -1.142 -1.677 970 HA LYS 40 HA LYS 40 -5.978 -1.227 -0.800 971 HB2 LYS 40 HB2 LYS 40 -7.736 -3.604 -1.531 972 HB3 LYS 40 HB3 LYS 40 -6.301 -3.643 -0.502 973 HG2 LYS 40 HG2 LYS 40 -7.549 -2.069 1.078 974 HG3 LYS 40 HG3 LYS 40 -8.993 -2.369 0.105 975 HD2 LYS 40 HD2 LYS 40 -8.756 -4.800 0.566 976 HD3 LYS 40 HD3 LYS 40 -7.352 -4.479 1.576 977 HE2 LYS 40 HE2 LYS 40 -9.159 -4.772 3.085 978 HE3 LYS 40 HE3 LYS 40 -8.931 -3.028 3.007 979 HZ1 LYS 40 HZ1 LYS 40 -11.256 -3.622 2.897 980 HZ2 LYS 40 HZ2 LYS 40 -10.983 -4.585 1.535 981 HZ3 LYS 40 HZ3 LYS 40 -10.776 -2.912 1.440 982 H ASP 41 H ASP 41 -7.415 -2.234 -3.878 983 HA ASP 41 HA ASP 41 -5.160 -3.484 -5.064 984 HB2 ASP 41 HB2 ASP 41 -7.548 -2.054 -6.299 985 HB3 ASP 41 HB3 ASP 41 -6.364 -2.946 -7.249 986 H PHE 42 H PHE 42 -6.193 -0.120 -4.827 987 HA PHE 42 HA PHE 42 -4.209 0.984 -6.583 988 HB2 PHE 42 HB2 PHE 42 -6.355 2.144 -6.188 989 HB3 PHE 42 HB3 PHE 42 -5.954 2.349 -4.485 990 HD1 PHE 42 HD2 PHE 42 -4.452 3.085 -7.857 991 HD2 PHE 42 HD1 PHE 42 -5.100 4.460 -3.859 992 HE1 PHE 42 HE2 PHE 42 -3.328 5.195 -8.395 993 HE2 PHE 42 HE1 PHE 42 -3.966 6.573 -4.415 994 HZ PHE 42 HZ PHE 42 -3.082 6.944 -6.684 995 H PHE 43 H PHE 43 -4.427 0.562 -3.032 996 HA PHE 43 HA PHE 43 -2.115 2.087 -2.347 997 HB2 PHE 43 HB2 PHE 43 -3.359 -0.206 -0.775 998 HB3 PHE 43 HB3 PHE 43 -2.207 0.965 -0.138 999 HD1 PHE 43 HD1 PHE 43 -3.197 3.556 -1.075 1000 HD2 PHE 43 HD2 PHE 43 -5.386 0.157 0.305 1001 HE1 PHE 43 HE1 PHE 43 -5.055 5.014 -0.383 1002 HE2 PHE 43 HE2 PHE 43 -7.236 1.604 0.981 1003 HZ PHE 43 HZ PHE 43 -7.074 4.048 0.640 1004 H LEU 44 H LEU 44 -2.547 -1.405 -2.904 1005 HA LEU 44 HA LEU 44 0.194 -2.137 -2.475 1006 HB2 LEU 44 HB2 LEU 44 -2.230 -3.532 -3.616 1007 HB3 LEU 44 HB3 LEU 44 -0.652 -4.253 -3.859 1008 HG LEU 44 HG LEU 44 -0.319 -4.381 -1.397 1009 HD11 LEU 44 HD11 LEU 44 -3.170 -3.385 -1.136 1010 HD12 LEU 44 HD12 LEU 44 -1.714 -2.513 -0.654 1011 HD13 LEU 44 HD13 LEU 44 -2.158 -4.003 0.173 1012 HD21 LEU 44 HD21 LEU 44 -1.869 -6.230 -0.965 1013 HD22 LEU 44 HD22 LEU 44 -1.226 -6.324 -2.602 1014 HD23 LEU 44 HD23 LEU 44 -2.871 -5.738 -2.333 1015 H GLY 45 H GLY 45 -1.724 -1.267 -5.338 1016 HA2 GLY 45 HA2 GLY 45 0.178 -1.816 -7.359 1017 HA3 GLY 45 HA3 GLY 45 -1.143 -0.669 -7.477 1018 H LEU 46 H LEU 46 -0.629 1.365 -5.892 1019 HA LEU 46 HA LEU 46 1.535 2.801 -7.056 1020 HB2 LEU 46 HB2 LEU 46 0.699 4.690 -5.993 1021 HB3 LEU 46 HB3 LEU 46 -0.720 3.671 -5.978 1022 HG LEU 46 HG LEU 46 0.242 3.029 -3.514 1023 HD11 LEU 46 HD11 LEU 46 1.208 5.880 -3.860 1024 HD12 LEU 46 HD12 LEU 46 2.227 4.453 -3.651 1025 HD13 LEU 46 HD13 LEU 46 1.155 4.965 -2.349 1026 HD21 LEU 46 HD21 LEU 46 -1.391 5.528 -4.046 1027 HD22 LEU 46 HD22 LEU 46 -1.304 4.643 -2.519 1028 HD23 LEU 46 HD23 LEU 46 -2.014 3.880 -3.939 1029 H GLY 47 H GLY 47 1.207 0.918 -4.128 1030 HA2 GLY 47 HA2 GLY 47 3.532 1.713 -2.710 1031 HA3 GLY 47 HA3 GLY 47 2.697 0.173 -2.548 1032 H TRP 48 H TRP 48 2.999 -0.627 -5.318 1033 HA TRP 48 HA TRP 48 5.687 -1.638 -5.350 1034 HB2 TRP 48 HB2 TRP 48 3.529 -2.725 -6.368 1035 HB3 TRP 48 HB3 TRP 48 3.855 -1.705 -7.764 1036 HD1 TRP 48 HD1 TRP 48 6.141 -2.290 -9.191 1037 HE1 TRP 48 HE1 TRP 48 7.570 -4.428 -9.301 1038 HE3 TRP 48 HE3 TRP 48 4.290 -4.715 -5.090 1039 HZ2 TRP 48 HZ2 TRP 48 7.847 -6.843 -7.860 1040 HZ3 TRP 48 HZ3 TRP 48 5.180 -6.935 -4.526 1041 HH2 TRP 48 HH2 TRP 48 6.923 -7.982 -5.884 1042 H LEU 49 H LEU 49 3.994 1.011 -7.017 1043 HA LEU 49 HA LEU 49 6.102 1.925 -8.671 1044 HB2 LEU 49 HB2 LEU 49 3.708 3.294 -7.426 1045 HB3 LEU 49 HB3 LEU 49 4.897 4.256 -8.275 1046 HG LEU 49 HG LEU 49 4.393 3.205 -10.381 1047 HD11 LEU 49 HD11 LEU 49 2.565 1.315 -8.912 1048 HD12 LEU 49 HD12 LEU 49 4.114 0.908 -9.657 1049 HD13 LEU 49 HD13 LEU 49 2.767 1.425 -10.665 1050 HD21 LEU 49 HD21 LEU 49 2.037 3.792 -10.700 1051 HD22 LEU 49 HD22 LEU 49 2.836 4.987 -9.686 1052 HD23 LEU 49 HD23 LEU 49 1.779 3.781 -8.954 1053 H LEU 50 H LEU 50 5.463 2.454 -5.223 1054 HA LEU 50 HA LEU 50 7.531 4.372 -4.742 1055 HB2 LEU 50 HB2 LEU 50 6.041 2.512 -2.857 1056 HB3 LEU 50 HB3 LEU 50 7.226 3.685 -2.299 1057 HG LEU 50 HG LEU 50 4.604 4.350 -3.713 1058 HD11 LEU 50 HD11 LEU 50 4.219 3.580 -1.426 1059 HD12 LEU 50 HD12 LEU 50 3.903 5.310 -1.552 1060 HD13 LEU 50 HD13 LEU 50 5.400 4.739 -0.805 1061 HD21 LEU 50 HD21 LEU 50 6.720 6.228 -2.595 1062 HD22 LEU 50 HD22 LEU 50 5.139 6.713 -3.215 1063 HD23 LEU 50 HD23 LEU 50 6.322 5.990 -4.300 1064 H ARG 51 H ARG 51 7.480 0.767 -4.527 1065 HA ARG 51 HA ARG 51 10.219 0.626 -3.607 1066 HB2 ARG 51 HB2 ARG 51 10.074 -1.794 -3.831 1067 HB3 ARG 51 HB3 ARG 51 8.649 -1.167 -3.043 1068 HG2 ARG 51 HG2 ARG 51 7.733 -2.797 -4.396 1069 HG3 ARG 51 HG3 ARG 51 7.542 -1.366 -5.400 1070 HD2 ARG 51 HD2 ARG 51 8.328 -3.263 -6.733 1071 HD3 ARG 51 HD3 ARG 51 9.558 -1.996 -6.686 1072 HE ARG 51 HE ARG 51 9.739 -4.185 -4.769 1073 HH11 ARG 51 HH11 ARG 51 10.972 -2.889 -7.705 1074 HH12 ARG 51 HH12 ARG 51 12.477 -3.721 -7.554 1075 HH21 ARG 51 HH21 ARG 51 11.653 -5.217 -4.573 1076 HH22 ARG 51 HH22 ARG 51 12.854 -5.025 -5.800 1077 H GLU 52 H GLU 52 8.752 0.893 -6.745 1078 HA GLU 52 HA GLU 52 11.241 0.360 -8.181 1079 HB2 GLU 52 HB2 GLU 52 8.608 1.548 -9.150 1080 HB3 GLU 52 HB3 GLU 52 9.979 1.165 -10.187 1081 HG2 GLU 52 HG2 GLU 52 8.313 -0.822 -8.609 1082 HG3 GLU 52 HG3 GLU 52 8.241 -0.551 -10.348 1083 H ASP 53 H ASP 53 9.788 2.977 -6.534 1084 HA ASP 53 HA ASP 53 10.389 5.062 -6.015 1085 HB2 ASP 53 HB2 ASP 53 12.693 4.018 -5.840 1086 HB3 ASP 53 HB3 ASP 53 13.008 4.559 -7.487 1087 H LYS 54 H LYS 54 9.033 4.382 -8.547 1088 HA LYS 54 HA LYS 54 9.869 6.405 -10.491 1089 HB2 LYS 54 HB2 LYS 54 7.680 4.295 -10.596 1090 HB3 LYS 54 HB3 LYS 54 8.006 5.435 -11.904 1091 HG2 LYS 54 HG2 LYS 54 10.346 4.519 -12.032 1092 HG3 LYS 54 HG3 LYS 54 9.881 3.292 -10.848 1093 HD2 LYS 54 HD2 LYS 54 8.618 3.676 -13.596 1094 HD3 LYS 54 HD3 LYS 54 9.814 2.445 -13.179 1095 HE2 LYS 54 HE2 LYS 54 8.198 1.479 -11.541 1096 HE3 LYS 54 HE3 LYS 54 7.005 2.679 -12.039 1097 HZ1 LYS 54 HZ1 LYS 54 8.230 0.614 -13.774 1098 HZ2 LYS 54 HZ2 LYS 54 7.087 1.760 -14.269 1099 HZ3 LYS 54 HZ3 LYS 54 6.668 0.578 -13.135 1100 H VAL 55 H VAL 55 7.832 6.500 -7.780 1101 HA VAL 55 HA VAL 55 6.424 8.856 -8.883 1102 HB VAL 55 HB VAL 55 4.307 8.355 -7.759 1103 HG11 VAL 55 HG11 VAL 55 3.486 6.557 -9.224 1104 HG12 VAL 55 HG12 VAL 55 5.147 6.095 -9.598 1105 HG13 VAL 55 HG13 VAL 55 4.538 7.676 -10.097 1106 HG21 VAL 55 HG21 VAL 55 5.091 6.982 -5.879 1107 HG22 VAL 55 HG22 VAL 55 5.521 5.672 -6.980 1108 HG23 VAL 55 HG23 VAL 55 3.828 6.124 -6.768 1109 H VAL 56 H VAL 56 5.574 10.289 -7.350 1110 HA VAL 56 HA VAL 56 6.543 10.164 -4.612 1111 HB VAL 56 HB VAL 56 8.008 11.762 -5.757 1112 HG11 VAL 56 HG11 VAL 56 5.514 13.295 -6.583 1113 HG12 VAL 56 HG12 VAL 56 6.580 12.390 -7.658 1114 HG13 VAL 56 HG13 VAL 56 7.181 13.828 -6.830 1115 HG21 VAL 56 HG21 VAL 56 7.424 12.273 -3.417 1116 HG22 VAL 56 HG22 VAL 56 6.029 13.214 -3.951 1117 HG23 VAL 56 HG23 VAL 56 7.661 13.764 -4.333 1118 H THR 57 H THR 57 5.039 10.661 -3.107 1119 HA THR 57 HA THR 57 2.262 10.889 -4.105 1120 HB THR 57 HB THR 57 1.650 9.677 -1.994 1121 HG1 THR 57 HG1 THR 57 3.521 8.699 -0.885 1122 HG21 THR 57 HG21 THR 57 2.091 8.341 -4.046 1123 HG22 THR 57 HG22 THR 57 2.570 7.470 -2.591 1124 HG23 THR 57 HG23 THR 57 3.795 8.235 -3.604 1125 H SER 58 H SER 58 0.988 12.494 -3.371 1126 HA SER 58 HA SER 58 1.808 14.264 -1.157 1127 HB2 SER 58 HB2 SER 58 1.353 16.278 -2.631 1128 HB3 SER 58 HB3 SER 58 2.763 15.352 -3.137 1129 HG SER 58 HG SER 58 0.358 14.594 -4.303 1130 H GLU 59 H GLU 59 -0.023 15.836 -0.623 1131 HA GLU 59 HA GLU 59 -2.615 14.400 -0.865 1132 HB2 GLU 59 HB2 GLU 59 -1.720 14.443 1.439 1133 HB3 GLU 59 HB3 GLU 59 -1.634 16.201 1.390 1134 HG2 GLU 59 HG2 GLU 59 -4.106 16.295 1.132 1135 HG3 GLU 59 HG3 GLU 59 -4.168 14.533 1.240 1136 H VAL 60 H VAL 60 -4.010 15.385 -2.181 1137 HA VAL 60 HA VAL 60 -4.268 18.347 -2.149 1138 HB VAL 60 HB VAL 60 -5.185 16.345 -4.274 1139 HG11 VAL 60 HG11 VAL 60 -6.895 18.121 -4.052 1140 HG12 VAL 60 HG12 VAL 60 -6.016 18.304 -5.569 1141 HG13 VAL 60 HG13 VAL 60 -5.649 19.362 -4.204 1142 HG21 VAL 60 HG21 VAL 60 -2.774 16.881 -4.352 1143 HG22 VAL 60 HG22 VAL 60 -3.151 18.606 -4.396 1144 HG23 VAL 60 HG23 VAL 60 -3.610 17.568 -5.750 1145 H GLU 61 H GLU 61 -5.668 18.860 -0.625 1146 HA GLU 61 HA GLU 61 -7.504 19.088 0.647 1147 HB2 GLU 61 HB2 GLU 61 -9.036 18.013 -1.748 1148 HB3 GLU 61 HB3 GLU 61 -9.641 19.101 -0.499 1149 HG2 GLU 61 HG2 GLU 61 -7.879 20.776 -1.317 1150 HG3 GLU 61 HG3 GLU 61 -7.630 19.701 -2.682 1151 H GLY 62 H GLY 62 -6.269 16.910 1.517 1152 HA2 GLY 62 HA2 GLY 62 -6.657 15.218 3.036 1153 HA3 GLY 62 HA3 GLY 62 -8.373 15.379 2.729 1154 H GLU 63 H GLU 63 -6.669 14.816 -0.178 1155 HA GLU 63 HA GLU 63 -7.239 11.897 -0.074 1156 HB2 GLU 63 HB2 GLU 63 -7.703 13.765 -2.444 1157 HB3 GLU 63 HB3 GLU 63 -7.918 12.014 -2.465 1158 HG2 GLU 63 HG2 GLU 63 -9.682 12.293 -0.678 1159 HG3 GLU 63 HG3 GLU 63 -9.541 14.040 -0.890 1160 H ILE 64 H ILE 64 -6.029 10.568 -1.549 1161 HA ILE 64 HA ILE 64 -3.220 11.283 -1.610 1162 HB ILE 64 HB ILE 64 -4.602 8.698 -2.468 1163 HG12 ILE 64 HG12 ILE 64 -3.161 9.411 0.135 1164 HG13 ILE 64 HG13 ILE 64 -4.896 9.174 -0.044 1165 HG21 ILE 64 HG21 ILE 64 -2.353 7.660 -2.366 1166 HG22 ILE 64 HG22 ILE 64 -1.638 9.233 -2.008 1167 HG23 ILE 64 HG23 ILE 64 -2.405 8.949 -3.571 1168 HD11 ILE 64 HD11 ILE 64 -3.867 7.259 1.003 1169 HD12 ILE 64 HD12 ILE 64 -2.757 7.062 -0.350 1170 HD13 ILE 64 HD13 ILE 64 -4.488 6.799 -0.581 1171 H PHE 65 H PHE 65 -2.368 12.324 -3.226 1172 HA PHE 65 HA PHE 65 -3.241 11.965 -6.037 1173 HB2 PHE 65 HB2 PHE 65 -3.688 14.252 -5.219 1174 HB3 PHE 65 HB3 PHE 65 -2.031 14.411 -4.655 1175 HD1 PHE 65 HD2 PHE 65 -4.165 14.210 -7.694 1176 HD2 PHE 65 HD1 PHE 65 -0.262 15.079 -6.184 1177 HE1 PHE 65 HE2 PHE 65 -3.536 15.173 -9.865 1178 HE2 PHE 65 HE1 PHE 65 0.359 16.038 -8.361 1179 HZ PHE 65 HZ PHE 65 -1.274 16.085 -10.203 1180 H VAL 66 H VAL 66 -1.806 10.472 -6.821 1181 HA VAL 66 HA VAL 66 1.066 10.653 -6.122 1182 HB VAL 66 HB VAL 66 1.322 8.388 -7.003 1183 HG11 VAL 66 HG11 VAL 66 -0.088 7.126 -5.418 1184 HG12 VAL 66 HG12 VAL 66 -1.138 8.531 -5.216 1185 HG13 VAL 66 HG13 VAL 66 0.537 8.598 -4.670 1186 HG21 VAL 66 HG21 VAL 66 -0.259 8.480 -8.892 1187 HG22 VAL 66 HG22 VAL 66 -1.621 8.481 -7.770 1188 HG23 VAL 66 HG23 VAL 66 -0.573 7.064 -7.885 1189 H LYS 67 H LYS 67 2.688 10.818 -7.716 1190 HA LYS 67 HA LYS 67 1.999 11.143 -10.548 1191 HB2 LYS 67 HB2 LYS 67 2.974 13.452 -10.691 1192 HB3 LYS 67 HB3 LYS 67 1.491 13.391 -9.747 1193 HG2 LYS 67 HG2 LYS 67 2.804 13.454 -7.659 1194 HG3 LYS 67 HG3 LYS 67 4.300 13.508 -8.598 1195 HD2 LYS 67 HD2 LYS 67 3.620 15.680 -9.562 1196 HD3 LYS 67 HD3 LYS 67 2.104 15.620 -8.654 1197 HE2 LYS 67 HE2 LYS 67 4.896 15.747 -7.460 1198 HE3 LYS 67 HE3 LYS 67 3.747 17.082 -7.550 1199 HZ1 LYS 67 HZ1 LYS 67 2.249 15.802 -6.113 1200 HZ2 LYS 67 HZ2 LYS 67 3.734 16.105 -5.366 1201 HZ3 LYS 67 HZ3 LYS 67 3.404 14.571 -5.997 1202 H LEU 68 H LEU 68 3.967 11.265 -11.912 1203 HA LEU 68 HA LEU 68 5.973 9.471 -10.943 1204 HB2 LEU 68 HB2 LEU 68 6.012 11.123 -13.499 1205 HB3 LEU 68 HB3 LEU 68 7.028 9.728 -13.152 1206 HG LEU 68 HG LEU 68 4.014 9.720 -13.596 1207 HD11 LEU 68 HD11 LEU 68 4.514 8.346 -15.553 1208 HD12 LEU 68 HD12 LEU 68 6.245 8.466 -15.221 1209 HD13 LEU 68 HD13 LEU 68 5.323 9.910 -15.656 1210 HD21 LEU 68 HD21 LEU 68 4.121 7.262 -13.343 1211 HD22 LEU 68 HD22 LEU 68 4.524 8.102 -11.850 1212 HD23 LEU 68 HD23 LEU 68 5.807 7.391 -12.832 1213 H VAL 69 H VAL 69 8.229 9.813 -10.602 1214 HA VAL 69 HA VAL 69 9.018 12.390 -9.550 1215 HB VAL 69 HB VAL 69 10.803 9.954 -10.062 1216 HG11 VAL 69 HG11 VAL 69 12.321 10.951 -8.362 1217 HG12 VAL 69 HG12 VAL 69 11.278 12.372 -8.262 1218 HG13 VAL 69 HG13 VAL 69 12.130 12.006 -9.764 1219 HG21 VAL 69 HG21 VAL 69 9.332 10.717 -7.509 1220 HG22 VAL 69 HG22 VAL 69 10.503 9.404 -7.669 1221 HG23 VAL 69 HG23 VAL 69 8.977 9.334 -8.548 1222 H LEU 70 H LEU 70 8.594 13.602 -11.478 1223 HA LEU 70 HA LEU 70 10.661 13.518 -13.604 1224 HB2 LEU 70 HB2 LEU 70 8.024 15.063 -13.528 1225 HB3 LEU 70 HB3 LEU 70 9.111 14.923 -14.903 1226 HG LEU 70 HG LEU 70 7.512 12.629 -13.686 1227 HD11 LEU 70 HD11 LEU 70 6.141 12.717 -15.712 1228 HD12 LEU 70 HD12 LEU 70 7.036 14.130 -16.281 1229 HD13 LEU 70 HD13 LEU 70 6.055 14.232 -14.815 1230 HD21 LEU 70 HD21 LEU 70 9.613 11.816 -14.664 1231 HD22 LEU 70 HD22 LEU 70 9.256 12.644 -16.182 1232 HD23 LEU 70 HD23 LEU 70 8.235 11.307 -15.642 1233 H GLU 71 H GLU 71 8.801 15.870 -11.671 1234 HA GLU 71 HA GLU 71 11.115 17.719 -11.580 1235 HB2 GLU 71 HB2 GLU 71 9.082 18.657 -12.617 1236 HB3 GLU 71 HB3 GLU 71 8.136 18.258 -11.191 1237 HG2 GLU 71 HG2 GLU 71 8.658 20.646 -11.270 1238 HG3 GLU 71 HG3 GLU 71 9.400 19.883 -9.866 1239 H HIS 72 H HIS 72 11.850 18.460 -9.629 1240 HA HIS 72 HA HIS 72 11.075 17.036 -7.177 1241 HB2 HIS 72 HB2 HIS 72 13.232 18.137 -6.287 1242 HB3 HIS 72 HB3 HIS 72 13.422 16.946 -7.566 1243 HD1 HIS 72 HD1 HIS 72 13.270 20.741 -7.214 1244 HD2 HIS 72 HD2 HIS 72 14.937 17.823 -9.656 1245 HE1 HIS 72 HE1 HIS 72 14.714 21.978 -8.849 1246 HE2 HIS 72 HE2 HIS 72 15.561 20.212 -10.416 1247 H HIS 73 H HIS 73 9.120 18.781 -7.918 1248 HA HIS 73 HA HIS 73 9.355 21.415 -6.784 1249 HB2 HIS 73 HB2 HIS 73 7.852 20.994 -8.692 1250 HB3 HIS 73 HB3 HIS 73 6.893 19.876 -7.729 1251 HD1 HIS 73 HD1 HIS 73 4.912 20.877 -6.578 1252 HD2 HIS 73 HD2 HIS 73 7.688 23.774 -7.667 1253 HE1 HIS 73 HE1 HIS 73 3.836 23.071 -6.024 1254 HE2 HIS 73 HE2 HIS 73 5.450 24.797 -6.872 1255 H HIS 74 H HIS 74 9.058 22.005 -4.736 1256 HA HIS 74 HA HIS 74 8.263 20.129 -2.663 1257 HB2 HIS 74 HB2 HIS 74 9.033 23.075 -2.413 1258 HB3 HIS 74 HB3 HIS 74 8.954 21.899 -1.099 1259 HD1 HIS 74 HD1 HIS 74 11.235 23.291 -3.595 1260 HD2 HIS 74 HD2 HIS 74 11.024 19.823 -1.311 1261 HE1 HIS 74 HE1 HIS 74 13.529 22.289 -3.685 1262 HE2 HIS 74 HE2 HIS 74 13.421 20.291 -2.171 1263 H HIS 75 H HIS 75 6.447 20.284 -1.341 1264 HA HIS 75 HA HIS 75 4.152 21.782 -2.404 1265 HB2 HIS 75 HB2 HIS 75 2.742 20.282 -1.135 1266 HB3 HIS 75 HB3 HIS 75 3.969 19.293 -1.913 1267 HD1 HIS 75 HD1 HIS 75 2.544 20.114 1.364 1268 HD2 HIS 75 HD2 HIS 75 6.026 18.355 -0.066 1269 HE1 HIS 75 HE1 HIS 75 3.575 18.962 3.339 1270 HE2 HIS 75 HE2 HIS 75 5.564 17.754 2.402 1271 H HIS 76 H HIS 76 2.717 22.955 -0.979 1272 HA HIS 76 HA HIS 76 3.968 24.155 1.421 1273 HB2 HIS 76 HB2 HIS 76 1.554 25.043 -0.227 1274 HB3 HIS 76 HB3 HIS 76 2.118 25.867 1.225 1275 HD1 HIS 76 HD1 HIS 76 2.281 26.328 -2.228 1276 HD2 HIS 76 HD2 HIS 76 5.170 26.425 0.758 1277 HE1 HIS 76 HE1 HIS 76 4.175 27.663 -3.185 1278 HE2 HIS 76 HE2 HIS 76 5.960 27.581 -1.420 1279 H HIS 77 H HIS 77 2.196 24.749 3.166 1280 HA HIS 77 HA HIS 77 1.401 22.273 4.322 1281 HB2 HIS 77 HB2 HIS 77 0.620 23.613 6.242 1282 HB3 HIS 77 HB3 HIS 77 2.205 24.145 5.702 1283 HD1 HIS 77 HD1 HIS 77 -1.358 25.267 5.942 1284 HD2 HIS 77 HD2 HIS 77 2.313 26.791 4.727 1285 HE1 HIS 77 HE1 HIS 77 -1.722 27.724 5.650 1286 HE2 HIS 77 HE2 HIS 77 0.551 28.651 5.097 Start of MODEL 15 1 H1 MET 1 H1 MET 1 8.050 13.602 10.111 2 H2 MET 1 H2 MET 1 8.467 15.211 9.788 3 H3 MET 1 H3 MET 1 9.453 13.953 9.232 4 HA MET 1 HA MET 1 7.807 13.193 7.721 5 HB2 MET 1 HB2 MET 1 6.072 15.436 8.852 6 HB3 MET 1 HB3 MET 1 5.648 14.459 7.453 7 HG2 MET 1 HG2 MET 1 5.569 12.457 8.873 8 HG3 MET 1 HG3 MET 1 5.999 13.438 10.278 9 HE1 MET 1 HE1 MET 1 3.350 11.515 9.998 10 HE2 MET 1 HE2 MET 1 2.159 12.542 10.797 11 HE3 MET 1 HE3 MET 1 3.778 12.379 11.476 12 H LYS 2 H LYS 2 10.022 14.229 6.987 13 HA LYS 2 HA LYS 2 9.971 16.874 5.870 14 HB2 LYS 2 HB2 LYS 2 12.033 15.480 6.549 15 HB3 LYS 2 HB3 LYS 2 11.845 14.614 5.034 16 HG2 LYS 2 HG2 LYS 2 12.192 17.628 5.127 17 HG3 LYS 2 HG3 LYS 2 13.577 16.538 5.168 18 HD2 LYS 2 HD2 LYS 2 12.858 15.597 2.959 19 HD3 LYS 2 HD3 LYS 2 11.520 16.750 2.924 20 HE2 LYS 2 HE2 LYS 2 13.145 18.623 2.950 21 HE3 LYS 2 HE3 LYS 2 14.475 17.462 2.959 22 HZ1 LYS 2 HZ1 LYS 2 14.092 18.267 0.749 23 HZ2 LYS 2 HZ2 LYS 2 12.464 17.829 0.809 24 HZ3 LYS 2 HZ3 LYS 2 13.662 16.630 0.811 25 H MET 3 H MET 3 9.419 13.619 4.547 26 HA MET 3 HA MET 3 7.682 14.767 2.464 27 HB2 MET 3 HB2 MET 3 8.585 13.244 0.719 28 HB3 MET 3 HB3 MET 3 9.799 14.380 1.286 29 HG2 MET 3 HG2 MET 3 10.705 12.528 2.755 30 HG3 MET 3 HG3 MET 3 9.612 11.425 1.917 31 HE1 MET 3 HE1 MET 3 9.872 12.955 -1.114 32 HE2 MET 3 HE2 MET 3 9.712 11.212 -0.884 33 HE3 MET 3 HE3 MET 3 11.054 11.858 -1.828 34 H LEU 4 H LEU 4 6.196 13.064 1.498 35 HA LEU 4 HA LEU 4 4.956 11.573 3.599 36 HB2 LEU 4 HB2 LEU 4 4.357 11.398 0.625 37 HB3 LEU 4 HB3 LEU 4 3.319 10.841 1.930 38 HG LEU 4 HG LEU 4 3.954 13.712 1.144 39 HD11 LEU 4 HD11 LEU 4 2.137 12.634 -0.093 40 HD12 LEU 4 HD12 LEU 4 1.532 13.940 0.921 41 HD13 LEU 4 HD13 LEU 4 1.305 12.261 1.419 42 HD21 LEU 4 HD21 LEU 4 4.122 13.654 3.576 43 HD22 LEU 4 HD22 LEU 4 2.563 12.835 3.698 44 HD23 LEU 4 HD23 LEU 4 2.650 14.490 3.089 45 H LYS 5 H LYS 5 7.231 10.717 1.123 46 HA LYS 5 HA LYS 5 7.075 7.891 1.206 47 HB2 LYS 5 HB2 LYS 5 8.259 9.215 -0.544 48 HB3 LYS 5 HB3 LYS 5 9.463 9.693 0.650 49 HG2 LYS 5 HG2 LYS 5 10.181 7.344 0.871 50 HG3 LYS 5 HG3 LYS 5 8.967 6.855 -0.315 51 HD2 LYS 5 HD2 LYS 5 10.105 8.120 -2.073 52 HD3 LYS 5 HD3 LYS 5 11.234 8.808 -0.901 53 HE2 LYS 5 HE2 LYS 5 11.044 5.847 -1.590 54 HE3 LYS 5 HE3 LYS 5 12.241 6.968 -2.243 55 HZ1 LYS 5 HZ1 LYS 5 13.164 5.747 -0.420 56 HZ2 LYS 5 HZ2 LYS 5 11.911 6.224 0.611 57 HZ3 LYS 5 HZ3 LYS 5 13.012 7.366 0.030 58 H GLU 6 H GLU 6 8.706 10.255 3.240 59 HA GLU 6 HA GLU 6 10.377 8.506 4.726 60 HB2 GLU 6 HB2 GLU 6 10.783 10.946 4.586 61 HB3 GLU 6 HB3 GLU 6 9.281 11.258 5.455 62 HG2 GLU 6 HG2 GLU 6 10.285 9.933 7.399 63 HG3 GLU 6 HG3 GLU 6 11.814 9.970 6.526 64 H LYS 7 H LYS 7 7.193 10.020 5.469 65 HA LYS 7 HA LYS 7 6.965 8.804 8.049 66 HB2 LYS 7 HB2 LYS 7 4.734 9.812 8.175 67 HB3 LYS 7 HB3 LYS 7 5.926 10.965 7.623 68 HG2 LYS 7 HG2 LYS 7 4.076 11.465 6.303 69 HG3 LYS 7 HG3 LYS 7 5.047 10.452 5.234 70 HD2 LYS 7 HD2 LYS 7 3.600 8.534 5.650 71 HD3 LYS 7 HD3 LYS 7 2.714 9.414 6.900 72 HE2 LYS 7 HE2 LYS 7 2.776 10.151 3.950 73 HE3 LYS 7 HE3 LYS 7 1.465 9.287 4.757 74 HZ1 LYS 7 HZ1 LYS 7 0.991 11.650 4.531 75 HZ2 LYS 7 HZ2 LYS 7 2.374 12.039 5.419 76 HZ3 LYS 7 HZ3 LYS 7 1.097 11.215 6.158 77 H ALA 8 H ALA 8 5.997 7.746 4.853 78 HA ALA 8 HA ALA 8 4.329 5.575 5.527 79 HB1 ALA 8 HB1 ALA 8 4.688 6.316 3.205 80 HB2 ALA 8 HB2 ALA 8 5.030 4.591 3.373 81 HB3 ALA 8 HB3 ALA 8 6.359 5.751 3.273 82 H GLY 9 H GLY 9 7.859 5.884 5.470 83 HA2 GLY 9 HA2 GLY 9 8.544 3.259 6.306 84 HA3 GLY 9 HA3 GLY 9 9.552 4.689 6.438 85 H ALA 10 H ALA 10 7.707 6.185 8.154 86 HA ALA 10 HA ALA 10 8.380 5.205 10.750 87 HB1 ALA 10 HB1 ALA 10 8.037 7.605 10.294 88 HB2 ALA 10 HB2 ALA 10 6.996 7.051 11.606 89 HB3 ALA 10 HB3 ALA 10 6.322 7.313 9.993 90 H LEU 11 H LEU 11 5.286 5.261 8.948 91 HA LEU 11 HA LEU 11 3.657 3.853 10.778 92 HB2 LEU 11 HB2 LEU 11 3.516 4.005 7.740 93 HB3 LEU 11 HB3 LEU 11 2.249 3.306 8.739 94 HG LEU 11 HG LEU 11 3.140 6.220 8.888 95 HD11 LEU 11 HD11 LEU 11 0.675 5.065 7.542 96 HD12 LEU 11 HD12 LEU 11 2.074 5.774 6.729 97 HD13 LEU 11 HD13 LEU 11 1.047 6.783 7.743 98 HD21 LEU 11 HD21 LEU 11 2.214 5.393 11.014 99 HD22 LEU 11 HD22 LEU 11 0.760 4.835 10.182 100 HD23 LEU 11 HD23 LEU 11 1.130 6.559 10.261 101 H ALA 12 H ALA 12 5.765 2.737 8.169 102 HA ALA 12 HA ALA 12 5.344 -0.031 8.257 103 HB1 ALA 12 HB1 ALA 12 7.909 1.471 7.630 104 HB2 ALA 12 HB2 ALA 12 6.613 1.110 6.489 105 HB3 ALA 12 HB3 ALA 12 7.556 -0.205 7.191 106 H GLY 13 H GLY 13 7.565 2.010 10.109 107 HA2 GLY 13 HA2 GLY 13 9.110 0.098 11.408 108 HA3 GLY 13 HA3 GLY 13 8.771 1.708 12.022 109 H GLN 14 H GLN 14 6.172 1.714 12.673 110 HA GLN 14 HA GLN 14 6.160 0.356 15.166 111 HB2 GLN 14 HB2 GLN 14 3.977 1.354 15.548 112 HB3 GLN 14 HB3 GLN 14 5.036 2.541 14.797 113 HG2 GLN 14 HG2 GLN 14 3.939 2.174 12.628 114 HG3 GLN 14 HG3 GLN 14 2.903 0.943 13.348 115 HE21 GLN 14 HE21 GLN 14 3.502 4.359 13.062 116 HE22 GLN 14 HE22 GLN 14 2.015 4.870 13.774 117 H ILE 15 H ILE 15 4.641 -0.428 12.056 118 HA ILE 15 HA ILE 15 2.916 -2.511 12.973 119 HB ILE 15 HB ILE 15 4.069 -1.974 10.198 120 HG12 ILE 15 HG12 ILE 15 1.282 -1.426 11.334 121 HG13 ILE 15 HG13 ILE 15 2.538 -0.211 11.118 122 HG21 ILE 15 HG21 ILE 15 3.459 -4.358 10.326 123 HG22 ILE 15 HG22 ILE 15 2.323 -3.495 9.293 124 HG23 ILE 15 HG23 ILE 15 1.857 -3.937 10.936 125 HD11 ILE 15 HD11 ILE 15 0.879 -0.092 9.360 126 HD12 ILE 15 HD12 ILE 15 1.182 -1.769 8.917 127 HD13 ILE 15 HD13 ILE 15 2.445 -0.556 8.693 128 H TRP 16 H TRP 16 6.246 -2.553 11.622 129 HA TRP 16 HA TRP 16 6.555 -5.375 11.705 130 HB2 TRP 16 HB2 TRP 16 8.019 -3.775 10.354 131 HB3 TRP 16 HB3 TRP 16 8.850 -3.367 11.853 132 HD1 TRP 16 HD1 TRP 16 8.636 -6.083 9.202 133 HE1 TRP 16 HE1 TRP 16 10.370 -7.913 9.668 134 HE3 TRP 16 HE3 TRP 16 10.220 -4.571 13.822 135 HZ2 TRP 16 HZ2 TRP 16 12.183 -8.630 11.704 136 HZ3 TRP 16 HZ3 TRP 16 11.946 -5.874 14.969 137 HH2 TRP 16 HH2 TRP 16 12.910 -7.870 13.938 138 H GLU 17 H GLU 17 7.445 -2.805 14.076 139 HA GLU 17 HA GLU 17 8.659 -4.527 15.985 140 HB2 GLU 17 HB2 GLU 17 7.237 -1.901 16.579 141 HB3 GLU 17 HB3 GLU 17 8.412 -2.713 17.610 142 HG2 GLU 17 HG2 GLU 17 8.939 -1.401 14.934 143 HG3 GLU 17 HG3 GLU 17 9.409 -0.789 16.510 144 H ALA 18 H ALA 18 5.286 -3.627 15.423 145 HA ALA 18 HA ALA 18 4.131 -4.855 17.733 146 HB1 ALA 18 HB1 ALA 18 2.867 -4.278 15.034 147 HB2 ALA 18 HB2 ALA 18 2.936 -3.163 16.399 148 HB3 ALA 18 HB3 ALA 18 1.994 -4.650 16.525 149 H LEU 19 H LEU 19 5.073 -6.062 14.562 150 HA LEU 19 HA LEU 19 4.027 -8.754 15.057 151 HB2 LEU 19 HB2 LEU 19 5.534 -7.540 12.715 152 HB3 LEU 19 HB3 LEU 19 5.012 -9.219 12.772 153 HG LEU 19 HG LEU 19 3.120 -6.827 12.865 154 HD11 LEU 19 HD11 LEU 19 4.217 -6.963 10.679 155 HD12 LEU 19 HD12 LEU 19 2.516 -7.404 10.556 156 HD13 LEU 19 HD13 LEU 19 3.755 -8.663 10.530 157 HD21 LEU 19 HD21 LEU 19 2.530 -9.802 12.599 158 HD22 LEU 19 HD22 LEU 19 1.338 -8.503 12.505 159 HD23 LEU 19 HD23 LEU 19 2.199 -8.795 14.012 160 H ASN 20 H ASN 20 6.960 -7.083 15.719 161 HA ASN 20 HA ASN 20 8.791 -9.267 15.556 162 HB2 ASN 20 HB2 ASN 20 9.548 -6.903 15.660 163 HB3 ASN 20 HB3 ASN 20 8.954 -6.777 17.308 164 HD21 ASN 20 HD21 ASN 20 10.976 -6.338 18.198 165 HD22 ASN 20 HD22 ASN 20 12.243 -7.503 18.270 166 H GLY 21 H GLY 21 9.059 -10.965 16.891 167 HA2 GLY 21 HA2 GLY 21 8.955 -12.303 18.791 168 HA3 GLY 21 HA3 GLY 21 8.131 -11.019 19.661 169 H THR 22 H THR 22 6.553 -11.439 16.733 170 HA THR 22 HA THR 22 4.604 -13.410 17.826 171 HB THR 22 HB THR 22 2.811 -12.386 16.673 172 HG1 THR 22 HG1 THR 22 4.783 -11.310 14.996 173 HG21 THR 22 HG21 THR 22 2.815 -9.986 17.259 174 HG22 THR 22 HG22 THR 22 4.557 -10.050 17.529 175 HG23 THR 22 HG23 THR 22 3.467 -10.968 18.572 176 H GLU 23 H GLU 23 3.733 -14.962 16.363 177 HA GLU 23 HA GLU 23 5.579 -15.870 14.309 178 HB2 GLU 23 HB2 GLU 23 2.982 -17.094 15.326 179 HB3 GLU 23 HB3 GLU 23 4.130 -17.883 14.239 180 HG2 GLU 23 HG2 GLU 23 5.868 -17.783 15.990 181 HG3 GLU 23 HG3 GLU 23 4.737 -16.982 17.078 182 H GLY 24 H GLY 24 2.956 -13.761 14.267 183 HA2 GLY 24 HA2 GLY 24 2.611 -12.670 12.058 184 HA3 GLY 24 HA3 GLY 24 2.355 -14.275 11.393 185 H LEU 25 H LEU 25 0.691 -11.607 12.031 186 HA LEU 25 HA LEU 25 -1.801 -13.007 12.834 187 HB2 LEU 25 HB2 LEU 25 -0.901 -10.220 13.685 188 HB3 LEU 25 HB3 LEU 25 -2.565 -10.758 13.803 189 HG LEU 25 HG LEU 25 -1.679 -12.657 15.332 190 HD11 LEU 25 HD11 LEU 25 0.741 -10.847 15.514 191 HD12 LEU 25 HD12 LEU 25 0.704 -12.473 14.832 192 HD13 LEU 25 HD13 LEU 25 0.395 -12.237 16.547 193 HD21 LEU 25 HD21 LEU 25 -3.000 -10.779 16.195 194 HD22 LEU 25 HD22 LEU 25 -1.539 -9.800 16.353 195 HD23 LEU 25 HD23 LEU 25 -1.746 -11.249 17.341 196 H THR 26 H THR 26 -3.807 -11.647 12.169 197 HA THR 26 HA THR 26 -3.584 -10.945 9.332 198 HB THR 26 HB THR 26 -6.027 -10.878 9.274 199 HG1 THR 26 HG1 THR 26 -7.119 -10.426 11.013 200 HG21 THR 26 HG21 THR 26 -6.599 -13.174 9.958 201 HG22 THR 26 HG22 THR 26 -5.127 -13.268 10.925 202 HG23 THR 26 HG23 THR 26 -5.020 -13.139 9.167 203 H GLN 27 H GLN 27 -5.061 -8.949 8.660 204 HA GLN 27 HA GLN 27 -3.383 -6.800 9.425 205 HB2 GLN 27 HB2 GLN 27 -4.404 -5.536 7.688 206 HB3 GLN 27 HB3 GLN 27 -4.294 -7.187 7.126 207 HG2 GLN 27 HG2 GLN 27 -6.459 -7.035 6.514 208 HG3 GLN 27 HG3 GLN 27 -6.878 -7.029 8.226 209 HE21 GLN 27 HE21 GLN 27 -6.454 -5.058 5.374 210 HE22 GLN 27 HE22 GLN 27 -7.204 -3.637 6.000 211 H LYS 28 H LYS 28 -6.773 -7.472 10.214 212 HA LYS 28 HA LYS 28 -7.348 -5.018 11.571 213 HB2 LYS 28 HB2 LYS 28 -8.650 -7.765 11.812 214 HB3 LYS 28 HB3 LYS 28 -9.334 -6.276 12.460 215 HG2 LYS 28 HG2 LYS 28 -8.722 -6.609 9.507 216 HG3 LYS 28 HG3 LYS 28 -10.242 -7.164 10.209 217 HD2 LYS 28 HD2 LYS 28 -9.264 -4.287 10.447 218 HD3 LYS 28 HD3 LYS 28 -10.276 -4.856 9.114 219 HE2 LYS 28 HE2 LYS 28 -11.016 -4.918 12.063 220 HE3 LYS 28 HE3 LYS 28 -11.651 -3.802 10.851 221 HZ1 LYS 28 HZ1 LYS 28 -12.531 -5.763 9.655 222 HZ2 LYS 28 HZ2 LYS 28 -13.222 -5.552 11.182 223 HZ3 LYS 28 HZ3 LYS 28 -12.048 -6.746 10.939 224 H GLN 29 H GLN 29 -5.975 -8.105 12.627 225 HA GLN 29 HA GLN 29 -6.035 -7.656 15.447 226 HB2 GLN 29 HB2 GLN 29 -4.243 -9.452 13.769 227 HB3 GLN 29 HB3 GLN 29 -4.257 -9.454 15.532 228 HG2 GLN 29 HG2 GLN 29 -6.652 -10.134 15.477 229 HG3 GLN 29 HG3 GLN 29 -6.573 -10.218 13.718 230 HE21 GLN 29 HE21 GLN 29 -5.453 -11.960 12.765 231 HE22 GLN 29 HE22 GLN 29 -4.939 -13.340 13.659 232 H ILE 30 H ILE 30 -3.557 -7.010 12.958 233 HA ILE 30 HA ILE 30 -1.551 -5.925 14.691 234 HB ILE 30 HB ILE 30 -1.966 -5.123 11.774 235 HG12 ILE 30 HG12 ILE 30 -0.345 -7.534 12.714 236 HG13 ILE 30 HG13 ILE 30 -1.970 -7.650 12.042 237 HG21 ILE 30 HG21 ILE 30 0.487 -4.788 11.758 238 HG22 ILE 30 HG22 ILE 30 0.576 -5.265 13.454 239 HG23 ILE 30 HG23 ILE 30 -0.281 -3.791 12.995 240 HD11 ILE 30 HD11 ILE 30 -0.325 -8.146 10.352 241 HD12 ILE 30 HD12 ILE 30 0.476 -6.597 10.620 242 HD13 ILE 30 HD13 ILE 30 -1.155 -6.643 9.945 243 H LYS 31 H LYS 31 -4.252 -4.553 12.907 244 HA LYS 31 HA LYS 31 -3.794 -1.804 13.129 245 HB2 LYS 31 HB2 LYS 31 -5.498 -3.111 11.706 246 HB3 LYS 31 HB3 LYS 31 -6.523 -3.138 13.134 247 HG2 LYS 31 HG2 LYS 31 -6.546 -0.644 13.116 248 HG3 LYS 31 HG3 LYS 31 -5.577 -0.670 11.641 249 HD2 LYS 31 HD2 LYS 31 -7.388 -1.884 10.463 250 HD3 LYS 31 HD3 LYS 31 -8.353 -1.893 11.944 251 HE2 LYS 31 HE2 LYS 31 -7.482 0.593 10.424 252 HE3 LYS 31 HE3 LYS 31 -9.083 -0.139 10.367 253 HZ1 LYS 31 HZ1 LYS 31 -9.332 0.313 12.731 254 HZ2 LYS 31 HZ2 LYS 31 -9.031 1.734 11.872 255 HZ3 LYS 31 HZ3 LYS 31 -7.798 1.019 12.780 256 H LYS 32 H LYS 32 -5.347 -4.059 15.403 257 HA LYS 32 HA LYS 32 -6.040 -2.231 17.472 258 HB2 LYS 32 HB2 LYS 32 -5.363 -5.192 17.493 259 HB3 LYS 32 HB3 LYS 32 -5.764 -4.335 18.975 260 HG2 LYS 32 HG2 LYS 32 -7.595 -4.593 16.570 261 HG3 LYS 32 HG3 LYS 32 -7.662 -5.600 18.024 262 HD2 LYS 32 HD2 LYS 32 -7.966 -3.376 19.332 263 HD3 LYS 32 HD3 LYS 32 -8.269 -2.630 17.757 264 HE2 LYS 32 HE2 LYS 32 -9.873 -4.839 19.090 265 HE3 LYS 32 HE3 LYS 32 -10.395 -3.185 18.770 266 HZ1 LYS 32 HZ1 LYS 32 -11.358 -4.590 17.139 267 HZ2 LYS 32 HZ2 LYS 32 -9.882 -5.331 16.788 268 HZ3 LYS 32 HZ3 LYS 32 -10.134 -3.714 16.361 269 H ALA 33 H ALA 33 -3.143 -4.277 17.016 270 HA ALA 33 HA ALA 33 -1.783 -3.652 19.392 271 HB1 ALA 33 HB1 ALA 33 0.192 -4.670 18.328 272 HB2 ALA 33 HB2 ALA 33 -0.594 -4.563 16.749 273 HB3 ALA 33 HB3 ALA 33 -1.264 -5.614 17.996 274 H THR 34 H THR 34 -1.750 -2.032 16.273 275 HA THR 34 HA THR 34 0.357 -0.123 17.028 276 HB THR 34 HB THR 34 0.116 0.665 14.646 277 HG1 THR 34 HG1 THR 34 -1.193 -0.753 13.276 278 HG21 THR 34 HG21 THR 34 1.775 -1.095 15.170 279 HG22 THR 34 HG22 THR 34 1.079 -1.331 13.568 280 HG23 THR 34 HG23 THR 34 0.544 -2.338 14.915 281 H LYS 35 H LYS 35 -3.089 -0.321 16.943 282 HA LYS 35 HA LYS 35 -4.818 1.087 17.281 283 HB2 LYS 35 HB2 LYS 35 -2.632 2.824 18.469 284 HB3 LYS 35 HB3 LYS 35 -4.315 3.340 18.462 285 HG2 LYS 35 HG2 LYS 35 -4.889 1.256 19.754 286 HG3 LYS 35 HG3 LYS 35 -3.160 0.906 19.874 287 HD2 LYS 35 HD2 LYS 35 -2.782 2.954 21.145 288 HD3 LYS 35 HD3 LYS 35 -4.447 3.482 20.888 289 HE2 LYS 35 HE2 LYS 35 -4.187 2.624 23.154 290 HE3 LYS 35 HE3 LYS 35 -5.242 1.554 22.234 291 HZ1 LYS 35 HZ1 LYS 35 -3.686 0.302 23.551 292 HZ2 LYS 35 HZ2 LYS 35 -2.375 1.094 22.838 293 HZ3 LYS 35 HZ3 LYS 35 -3.346 0.070 21.911 294 H LEU 36 H LEU 36 -3.332 1.171 14.715 295 HA LEU 36 HA LEU 36 -3.463 3.786 13.574 296 HB2 LEU 36 HB2 LEU 36 -3.527 1.030 12.283 297 HB3 LEU 36 HB3 LEU 36 -3.478 2.523 11.354 298 HG LEU 36 HG LEU 36 -1.319 1.559 13.278 299 HD11 LEU 36 HD11 LEU 36 0.086 1.275 11.303 300 HD12 LEU 36 HD12 LEU 36 -1.245 1.771 10.253 301 HD13 LEU 36 HD13 LEU 36 -1.362 0.275 11.184 302 HD21 LEU 36 HD21 LEU 36 -1.351 4.069 11.564 303 HD22 LEU 36 HD22 LEU 36 0.021 3.481 12.511 304 HD23 LEU 36 HD23 LEU 36 -1.449 4.007 13.326 305 H LYS 37 H LYS 37 -5.216 4.967 13.018 306 HA LYS 37 HA LYS 37 -7.816 3.996 13.721 307 HB2 LYS 37 HB2 LYS 37 -7.034 6.672 12.501 308 HB3 LYS 37 HB3 LYS 37 -8.609 6.292 13.194 309 HG2 LYS 37 HG2 LYS 37 -5.953 6.493 14.660 310 HG3 LYS 37 HG3 LYS 37 -7.333 7.588 14.794 311 HD2 LYS 37 HD2 LYS 37 -7.253 4.674 15.709 312 HD3 LYS 37 HD3 LYS 37 -7.158 6.089 16.757 313 HE2 LYS 37 HE2 LYS 37 -9.549 5.349 15.026 314 HE3 LYS 37 HE3 LYS 37 -9.413 5.058 16.759 315 HZ1 LYS 37 HZ1 LYS 37 -10.696 7.048 16.226 316 HZ2 LYS 37 HZ2 LYS 37 -9.341 7.740 15.488 317 HZ3 LYS 37 HZ3 LYS 37 -9.327 7.408 17.145 318 H ALA 38 H ALA 38 -6.229 4.605 10.608 319 HA ALA 38 HA ALA 38 -8.595 3.421 9.241 320 HB1 ALA 38 HB1 ALA 38 -7.856 4.524 7.165 321 HB2 ALA 38 HB2 ALA 38 -6.488 5.244 8.023 322 HB3 ALA 38 HB3 ALA 38 -8.135 5.712 8.446 323 H ASP 39 H ASP 39 -8.316 1.668 7.977 324 HA ASP 39 HA ASP 39 -5.989 0.032 8.053 325 HB2 ASP 39 HB2 ASP 39 -7.180 -1.382 6.423 326 HB3 ASP 39 HB3 ASP 39 -8.237 -0.921 7.749 327 H LYS 40 H LYS 40 -7.008 2.619 6.011 328 HA LYS 40 HA LYS 40 -5.530 2.194 3.672 329 HB2 LYS 40 HB2 LYS 40 -6.284 4.881 4.893 330 HB3 LYS 40 HB3 LYS 40 -5.903 4.560 3.198 331 HG2 LYS 40 HG2 LYS 40 -7.909 2.971 3.188 332 HG3 LYS 40 HG3 LYS 40 -8.332 3.630 4.767 333 HD2 LYS 40 HD2 LYS 40 -8.540 5.872 3.790 334 HD3 LYS 40 HD3 LYS 40 -8.049 5.259 2.211 335 HE2 LYS 40 HE2 LYS 40 -10.081 3.746 2.275 336 HE3 LYS 40 HE3 LYS 40 -10.597 4.601 3.733 337 HZ1 LYS 40 HZ1 LYS 40 -10.259 5.702 1.000 338 HZ2 LYS 40 HZ2 LYS 40 -10.515 6.667 2.365 339 HZ3 LYS 40 HZ3 LYS 40 -11.695 5.559 1.888 340 H ASP 41 H ASP 41 -4.532 3.954 6.656 341 HA ASP 41 HA ASP 41 -1.920 4.626 5.571 342 HB2 ASP 41 HB2 ASP 41 -1.407 5.441 7.910 343 HB3 ASP 41 HB3 ASP 41 -2.804 6.200 7.152 344 H PHE 42 H PHE 42 -3.265 2.077 7.601 345 HA PHE 42 HA PHE 42 -0.957 0.594 8.211 346 HB2 PHE 42 HB2 PHE 42 -3.094 -0.036 9.161 347 HB3 PHE 42 HB3 PHE 42 -3.788 -0.322 7.570 348 HD1 PHE 42 HD1 PHE 42 -1.360 -1.633 10.070 349 HD2 PHE 42 HD2 PHE 42 -3.470 -2.428 6.431 350 HE1 PHE 42 HE1 PHE 42 -0.636 -3.979 10.149 351 HE2 PHE 42 HE2 PHE 42 -2.744 -4.767 6.533 352 HZ PHE 42 HZ PHE 42 -1.326 -5.546 8.384 353 H PHE 43 H PHE 43 -2.849 0.678 5.151 354 HA PHE 43 HA PHE 43 -1.377 -1.330 3.776 355 HB2 PHE 43 HB2 PHE 43 -2.938 1.000 2.594 356 HB3 PHE 43 HB3 PHE 43 -2.357 -0.389 1.681 357 HD1 PHE 43 HD2 PHE 43 -3.056 -2.555 3.762 358 HD2 PHE 43 HD1 PHE 43 -5.275 0.760 2.220 359 HE1 PHE 43 HE2 PHE 43 -5.160 -3.733 4.236 360 HE2 PHE 43 HE1 PHE 43 -7.367 -0.420 2.704 361 HZ PHE 43 HZ PHE 43 -7.317 -2.673 3.709 362 H LEU 44 H LEU 44 -0.828 2.157 4.119 363 HA LEU 44 HA LEU 44 1.397 2.357 2.332 364 HB2 LEU 44 HB2 LEU 44 0.334 4.055 4.590 365 HB3 LEU 44 HB3 LEU 44 1.931 4.408 3.959 366 HG LEU 44 HG LEU 44 1.013 4.869 1.731 367 HD11 LEU 44 HD11 LEU 44 -1.389 4.919 1.254 368 HD12 LEU 44 HD12 LEU 44 -1.735 4.268 2.857 369 HD13 LEU 44 HD13 LEU 44 -0.862 3.290 1.677 370 HD21 LEU 44 HD21 LEU 44 1.119 6.732 3.338 371 HD22 LEU 44 HD22 LEU 44 -0.523 6.370 3.878 372 HD23 LEU 44 HD23 LEU 44 -0.236 6.921 2.227 373 H GLY 45 H GLY 45 1.118 1.589 5.799 374 HA2 GLY 45 HA2 GLY 45 3.920 1.471 6.385 375 HA3 GLY 45 HA3 GLY 45 2.621 0.804 7.360 376 H LEU 46 H LEU 46 1.588 -1.238 6.285 377 HA LEU 46 HA LEU 46 3.353 -3.381 6.102 378 HB2 LEU 46 HB2 LEU 46 0.956 -3.626 6.627 379 HB3 LEU 46 HB3 LEU 46 0.530 -3.133 4.997 380 HG LEU 46 HG LEU 46 1.712 -5.206 4.127 381 HD11 LEU 46 HD11 LEU 46 2.213 -7.037 5.672 382 HD12 LEU 46 HD12 LEU 46 1.840 -6.000 7.050 383 HD13 LEU 46 HD13 LEU 46 3.215 -5.625 6.006 384 HD21 LEU 46 HD21 LEU 46 -0.098 -6.760 4.678 385 HD22 LEU 46 HD22 LEU 46 -0.737 -5.149 4.360 386 HD23 LEU 46 HD23 LEU 46 -0.602 -5.731 6.022 387 H GLY 47 H GLY 47 2.041 -1.357 3.519 388 HA2 GLY 47 HA2 GLY 47 2.982 -2.806 1.262 389 HA3 GLY 47 HA3 GLY 47 2.588 -1.091 1.300 390 H TRP 48 H TRP 48 4.477 -0.362 3.346 391 HA TRP 48 HA TRP 48 6.942 -0.212 1.876 392 HB2 TRP 48 HB2 TRP 48 6.012 1.597 3.428 393 HB3 TRP 48 HB3 TRP 48 6.519 0.594 4.781 394 HD1 TRP 48 HD1 TRP 48 9.182 0.482 5.284 395 HE1 TRP 48 HE1 TRP 48 11.150 1.924 4.479 396 HE3 TRP 48 HE3 TRP 48 6.893 2.911 1.407 397 HZ2 TRP 48 HZ2 TRP 48 11.679 3.829 2.480 398 HZ3 TRP 48 HZ3 TRP 48 8.203 4.531 0.091 399 HH2 TRP 48 HH2 TRP 48 10.552 4.979 0.623 400 H LEU 49 H LEU 49 5.714 -2.321 4.444 401 HA LEU 49 HA LEU 49 8.173 -3.651 5.047 402 HB2 LEU 49 HB2 LEU 49 5.265 -4.384 5.358 403 HB3 LEU 49 HB3 LEU 49 6.462 -5.637 5.573 404 HG LEU 49 HG LEU 49 7.415 -4.559 7.506 405 HD11 LEU 49 HD11 LEU 49 6.640 -2.419 8.372 406 HD12 LEU 49 HD12 LEU 49 5.604 -2.214 6.952 407 HD13 LEU 49 HD13 LEU 49 7.362 -2.257 6.773 408 HD21 LEU 49 HD21 LEU 49 5.333 -5.837 7.921 409 HD22 LEU 49 HD22 LEU 49 4.389 -4.359 7.724 410 HD23 LEU 49 HD23 LEU 49 5.530 -4.510 9.065 411 H LEU 50 H LEU 50 5.833 -4.048 2.427 412 HA LEU 50 HA LEU 50 7.121 -6.304 1.171 413 HB2 LEU 50 HB2 LEU 50 5.153 -4.260 0.084 414 HB3 LEU 50 HB3 LEU 50 5.714 -5.655 -0.832 415 HG LEU 50 HG LEU 50 4.091 -5.757 1.751 416 HD11 LEU 50 HD11 LEU 50 2.279 -6.657 0.360 417 HD12 LEU 50 HD12 LEU 50 3.261 -6.436 -1.092 418 HD13 LEU 50 HD13 LEU 50 2.735 -5.033 -0.155 419 HD21 LEU 50 HD21 LEU 50 5.647 -7.650 1.635 420 HD22 LEU 50 HD22 LEU 50 5.079 -8.050 0.011 421 HD23 LEU 50 HD23 LEU 50 3.992 -8.192 1.391 422 H ARG 51 H ARG 51 7.347 -2.781 0.838 423 HA ARG 51 HA ARG 51 9.186 -2.475 -1.248 424 HB2 ARG 51 HB2 ARG 51 7.942 -0.707 0.163 425 HB3 ARG 51 HB3 ARG 51 9.212 -0.875 1.350 426 HG2 ARG 51 HG2 ARG 51 9.719 -0.009 -1.500 427 HG3 ARG 51 HG3 ARG 51 9.333 1.124 -0.213 428 HD2 ARG 51 HD2 ARG 51 11.377 0.404 0.991 429 HD3 ARG 51 HD3 ARG 51 11.769 -0.696 -0.337 430 HE ARG 51 HE ARG 51 12.023 2.186 -0.290 431 HH11 ARG 51 HH11 ARG 51 12.063 -0.625 -2.327 432 HH12 ARG 51 HH12 ARG 51 12.751 0.230 -3.658 433 HH21 ARG 51 HH21 ARG 51 12.947 3.216 -1.974 434 HH22 ARG 51 HH22 ARG 51 13.237 2.390 -3.461 435 H GLU 52 H GLU 52 9.758 -3.120 2.202 436 HA GLU 52 HA GLU 52 12.625 -3.366 2.006 437 HB2 GLU 52 HB2 GLU 52 10.708 -4.193 4.232 438 HB3 GLU 52 HB3 GLU 52 12.456 -4.056 4.389 439 HG2 GLU 52 HG2 GLU 52 12.371 -1.662 4.174 440 HG3 GLU 52 HG3 GLU 52 10.677 -1.698 3.692 441 H ASP 53 H ASP 53 9.933 -5.480 1.506 442 HA ASP 53 HA ASP 53 9.573 -7.682 1.164 443 HB2 ASP 53 HB2 ASP 53 11.361 -7.284 -0.566 444 HB3 ASP 53 HB3 ASP 53 12.565 -7.820 0.599 445 H LYS 54 H LYS 54 10.334 -6.623 3.782 446 HA LYS 54 HA LYS 54 11.737 -8.722 5.227 447 HB2 LYS 54 HB2 LYS 54 12.311 -6.356 5.578 448 HB3 LYS 54 HB3 LYS 54 10.666 -5.997 6.075 449 HG2 LYS 54 HG2 LYS 54 10.925 -7.045 8.155 450 HG3 LYS 54 HG3 LYS 54 12.302 -8.001 7.618 451 HD2 LYS 54 HD2 LYS 54 12.843 -6.131 9.231 452 HD3 LYS 54 HD3 LYS 54 13.782 -6.137 7.736 453 HE2 LYS 54 HE2 LYS 54 13.160 -3.859 8.303 454 HE3 LYS 54 HE3 LYS 54 12.313 -4.345 6.840 455 HZ1 LYS 54 HZ1 LYS 54 11.171 -4.164 9.576 456 HZ2 LYS 54 HZ2 LYS 54 10.343 -4.774 8.231 457 HZ3 LYS 54 HZ3 LYS 54 10.839 -3.161 8.253 458 H VAL 55 H VAL 55 8.567 -8.389 4.269 459 HA VAL 55 HA VAL 55 7.739 -10.358 6.319 460 HB VAL 55 HB VAL 55 5.411 -9.581 6.361 461 HG11 VAL 55 HG11 VAL 55 6.932 -8.729 8.091 462 HG12 VAL 55 HG12 VAL 55 5.687 -7.541 7.705 463 HG13 VAL 55 HG13 VAL 55 7.324 -7.336 7.080 464 HG21 VAL 55 HG21 VAL 55 6.316 -7.257 4.605 465 HG22 VAL 55 HG22 VAL 55 4.722 -7.411 5.350 466 HG23 VAL 55 HG23 VAL 55 5.237 -8.569 4.122 467 H VAL 56 H VAL 56 5.857 -11.665 5.611 468 HA VAL 56 HA VAL 56 5.680 -12.135 2.714 469 HB VAL 56 HB VAL 56 5.165 -14.162 4.935 470 HG11 VAL 56 HG11 VAL 56 5.159 -15.856 3.128 471 HG12 VAL 56 HG12 VAL 56 5.379 -14.583 1.925 472 HG13 VAL 56 HG13 VAL 56 3.894 -14.650 2.878 473 HG21 VAL 56 HG21 VAL 56 7.631 -13.937 3.165 474 HG22 VAL 56 HG22 VAL 56 7.301 -15.237 4.313 475 HG23 VAL 56 HG23 VAL 56 7.561 -13.591 4.895 476 H THR 57 H THR 57 3.669 -11.930 1.795 477 HA THR 57 HA THR 57 1.337 -11.368 3.546 478 HB THR 57 HB THR 57 0.302 -10.411 1.388 479 HG1 THR 57 HG1 THR 57 3.008 -10.466 0.485 480 HG21 THR 57 HG21 THR 57 2.793 -9.051 2.460 481 HG22 THR 57 HG22 THR 57 1.163 -8.907 3.123 482 HG23 THR 57 HG23 THR 57 1.522 -8.266 1.518 483 H SER 58 H SER 58 -0.414 -12.612 3.493 484 HA SER 58 HA SER 58 -0.901 -14.621 1.410 485 HB2 SER 58 HB2 SER 58 0.474 -15.802 3.129 486 HB3 SER 58 HB3 SER 58 -0.682 -15.342 4.378 487 HG SER 58 HG SER 58 -0.744 -17.507 2.963 488 H GLU 59 H GLU 59 -3.048 -15.742 1.872 489 HA GLU 59 HA GLU 59 -5.063 -13.802 2.884 490 HB2 GLU 59 HB2 GLU 59 -5.141 -14.128 0.435 491 HB3 GLU 59 HB3 GLU 59 -5.247 -15.872 0.647 492 HG2 GLU 59 HG2 GLU 59 -7.464 -15.475 1.844 493 HG3 GLU 59 HG3 GLU 59 -7.353 -13.791 1.325 494 H VAL 60 H VAL 60 -5.833 -14.501 4.827 495 HA VAL 60 HA VAL 60 -6.775 -17.310 5.065 496 HB VAL 60 HB VAL 60 -5.380 -15.700 7.270 497 HG11 VAL 60 HG11 VAL 60 -7.248 -16.926 8.271 498 HG12 VAL 60 HG12 VAL 60 -5.722 -17.665 8.747 499 HG13 VAL 60 HG13 VAL 60 -6.719 -18.423 7.501 500 HG21 VAL 60 HG21 VAL 60 -4.590 -18.337 5.981 501 HG22 VAL 60 HG22 VAL 60 -3.734 -17.537 7.302 502 HG23 VAL 60 HG23 VAL 60 -3.805 -16.780 5.710 503 H GLU 61 H GLU 61 -8.874 -17.429 5.494 504 HA GLU 61 HA GLU 61 -11.012 -17.061 6.108 505 HB2 GLU 61 HB2 GLU 61 -9.809 -15.113 8.125 506 HB3 GLU 61 HB3 GLU 61 -11.438 -15.778 8.196 507 HG2 GLU 61 HG2 GLU 61 -8.915 -17.458 8.319 508 HG3 GLU 61 HG3 GLU 61 -9.740 -16.860 9.743 509 H GLY 62 H GLY 62 -9.944 -15.496 3.905 510 HA2 GLY 62 HA2 GLY 62 -10.718 -13.935 2.410 511 HA3 GLY 62 HA3 GLY 62 -12.062 -13.618 3.494 512 H GLU 63 H GLU 63 -8.842 -13.269 4.773 513 HA GLU 63 HA GLU 63 -8.893 -10.323 4.456 514 HB2 GLU 63 HB2 GLU 63 -9.911 -11.176 6.673 515 HB3 GLU 63 HB3 GLU 63 -8.290 -11.710 7.106 516 HG2 GLU 63 HG2 GLU 63 -7.525 -9.319 6.817 517 HG3 GLU 63 HG3 GLU 63 -9.214 -8.866 6.592 518 H ILE 64 H ILE 64 -6.794 -9.292 5.047 519 HA ILE 64 HA ILE 64 -4.543 -10.606 3.849 520 HB ILE 64 HB ILE 64 -4.605 -7.972 5.398 521 HG12 ILE 64 HG12 ILE 64 -4.887 -8.412 2.385 522 HG13 ILE 64 HG13 ILE 64 -6.196 -7.946 3.468 523 HG21 ILE 64 HG21 ILE 64 -2.533 -7.410 4.151 524 HG22 ILE 64 HG22 ILE 64 -2.545 -9.013 3.413 525 HG23 ILE 64 HG23 ILE 64 -2.319 -8.846 5.156 526 HD11 ILE 64 HD11 ILE 64 -5.051 -5.821 3.925 527 HD12 ILE 64 HD12 ILE 64 -5.364 -6.047 2.205 528 HD13 ILE 64 HD13 ILE 64 -3.740 -6.297 2.839 529 H PHE 65 H PHE 65 -3.690 -12.278 5.000 530 HA PHE 65 HA PHE 65 -2.931 -11.959 7.846 531 HB2 PHE 65 HB2 PHE 65 -4.119 -14.039 7.353 532 HB3 PHE 65 HB3 PHE 65 -3.022 -14.409 6.029 533 HD1 PHE 65 HD2 PHE 65 -3.231 -14.088 9.744 534 HD2 PHE 65 HD1 PHE 65 -0.962 -15.597 6.440 535 HE1 PHE 65 HE2 PHE 65 -1.811 -15.363 11.288 536 HE2 PHE 65 HE1 PHE 65 0.450 -16.868 7.998 537 HZ PHE 65 HZ PHE 65 0.027 -16.751 10.419 538 H VAL 66 H VAL 66 -0.857 -11.316 8.248 539 HA VAL 66 HA VAL 66 1.261 -12.004 6.278 540 HB VAL 66 HB VAL 66 2.410 -9.888 6.666 541 HG11 VAL 66 HG11 VAL 66 0.854 -8.350 5.539 542 HG12 VAL 66 HG12 VAL 66 -0.505 -9.395 5.954 543 HG13 VAL 66 HG13 VAL 66 0.744 -9.972 4.850 544 HG21 VAL 66 HG21 VAL 66 1.779 -9.446 8.993 545 HG22 VAL 66 HG22 VAL 66 0.109 -9.140 8.512 546 HG23 VAL 66 HG23 VAL 66 1.394 -8.046 7.991 547 H LYS 67 H LYS 67 3.379 -12.175 7.068 548 HA LYS 67 HA LYS 67 3.829 -12.512 9.965 549 HB2 LYS 67 HB2 LYS 67 4.961 -14.754 9.496 550 HB3 LYS 67 HB3 LYS 67 3.208 -14.767 9.341 551 HG2 LYS 67 HG2 LYS 67 3.386 -14.654 6.899 552 HG3 LYS 67 HG3 LYS 67 5.147 -14.568 7.012 553 HD2 LYS 67 HD2 LYS 67 5.219 -16.828 7.972 554 HD3 LYS 67 HD3 LYS 67 3.455 -16.917 7.970 555 HE2 LYS 67 HE2 LYS 67 3.402 -16.903 5.545 556 HE3 LYS 67 HE3 LYS 67 5.134 -16.578 5.458 557 HZ1 LYS 67 HZ1 LYS 67 5.604 -18.723 6.326 558 HZ2 LYS 67 HZ2 LYS 67 4.514 -18.919 5.048 559 HZ3 LYS 67 HZ3 LYS 67 3.971 -19.030 6.641 560 H LEU 68 H LEU 68 6.201 -12.557 10.454 561 HA LEU 68 HA LEU 68 7.717 -10.839 8.703 562 HB2 LEU 68 HB2 LEU 68 8.711 -12.411 11.118 563 HB3 LEU 68 HB3 LEU 68 9.553 -11.084 10.324 564 HG LEU 68 HG LEU 68 7.005 -10.916 11.985 565 HD11 LEU 68 HD11 LEU 68 9.075 -11.044 13.291 566 HD12 LEU 68 HD12 LEU 68 8.320 -9.461 13.446 567 HD13 LEU 68 HD13 LEU 68 9.736 -9.663 12.410 568 HD21 LEU 68 HD21 LEU 68 6.693 -9.412 10.109 569 HD22 LEU 68 HD22 LEU 68 8.297 -8.714 10.339 570 HD23 LEU 68 HD23 LEU 68 7.042 -8.464 11.554 571 H VAL 69 H VAL 69 9.769 -11.378 7.642 572 HA VAL 69 HA VAL 69 10.039 -14.121 6.705 573 HB VAL 69 HB VAL 69 11.968 -11.778 6.291 574 HG11 VAL 69 HG11 VAL 69 12.858 -13.097 4.386 575 HG12 VAL 69 HG12 VAL 69 11.788 -14.438 4.809 576 HG13 VAL 69 HG13 VAL 69 13.075 -13.955 5.915 577 HG21 VAL 69 HG21 VAL 69 9.740 -11.293 5.349 578 HG22 VAL 69 HG22 VAL 69 9.770 -12.811 4.452 579 HG23 VAL 69 HG23 VAL 69 10.925 -11.534 4.064 580 H LEU 70 H LEU 70 10.224 -15.184 8.662 581 HA LEU 70 HA LEU 70 12.452 -14.601 10.491 582 HB2 LEU 70 HB2 LEU 70 11.264 -15.769 12.206 583 HB3 LEU 70 HB3 LEU 70 10.143 -14.679 11.424 584 HG LEU 70 HG LEU 70 10.195 -17.722 11.127 585 HD11 LEU 70 HD11 LEU 70 9.352 -17.001 13.296 586 HD12 LEU 70 HD12 LEU 70 8.046 -17.665 12.321 587 HD13 LEU 70 HD13 LEU 70 8.194 -15.916 12.521 588 HD21 LEU 70 HD21 LEU 70 8.218 -15.774 9.891 589 HD22 LEU 70 HD22 LEU 70 8.088 -17.536 9.867 590 HD23 LEU 70 HD23 LEU 70 9.410 -16.739 9.020 591 H GLU 71 H GLU 71 14.193 -15.899 10.665 592 HA GLU 71 HA GLU 71 14.256 -18.399 9.054 593 HB2 GLU 71 HB2 GLU 71 16.613 -17.920 8.570 594 HB3 GLU 71 HB3 GLU 71 15.584 -16.586 8.056 595 HG2 GLU 71 HG2 GLU 71 16.257 -15.254 9.979 596 HG3 GLU 71 HG3 GLU 71 17.176 -16.603 10.642 597 H HIS 72 H HIS 72 14.344 -17.414 12.261 598 HA HIS 72 HA HIS 72 16.418 -18.981 13.389 599 HB2 HIS 72 HB2 HIS 72 15.185 -17.182 14.623 600 HB3 HIS 72 HB3 HIS 72 13.762 -18.212 14.684 601 HD1 HIS 72 HD1 HIS 72 16.997 -17.563 16.371 602 HD2 HIS 72 HD2 HIS 72 14.038 -20.488 16.488 603 HE1 HIS 72 HE1 HIS 72 17.466 -18.911 18.426 604 HE2 HIS 72 HE2 HIS 72 15.758 -20.743 18.407 605 H HIS 73 H HIS 73 13.041 -19.740 12.637 606 HA HIS 73 HA HIS 73 13.659 -22.569 12.368 607 HB2 HIS 73 HB2 HIS 73 12.945 -22.231 14.794 608 HB3 HIS 73 HB3 HIS 73 11.372 -21.712 14.209 609 HD1 HIS 73 HD1 HIS 73 13.308 -24.693 15.089 610 HD2 HIS 73 HD2 HIS 73 9.883 -23.874 12.880 611 HE1 HIS 73 HE1 HIS 73 12.167 -26.904 14.767 612 HE2 HIS 73 HE2 HIS 73 10.176 -26.402 13.323 613 H HIS 74 H HIS 74 12.750 -23.211 10.498 614 HA HIS 74 HA HIS 74 10.844 -21.598 9.075 615 HB2 HIS 74 HB2 HIS 74 10.950 -23.419 7.325 616 HB3 HIS 74 HB3 HIS 74 12.506 -22.728 7.750 617 HD1 HIS 74 HD1 HIS 74 14.306 -24.325 8.484 618 HD2 HIS 74 HD2 HIS 74 10.564 -26.134 8.384 619 HE1 HIS 74 HE1 HIS 74 14.729 -26.776 8.816 620 HE2 HIS 74 HE2 HIS 74 12.446 -27.796 8.989 621 H HIS 75 H HIS 75 8.677 -21.739 9.001 622 HA HIS 75 HA HIS 75 7.247 -23.749 10.565 623 HB2 HIS 75 HB2 HIS 75 6.289 -21.306 9.009 624 HB3 HIS 75 HB3 HIS 75 5.200 -22.390 9.869 625 HD1 HIS 75 HD1 HIS 75 4.798 -21.869 12.279 626 HD2 HIS 75 HD2 HIS 75 8.204 -19.973 10.839 627 HE1 HIS 75 HE1 HIS 75 5.537 -20.332 14.116 628 HE2 HIS 75 HE2 HIS 75 7.695 -19.352 13.301 629 H HIS 76 H HIS 76 6.589 -25.633 9.723 630 HA HIS 76 HA HIS 76 7.024 -26.233 6.923 631 HB2 HIS 76 HB2 HIS 76 7.677 -27.702 8.916 632 HB3 HIS 76 HB3 HIS 76 5.974 -28.114 9.073 633 HD1 HIS 76 HD1 HIS 76 5.947 -30.514 8.342 634 HD2 HIS 76 HD2 HIS 76 8.115 -28.132 5.717 635 HE1 HIS 76 HE1 HIS 76 6.580 -32.019 6.444 636 HE2 HIS 76 HE2 HIS 76 8.074 -30.616 4.999 637 H HIS 77 H HIS 77 4.391 -24.842 8.320 638 HA HIS 77 HA HIS 77 2.810 -25.391 5.949 639 HB2 HIS 77 HB2 HIS 77 0.727 -25.988 7.074 640 HB3 HIS 77 HB3 HIS 77 1.975 -27.125 7.553 641 HD1 HIS 77 HD1 HIS 77 -0.415 -24.664 8.894 642 HD2 HIS 77 HD2 HIS 77 2.846 -26.823 10.303 643 HE1 HIS 77 HE1 HIS 77 -0.519 -24.480 11.388 644 HE2 HIS 77 HE2 HIS 77 1.380 -25.897 12.225 645 H1 MET 1 H MET 1 1.762 -16.434 -8.601 646 HA MET 1 HA MET 1 0.551 -14.503 -8.575 647 HB2 MET 1 HB2 MET 1 -1.543 -16.260 -9.930 648 HB3 MET 1 HB3 MET 1 -1.529 -14.501 -9.950 649 HG2 MET 1 HG2 MET 1 0.569 -14.521 -11.226 650 HG3 MET 1 HG3 MET 1 0.589 -16.287 -11.181 651 HE1 MET 1 HE1 MET 1 0.838 -14.660 -13.915 652 HE2 MET 1 HE2 MET 1 -0.270 -15.559 -14.951 653 HE3 MET 1 HE3 MET 1 0.803 -16.424 -13.849 654 H LYS 2 H LYS 2 -0.409 -17.130 -6.778 655 HA LYS 2 HA LYS 2 -2.869 -16.177 -5.596 656 HB2 LYS 2 HB2 LYS 2 -0.992 -18.443 -4.795 657 HB3 LYS 2 HB3 LYS 2 -2.578 -18.161 -4.080 658 HG2 LYS 2 HG2 LYS 2 -3.655 -18.588 -6.244 659 HG3 LYS 2 HG3 LYS 2 -2.080 -18.779 -7.010 660 HD2 LYS 2 HD2 LYS 2 -3.031 -20.975 -6.649 661 HD3 LYS 2 HD3 LYS 2 -1.658 -20.786 -5.561 662 HE2 LYS 2 HE2 LYS 2 -4.501 -20.272 -4.634 663 HE3 LYS 2 HE3 LYS 2 -3.811 -21.891 -4.630 664 HZ1 LYS 2 HZ1 LYS 2 -3.578 -20.923 -2.487 665 HZ2 LYS 2 HZ2 LYS 2 -2.827 -19.543 -3.106 666 HZ3 LYS 2 HZ3 LYS 2 -2.041 -21.040 -3.172 667 H MET 3 H MET 3 0.295 -15.181 -5.156 668 HA MET 3 HA MET 3 0.156 -14.603 -2.297 669 HB2 MET 3 HB2 MET 3 2.228 -13.690 -4.346 670 HB3 MET 3 HB3 MET 3 2.380 -13.597 -2.594 671 HG2 MET 3 HG2 MET 3 2.238 -16.150 -4.225 672 HG3 MET 3 HG3 MET 3 3.699 -15.441 -3.534 673 HE1 MET 3 HE1 MET 3 2.763 -14.498 -0.617 674 HE2 MET 3 HE2 MET 3 4.250 -15.395 -0.934 675 HE3 MET 3 HE3 MET 3 3.137 -15.949 0.315 676 H LEU 4 H LEU 4 -0.379 -12.624 -1.408 677 HA LEU 4 HA LEU 4 -1.745 -10.632 -2.935 678 HB2 LEU 4 HB2 LEU 4 -0.829 -10.742 -0.051 679 HB3 LEU 4 HB3 LEU 4 -1.575 -9.294 -0.699 680 HG LEU 4 HG LEU 4 -3.661 -10.555 -1.170 681 HD11 LEU 4 HD11 LEU 4 -4.006 -12.842 -0.324 682 HD12 LEU 4 HD12 LEU 4 -2.298 -12.943 0.112 683 HD13 LEU 4 HD13 LEU 4 -2.772 -12.793 -1.581 684 HD21 LEU 4 HD21 LEU 4 -3.430 -9.407 0.989 685 HD22 LEU 4 HD22 LEU 4 -2.717 -10.856 1.702 686 HD23 LEU 4 HD23 LEU 4 -4.396 -10.873 1.159 687 H LYS 5 H LYS 5 1.575 -11.067 -2.158 688 HA LYS 5 HA LYS 5 2.654 -8.499 -2.690 689 HB2 LYS 5 HB2 LYS 5 3.880 -10.481 -1.691 690 HB3 LYS 5 HB3 LYS 5 3.876 -11.231 -3.287 691 HG2 LYS 5 HG2 LYS 5 5.239 -9.356 -4.160 692 HG3 LYS 5 HG3 LYS 5 5.247 -8.621 -2.553 693 HD2 LYS 5 HD2 LYS 5 6.435 -10.635 -1.671 694 HD3 LYS 5 HD3 LYS 5 6.457 -11.318 -3.300 695 HE2 LYS 5 HE2 LYS 5 8.618 -10.296 -2.780 696 HE3 LYS 5 HE3 LYS 5 7.821 -9.396 -4.067 697 HZ1 LYS 5 HZ1 LYS 5 7.146 -7.739 -2.447 698 HZ2 LYS 5 HZ2 LYS 5 8.821 -7.935 -2.434 699 HZ3 LYS 5 HZ3 LYS 5 7.891 -8.612 -1.205 700 H GLU 6 H GLU 6 1.873 -11.277 -4.784 701 HA GLU 6 HA GLU 6 2.786 -10.089 -7.236 702 HB2 GLU 6 HB2 GLU 6 0.932 -12.484 -6.897 703 HB3 GLU 6 HB3 GLU 6 1.825 -12.047 -8.355 704 HG2 GLU 6 HG2 GLU 6 2.937 -13.088 -5.732 705 HG3 GLU 6 HG3 GLU 6 2.937 -13.894 -7.297 706 H LYS 7 H LYS 7 -0.250 -10.225 -5.515 707 HA LYS 7 HA LYS 7 -2.061 -9.320 -7.484 708 HB2 LYS 7 HB2 LYS 7 -2.349 -10.193 -4.946 709 HB3 LYS 7 HB3 LYS 7 -2.360 -8.478 -4.582 710 HG2 LYS 7 HG2 LYS 7 -4.292 -9.926 -6.426 711 HG3 LYS 7 HG3 LYS 7 -4.628 -9.430 -4.766 712 HD2 LYS 7 HD2 LYS 7 -4.432 -7.060 -5.420 713 HD3 LYS 7 HD3 LYS 7 -4.015 -7.530 -7.071 714 HE2 LYS 7 HE2 LYS 7 -6.268 -8.679 -7.227 715 HE3 LYS 7 HE3 LYS 7 -6.674 -7.969 -5.664 716 HZ1 LYS 7 HZ1 LYS 7 -6.347 -5.772 -6.656 717 HZ2 LYS 7 HZ2 LYS 7 -7.545 -6.653 -7.461 718 HZ3 LYS 7 HZ3 LYS 7 -6.010 -6.492 -8.150 719 H ALA 8 H ALA 8 -0.200 -7.550 -5.030 720 HA ALA 8 HA ALA 8 -0.816 -4.896 -5.734 721 HB1 ALA 8 HB1 ALA 8 1.712 -5.963 -4.440 722 HB2 ALA 8 HB2 ALA 8 0.213 -5.552 -3.602 723 HB3 ALA 8 HB3 ALA 8 1.154 -4.287 -4.398 724 H GLY 9 H GLY 9 1.883 -6.979 -6.799 725 HA2 GLY 9 HA2 GLY 9 3.215 -5.132 -8.480 726 HA3 GLY 9 HA3 GLY 9 3.360 -6.878 -8.550 727 H ALA 10 H ALA 10 0.611 -7.447 -9.178 728 HA ALA 10 HA ALA 10 0.581 -7.140 -12.012 729 HB1 ALA 10 HB1 ALA 10 -0.406 -9.080 -10.867 730 HB2 ALA 10 HB2 ALA 10 -1.588 -8.287 -11.911 731 HB3 ALA 10 HB3 ALA 10 -1.648 -8.043 -10.163 732 H LEU 11 H LEU 11 -1.054 -5.393 -9.396 733 HA LEU 11 HA LEU 11 -2.716 -3.754 -11.097 734 HB2 LEU 11 HB2 LEU 11 -1.871 -3.357 -8.202 735 HB3 LEU 11 HB3 LEU 11 -3.122 -2.434 -9.027 736 HG LEU 11 HG LEU 11 -3.240 -5.425 -8.442 737 HD11 LEU 11 HD11 LEU 11 -4.970 -4.867 -6.815 738 HD12 LEU 11 HD12 LEU 11 -4.750 -3.146 -7.138 739 HD13 LEU 11 HD13 LEU 11 -3.444 -4.084 -6.408 740 HD21 LEU 11 HD21 LEU 11 -5.354 -3.615 -9.661 741 HD22 LEU 11 HD22 LEU 11 -5.574 -5.309 -9.207 742 HD23 LEU 11 HD23 LEU 11 -4.457 -4.884 -10.501 743 H ALA 12 H ALA 12 0.564 -3.561 -9.907 744 HA ALA 12 HA ALA 12 1.047 -0.831 -9.821 745 HB1 ALA 12 HB1 ALA 12 3.418 -1.372 -9.972 746 HB2 ALA 12 HB2 ALA 12 3.035 -2.984 -10.591 747 HB3 ALA 12 HB3 ALA 12 2.583 -2.540 -8.944 748 H GLY 13 H GLY 13 1.772 -2.973 -12.592 749 HA2 GLY 13 HA2 GLY 13 2.873 -1.070 -14.322 750 HA3 GLY 13 HA3 GLY 13 2.135 -2.577 -14.832 751 H GLN 14 H GLN 14 -0.487 -2.260 -14.309 752 HA GLN 14 HA GLN 14 -1.433 -0.694 -16.465 753 HB2 GLN 14 HB2 GLN 14 -3.710 -1.370 -15.668 754 HB3 GLN 14 HB3 GLN 14 -2.591 -2.720 -15.843 755 HG2 GLN 14 HG2 GLN 14 -2.230 -2.783 -13.426 756 HG3 GLN 14 HG3 GLN 14 -3.263 -1.370 -13.211 757 HE21 GLN 14 HE21 GLN 14 -4.604 -2.554 -11.804 758 HE22 GLN 14 HE22 GLN 14 -5.716 -3.731 -12.392 759 H ILE 15 H ILE 15 -1.461 -0.040 -12.940 760 HA ILE 15 HA ILE 15 -2.985 2.377 -13.041 761 HB ILE 15 HB ILE 15 -1.004 1.323 -10.974 762 HG12 ILE 15 HG12 ILE 15 -4.055 1.547 -10.877 763 HG13 ILE 15 HG13 ILE 15 -3.174 0.072 -11.257 764 HG21 ILE 15 HG21 ILE 15 -2.743 3.810 -10.707 765 HG22 ILE 15 HG22 ILE 15 -0.979 3.770 -10.772 766 HG23 ILE 15 HG23 ILE 15 -1.825 3.062 -9.397 767 HD11 ILE 15 HD11 ILE 15 -3.091 1.553 -8.625 768 HD12 ILE 15 HD12 ILE 15 -2.217 0.065 -9.002 769 HD13 ILE 15 HD13 ILE 15 -3.978 0.070 -8.969 770 H TRP 16 H TRP 16 0.533 1.747 -13.058 771 HA TRP 16 HA TRP 16 1.558 4.327 -13.259 772 HB2 TRP 16 HB2 TRP 16 2.913 2.245 -12.959 773 HB3 TRP 16 HB3 TRP 16 2.592 1.796 -14.627 774 HD1 TRP 16 HD1 TRP 16 4.826 4.013 -12.499 775 HE1 TRP 16 HE1 TRP 16 6.628 5.099 -13.981 776 HE3 TRP 16 HE3 TRP 16 3.056 2.645 -17.104 777 HZ2 TRP 16 HZ2 TRP 16 7.220 5.362 -16.719 778 HZ3 TRP 16 HZ3 TRP 16 4.289 3.360 -19.108 779 HH2 TRP 16 HH2 TRP 16 6.324 4.695 -18.918 780 H GLU 17 H GLU 17 0.424 2.166 -15.866 781 HA GLU 17 HA GLU 17 0.983 3.876 -18.071 782 HB2 GLU 17 HB2 GLU 17 -0.909 1.503 -17.822 783 HB3 GLU 17 HB3 GLU 17 -0.547 2.309 -19.348 784 HG2 GLU 17 HG2 GLU 17 1.828 1.711 -19.118 785 HG3 GLU 17 HG3 GLU 17 1.495 0.933 -17.573 786 H ALA 18 H ALA 18 -1.785 3.690 -15.899 787 HA ALA 18 HA ALA 18 -3.574 5.357 -17.395 788 HB1 ALA 18 HB1 ALA 18 -4.350 3.915 -15.549 789 HB2 ALA 18 HB2 ALA 18 -4.810 5.598 -15.279 790 HB3 ALA 18 HB3 ALA 18 -3.452 4.897 -14.391 791 H LEU 19 H LEU 19 -1.088 6.045 -14.924 792 HA LEU 19 HA LEU 19 -1.476 8.923 -14.964 793 HB2 LEU 19 HB2 LEU 19 0.606 7.131 -13.678 794 HB3 LEU 19 HB3 LEU 19 0.771 8.875 -13.651 795 HG LEU 19 HG LEU 19 -1.415 9.025 -12.409 796 HD11 LEU 19 HD11 LEU 19 -1.206 6.012 -12.234 797 HD12 LEU 19 HD12 LEU 19 -2.451 6.930 -13.086 798 HD13 LEU 19 HD13 LEU 19 -2.334 7.025 -11.332 799 HD21 LEU 19 HD21 LEU 19 0.717 9.132 -11.198 800 HD22 LEU 19 HD22 LEU 19 0.745 7.372 -11.053 801 HD23 LEU 19 HD23 LEU 19 -0.509 8.308 -10.236 802 H ASN 20 H ASN 20 0.309 6.703 -16.927 803 HA ASN 20 HA ASN 20 2.461 8.377 -17.733 804 HB2 ASN 20 HB2 ASN 20 2.444 5.894 -18.017 805 HB3 ASN 20 HB3 ASN 20 1.215 6.049 -19.265 806 HD21 ASN 20 HD21 ASN 20 2.505 5.148 -20.869 807 HD22 ASN 20 HD22 ASN 20 3.888 5.947 -21.520 808 H GLY 21 H GLY 21 2.553 10.009 -19.185 809 HA2 GLY 21 HA2 GLY 21 1.869 11.257 -21.114 810 HA3 GLY 21 HA3 GLY 21 0.243 10.609 -20.959 811 H THR 22 H THR 22 0.560 11.171 -17.921 812 HA THR 22 HA THR 22 0.051 14.111 -17.949 813 HB THR 22 HB THR 22 -1.367 13.876 -16.007 814 HG1 THR 22 HG1 THR 22 -0.898 11.079 -15.936 815 HG21 THR 22 HG21 THR 22 -3.190 12.370 -16.757 816 HG22 THR 22 HG22 THR 22 -2.091 11.631 -17.925 817 HG23 THR 22 HG23 THR 22 -2.551 13.326 -18.096 818 H GLU 23 H GLU 23 0.582 15.153 -15.738 819 HA GLU 23 HA GLU 23 3.146 14.100 -14.664 820 HB2 GLU 23 HB2 GLU 23 3.690 16.388 -13.974 821 HB3 GLU 23 HB3 GLU 23 3.368 16.324 -15.704 822 HG2 GLU 23 HG2 GLU 23 1.161 17.312 -15.374 823 HG3 GLU 23 HG3 GLU 23 1.376 17.279 -13.620 824 H GLY 24 H GLY 24 0.263 13.442 -13.929 825 HA2 GLY 24 HA2 GLY 24 0.374 12.567 -11.455 826 HA3 GLY 24 HA3 GLY 24 0.146 14.271 -11.102 827 H LEU 25 H LEU 25 -1.510 11.769 -10.688 828 HA LEU 25 HA LEU 25 -4.104 13.000 -11.393 829 HB2 LEU 25 HB2 LEU 25 -3.406 10.040 -11.703 830 HB3 LEU 25 HB3 LEU 25 -5.048 10.667 -11.746 831 HG LEU 25 HG LEU 25 -2.864 11.339 -13.767 832 HD11 LEU 25 HD11 LEU 25 -3.594 9.015 -13.982 833 HD12 LEU 25 HD12 LEU 25 -4.154 9.973 -15.350 834 HD13 LEU 25 HD13 LEU 25 -5.283 9.527 -14.065 835 HD21 LEU 25 HD21 LEU 25 -5.807 12.108 -13.762 836 HD22 LEU 25 HD22 LEU 25 -4.660 12.422 -15.070 837 HD23 LEU 25 HD23 LEU 25 -4.443 13.200 -13.505 838 H THR 26 H THR 26 -5.848 12.336 -9.931 839 HA THR 26 HA THR 26 -4.957 11.439 -7.248 840 HB THR 26 HB THR 26 -7.067 12.355 -6.366 841 HG1 THR 26 HG1 THR 26 -8.600 13.266 -7.673 842 HG21 THR 26 HG21 THR 26 -5.171 13.914 -6.539 843 HG22 THR 26 HG22 THR 26 -6.696 14.757 -6.819 844 HG23 THR 26 HG23 THR 26 -5.657 14.343 -8.184 845 H GLN 27 H GLN 27 -6.603 10.055 -6.037 846 HA GLN 27 HA GLN 27 -6.606 7.580 -7.354 847 HB2 GLN 27 HB2 GLN 27 -7.563 6.630 -5.363 848 HB3 GLN 27 HB3 GLN 27 -6.401 7.864 -4.895 849 HG2 GLN 27 HG2 GLN 27 -8.232 9.413 -4.385 850 HG3 GLN 27 HG3 GLN 27 -9.419 8.213 -4.896 851 HE21 GLN 27 HE21 GLN 27 -9.662 6.309 -3.611 852 HE22 GLN 27 HE22 GLN 27 -9.181 6.284 -1.955 853 H LYS 28 H LYS 28 -9.244 9.883 -6.985 854 HA LYS 28 HA LYS 28 -11.424 8.264 -7.807 855 HB2 LYS 28 HB2 LYS 28 -11.708 10.418 -6.651 856 HB3 LYS 28 HB3 LYS 28 -11.009 11.275 -8.019 857 HG2 LYS 28 HG2 LYS 28 -12.926 10.692 -9.418 858 HG3 LYS 28 HG3 LYS 28 -13.614 9.708 -8.119 859 HD2 LYS 28 HD2 LYS 28 -13.945 11.697 -6.732 860 HD3 LYS 28 HD3 LYS 28 -13.114 12.707 -7.920 861 HE2 LYS 28 HE2 LYS 28 -15.714 11.218 -8.430 862 HE3 LYS 28 HE3 LYS 28 -15.595 12.930 -8.016 863 HZ1 LYS 28 HZ1 LYS 28 -15.812 12.698 -10.367 864 HZ2 LYS 28 HZ2 LYS 28 -14.516 11.617 -10.451 865 HZ3 LYS 28 HZ3 LYS 28 -14.242 13.233 -10.039 866 H GLN 29 H GLN 29 -9.189 10.322 -9.655 867 HA GLN 29 HA GLN 29 -10.375 10.001 -12.234 868 HB2 GLN 29 HB2 GLN 29 -7.522 10.735 -11.454 869 HB3 GLN 29 HB3 GLN 29 -8.190 10.894 -13.080 870 HG2 GLN 29 HG2 GLN 29 -9.803 12.557 -12.286 871 HG3 GLN 29 HG3 GLN 29 -9.223 12.372 -10.631 872 HE21 GLN 29 HE21 GLN 29 -7.228 13.299 -10.067 873 HE22 GLN 29 HE22 GLN 29 -6.427 14.449 -11.072 874 H ILE 30 H ILE 30 -7.774 8.302 -10.536 875 HA ILE 30 HA ILE 30 -7.038 6.542 -12.685 876 HB ILE 30 HB ILE 30 -6.505 6.121 -9.708 877 HG12 ILE 30 HG12 ILE 30 -4.693 7.636 -11.649 878 HG13 ILE 30 HG13 ILE 30 -5.827 8.447 -10.577 879 HG21 ILE 30 HG21 ILE 30 -5.976 4.158 -11.113 880 HG22 ILE 30 HG22 ILE 30 -4.493 4.886 -10.493 881 HG23 ILE 30 HG23 ILE 30 -4.975 5.161 -12.169 882 HD11 ILE 30 HD11 ILE 30 -3.543 6.690 -9.679 883 HD12 ILE 30 HD12 ILE 30 -4.647 7.592 -8.637 884 HD13 ILE 30 HD13 ILE 30 -3.545 8.455 -9.712 885 H LYS 31 H LYS 31 -9.280 6.336 -9.970 886 HA LYS 31 HA LYS 31 -9.911 3.612 -9.871 887 HB2 LYS 31 HB2 LYS 31 -10.627 5.366 -8.225 888 HB3 LYS 31 HB3 LYS 31 -11.772 5.985 -9.399 889 HG2 LYS 31 HG2 LYS 31 -12.932 4.666 -7.747 890 HG3 LYS 31 HG3 LYS 31 -13.010 3.832 -9.303 891 HD2 LYS 31 HD2 LYS 31 -11.312 2.237 -8.610 892 HD3 LYS 31 HD3 LYS 31 -10.971 3.158 -7.139 893 HE2 LYS 31 HE2 LYS 31 -12.344 1.140 -6.695 894 HE3 LYS 31 HE3 LYS 31 -13.181 2.624 -6.245 895 HZ1 LYS 31 HZ1 LYS 31 -14.587 1.006 -7.409 896 HZ2 LYS 31 HZ2 LYS 31 -13.621 1.158 -8.788 897 HZ3 LYS 31 HZ3 LYS 31 -14.497 2.485 -8.219 898 H LYS 32 H LYS 32 -11.465 6.202 -11.757 899 HA LYS 32 HA LYS 32 -13.223 4.531 -13.261 900 HB2 LYS 32 HB2 LYS 32 -12.235 7.359 -13.786 901 HB3 LYS 32 HB3 LYS 32 -13.519 6.575 -14.704 902 HG2 LYS 32 HG2 LYS 32 -13.615 7.109 -11.712 903 HG3 LYS 32 HG3 LYS 32 -14.350 8.139 -12.943 904 HD2 LYS 32 HD2 LYS 32 -15.077 5.217 -12.443 905 HD3 LYS 32 HD3 LYS 32 -15.990 6.605 -11.849 906 HE2 LYS 32 HE2 LYS 32 -16.396 7.312 -14.207 907 HE3 LYS 32 HE3 LYS 32 -15.539 5.874 -14.766 908 HZ1 LYS 32 HZ1 LYS 32 -17.205 4.514 -13.667 909 HZ2 LYS 32 HZ2 LYS 32 -17.913 5.557 -14.797 910 HZ3 LYS 32 HZ3 LYS 32 -18.019 5.901 -13.145 911 H ALA 33 H ALA 33 -9.956 5.776 -13.907 912 HA ALA 33 HA ALA 33 -9.802 5.183 -16.677 913 HB1 ALA 33 HB1 ALA 33 -7.380 5.527 -16.420 914 HB2 ALA 33 HB2 ALA 33 -7.537 5.418 -14.664 915 HB3 ALA 33 HB3 ALA 33 -8.284 6.759 -15.534 916 H THR 34 H THR 34 -8.548 3.377 -13.878 917 HA THR 34 HA THR 34 -7.765 1.063 -15.467 918 HB THR 34 HB THR 34 -6.913 0.144 -13.308 919 HG1 THR 34 HG1 THR 34 -7.266 2.496 -11.899 920 HG21 THR 34 HG21 THR 34 -5.404 1.605 -14.625 921 HG22 THR 34 HG22 THR 34 -5.127 1.797 -12.893 922 HG23 THR 34 HG23 THR 34 -6.036 3.022 -13.783 923 H LYS 35 H LYS 35 -10.518 2.090 -13.690 924 HA LYS 35 HA LYS 35 -12.501 1.196 -13.095 925 HB2 LYS 35 HB2 LYS 35 -11.720 -0.781 -15.262 926 HB3 LYS 35 HB3 LYS 35 -13.315 -0.786 -14.511 927 HG2 LYS 35 HG2 LYS 35 -13.843 1.383 -15.371 928 HG3 LYS 35 HG3 LYS 35 -12.172 1.684 -15.858 929 HD2 LYS 35 HD2 LYS 35 -14.006 -0.420 -17.085 930 HD3 LYS 35 HD3 LYS 35 -13.669 1.168 -17.782 931 HE2 LYS 35 HE2 LYS 35 -11.671 -1.080 -17.334 932 HE3 LYS 35 HE3 LYS 35 -12.284 -0.497 -18.883 933 HZ1 LYS 35 HZ1 LYS 35 -11.213 1.641 -18.434 934 HZ2 LYS 35 HZ2 LYS 35 -10.094 0.375 -18.442 935 HZ3 LYS 35 HZ3 LYS 35 -10.599 1.044 -16.978 936 H LEU 36 H LEU 36 -10.218 0.431 -11.510 937 HA LEU 36 HA LEU 36 -10.333 -2.235 -10.553 938 HB2 LEU 36 HB2 LEU 36 -9.555 0.293 -9.045 939 HB3 LEU 36 HB3 LEU 36 -9.282 -1.339 -8.450 940 HG LEU 36 HG LEU 36 -7.994 -0.101 -10.915 941 HD11 LEU 36 HD11 LEU 36 -5.901 -0.210 -9.660 942 HD12 LEU 36 HD12 LEU 36 -6.748 -0.863 -8.256 943 HD13 LEU 36 HD13 LEU 36 -7.085 0.781 -8.808 944 HD21 LEU 36 HD21 LEU 36 -7.594 -2.880 -9.755 945 HD22 LEU 36 HD22 LEU 36 -6.638 -2.159 -11.056 946 HD23 LEU 36 HD23 LEU 36 -8.352 -2.486 -11.302 947 H LYS 37 H LYS 37 -11.293 -3.107 -8.607 948 HA LYS 37 HA LYS 37 -14.056 -2.443 -8.303 949 HB2 LYS 37 HB2 LYS 37 -14.058 -4.276 -6.571 950 HB3 LYS 37 HB3 LYS 37 -13.417 -4.758 -8.138 951 HG2 LYS 37 HG2 LYS 37 -11.141 -4.658 -7.311 952 HG3 LYS 37 HG3 LYS 37 -11.682 -3.981 -5.770 953 HD2 LYS 37 HD2 LYS 37 -12.898 -6.101 -5.295 954 HD3 LYS 37 HD3 LYS 37 -12.304 -6.772 -6.820 955 HE2 LYS 37 HE2 LYS 37 -10.959 -7.532 -4.885 956 HE3 LYS 37 HE3 LYS 37 -9.992 -6.595 -6.023 957 HZ1 LYS 37 HZ1 LYS 37 -9.548 -5.988 -3.717 958 HZ2 LYS 37 HZ2 LYS 37 -11.160 -5.531 -3.511 959 HZ3 LYS 37 HZ3 LYS 37 -10.177 -4.682 -4.588 960 H ALA 38 H ALA 38 -11.204 -1.918 -6.206 961 HA ALA 38 HA ALA 38 -12.753 -0.017 -4.552 962 HB1 ALA 38 HB1 ALA 38 -12.773 -2.171 -3.337 963 HB2 ALA 38 HB2 ALA 38 -11.833 -0.955 -2.469 964 HB3 ALA 38 HB3 ALA 38 -11.008 -2.220 -3.386 965 H ASP 39 H ASP 39 -11.465 1.456 -3.329 966 HA ASP 39 HA ASP 39 -8.995 2.365 -4.451 967 HB2 ASP 39 HB2 ASP 39 -9.026 4.034 -2.641 968 HB3 ASP 39 HB3 ASP 39 -10.599 3.931 -3.412 969 H LYS 40 H LYS 40 -9.856 0.162 -1.924 970 HA LYS 40 HA LYS 40 -7.578 0.123 -0.302 971 HB2 LYS 40 HB2 LYS 40 -9.414 -2.215 -0.958 972 HB3 LYS 40 HB3 LYS 40 -8.362 -2.083 0.454 973 HG2 LYS 40 HG2 LYS 40 -10.774 -0.344 -0.175 974 HG3 LYS 40 HG3 LYS 40 -10.673 -1.604 1.062 975 HD2 LYS 40 HD2 LYS 40 -8.881 -0.248 2.206 976 HD3 LYS 40 HD3 LYS 40 -9.132 1.028 1.009 977 HE2 LYS 40 HE2 LYS 40 -10.333 1.493 3.114 978 HE3 LYS 40 HE3 LYS 40 -11.451 1.301 1.761 979 HZ1 LYS 40 HZ1 LYS 40 -11.852 -0.980 2.493 980 HZ2 LYS 40 HZ2 LYS 40 -12.244 0.131 3.698 981 HZ3 LYS 40 HZ3 LYS 40 -10.810 -0.761 3.807 982 H ASP 41 H ASP 41 -8.233 -1.837 -3.228 983 HA ASP 41 HA ASP 41 -5.692 -3.234 -3.098 984 HB2 ASP 41 HB2 ASP 41 -6.347 -4.144 -5.359 985 HB3 ASP 41 HB3 ASP 41 -7.524 -4.449 -4.091 986 H PHE 42 H PHE 42 -7.022 -0.458 -4.848 987 HA PHE 42 HA PHE 42 -4.909 0.265 -6.515 988 HB2 PHE 42 HB2 PHE 42 -6.955 1.483 -6.689 989 HB3 PHE 42 HB3 PHE 42 -6.937 1.931 -4.987 990 HD1 PHE 42 HD2 PHE 42 -5.015 2.442 -8.173 991 HD2 PHE 42 HD1 PHE 42 -6.100 4.047 -4.359 992 HE1 PHE 42 HE2 PHE 42 -3.861 4.539 -8.714 993 HE2 PHE 42 HE1 PHE 42 -4.938 6.133 -4.916 994 HZ PHE 42 HZ PHE 42 -3.817 6.381 -7.086 995 H PHE 43 H PHE 43 -5.223 0.878 -2.993 996 HA PHE 43 HA PHE 43 -2.913 2.468 -2.644 997 HB2 PHE 43 HB2 PHE 43 -4.209 0.577 -0.639 998 HB3 PHE 43 HB3 PHE 43 -3.017 1.811 -0.233 999 HD1 PHE 43 HD1 PHE 43 -4.049 4.079 -1.979 1000 HD2 PHE 43 HD2 PHE 43 -6.100 1.336 0.583 1001 HE1 PHE 43 HE1 PHE 43 -5.840 5.729 -1.640 1002 HE2 PHE 43 HE2 PHE 43 -7.890 2.984 0.906 1003 HZ PHE 43 HZ PHE 43 -7.763 5.182 -0.203 1004 H LEU 44 H LEU 44 -3.267 -1.051 -2.756 1005 HA LEU 44 HA LEU 44 -0.544 -1.697 -2.101 1006 HB2 LEU 44 HB2 LEU 44 -2.843 -3.241 -3.326 1007 HB3 LEU 44 HB3 LEU 44 -1.236 -3.938 -3.316 1008 HG LEU 44 HG LEU 44 -1.195 -3.825 -0.828 1009 HD11 LEU 44 HD11 LEU 44 -4.068 -2.875 -1.012 1010 HD12 LEU 44 HD12 LEU 44 -2.692 -1.937 -0.428 1011 HD13 LEU 44 HD13 LEU 44 -3.226 -3.357 0.466 1012 HD21 LEU 44 HD21 LEU 44 -2.766 -5.661 -0.404 1013 HD22 LEU 44 HD22 LEU 44 -1.928 -5.896 -1.937 1014 HD23 LEU 44 HD23 LEU 44 -3.599 -5.322 -1.925 1015 H GLY 45 H GLY 45 -2.304 -1.040 -5.105 1016 HA2 GLY 45 HA2 GLY 45 -0.309 -1.763 -6.990 1017 HA3 GLY 45 HA3 GLY 45 -1.644 -0.660 -7.272 1018 H LEU 46 H LEU 46 -1.219 1.519 -5.830 1019 HA LEU 46 HA LEU 46 0.951 2.883 -7.074 1020 HB2 LEU 46 HB2 LEU 46 0.066 4.846 -6.196 1021 HB3 LEU 46 HB3 LEU 46 -1.341 3.810 -6.164 1022 HG LEU 46 HG LEU 46 -0.483 3.388 -3.611 1023 HD11 LEU 46 HD11 LEU 46 0.355 5.436 -2.576 1024 HD12 LEU 46 HD12 LEU 46 0.460 6.220 -4.155 1025 HD13 LEU 46 HD13 LEU 46 1.491 4.836 -3.788 1026 HD21 LEU 46 HD21 LEU 46 -2.129 5.798 -4.434 1027 HD22 LEU 46 HD22 LEU 46 -2.106 5.044 -2.835 1028 HD23 LEU 46 HD23 LEU 46 -2.728 4.152 -4.221 1029 H GLY 47 H GLY 47 0.567 1.270 -4.011 1030 HA2 GLY 47 HA2 GLY 47 2.835 2.229 -2.597 1031 HA3 GLY 47 HA3 GLY 47 2.013 0.698 -2.322 1032 H TRP 48 H TRP 48 2.367 -0.455 -4.881 1033 HA TRP 48 HA TRP 48 5.030 -1.471 -4.740 1034 HB2 TRP 48 HB2 TRP 48 2.908 -2.656 -5.620 1035 HB3 TRP 48 HB3 TRP 48 3.162 -1.772 -7.122 1036 HD1 TRP 48 HD1 TRP 48 5.122 -2.645 -8.716 1037 HE1 TRP 48 HE1 TRP 48 6.585 -4.763 -8.685 1038 HE3 TRP 48 HE3 TRP 48 4.140 -4.253 -3.964 1039 HZ2 TRP 48 HZ2 TRP 48 7.278 -6.807 -6.879 1040 HZ3 TRP 48 HZ3 TRP 48 5.260 -6.291 -3.147 1041 HH2 TRP 48 HH2 TRP 48 6.799 -7.541 -4.582 1042 H LEU 49 H LEU 49 3.497 1.070 -6.673 1043 HA LEU 49 HA LEU 49 5.649 1.652 -8.429 1044 HB2 LEU 49 HB2 LEU 49 3.312 3.247 -7.373 1045 HB3 LEU 49 HB3 LEU 49 4.556 4.085 -8.268 1046 HG LEU 49 HG LEU 49 4.055 2.938 -10.289 1047 HD11 LEU 49 HD11 LEU 49 3.824 0.685 -9.459 1048 HD12 LEU 49 HD12 LEU 49 2.455 1.108 -10.482 1049 HD13 LEU 49 HD13 LEU 49 2.270 1.089 -8.722 1050 HD21 LEU 49 HD21 LEU 49 1.703 3.454 -10.702 1051 HD22 LEU 49 HD22 LEU 49 2.437 4.720 -9.721 1052 HD23 LEU 49 HD23 LEU 49 1.388 3.519 -8.965 1053 H LEU 50 H LEU 50 5.042 2.629 -5.071 1054 HA LEU 50 HA LEU 50 7.211 4.460 -4.782 1055 HB2 LEU 50 HB2 LEU 50 5.624 2.883 -2.733 1056 HB3 LEU 50 HB3 LEU 50 6.886 4.013 -2.273 1057 HG LEU 50 HG LEU 50 4.362 4.787 -3.809 1058 HD11 LEU 50 HD11 LEU 50 3.776 4.105 -1.532 1059 HD12 LEU 50 HD12 LEU 50 3.603 5.851 -1.715 1060 HD13 LEU 50 HD13 LEU 50 5.001 5.191 -0.864 1061 HD21 LEU 50 HD21 LEU 50 5.040 7.111 -3.339 1062 HD22 LEU 50 HD22 LEU 50 6.253 6.275 -4.305 1063 HD23 LEU 50 HD23 LEU 50 6.529 6.535 -2.579 1064 H ARG 51 H ARG 51 7.023 0.892 -4.330 1065 HA ARG 51 HA ARG 51 9.672 0.674 -3.223 1066 HB2 ARG 51 HB2 ARG 51 9.410 -1.683 -3.220 1067 HB3 ARG 51 HB3 ARG 51 7.799 -1.060 -2.952 1068 HG2 ARG 51 HG2 ARG 51 7.258 -2.688 -4.469 1069 HG3 ARG 51 HG3 ARG 51 7.617 -1.399 -5.606 1070 HD2 ARG 51 HD2 ARG 51 10.036 -2.371 -5.629 1071 HD3 ARG 51 HD3 ARG 51 9.300 -3.806 -4.903 1072 HE ARG 51 HE ARG 51 7.863 -3.002 -7.216 1073 HH11 ARG 51 HH11 ARG 51 10.727 -4.714 -6.315 1074 HH12 ARG 51 HH12 ARG 51 10.913 -5.416 -7.877 1075 HH21 ARG 51 HH21 ARG 51 8.165 -3.875 -9.221 1076 HH22 ARG 51 HH22 ARG 51 9.487 -4.952 -9.501 1077 H GLU 52 H GLU 52 8.377 0.718 -6.465 1078 HA GLU 52 HA GLU 52 10.859 0.078 -7.820 1079 HB2 GLU 52 HB2 GLU 52 8.249 1.260 -8.878 1080 HB3 GLU 52 HB3 GLU 52 9.572 0.655 -9.875 1081 HG2 GLU 52 HG2 GLU 52 9.229 -1.607 -9.052 1082 HG3 GLU 52 HG3 GLU 52 8.010 -1.050 -7.913 1083 H ASP 53 H ASP 53 9.604 2.859 -6.319 1084 HA ASP 53 HA ASP 53 10.221 4.999 -6.075 1085 HB2 ASP 53 HB2 ASP 53 12.766 4.166 -7.520 1086 HB3 ASP 53 HB3 ASP 53 12.552 5.701 -6.686 1087 H LYS 54 H LYS 54 8.861 4.004 -8.612 1088 HA LYS 54 HA LYS 54 9.589 5.987 -10.622 1089 HB2 LYS 54 HB2 LYS 54 7.570 3.716 -10.606 1090 HB3 LYS 54 HB3 LYS 54 7.629 4.898 -11.914 1091 HG2 LYS 54 HG2 LYS 54 10.046 4.266 -12.268 1092 HG3 LYS 54 HG3 LYS 54 9.820 2.963 -11.099 1093 HD2 LYS 54 HD2 LYS 54 8.132 3.237 -13.623 1094 HD3 LYS 54 HD3 LYS 54 9.649 2.339 -13.582 1095 HE2 LYS 54 HE2 LYS 54 7.900 0.737 -13.332 1096 HE3 LYS 54 HE3 LYS 54 8.637 0.906 -11.744 1097 HZ1 LYS 54 HZ1 LYS 54 6.271 0.816 -11.562 1098 HZ2 LYS 54 HZ2 LYS 54 6.075 2.103 -12.642 1099 HZ3 LYS 54 HZ3 LYS 54 6.779 2.368 -11.133 1100 H VAL 55 H VAL 55 7.685 6.186 -7.874 1101 HA VAL 55 HA VAL 55 6.309 8.527 -9.002 1102 HB VAL 55 HB VAL 55 4.195 8.138 -7.816 1103 HG11 VAL 55 HG11 VAL 55 4.290 7.368 -10.137 1104 HG12 VAL 55 HG12 VAL 55 3.228 6.336 -9.178 1105 HG13 VAL 55 HG13 VAL 55 4.847 5.778 -9.607 1106 HG21 VAL 55 HG21 VAL 55 3.657 5.964 -6.739 1107 HG22 VAL 55 HG22 VAL 55 4.976 6.802 -5.922 1108 HG23 VAL 55 HG23 VAL 55 5.325 5.441 -6.987 1109 H VAL 56 H VAL 56 5.417 9.958 -7.391 1110 HA VAL 56 HA VAL 56 6.325 9.714 -4.650 1111 HB VAL 56 HB VAL 56 8.145 10.988 -5.734 1112 HG11 VAL 56 HG11 VAL 56 6.049 13.049 -6.510 1113 HG12 VAL 56 HG12 VAL 56 6.918 11.984 -7.617 1114 HG13 VAL 56 HG13 VAL 56 7.794 13.224 -6.717 1115 HG21 VAL 56 HG21 VAL 56 7.643 11.503 -3.382 1116 HG22 VAL 56 HG22 VAL 56 6.481 12.737 -3.879 1117 HG23 VAL 56 HG23 VAL 56 8.198 12.952 -4.223 1118 H THR 57 H THR 57 5.018 10.909 -3.166 1119 HA THR 57 HA THR 57 2.308 11.418 -4.266 1120 HB THR 57 HB THR 57 1.448 10.642 -2.038 1121 HG1 THR 57 HG1 THR 57 3.145 9.403 -0.797 1122 HG21 THR 57 HG21 THR 57 1.910 8.227 -2.338 1123 HG22 THR 57 HG22 THR 57 3.246 8.606 -3.425 1124 HG23 THR 57 HG23 THR 57 1.587 8.999 -3.890 1125 H SER 58 H SER 58 1.041 13.037 -3.370 1126 HA SER 58 HA SER 58 2.108 14.950 -1.421 1127 HB2 SER 58 HB2 SER 58 1.294 15.780 -4.248 1128 HB3 SER 58 HB3 SER 58 1.589 16.905 -2.923 1129 HG SER 58 HG SER 58 3.749 16.093 -2.853 1130 H GLU 59 H GLU 59 0.390 16.651 -0.913 1131 HA GLU 59 HA GLU 59 -2.374 15.605 -1.275 1132 HB2 GLU 59 HB2 GLU 59 -1.618 15.502 1.097 1133 HB3 GLU 59 HB3 GLU 59 -1.297 17.235 1.071 1134 HG2 GLU 59 HG2 GLU 59 -3.702 17.671 0.673 1135 HG3 GLU 59 HG3 GLU 59 -4.021 15.933 0.704 1136 H VAL 60 H VAL 60 -3.266 16.770 -2.831 1137 HA VAL 60 HA VAL 60 -2.903 19.727 -2.927 1138 HB VAL 60 HB VAL 60 -3.233 17.755 -5.241 1139 HG11 VAL 60 HG11 VAL 60 -3.468 20.791 -5.411 1140 HG12 VAL 60 HG12 VAL 60 -4.756 19.625 -5.730 1141 HG13 VAL 60 HG13 VAL 60 -3.352 19.695 -6.793 1142 HG21 VAL 60 HG21 VAL 60 -0.923 18.141 -4.449 1143 HG22 VAL 60 HG22 VAL 60 -1.131 19.882 -4.677 1144 HG23 VAL 60 HG23 VAL 60 -1.155 18.800 -6.072 1145 H GLU 61 H GLU 61 -4.635 20.766 -2.297 1146 HA GLU 61 HA GLU 61 -6.738 21.405 -1.761 1147 HB2 GLU 61 HB2 GLU 61 -7.588 19.832 -4.237 1148 HB3 GLU 61 HB3 GLU 61 -8.408 21.224 -3.529 1149 HG2 GLU 61 HG2 GLU 61 -5.671 21.254 -4.842 1150 HG3 GLU 61 HG3 GLU 61 -7.149 21.808 -5.592 1151 H GLY 62 H GLY 62 -5.856 18.981 -0.446 1152 HA2 GLY 62 HA2 GLY 62 -6.735 17.488 1.090 1153 HA3 GLY 62 HA3 GLY 62 -8.349 17.916 0.558 1154 H GLU 63 H GLU 63 -6.457 16.986 -2.080 1155 HA GLU 63 HA GLU 63 -7.608 14.262 -2.171 1156 HB2 GLU 63 HB2 GLU 63 -6.471 16.107 -4.313 1157 HB3 GLU 63 HB3 GLU 63 -6.963 14.448 -4.634 1158 HG2 GLU 63 HG2 GLU 63 -8.902 16.459 -3.464 1159 HG3 GLU 63 HG3 GLU 63 -8.601 16.373 -5.201 1160 H ILE 64 H ILE 64 -6.325 12.433 -2.363 1161 HA ILE 64 HA ILE 64 -3.489 12.507 -1.939 1162 HB ILE 64 HB ILE 64 -5.228 10.176 -2.901 1163 HG12 ILE 64 HG12 ILE 64 -4.301 10.935 -0.085 1164 HG13 ILE 64 HG13 ILE 64 -5.954 11.010 -0.687 1165 HG21 ILE 64 HG21 ILE 64 -3.373 8.703 -2.140 1166 HG22 ILE 64 HG22 ILE 64 -2.394 10.123 -1.772 1167 HG23 ILE 64 HG23 ILE 64 -2.853 9.775 -3.440 1168 HD11 ILE 64 HD11 ILE 64 -5.657 9.095 0.744 1169 HD12 ILE 64 HD12 ILE 64 -4.318 8.509 -0.239 1170 HD13 ILE 64 HD13 ILE 64 -5.953 8.547 -0.905 1171 H PHE 65 H PHE 65 -2.274 13.442 -3.468 1172 HA PHE 65 HA PHE 65 -2.828 13.069 -6.351 1173 HB2 PHE 65 HB2 PHE 65 -2.877 15.389 -5.433 1174 HB3 PHE 65 HB3 PHE 65 -1.211 15.216 -4.897 1175 HD1 PHE 65 HD2 PHE 65 -3.089 14.606 -8.116 1176 HD2 PHE 65 HD1 PHE 65 0.280 16.445 -6.222 1177 HE1 PHE 65 HE2 PHE 65 -2.344 15.499 -10.278 1178 HE2 PHE 65 HE1 PHE 65 1.009 17.338 -8.394 1179 HZ PHE 65 HZ PHE 65 -0.300 16.864 -10.425 1180 H VAL 66 H VAL 66 -1.716 11.283 -6.979 1181 HA VAL 66 HA VAL 66 1.137 10.940 -6.231 1182 HB VAL 66 HB VAL 66 -0.262 9.040 -5.585 1183 HG11 VAL 66 HG11 VAL 66 -1.060 8.764 -8.507 1184 HG12 VAL 66 HG12 VAL 66 -2.113 9.289 -7.192 1185 HG13 VAL 66 HG13 VAL 66 -1.486 7.640 -7.212 1186 HG21 VAL 66 HG21 VAL 66 0.955 7.193 -6.683 1187 HG22 VAL 66 HG22 VAL 66 2.046 8.526 -6.301 1188 HG23 VAL 66 HG23 VAL 66 1.489 8.288 -7.960 1189 H LYS 67 H LYS 67 2.742 10.762 -7.838 1190 HA LYS 67 HA LYS 67 1.959 11.053 -10.665 1191 HB2 LYS 67 HB2 LYS 67 3.548 13.060 -10.893 1192 HB3 LYS 67 HB3 LYS 67 1.976 13.346 -10.180 1193 HG2 LYS 67 HG2 LYS 67 4.307 12.858 -8.343 1194 HG3 LYS 67 HG3 LYS 67 4.158 14.418 -9.154 1195 HD2 LYS 67 HD2 LYS 67 1.762 14.505 -8.218 1196 HD3 LYS 67 HD3 LYS 67 2.220 13.139 -7.197 1197 HE2 LYS 67 HE2 LYS 67 3.633 15.829 -7.226 1198 HE3 LYS 67 HE3 LYS 67 2.404 15.352 -6.057 1199 HZ1 LYS 67 HZ1 LYS 67 5.089 14.158 -6.419 1200 HZ2 LYS 67 HZ2 LYS 67 3.896 13.492 -5.427 1201 HZ3 LYS 67 HZ3 LYS 67 4.517 15.029 -5.086 1202 H LEU 68 H LEU 68 3.623 10.679 -12.191 1203 HA LEU 68 HA LEU 68 5.415 8.601 -11.381 1204 HB2 LEU 68 HB2 LEU 68 5.263 9.963 -14.093 1205 HB3 LEU 68 HB3 LEU 68 6.039 8.426 -13.744 1206 HG LEU 68 HG LEU 68 3.060 9.028 -13.758 1207 HD11 LEU 68 HD11 LEU 68 2.973 7.336 -15.533 1208 HD12 LEU 68 HD12 LEU 68 4.727 7.137 -15.453 1209 HD13 LEU 68 HD13 LEU 68 4.029 8.677 -15.970 1210 HD21 LEU 68 HD21 LEU 68 2.703 6.638 -13.170 1211 HD22 LEU 68 HD22 LEU 68 3.439 7.565 -11.867 1212 HD23 LEU 68 HD23 LEU 68 4.434 6.480 -12.842 1213 H VAL 69 H VAL 69 6.744 9.747 -9.879 1214 HA VAL 69 HA VAL 69 8.270 11.288 -9.083 1215 HB VAL 69 HB VAL 69 9.333 9.096 -9.286 1216 HG11 VAL 69 HG11 VAL 69 10.887 8.513 -11.126 1217 HG12 VAL 69 HG12 VAL 69 10.418 9.985 -11.979 1218 HG13 VAL 69 HG13 VAL 69 9.227 8.714 -11.700 1219 HG21 VAL 69 HG21 VAL 69 10.622 10.887 -8.248 1220 HG22 VAL 69 HG22 VAL 69 11.272 11.375 -9.815 1221 HG23 VAL 69 HG23 VAL 69 11.709 9.809 -9.129 1222 H LEU 70 H LEU 70 7.261 13.139 -10.154 1223 HA LEU 70 HA LEU 70 7.892 13.846 -12.813 1224 HB2 LEU 70 HB2 LEU 70 6.360 15.625 -12.613 1225 HB3 LEU 70 HB3 LEU 70 5.729 14.335 -11.608 1226 HG LEU 70 HG LEU 70 7.058 16.896 -10.637 1227 HD11 LEU 70 HD11 LEU 70 4.167 15.991 -10.429 1228 HD12 LEU 70 HD12 LEU 70 4.799 17.257 -11.486 1229 HD13 LEU 70 HD13 LEU 70 4.845 17.471 -9.738 1230 HD21 LEU 70 HD21 LEU 70 6.447 16.208 -8.338 1231 HD22 LEU 70 HD22 LEU 70 7.645 15.143 -9.063 1232 HD23 LEU 70 HD23 LEU 70 5.965 14.623 -8.950 1233 H GLU 71 H GLU 71 9.686 14.753 -13.584 1234 HA GLU 71 HA GLU 71 11.403 16.569 -12.162 1235 HB2 GLU 71 HB2 GLU 71 12.378 17.034 -14.444 1236 HB3 GLU 71 HB3 GLU 71 12.342 15.329 -14.010 1237 HG2 GLU 71 HG2 GLU 71 10.373 14.969 -15.428 1238 HG3 GLU 71 HG3 GLU 71 10.312 16.688 -15.818 1239 H HIS 72 H HIS 72 8.341 16.901 -13.570 1240 HA HIS 72 HA HIS 72 8.208 19.650 -14.249 1241 HB2 HIS 72 HB2 HIS 72 6.054 17.738 -13.221 1242 HB3 HIS 72 HB3 HIS 72 5.729 19.318 -13.923 1243 HD1 HIS 72 HD1 HIS 72 4.991 19.149 -16.259 1244 HD2 HIS 72 HD2 HIS 72 7.599 16.067 -15.288 1245 HE1 HIS 72 HE1 HIS 72 5.160 17.740 -18.322 1246 HE2 HIS 72 HE2 HIS 72 6.871 15.990 -17.767 1247 H HIS 73 H HIS 73 8.826 21.208 -12.790 1248 HA HIS 73 HA HIS 73 8.813 20.792 -9.952 1249 HB2 HIS 73 HB2 HIS 73 9.376 23.339 -11.525 1250 HB3 HIS 73 HB3 HIS 73 9.744 23.086 -9.820 1251 HD1 HIS 73 HD1 HIS 73 11.104 22.563 -13.185 1252 HD2 HIS 73 HD2 HIS 73 11.780 21.038 -9.377 1253 HE1 HIS 73 HE1 HIS 73 13.310 21.374 -13.321 1254 HE2 HIS 73 HE2 HIS 73 13.628 20.345 -11.051 1255 H HIS 74 H HIS 74 6.679 20.389 -9.409 1256 HA HIS 74 HA HIS 74 4.495 22.215 -9.943 1257 HB2 HIS 74 HB2 HIS 74 4.331 19.673 -9.830 1258 HB3 HIS 74 HB3 HIS 74 4.544 19.788 -8.090 1259 HD1 HIS 74 HD1 HIS 74 2.494 20.461 -6.704 1260 HD2 HIS 74 HD2 HIS 74 1.819 20.616 -10.802 1261 HE1 HIS 74 HE1 HIS 74 0.021 20.784 -6.964 1262 HE2 HIS 74 HE2 HIS 74 -0.322 21.089 -9.435 1263 H HIS 75 H HIS 75 6.863 21.863 -7.473 1264 HA HIS 75 HA HIS 75 5.567 23.174 -5.288 1265 HB2 HIS 75 HB2 HIS 75 7.534 21.697 -4.989 1266 HB3 HIS 75 HB3 HIS 75 8.534 22.795 -5.925 1267 HD1 HIS 75 HD1 HIS 75 7.150 22.228 -2.524 1268 HD2 HIS 75 HD2 HIS 75 9.378 25.119 -4.500 1269 HE1 HIS 75 HE1 HIS 75 8.109 23.684 -0.718 1270 HE2 HIS 75 HE2 HIS 75 9.556 25.341 -1.932 1271 H HIS 76 H HIS 76 4.608 25.085 -5.985 1272 HA HIS 76 HA HIS 76 6.404 27.336 -6.772 1273 HB2 HIS 76 HB2 HIS 76 3.469 26.872 -7.464 1274 HB3 HIS 76 HB3 HIS 76 4.299 28.395 -7.747 1275 HD1 HIS 76 HD1 HIS 76 5.820 28.556 -9.793 1276 HD2 HIS 76 HD2 HIS 76 4.236 24.756 -9.231 1277 HE1 HIS 76 HE1 HIS 76 6.293 27.306 -11.914 1278 HE2 HIS 76 HE2 HIS 76 5.523 24.965 -11.462 1279 H HIS 77 H HIS 77 6.187 29.280 -5.685 1280 HA HIS 77 HA HIS 77 4.225 29.557 -3.488 1281 HB2 HIS 77 HB2 HIS 77 6.464 28.726 -2.601 1282 HB3 HIS 77 HB3 HIS 77 7.204 30.199 -3.201 1283 HD1 HIS 77 HD1 HIS 77 5.254 28.822 -0.356 1284 HD2 HIS 77 HD2 HIS 77 6.501 32.562 -1.688 1285 HE1 HIS 77 HE1 HIS 77 4.970 30.365 1.605 1286 HE2 HIS 77 HE2 HIS 77 5.737 32.607 0.782 Start of MODEL 16 1 H1 MET 1 H1 MET 1 8.751 17.801 5.730 2 H2 MET 1 H2 MET 1 7.421 18.485 6.511 3 H3 MET 1 H3 MET 1 8.372 19.432 5.482 4 HA MET 1 HA MET 1 6.318 18.844 4.399 5 HB2 MET 1 HB2 MET 1 8.510 19.027 3.124 6 HB3 MET 1 HB3 MET 1 8.663 17.282 3.223 7 HG2 MET 1 HG2 MET 1 6.378 18.700 1.833 8 HG3 MET 1 HG3 MET 1 7.845 18.149 1.023 9 HE1 MET 1 HE1 MET 1 6.553 16.667 -0.738 10 HE2 MET 1 HE2 MET 1 5.038 17.279 -0.073 11 HE3 MET 1 HE3 MET 1 5.263 15.545 -0.306 12 H LYS 2 H LYS 2 4.614 17.514 4.874 13 HA LYS 2 HA LYS 2 5.009 14.817 5.906 14 HB2 LYS 2 HB2 LYS 2 2.526 14.807 6.226 15 HB3 LYS 2 HB3 LYS 2 3.327 16.158 7.014 16 HG2 LYS 2 HG2 LYS 2 2.505 17.722 5.397 17 HG3 LYS 2 HG3 LYS 2 1.964 16.430 4.321 18 HD2 LYS 2 HD2 LYS 2 0.315 15.740 6.121 19 HD3 LYS 2 HD3 LYS 2 0.770 17.193 7.018 20 HE2 LYS 2 HE2 LYS 2 -0.039 18.608 5.208 21 HE3 LYS 2 HE3 LYS 2 -0.352 17.197 4.194 22 HZ1 LYS 2 HZ1 LYS 2 -1.741 17.894 6.721 23 HZ2 LYS 2 HZ2 LYS 2 -2.007 16.483 5.830 24 HZ3 LYS 2 HZ3 LYS 2 -2.377 17.988 5.154 25 H MET 3 H MET 3 5.928 13.803 4.084 26 HA MET 3 HA MET 3 4.554 13.631 1.536 27 HB2 MET 3 HB2 MET 3 7.179 13.580 2.209 28 HB3 MET 3 HB3 MET 3 6.897 11.852 2.230 29 HG2 MET 3 HG2 MET 3 6.412 13.651 -0.154 30 HG3 MET 3 HG3 MET 3 7.868 12.696 0.116 31 HE1 MET 3 HE1 MET 3 6.441 10.571 -2.740 32 HE2 MET 3 HE2 MET 3 7.885 11.286 -2.019 33 HE3 MET 3 HE3 MET 3 6.588 12.322 -2.626 34 H LEU 4 H LEU 4 3.424 11.838 0.711 35 HA LEU 4 HA LEU 4 2.055 10.067 2.454 36 HB2 LEU 4 HB2 LEU 4 1.399 10.920 0.097 37 HB3 LEU 4 HB3 LEU 4 2.429 9.667 -0.542 38 HG LEU 4 HG LEU 4 0.006 9.129 -0.657 39 HD11 LEU 4 HD11 LEU 4 1.487 7.191 1.120 40 HD12 LEU 4 HD12 LEU 4 1.587 7.284 -0.639 41 HD13 LEU 4 HD13 LEU 4 0.064 6.843 0.127 42 HD21 LEU 4 HD21 LEU 4 0.071 9.080 2.364 43 HD22 LEU 4 HD22 LEU 4 -1.280 8.580 1.341 44 HD23 LEU 4 HD23 LEU 4 -0.757 10.262 1.350 45 H LYS 5 H LYS 5 4.992 9.692 0.540 46 HA LYS 5 HA LYS 5 5.452 6.914 0.929 47 HB2 LYS 5 HB2 LYS 5 6.523 8.398 -0.828 48 HB3 LYS 5 HB3 LYS 5 7.518 9.108 0.444 49 HG2 LYS 5 HG2 LYS 5 8.552 6.925 0.874 50 HG3 LYS 5 HG3 LYS 5 7.503 6.179 -0.335 51 HD2 LYS 5 HD2 LYS 5 8.562 7.644 -2.082 52 HD3 LYS 5 HD3 LYS 5 9.677 8.248 -0.849 53 HE2 LYS 5 HE2 LYS 5 10.548 5.967 -0.512 54 HE3 LYS 5 HE3 LYS 5 9.406 5.343 -1.705 55 HZ1 LYS 5 HZ1 LYS 5 11.679 7.175 -2.182 56 HZ2 LYS 5 HZ2 LYS 5 10.502 6.825 -3.341 57 HZ3 LYS 5 HZ3 LYS 5 11.491 5.594 -2.747 58 H GLU 6 H GLU 6 6.306 9.798 2.801 59 HA GLU 6 HA GLU 6 8.106 8.567 4.622 60 HB2 GLU 6 HB2 GLU 6 6.587 11.181 4.705 61 HB3 GLU 6 HB3 GLU 6 7.616 10.675 6.041 62 HG2 GLU 6 HG2 GLU 6 8.508 11.146 3.182 63 HG3 GLU 6 HG3 GLU 6 8.775 12.228 4.544 64 H LYS 7 H LYS 7 4.584 9.295 4.880 65 HA LYS 7 HA LYS 7 4.328 8.326 7.549 66 HB2 LYS 7 HB2 LYS 7 1.911 8.308 7.198 67 HB3 LYS 7 HB3 LYS 7 2.613 9.790 6.563 68 HG2 LYS 7 HG2 LYS 7 2.319 9.087 4.303 69 HG3 LYS 7 HG3 LYS 7 2.000 7.425 4.784 70 HD2 LYS 7 HD2 LYS 7 -0.079 8.382 4.116 71 HD3 LYS 7 HD3 LYS 7 -0.125 8.196 5.863 72 HE2 LYS 7 HE2 LYS 7 0.557 10.828 4.515 73 HE3 LYS 7 HE3 LYS 7 -1.094 10.359 4.907 74 HZ1 LYS 7 HZ1 LYS 7 1.129 10.764 6.829 75 HZ2 LYS 7 HZ2 LYS 7 -0.398 10.171 7.244 76 HZ3 LYS 7 HZ3 LYS 7 -0.238 11.737 6.628 77 H ALA 8 H ALA 8 3.895 6.711 4.386 78 HA ALA 8 HA ALA 8 3.004 4.187 5.271 79 HB1 ALA 8 HB1 ALA 8 2.930 4.901 2.915 80 HB2 ALA 8 HB2 ALA 8 3.778 3.361 3.071 81 HB3 ALA 8 HB3 ALA 8 4.692 4.854 2.831 82 H GLY 9 H GLY 9 6.266 5.480 4.827 83 HA2 GLY 9 HA2 GLY 9 7.752 3.158 5.543 84 HA3 GLY 9 HA3 GLY 9 8.347 4.809 5.533 85 H ALA 10 H ALA 10 6.552 5.901 7.440 86 HA ALA 10 HA ALA 10 7.874 5.354 9.886 87 HB1 ALA 10 HB1 ALA 10 5.266 6.850 9.419 88 HB2 ALA 10 HB2 ALA 10 6.883 7.551 9.361 89 HB3 ALA 10 HB3 ALA 10 6.258 6.923 10.885 90 H LEU 11 H LEU 11 4.534 4.635 8.834 91 HA LEU 11 HA LEU 11 3.637 3.222 11.103 92 HB2 LEU 11 HB2 LEU 11 2.733 2.909 8.210 93 HB3 LEU 11 HB3 LEU 11 1.823 2.395 9.624 94 HG LEU 11 HG LEU 11 2.499 5.285 8.942 95 HD11 LEU 11 HD11 LEU 11 0.142 5.566 8.367 96 HD12 LEU 11 HD12 LEU 11 -0.144 3.843 8.627 97 HD13 LEU 11 HD13 LEU 11 0.925 4.377 7.328 98 HD21 LEU 11 HD21 LEU 11 0.948 5.911 10.728 99 HD22 LEU 11 HD22 LEU 11 2.286 4.952 11.357 100 HD23 LEU 11 HD23 LEU 11 0.700 4.211 11.131 101 H ALA 12 H ALA 12 5.420 2.176 8.252 102 HA ALA 12 HA ALA 12 5.243 -0.619 8.463 103 HB1 ALA 12 HB1 ALA 12 7.552 1.049 7.422 104 HB2 ALA 12 HB2 ALA 12 6.128 0.562 6.503 105 HB3 ALA 12 HB3 ALA 12 7.263 -0.664 7.072 106 H GLY 13 H GLY 13 7.522 1.638 9.996 107 HA2 GLY 13 HA2 GLY 13 9.373 -0.172 11.074 108 HA3 GLY 13 HA3 GLY 13 9.049 1.439 11.691 109 H GLN 14 H GLN 14 6.541 1.301 12.682 110 HA GLN 14 HA GLN 14 6.860 -0.079 15.155 111 HB2 GLN 14 HB2 GLN 14 4.561 0.767 15.691 112 HB3 GLN 14 HB3 GLN 14 5.667 2.023 15.145 113 HG2 GLN 14 HG2 GLN 14 4.626 1.972 12.907 114 HG3 GLN 14 HG3 GLN 14 3.524 0.708 13.454 115 HE21 GLN 14 HE21 GLN 14 4.329 4.108 13.709 116 HE22 GLN 14 HE22 GLN 14 2.837 4.600 14.418 117 H ILE 15 H ILE 15 4.937 -0.808 12.241 118 HA ILE 15 HA ILE 15 3.429 -2.978 13.285 119 HB ILE 15 HB ILE 15 4.190 -2.287 10.420 120 HG12 ILE 15 HG12 ILE 15 1.547 -2.039 11.928 121 HG13 ILE 15 HG13 ILE 15 2.645 -0.709 11.583 122 HG21 ILE 15 HG21 ILE 15 3.809 -4.715 10.481 123 HG22 ILE 15 HG22 ILE 15 2.484 -3.910 9.641 124 HG23 ILE 15 HG23 ILE 15 2.266 -4.472 11.299 125 HD11 ILE 15 HD11 ILE 15 1.105 -2.326 9.550 126 HD12 ILE 15 HD12 ILE 15 2.232 -1.019 9.174 127 HD13 ILE 15 HD13 ILE 15 0.758 -0.681 10.080 128 H TRP 16 H TRP 16 6.543 -2.911 11.548 129 HA TRP 16 HA TRP 16 7.030 -5.684 11.448 130 HB2 TRP 16 HB2 TRP 16 8.327 -3.972 10.141 131 HB3 TRP 16 HB3 TRP 16 9.120 -3.461 11.629 132 HD1 TRP 16 HD1 TRP 16 9.014 -6.353 9.128 133 HE1 TRP 16 HE1 TRP 16 11.078 -7.854 9.467 134 HE3 TRP 16 HE3 TRP 16 10.905 -4.221 13.381 135 HZ2 TRP 16 HZ2 TRP 16 13.210 -8.121 11.286 136 HZ3 TRP 16 HZ3 TRP 16 12.955 -5.165 14.366 137 HH2 TRP 16 HH2 TRP 16 14.080 -7.082 13.343 138 H GLU 17 H GLU 17 7.920 -3.261 13.882 139 HA GLU 17 HA GLU 17 9.550 -4.908 15.522 140 HB2 GLU 17 HB2 GLU 17 9.286 -2.271 15.350 141 HB3 GLU 17 HB3 GLU 17 8.059 -2.483 16.586 142 HG2 GLU 17 HG2 GLU 17 10.968 -3.312 16.838 143 HG3 GLU 17 HG3 GLU 17 10.289 -1.816 17.472 144 H ALA 18 H ALA 18 6.083 -4.085 15.655 145 HA ALA 18 HA ALA 18 5.390 -5.450 18.051 146 HB1 ALA 18 HB1 ALA 18 3.641 -4.823 15.650 147 HB2 ALA 18 HB2 ALA 18 3.935 -3.755 17.023 148 HB3 ALA 18 HB3 ALA 18 3.065 -5.271 17.261 149 H LEU 19 H LEU 19 5.675 -6.538 14.714 150 HA LEU 19 HA LEU 19 4.687 -9.230 15.227 151 HB2 LEU 19 HB2 LEU 19 5.895 -7.880 12.794 152 HB3 LEU 19 HB3 LEU 19 5.400 -9.566 12.796 153 HG LEU 19 HG LEU 19 3.503 -7.238 13.310 154 HD11 LEU 19 HD11 LEU 19 2.662 -7.603 11.028 155 HD12 LEU 19 HD12 LEU 19 3.926 -8.803 10.741 156 HD13 LEU 19 HD13 LEU 19 4.357 -7.113 11.021 157 HD21 LEU 19 HD21 LEU 19 2.778 -9.344 14.341 158 HD22 LEU 19 HD22 LEU 19 2.950 -10.185 12.798 159 HD23 LEU 19 HD23 LEU 19 1.732 -8.921 12.986 160 H ASN 20 H ASN 20 7.743 -7.617 15.442 161 HA ASN 20 HA ASN 20 9.497 -9.736 14.798 162 HB2 ASN 20 HB2 ASN 20 10.088 -7.259 15.047 163 HB3 ASN 20 HB3 ASN 20 10.141 -7.519 16.785 164 HD21 ASN 20 HD21 ASN 20 11.233 -9.615 14.143 165 HD22 ASN 20 HD22 ASN 20 12.886 -9.624 14.612 166 H GLY 21 H GLY 21 9.918 -11.585 15.818 167 HA2 GLY 21 HA2 GLY 21 10.164 -13.191 17.463 168 HA3 GLY 21 HA3 GLY 21 9.884 -11.968 18.687 169 H THR 22 H THR 22 7.427 -12.047 16.313 170 HA THR 22 HA THR 22 5.585 -13.555 18.089 171 HB THR 22 HB THR 22 4.803 -11.638 15.835 172 HG1 THR 22 HG1 THR 22 4.859 -10.014 17.231 173 HG21 THR 22 HG21 THR 22 2.624 -11.534 16.975 174 HG22 THR 22 HG22 THR 22 3.188 -12.670 18.200 175 HG23 THR 22 HG23 THR 22 3.004 -13.202 16.526 176 H GLU 23 H GLU 23 4.317 -15.257 17.257 177 HA GLU 23 HA GLU 23 5.114 -16.823 15.082 178 HB2 GLU 23 HB2 GLU 23 2.288 -16.707 16.216 179 HB3 GLU 23 HB3 GLU 23 3.054 -18.077 15.419 180 HG2 GLU 23 HG2 GLU 23 3.829 -16.929 18.123 181 HG3 GLU 23 HG3 GLU 23 2.860 -18.376 17.862 182 H GLY 24 H GLY 24 2.895 -14.128 15.200 183 HA2 GLY 24 HA2 GLY 24 2.611 -13.063 12.866 184 HA3 GLY 24 HA3 GLY 24 1.802 -14.586 12.500 185 H LEU 25 H LEU 25 0.775 -11.716 12.704 186 HA LEU 25 HA LEU 25 -1.486 -12.229 14.557 187 HB2 LEU 25 HB2 LEU 25 -0.011 -9.596 14.170 188 HB3 LEU 25 HB3 LEU 25 -1.543 -9.739 15.015 189 HG LEU 25 HG LEU 25 1.082 -11.001 15.906 190 HD11 LEU 25 HD11 LEU 25 1.132 -8.572 16.138 191 HD12 LEU 25 HD12 LEU 25 1.046 -9.341 17.720 192 HD13 LEU 25 HD13 LEU 25 -0.396 -8.595 17.022 193 HD21 LEU 25 HD21 LEU 25 -1.619 -10.955 17.299 194 HD22 LEU 25 HD22 LEU 25 -0.110 -11.548 18.001 195 HD23 LEU 25 HD23 LEU 25 -0.816 -12.370 16.612 196 H THR 26 H THR 26 -3.537 -11.378 13.872 197 HA THR 26 HA THR 26 -3.916 -10.994 11.027 198 HB THR 26 HB THR 26 -6.293 -10.652 11.508 199 HG1 THR 26 HG1 THR 26 -6.797 -10.837 13.940 200 HG21 THR 26 HG21 THR 26 -6.855 -12.731 12.716 201 HG22 THR 26 HG22 THR 26 -5.199 -12.851 13.312 202 HG23 THR 26 HG23 THR 26 -5.531 -13.008 11.583 203 H GLN 27 H GLN 27 -5.080 -9.046 10.150 204 HA GLN 27 HA GLN 27 -3.662 -6.686 10.469 205 HB2 GLN 27 HB2 GLN 27 -5.430 -5.625 9.102 206 HB3 GLN 27 HB3 GLN 27 -4.951 -7.194 8.466 207 HG2 GLN 27 HG2 GLN 27 -6.992 -8.189 9.536 208 HG3 GLN 27 HG3 GLN 27 -7.496 -6.565 10.002 209 HE21 GLN 27 HE21 GLN 27 -8.078 -5.080 8.308 210 HE22 GLN 27 HE22 GLN 27 -8.563 -5.664 6.759 211 H LYS 28 H LYS 28 -6.615 -7.672 12.097 212 HA LYS 28 HA LYS 28 -7.169 -5.280 13.521 213 HB2 LYS 28 HB2 LYS 28 -7.876 -8.145 14.260 214 HB3 LYS 28 HB3 LYS 28 -8.641 -6.695 14.915 215 HG2 LYS 28 HG2 LYS 28 -9.516 -6.125 12.690 216 HG3 LYS 28 HG3 LYS 28 -8.694 -7.524 11.993 217 HD2 LYS 28 HD2 LYS 28 -11.034 -8.062 12.293 218 HD3 LYS 28 HD3 LYS 28 -10.085 -9.018 13.433 219 HE2 LYS 28 HE2 LYS 28 -10.666 -7.369 15.228 220 HE3 LYS 28 HE3 LYS 28 -11.684 -6.506 14.070 221 HZ1 LYS 28 HZ1 LYS 28 -12.038 -9.303 14.990 222 HZ2 LYS 28 HZ2 LYS 28 -12.987 -8.550 13.812 223 HZ3 LYS 28 HZ3 LYS 28 -13.004 -7.980 15.403 224 H GLN 29 H GLN 29 -5.329 -8.197 14.460 225 HA GLN 29 HA GLN 29 -4.853 -7.494 17.173 226 HB2 GLN 29 HB2 GLN 29 -3.381 -9.431 15.354 227 HB3 GLN 29 HB3 GLN 29 -3.099 -9.313 17.089 228 HG2 GLN 29 HG2 GLN 29 -5.731 -10.060 15.784 229 HG3 GLN 29 HG3 GLN 29 -4.582 -11.195 16.487 230 HE21 GLN 29 HE21 GLN 29 -7.404 -10.627 17.197 231 HE22 GLN 29 HE22 GLN 29 -7.387 -10.240 18.876 232 H ILE 30 H ILE 30 -2.865 -7.053 14.265 233 HA ILE 30 HA ILE 30 -0.502 -6.094 15.456 234 HB ILE 30 HB ILE 30 -1.637 -5.372 12.716 235 HG12 ILE 30 HG12 ILE 30 0.323 -7.583 13.466 236 HG13 ILE 30 HG13 ILE 30 -1.382 -7.836 13.122 237 HG21 ILE 30 HG21 ILE 30 0.165 -3.818 13.354 238 HG22 ILE 30 HG22 ILE 30 0.696 -4.884 12.055 239 HG23 ILE 30 HG23 ILE 30 1.234 -5.179 13.710 240 HD11 ILE 30 HD11 ILE 30 -1.018 -7.069 10.821 241 HD12 ILE 30 HD12 ILE 30 -0.021 -8.459 11.240 242 HD13 ILE 30 HD13 ILE 30 0.699 -6.852 11.175 243 H LYS 31 H LYS 31 -3.354 -4.300 14.252 244 HA LYS 31 HA LYS 31 -2.341 -1.689 14.627 245 HB2 LYS 31 HB2 LYS 31 -5.239 -2.588 14.573 246 HB3 LYS 31 HB3 LYS 31 -4.696 -0.913 14.457 247 HG2 LYS 31 HG2 LYS 31 -3.421 -1.595 12.361 248 HG3 LYS 31 HG3 LYS 31 -4.270 -3.138 12.444 249 HD2 LYS 31 HD2 LYS 31 -5.464 -0.376 12.046 250 HD3 LYS 31 HD3 LYS 31 -5.461 -1.717 10.896 251 HE2 LYS 31 HE2 LYS 31 -6.978 -1.659 13.531 252 HE3 LYS 31 HE3 LYS 31 -7.673 -1.370 11.938 253 HZ1 LYS 31 HZ1 LYS 31 -7.098 -3.609 11.307 254 HZ2 LYS 31 HZ2 LYS 31 -8.063 -3.621 12.693 255 HZ3 LYS 31 HZ3 LYS 31 -6.396 -3.898 12.813 256 H LYS 32 H LYS 32 -3.862 -3.863 16.946 257 HA LYS 32 HA LYS 32 -4.319 -1.902 18.984 258 HB2 LYS 32 HB2 LYS 32 -5.430 -4.126 19.015 259 HB3 LYS 32 HB3 LYS 32 -3.876 -4.905 19.285 260 HG2 LYS 32 HG2 LYS 32 -5.146 -4.742 21.376 261 HG3 LYS 32 HG3 LYS 32 -3.669 -3.775 21.469 262 HD2 LYS 32 HD2 LYS 32 -5.063 -1.737 20.899 263 HD3 LYS 32 HD3 LYS 32 -6.504 -2.753 21.008 264 HE2 LYS 32 HE2 LYS 32 -4.539 -2.208 23.264 265 HE3 LYS 32 HE3 LYS 32 -6.132 -1.473 23.083 266 HZ1 LYS 32 HZ1 LYS 32 -5.597 -4.368 23.483 267 HZ2 LYS 32 HZ2 LYS 32 -7.125 -3.670 23.304 268 HZ3 LYS 32 HZ3 LYS 32 -6.178 -3.297 24.655 269 H ALA 33 H ALA 33 -1.648 -4.215 18.382 270 HA ALA 33 HA ALA 33 -0.029 -3.510 20.612 271 HB1 ALA 33 HB1 ALA 33 1.722 -4.840 19.502 272 HB2 ALA 33 HB2 ALA 33 0.787 -4.834 18.002 273 HB3 ALA 33 HB3 ALA 33 0.159 -5.659 19.429 274 H THR 34 H THR 34 -0.176 -2.258 17.330 275 HA THR 34 HA THR 34 2.149 -0.503 17.576 276 HB THR 34 HB THR 34 1.581 0.170 15.246 277 HG1 THR 34 HG1 THR 34 -0.199 -1.197 14.299 278 HG21 THR 34 HG21 THR 34 2.969 -1.852 15.555 279 HG22 THR 34 HG22 THR 34 1.927 -1.998 14.139 280 HG23 THR 34 HG23 THR 34 1.508 -2.845 15.629 281 H LYS 35 H LYS 35 -1.222 -0.356 18.134 282 HA LYS 35 HA LYS 35 -2.688 1.190 18.849 283 HB2 LYS 35 HB2 LYS 35 -0.346 3.127 19.100 284 HB3 LYS 35 HB3 LYS 35 -1.937 3.325 19.832 285 HG2 LYS 35 HG2 LYS 35 -1.552 1.386 21.281 286 HG3 LYS 35 HG3 LYS 35 0.002 1.076 20.501 287 HD2 LYS 35 HD2 LYS 35 -0.750 3.459 22.232 288 HD3 LYS 35 HD3 LYS 35 0.400 2.179 22.621 289 HE2 LYS 35 HE2 LYS 35 0.703 4.341 20.509 290 HE3 LYS 35 HE3 LYS 35 1.640 4.157 21.990 291 HZ1 LYS 35 HZ1 LYS 35 1.684 2.362 19.621 292 HZ2 LYS 35 HZ2 LYS 35 2.485 2.038 21.070 293 HZ3 LYS 35 HZ3 LYS 35 2.927 3.383 20.149 294 H LEU 36 H LEU 36 -2.175 0.833 16.039 295 HA LEU 36 HA LEU 36 -2.555 3.312 14.635 296 HB2 LEU 36 HB2 LEU 36 -3.146 0.433 13.867 297 HB3 LEU 36 HB3 LEU 36 -3.380 1.780 12.768 298 HG LEU 36 HG LEU 36 -0.710 0.914 13.947 299 HD11 LEU 36 HD11 LEU 36 -0.160 0.200 11.654 300 HD12 LEU 36 HD12 LEU 36 -1.797 0.603 11.127 301 HD13 LEU 36 HD13 LEU 36 -1.538 -0.692 12.300 302 HD21 LEU 36 HD21 LEU 36 0.297 2.549 12.409 303 HD22 LEU 36 HD22 LEU 36 -0.764 3.333 13.575 304 HD23 LEU 36 HD23 LEU 36 -1.312 3.086 11.914 305 H LYS 37 H LYS 37 -4.556 3.860 13.414 306 HA LYS 37 HA LYS 37 -6.855 3.867 15.225 307 HB2 LYS 37 HB2 LYS 37 -6.082 6.004 14.355 308 HB3 LYS 37 HB3 LYS 37 -6.230 5.436 12.693 309 HG2 LYS 37 HG2 LYS 37 -8.654 5.383 12.868 310 HG3 LYS 37 HG3 LYS 37 -8.578 5.742 14.595 311 HD2 LYS 37 HD2 LYS 37 -7.649 7.974 14.108 312 HD3 LYS 37 HD3 LYS 37 -7.665 7.618 12.376 313 HE2 LYS 37 HE2 LYS 37 -9.597 9.020 13.048 314 HE3 LYS 37 HE3 LYS 37 -10.119 7.459 12.414 315 HZ1 LYS 37 HZ1 LYS 37 -9.882 8.124 15.304 316 HZ2 LYS 37 HZ2 LYS 37 -10.474 6.679 14.655 317 HZ3 LYS 37 HZ3 LYS 37 -11.327 8.120 14.425 318 H ALA 38 H ALA 38 -6.186 3.056 11.809 319 HA ALA 38 HA ALA 38 -8.667 1.466 11.624 320 HB1 ALA 38 HB1 ALA 38 -8.026 3.712 9.670 321 HB2 ALA 38 HB2 ALA 38 -9.302 3.745 10.889 322 HB3 ALA 38 HB3 ALA 38 -9.385 2.588 9.560 323 H ASP 39 H ASP 39 -8.757 0.158 9.648 324 HA ASP 39 HA ASP 39 -6.342 -1.189 9.040 325 HB2 ASP 39 HB2 ASP 39 -9.012 -1.239 7.567 326 HB3 ASP 39 HB3 ASP 39 -7.709 -2.412 7.349 327 H LYS 40 H LYS 40 -7.928 1.529 7.547 328 HA LYS 40 HA LYS 40 -6.844 1.664 4.999 329 HB2 LYS 40 HB2 LYS 40 -7.493 3.914 6.944 330 HB3 LYS 40 HB3 LYS 40 -7.158 4.171 5.232 331 HG2 LYS 40 HG2 LYS 40 -9.425 2.452 6.296 332 HG3 LYS 40 HG3 LYS 40 -9.592 4.140 5.802 333 HD2 LYS 40 HD2 LYS 40 -8.935 3.557 3.498 334 HD3 LYS 40 HD3 LYS 40 -8.678 1.875 3.975 335 HE2 LYS 40 HE2 LYS 40 -10.849 2.252 2.798 336 HE3 LYS 40 HE3 LYS 40 -11.051 1.589 4.418 337 HZ1 LYS 40 HZ1 LYS 40 -11.310 4.473 3.753 338 HZ2 LYS 40 HZ2 LYS 40 -11.670 3.739 5.232 339 HZ3 LYS 40 HZ3 LYS 40 -12.615 3.405 3.870 340 H ASP 41 H ASP 41 -5.394 3.043 7.981 341 HA ASP 41 HA ASP 41 -2.988 3.922 6.639 342 HB2 ASP 41 HB2 ASP 41 -2.180 4.385 9.031 343 HB3 ASP 41 HB3 ASP 41 -3.596 5.272 8.493 344 H PHE 42 H PHE 42 -3.960 1.078 8.487 345 HA PHE 42 HA PHE 42 -1.492 -0.231 8.752 346 HB2 PHE 42 HB2 PHE 42 -3.461 -1.112 9.871 347 HB3 PHE 42 HB3 PHE 42 -4.278 -1.385 8.338 348 HD1 PHE 42 HD1 PHE 42 -1.377 -2.503 10.403 349 HD2 PHE 42 HD2 PHE 42 -4.021 -3.471 7.179 350 HE1 PHE 42 HE1 PHE 42 -0.439 -4.767 10.301 351 HE2 PHE 42 HE2 PHE 42 -3.075 -5.739 7.094 352 HZ PHE 42 HZ PHE 42 -1.280 -6.384 8.650 353 H PHE 43 H PHE 43 -3.673 -0.101 5.914 354 HA PHE 43 HA PHE 43 -2.366 -2.039 4.311 355 HB2 PHE 43 HB2 PHE 43 -4.030 0.346 3.404 356 HB3 PHE 43 HB3 PHE 43 -3.570 -1.010 2.378 357 HD1 PHE 43 HD2 PHE 43 -4.053 -3.324 4.251 358 HD2 PHE 43 HD1 PHE 43 -6.393 0.181 3.480 359 HE1 PHE 43 HE2 PHE 43 -6.087 -4.519 4.944 360 HE2 PHE 43 HE1 PHE 43 -8.421 -1.029 4.178 361 HZ PHE 43 HZ PHE 43 -8.270 -3.376 4.913 362 H LEU 44 H LEU 44 -1.702 1.393 4.783 363 HA LEU 44 HA LEU 44 0.307 1.624 2.730 364 HB2 LEU 44 HB2 LEU 44 -0.489 3.354 5.083 365 HB3 LEU 44 HB3 LEU 44 0.955 3.729 4.161 366 HG LEU 44 HG LEU 44 -0.423 3.993 2.104 367 HD11 LEU 44 HD11 LEU 44 -2.865 4.131 2.202 368 HD12 LEU 44 HD12 LEU 44 -2.839 3.602 3.887 369 HD13 LEU 44 HD13 LEU 44 -2.297 2.511 2.610 370 HD21 LEU 44 HD21 LEU 44 -1.452 6.137 2.694 371 HD22 LEU 44 HD22 LEU 44 0.126 5.960 3.457 372 HD23 LEU 44 HD23 LEU 44 -1.342 5.733 4.410 373 H GLY 45 H GLY 45 0.397 1.013 6.254 374 HA2 GLY 45 HA2 GLY 45 3.218 0.909 6.594 375 HA3 GLY 45 HA3 GLY 45 2.026 0.155 7.642 376 H LEU 46 H LEU 46 0.946 -1.857 6.490 377 HA LEU 46 HA LEU 46 2.753 -3.936 6.031 378 HB2 LEU 46 HB2 LEU 46 0.458 -4.394 6.689 379 HB3 LEU 46 HB3 LEU 46 -0.163 -3.645 5.229 380 HG LEU 46 HG LEU 46 0.863 -5.493 3.872 381 HD11 LEU 46 HD11 LEU 46 2.675 -6.159 5.344 382 HD12 LEU 46 HD12 LEU 46 1.653 -7.539 4.954 383 HD13 LEU 46 HD13 LEU 46 1.521 -6.766 6.536 384 HD21 LEU 46 HD21 LEU 46 -1.081 -6.435 5.996 385 HD22 LEU 46 HD22 LEU 46 -0.784 -7.212 4.438 386 HD23 LEU 46 HD23 LEU 46 -1.496 -5.601 4.495 387 H GLY 47 H GLY 47 1.212 -1.750 3.717 388 HA2 GLY 47 HA2 GLY 47 1.927 -3.031 1.287 389 HA3 GLY 47 HA3 GLY 47 1.551 -1.322 1.480 390 H TRP 48 H TRP 48 3.610 -0.747 3.373 391 HA TRP 48 HA TRP 48 5.932 -0.460 1.741 392 HB2 TRP 48 HB2 TRP 48 5.191 1.113 3.632 393 HB3 TRP 48 HB3 TRP 48 5.818 -0.086 4.762 394 HD1 TRP 48 HD1 TRP 48 8.494 -0.266 4.974 395 HE1 TRP 48 HE1 TRP 48 10.415 1.184 4.099 396 HE3 TRP 48 HE3 TRP 48 5.878 2.654 1.704 397 HZ2 TRP 48 HZ2 TRP 48 10.786 3.289 2.278 398 HZ3 TRP 48 HZ3 TRP 48 7.092 4.374 0.430 399 HH2 TRP 48 HH2 TRP 48 9.502 4.685 0.723 400 H LEU 49 H LEU 49 5.062 -2.643 4.447 401 HA LEU 49 HA LEU 49 7.451 -4.119 4.668 402 HB2 LEU 49 HB2 LEU 49 4.564 -4.711 5.265 403 HB3 LEU 49 HB3 LEU 49 5.689 -6.046 5.309 404 HG LEU 49 HG LEU 49 6.908 -5.101 7.159 405 HD11 LEU 49 HD11 LEU 49 6.393 -2.961 8.171 406 HD12 LEU 49 HD12 LEU 49 5.216 -2.625 6.884 407 HD13 LEU 49 HD13 LEU 49 6.937 -2.779 6.505 408 HD21 LEU 49 HD21 LEU 49 3.938 -4.731 7.677 409 HD22 LEU 49 HD22 LEU 49 5.189 -4.994 8.899 410 HD23 LEU 49 HD23 LEU 49 4.810 -6.265 7.742 411 H LEU 50 H LEU 50 4.857 -4.389 2.278 412 HA LEU 50 HA LEU 50 5.702 -6.787 1.000 413 HB2 LEU 50 HB2 LEU 50 4.113 -4.450 -0.120 414 HB3 LEU 50 HB3 LEU 50 4.320 -5.988 -0.944 415 HG LEU 50 HG LEU 50 2.830 -5.536 1.675 416 HD11 LEU 50 HD11 LEU 50 0.821 -6.177 0.418 417 HD12 LEU 50 HD12 LEU 50 1.769 -6.288 -1.067 418 HD13 LEU 50 HD13 LEU 50 1.576 -4.732 -0.254 419 HD21 LEU 50 HD21 LEU 50 3.948 -7.705 1.748 420 HD22 LEU 50 HD22 LEU 50 3.267 -8.141 0.176 421 HD23 LEU 50 HD23 LEU 50 2.205 -7.916 1.570 422 H ARG 51 H ARG 51 6.446 -3.321 0.290 423 HA ARG 51 HA ARG 51 8.238 -3.987 -1.875 424 HB2 ARG 51 HB2 ARG 51 8.815 -1.605 -1.950 425 HB3 ARG 51 HB3 ARG 51 7.087 -1.843 -1.923 426 HG2 ARG 51 HG2 ARG 51 7.453 0.061 -0.593 427 HG3 ARG 51 HG3 ARG 51 7.194 -1.236 0.564 428 HD2 ARG 51 HD2 ARG 51 8.994 0.130 1.367 429 HD3 ARG 51 HD3 ARG 51 9.685 -1.400 0.844 430 HE ARG 51 HE ARG 51 9.772 1.020 -0.850 431 HH11 ARG 51 HH11 ARG 51 11.435 -1.624 0.635 432 HH12 ARG 51 HH12 ARG 51 12.950 -1.182 -0.054 433 HH21 ARG 51 HH21 ARG 51 11.737 1.562 -1.696 434 HH22 ARG 51 HH22 ARG 51 13.118 0.586 -1.353 435 H GLU 52 H GLU 52 8.593 -3.895 1.537 436 HA GLU 52 HA GLU 52 11.505 -3.767 1.603 437 HB2 GLU 52 HB2 GLU 52 9.419 -4.449 3.708 438 HB3 GLU 52 HB3 GLU 52 11.145 -4.391 4.040 439 HG2 GLU 52 HG2 GLU 52 9.632 -1.987 2.994 440 HG3 GLU 52 HG3 GLU 52 9.705 -2.370 4.709 441 H ASP 53 H ASP 53 9.077 -6.164 1.145 442 HA ASP 53 HA ASP 53 9.052 -8.370 0.683 443 HB2 ASP 53 HB2 ASP 53 12.075 -8.074 0.405 444 HB3 ASP 53 HB3 ASP 53 11.129 -9.440 -0.183 445 H LYS 54 H LYS 54 9.560 -7.376 3.479 446 HA LYS 54 HA LYS 54 11.005 -9.613 4.760 447 HB2 LYS 54 HB2 LYS 54 11.185 -8.169 6.734 448 HB3 LYS 54 HB3 LYS 54 11.783 -7.349 5.297 449 HG2 LYS 54 HG2 LYS 54 9.504 -6.182 5.169 450 HG3 LYS 54 HG3 LYS 54 9.188 -6.835 6.783 451 HD2 LYS 54 HD2 LYS 54 11.216 -5.678 7.638 452 HD3 LYS 54 HD3 LYS 54 11.521 -5.021 6.029 453 HE2 LYS 54 HE2 LYS 54 9.235 -3.887 6.202 454 HE3 LYS 54 HE3 LYS 54 9.225 -4.367 7.902 455 HZ1 LYS 54 HZ1 LYS 54 10.049 -2.136 7.666 456 HZ2 LYS 54 HZ2 LYS 54 11.242 -2.636 6.575 457 HZ3 LYS 54 HZ3 LYS 54 11.305 -3.139 8.189 458 H VAL 55 H VAL 55 7.923 -9.202 3.867 459 HA VAL 55 HA VAL 55 6.951 -10.861 6.131 460 HB VAL 55 HB VAL 55 4.687 -9.873 5.999 461 HG11 VAL 55 HG11 VAL 55 6.235 -9.043 7.702 462 HG12 VAL 55 HG12 VAL 55 5.170 -7.754 7.145 463 HG13 VAL 55 HG13 VAL 55 6.842 -7.818 6.585 464 HG21 VAL 55 HG21 VAL 55 4.716 -9.062 3.671 465 HG22 VAL 55 HG22 VAL 55 5.908 -7.832 4.096 466 HG23 VAL 55 HG23 VAL 55 4.281 -7.754 4.775 467 H VAL 56 H VAL 56 5.238 -12.285 5.709 468 HA VAL 56 HA VAL 56 4.150 -12.489 3.018 469 HB VAL 56 HB VAL 56 5.964 -14.171 3.112 470 HG11 VAL 56 HG11 VAL 56 4.470 -15.442 5.426 471 HG12 VAL 56 HG12 VAL 56 6.030 -14.621 5.520 472 HG13 VAL 56 HG13 VAL 56 5.879 -16.125 4.608 473 HG21 VAL 56 HG21 VAL 56 4.678 -16.131 2.348 474 HG22 VAL 56 HG22 VAL 56 3.994 -14.634 1.709 475 HG23 VAL 56 HG23 VAL 56 3.212 -15.453 3.062 476 H THR 57 H THR 57 1.949 -12.990 2.990 477 HA THR 57 HA THR 57 0.654 -12.852 5.659 478 HB THR 57 HB THR 57 -1.190 -11.599 4.584 479 HG1 THR 57 HG1 THR 57 -1.133 -12.328 2.479 480 HG21 THR 57 HG21 THR 57 0.681 -10.263 5.510 481 HG22 THR 57 HG22 THR 57 -0.017 -9.477 4.093 482 HG23 THR 57 HG23 THR 57 1.514 -10.343 3.955 483 H SER 58 H SER 58 -0.708 -14.426 6.169 484 HA SER 58 HA SER 58 -1.588 -16.494 4.333 485 HB2 SER 58 HB2 SER 58 -2.303 -16.112 7.277 486 HB3 SER 58 HB3 SER 58 -2.472 -17.590 6.330 487 HG SER 58 HG SER 58 -0.595 -17.919 7.308 488 H GLU 59 H GLU 59 -3.706 -16.770 3.639 489 HA GLU 59 HA GLU 59 -5.638 -14.596 4.090 490 HB2 GLU 59 HB2 GLU 59 -5.185 -15.313 1.743 491 HB3 GLU 59 HB3 GLU 59 -5.711 -16.943 2.137 492 HG2 GLU 59 HG2 GLU 59 -7.499 -15.799 0.962 493 HG3 GLU 59 HG3 GLU 59 -7.986 -16.083 2.629 494 H VAL 60 H VAL 60 -6.641 -14.937 6.018 495 HA VAL 60 HA VAL 60 -7.842 -17.589 6.625 496 HB VAL 60 HB VAL 60 -7.317 -15.241 8.514 497 HG11 VAL 60 HG11 VAL 60 -8.230 -18.062 9.168 498 HG12 VAL 60 HG12 VAL 60 -9.205 -16.596 9.295 499 HG13 VAL 60 HG13 VAL 60 -7.809 -16.822 10.352 500 HG21 VAL 60 HG21 VAL 60 -5.476 -16.571 9.472 501 HG22 VAL 60 HG22 VAL 60 -5.190 -16.229 7.764 502 HG23 VAL 60 HG23 VAL 60 -5.747 -17.827 8.262 503 H GLU 61 H GLU 61 -9.834 -17.542 5.672 504 HA GLU 61 HA GLU 61 -11.903 -16.948 5.024 505 HB2 GLU 61 HB2 GLU 61 -13.482 -16.460 6.913 506 HB3 GLU 61 HB3 GLU 61 -12.446 -17.852 7.174 507 HG2 GLU 61 HG2 GLU 61 -11.150 -16.730 8.812 508 HG3 GLU 61 HG3 GLU 61 -11.773 -15.151 8.361 509 H GLY 62 H GLY 62 -10.391 -14.952 4.044 510 HA2 GLY 62 HA2 GLY 62 -10.777 -12.940 2.977 511 HA3 GLY 62 HA3 GLY 62 -12.208 -12.698 3.952 512 H GLU 63 H GLU 63 -9.510 -13.331 5.919 513 HA GLU 63 HA GLU 63 -9.048 -10.461 6.487 514 HB2 GLU 63 HB2 GLU 63 -8.745 -12.870 8.344 515 HB3 GLU 63 HB3 GLU 63 -8.488 -11.188 8.797 516 HG2 GLU 63 HG2 GLU 63 -11.159 -12.271 7.845 517 HG3 GLU 63 HG3 GLU 63 -10.677 -12.227 9.538 518 H ILE 64 H ILE 64 -6.947 -9.730 6.764 519 HA ILE 64 HA ILE 64 -4.768 -11.232 5.567 520 HB ILE 64 HB ILE 64 -4.737 -8.458 6.846 521 HG12 ILE 64 HG12 ILE 64 -5.032 -9.161 3.888 522 HG13 ILE 64 HG13 ILE 64 -6.324 -8.567 4.924 523 HG21 ILE 64 HG21 ILE 64 -2.492 -9.429 6.702 524 HG22 ILE 64 HG22 ILE 64 -2.660 -8.083 5.575 525 HG23 ILE 64 HG23 ILE 64 -2.716 -9.744 4.978 526 HD11 ILE 64 HD11 ILE 64 -5.134 -6.441 5.199 527 HD12 ILE 64 HD12 ILE 64 -5.446 -6.804 3.503 528 HD13 ILE 64 HD13 ILE 64 -3.830 -7.033 4.165 529 H PHE 65 H PHE 65 -3.407 -12.492 6.734 530 HA PHE 65 HA PHE 65 -2.927 -11.974 9.630 531 HB2 PHE 65 HB2 PHE 65 -4.183 -14.086 9.217 532 HB3 PHE 65 HB3 PHE 65 -2.924 -14.637 8.124 533 HD1 PHE 65 HD2 PHE 65 -3.792 -14.034 11.674 534 HD2 PHE 65 HD1 PHE 65 -0.845 -15.608 9.002 535 HE1 PHE 65 HE2 PHE 65 -2.672 -15.149 13.554 536 HE2 PHE 65 HE1 PHE 65 0.264 -16.721 10.892 537 HZ PHE 65 HZ PHE 65 -0.645 -16.493 13.168 538 H VAL 66 H VAL 66 -0.928 -10.950 9.708 539 HA VAL 66 HA VAL 66 0.986 -11.382 7.516 540 HB VAL 66 HB VAL 66 1.079 -9.250 9.687 541 HG11 VAL 66 HG11 VAL 66 2.565 -8.033 8.115 542 HG12 VAL 66 HG12 VAL 66 2.494 -9.397 6.998 543 HG13 VAL 66 HG13 VAL 66 3.248 -9.595 8.581 544 HG21 VAL 66 HG21 VAL 66 -1.029 -9.032 8.436 545 HG22 VAL 66 HG22 VAL 66 -0.141 -9.029 6.911 546 HG23 VAL 66 HG23 VAL 66 0.063 -7.697 8.051 547 H LYS 67 H LYS 67 2.897 -12.400 7.752 548 HA LYS 67 HA LYS 67 4.028 -12.869 10.477 549 HB2 LYS 67 HB2 LYS 67 4.318 -14.713 8.064 550 HB3 LYS 67 HB3 LYS 67 4.883 -15.026 9.704 551 HG2 LYS 67 HG2 LYS 67 2.534 -15.168 10.476 552 HG3 LYS 67 HG3 LYS 67 1.976 -14.844 8.831 553 HD2 LYS 67 HD2 LYS 67 3.564 -17.273 9.763 554 HD3 LYS 67 HD3 LYS 67 1.857 -17.246 9.318 555 HE2 LYS 67 HE2 LYS 67 4.195 -16.717 7.444 556 HE3 LYS 67 HE3 LYS 67 3.227 -18.189 7.504 557 HZ1 LYS 67 HZ1 LYS 67 2.517 -16.777 5.704 558 HZ2 LYS 67 HZ2 LYS 67 2.240 -15.485 6.762 559 HZ3 LYS 67 HZ3 LYS 67 1.289 -16.880 6.860 560 H LEU 68 H LEU 68 6.333 -12.617 10.619 561 HA LEU 68 HA LEU 68 7.590 -11.092 8.473 562 HB2 LEU 68 HB2 LEU 68 8.743 -12.023 11.127 563 HB3 LEU 68 HB3 LEU 68 9.545 -10.943 9.992 564 HG LEU 68 HG LEU 68 7.107 -10.361 11.711 565 HD11 LEU 68 HD11 LEU 68 9.819 -9.012 11.534 566 HD12 LEU 68 HD12 LEU 68 9.272 -10.104 12.812 567 HD13 LEU 68 HD13 LEU 68 8.484 -8.544 12.594 568 HD21 LEU 68 HD21 LEU 68 6.994 -8.128 10.661 569 HD22 LEU 68 HD22 LEU 68 6.606 -9.417 9.527 570 HD23 LEU 68 HD23 LEU 68 8.187 -8.633 9.459 571 H VAL 69 H VAL 69 9.130 -11.814 7.062 572 HA VAL 69 HA VAL 69 9.892 -14.530 6.740 573 HB VAL 69 HB VAL 69 11.206 -11.960 5.731 574 HG11 VAL 69 HG11 VAL 69 12.897 -13.746 5.714 575 HG12 VAL 69 HG12 VAL 69 12.408 -13.353 4.066 576 HG13 VAL 69 HG13 VAL 69 11.791 -14.813 4.842 577 HG21 VAL 69 HG21 VAL 69 10.092 -12.486 3.581 578 HG22 VAL 69 HG22 VAL 69 8.912 -12.299 4.880 579 HG23 VAL 69 HG23 VAL 69 9.346 -13.912 4.308 580 H LEU 70 H LEU 70 11.307 -15.712 7.928 581 HA LEU 70 HA LEU 70 12.523 -14.597 10.257 582 HB2 LEU 70 HB2 LEU 70 12.819 -17.389 9.091 583 HB3 LEU 70 HB3 LEU 70 13.336 -16.898 10.699 584 HG LEU 70 HG LEU 70 10.464 -17.055 9.688 585 HD11 LEU 70 HD11 LEU 70 11.889 -18.684 11.815 586 HD12 LEU 70 HD12 LEU 70 11.441 -19.239 10.200 587 HD13 LEU 70 HD13 LEU 70 10.187 -18.819 11.362 588 HD21 LEU 70 HD21 LEU 70 9.765 -16.419 11.972 589 HD22 LEU 70 HD22 LEU 70 10.655 -15.127 11.172 590 HD23 LEU 70 HD23 LEU 70 11.451 -16.110 12.404 591 H GLU 71 H GLU 71 14.018 -13.068 9.533 592 HA GLU 71 HA GLU 71 16.394 -13.722 8.042 593 HB2 GLU 71 HB2 GLU 71 15.799 -11.357 9.871 594 HB3 GLU 71 HB3 GLU 71 17.145 -11.460 8.738 595 HG2 GLU 71 HG2 GLU 71 15.578 -11.468 6.849 596 HG3 GLU 71 HG3 GLU 71 14.207 -11.445 7.962 597 H HIS 72 H HIS 72 15.706 -12.995 11.478 598 HA HIS 72 HA HIS 72 17.876 -14.797 12.367 599 HB2 HIS 72 HB2 HIS 72 17.369 -12.043 13.592 600 HB3 HIS 72 HB3 HIS 72 18.627 -13.183 14.061 601 HD1 HIS 72 HD1 HIS 72 20.431 -13.683 12.030 602 HD2 HIS 72 HD2 HIS 72 18.180 -10.198 11.751 603 HE1 HIS 72 HE1 HIS 72 21.636 -12.235 10.373 604 HE2 HIS 72 HE2 HIS 72 20.143 -10.240 10.067 605 H HIS 73 H HIS 73 17.622 -14.860 15.006 606 HA HIS 73 HA HIS 73 14.771 -15.456 15.593 607 HB2 HIS 73 HB2 HIS 73 15.609 -17.523 16.838 608 HB3 HIS 73 HB3 HIS 73 15.725 -17.588 15.084 609 HD1 HIS 73 HD1 HIS 73 17.851 -17.404 18.172 610 HD2 HIS 73 HD2 HIS 73 18.349 -17.738 14.062 611 HE1 HIS 73 HE1 HIS 73 20.245 -18.048 17.840 612 HE2 HIS 73 HE2 HIS 73 20.564 -18.106 15.351 613 H HIS 74 H HIS 74 14.269 -15.662 17.913 614 HA HIS 74 HA HIS 74 15.971 -14.021 19.710 615 HB2 HIS 74 HB2 HIS 74 12.940 -13.787 19.406 616 HB3 HIS 74 HB3 HIS 74 13.900 -12.943 20.614 617 HD1 HIS 74 HD1 HIS 74 15.070 -10.793 19.892 618 HD2 HIS 74 HD2 HIS 74 13.166 -12.745 16.757 619 HE1 HIS 74 HE1 HIS 74 15.038 -9.152 18.000 620 HE2 HIS 74 HE2 HIS 74 14.114 -10.442 16.058 621 H HIS 75 H HIS 75 16.011 -14.691 21.864 622 HA HIS 75 HA HIS 75 14.626 -17.134 22.690 623 HB2 HIS 75 HB2 HIS 75 16.497 -15.259 24.205 624 HB3 HIS 75 HB3 HIS 75 15.826 -16.744 24.878 625 HD1 HIS 75 HD1 HIS 75 18.615 -15.494 22.861 626 HD2 HIS 75 HD2 HIS 75 16.745 -19.144 23.509 627 HE1 HIS 75 HE1 HIS 75 20.219 -17.220 22.017 628 HE2 HIS 75 HE2 HIS 75 19.145 -19.422 22.588 629 H HIS 76 H HIS 76 14.022 -13.773 22.759 630 HA HIS 76 HA HIS 76 11.645 -14.113 24.509 631 HB2 HIS 76 HB2 HIS 76 13.428 -11.646 24.183 632 HB3 HIS 76 HB3 HIS 76 11.924 -11.681 25.096 633 HD1 HIS 76 HD1 HIS 76 11.999 -12.667 27.463 634 HD2 HIS 76 HD2 HIS 76 15.617 -13.012 25.445 635 HE1 HIS 76 HE1 HIS 76 13.672 -13.364 29.194 636 HE2 HIS 76 HE2 HIS 76 15.873 -13.434 27.989 637 H HIS 77 H HIS 77 10.586 -11.473 23.784 638 HA HIS 77 HA HIS 77 9.400 -12.074 21.202 639 HB2 HIS 77 HB2 HIS 77 8.183 -11.055 23.215 640 HB3 HIS 77 HB3 HIS 77 9.025 -9.551 22.881 641 HD1 HIS 77 HD1 HIS 77 8.277 -8.238 20.730 642 HD2 HIS 77 HD2 HIS 77 6.042 -11.643 21.518 643 HE1 HIS 77 HE1 HIS 77 6.242 -8.046 19.285 644 HE2 HIS 77 HE2 HIS 77 4.995 -10.194 19.663 645 H1 MET 1 H MET 1 2.339 -15.679 -7.199 646 HA MET 1 HA MET 1 0.682 -16.589 -8.499 647 HB2 MET 1 HB2 MET 1 0.720 -18.927 -6.544 648 HB3 MET 1 HB3 MET 1 -0.179 -18.886 -8.057 649 HG2 MET 1 HG2 MET 1 1.945 -18.726 -9.302 650 HG3 MET 1 HG3 MET 1 2.835 -18.798 -7.777 651 HE1 MET 1 HE1 MET 1 4.250 -20.915 -8.795 652 HE2 MET 1 HE2 MET 1 3.308 -20.799 -10.283 653 HE3 MET 1 HE3 MET 1 3.463 -22.349 -9.455 654 H LYS 2 H LYS 2 0.267 -16.777 -4.987 655 HA LYS 2 HA LYS 2 -2.370 -15.456 -5.165 656 HB2 LYS 2 HB2 LYS 2 -3.283 -17.018 -3.393 657 HB3 LYS 2 HB3 LYS 2 -3.007 -17.774 -4.955 658 HG2 LYS 2 HG2 LYS 2 -0.966 -18.842 -4.125 659 HG3 LYS 2 HG3 LYS 2 -1.127 -18.008 -2.580 660 HD2 LYS 2 HD2 LYS 2 -1.894 -20.293 -2.308 661 HD3 LYS 2 HD3 LYS 2 -3.289 -19.216 -2.192 662 HE2 LYS 2 HE2 LYS 2 -3.823 -21.209 -3.532 663 HE3 LYS 2 HE3 LYS 2 -3.892 -19.757 -4.534 664 HZ1 LYS 2 HZ1 LYS 2 -1.563 -21.598 -4.400 665 HZ2 LYS 2 HZ2 LYS 2 -1.757 -20.289 -5.455 666 HZ3 LYS 2 HZ3 LYS 2 -2.750 -21.646 -5.597 667 H MET 3 H MET 3 -1.459 -13.521 -4.414 668 HA MET 3 HA MET 3 -0.870 -13.249 -1.607 669 HB2 MET 3 HB2 MET 3 1.262 -14.212 -2.357 670 HB3 MET 3 HB3 MET 3 1.415 -12.992 -3.613 671 HG2 MET 3 HG2 MET 3 2.879 -12.621 -1.635 672 HG3 MET 3 HG3 MET 3 1.801 -11.273 -1.995 673 HE1 MET 3 HE1 MET 3 2.098 -11.174 1.935 674 HE2 MET 3 HE2 MET 3 2.316 -10.258 0.444 675 HE3 MET 3 HE3 MET 3 3.371 -11.627 0.800 676 H LEU 4 H LEU 4 -0.810 -11.121 -0.897 677 HA LEU 4 HA LEU 4 -2.086 -9.042 -2.279 678 HB2 LEU 4 HB2 LEU 4 -0.254 -9.036 0.134 679 HB3 LEU 4 HB3 LEU 4 -0.899 -7.535 -0.499 680 HG LEU 4 HG LEU 4 -3.213 -8.331 -0.060 681 HD11 LEU 4 HD11 LEU 4 -3.665 -10.313 1.301 682 HD12 LEU 4 HD12 LEU 4 -1.959 -10.762 1.245 683 HD13 LEU 4 HD13 LEU 4 -2.918 -10.752 -0.236 684 HD21 LEU 4 HD21 LEU 4 -2.057 -6.962 1.613 685 HD22 LEU 4 HD22 LEU 4 -1.416 -8.414 2.385 686 HD23 LEU 4 HD23 LEU 4 -3.154 -8.108 2.383 687 H LYS 5 H LYS 5 1.419 -9.575 -1.820 688 HA LYS 5 HA LYS 5 2.533 -7.554 -3.378 689 HB2 LYS 5 HB2 LYS 5 3.890 -9.048 -2.004 690 HB3 LYS 5 HB3 LYS 5 3.400 -10.436 -2.969 691 HG2 LYS 5 HG2 LYS 5 4.623 -9.480 -4.920 692 HG3 LYS 5 HG3 LYS 5 5.185 -8.158 -3.895 693 HD2 LYS 5 HD2 LYS 5 5.749 -11.102 -3.348 694 HD3 LYS 5 HD3 LYS 5 6.851 -10.037 -4.221 695 HE2 LYS 5 HE2 LYS 5 5.928 -9.593 -1.357 696 HE3 LYS 5 HE3 LYS 5 7.466 -10.321 -1.824 697 HZ1 LYS 5 HZ1 LYS 5 6.602 -7.577 -2.549 698 HZ2 LYS 5 HZ2 LYS 5 8.092 -8.286 -2.911 699 HZ3 LYS 5 HZ3 LYS 5 7.681 -7.967 -1.308 700 H GLU 6 H GLU 6 1.299 -10.737 -4.420 701 HA GLU 6 HA GLU 6 2.237 -10.808 -7.052 702 HB2 GLU 6 HB2 GLU 6 1.412 -12.812 -5.951 703 HB3 GLU 6 HB3 GLU 6 -0.184 -12.111 -5.759 704 HG2 GLU 6 HG2 GLU 6 -0.235 -13.790 -7.496 705 HG3 GLU 6 HG3 GLU 6 -0.533 -12.201 -8.195 706 H LYS 7 H LYS 7 -1.081 -9.970 -5.956 707 HA LYS 7 HA LYS 7 -1.982 -8.981 -8.458 708 HB2 LYS 7 HB2 LYS 7 -3.924 -8.063 -7.170 709 HB3 LYS 7 HB3 LYS 7 -3.593 -9.754 -6.847 710 HG2 LYS 7 HG2 LYS 7 -3.977 -9.068 -4.689 711 HG3 LYS 7 HG3 LYS 7 -2.247 -8.759 -4.764 712 HD2 LYS 7 HD2 LYS 7 -3.049 -6.800 -3.780 713 HD3 LYS 7 HD3 LYS 7 -2.950 -6.327 -5.473 714 HE2 LYS 7 HE2 LYS 7 -5.477 -7.186 -4.011 715 HE3 LYS 7 HE3 LYS 7 -5.034 -5.529 -4.411 716 HZ1 LYS 7 HZ1 LYS 7 -5.677 -7.697 -6.329 717 HZ2 LYS 7 HZ2 LYS 7 -5.148 -6.155 -6.770 718 HZ3 LYS 7 HZ3 LYS 7 -6.623 -6.342 -5.972 719 H ALA 8 H ALA 8 -0.332 -7.378 -5.774 720 HA ALA 8 HA ALA 8 -0.765 -4.658 -6.449 721 HB1 ALA 8 HB1 ALA 8 1.157 -4.168 -4.991 722 HB2 ALA 8 HB2 ALA 8 1.628 -5.872 -5.014 723 HB3 ALA 8 HB3 ALA 8 0.110 -5.384 -4.259 724 H GLY 9 H GLY 9 1.771 -6.930 -7.475 725 HA2 GLY 9 HA2 GLY 9 3.400 -5.116 -8.929 726 HA3 GLY 9 HA3 GLY 9 3.368 -6.863 -9.119 727 H ALA 10 H ALA 10 0.747 -7.254 -9.963 728 HA ALA 10 HA ALA 10 0.724 -6.596 -12.716 729 HB1 ALA 10 HB1 ALA 10 -0.437 -8.562 -11.789 730 HB2 ALA 10 HB2 ALA 10 -1.537 -7.564 -12.742 731 HB3 ALA 10 HB3 ALA 10 -1.590 -7.506 -10.978 732 H LEU 11 H LEU 11 -0.759 -5.039 -9.918 733 HA LEU 11 HA LEU 11 -2.309 -3.081 -11.349 734 HB2 LEU 11 HB2 LEU 11 -1.383 -3.265 -8.461 735 HB3 LEU 11 HB3 LEU 11 -2.450 -1.995 -9.048 736 HG LEU 11 HG LEU 11 -3.141 -4.949 -9.239 737 HD11 LEU 11 HD11 LEU 11 -4.593 -4.654 -7.292 738 HD12 LEU 11 HD12 LEU 11 -3.969 -3.018 -7.065 739 HD13 LEU 11 HD13 LEU 11 -2.894 -4.406 -6.887 740 HD21 LEU 11 HD21 LEU 11 -4.854 -2.462 -9.531 741 HD22 LEU 11 HD22 LEU 11 -5.433 -4.128 -9.599 742 HD23 LEU 11 HD23 LEU 11 -4.328 -3.533 -10.834 743 H ALA 12 H ALA 12 0.966 -3.245 -10.101 744 HA ALA 12 HA ALA 12 1.702 -0.587 -9.877 745 HB1 ALA 12 HB1 ALA 12 3.092 -2.482 -9.133 746 HB2 ALA 12 HB2 ALA 12 4.025 -1.359 -10.122 747 HB3 ALA 12 HB3 ALA 12 3.464 -2.885 -10.813 748 H GLY 13 H GLY 13 2.197 -2.616 -12.764 749 HA2 GLY 13 HA2 GLY 13 3.125 -0.657 -14.552 750 HA3 GLY 13 HA3 GLY 13 2.326 -2.151 -15.017 751 H GLN 14 H GLN 14 -0.196 -1.437 -13.637 752 HA GLN 14 HA GLN 14 -1.482 -0.097 -15.831 753 HB2 GLN 14 HB2 GLN 14 -2.661 -1.007 -13.172 754 HB3 GLN 14 HB3 GLN 14 -3.586 -0.516 -14.591 755 HG2 GLN 14 HG2 GLN 14 -2.560 -2.427 -15.855 756 HG3 GLN 14 HG3 GLN 14 -1.773 -2.943 -14.364 757 HE21 GLN 14 HE21 GLN 14 -3.067 -3.825 -12.702 758 HE22 GLN 14 HE22 GLN 14 -4.667 -4.391 -12.998 759 H ILE 15 H ILE 15 -1.087 0.772 -12.351 760 HA ILE 15 HA ILE 15 -2.269 3.354 -12.483 761 HB ILE 15 HB ILE 15 -0.357 2.099 -10.468 762 HG12 ILE 15 HG12 ILE 15 -2.315 2.416 -8.881 763 HG13 ILE 15 HG13 ILE 15 -3.260 3.036 -10.225 764 HG21 ILE 15 HG21 ILE 15 -1.396 4.952 -10.304 765 HG22 ILE 15 HG22 ILE 15 0.289 4.459 -10.490 766 HG23 ILE 15 HG23 ILE 15 -0.574 4.093 -8.996 767 HD11 ILE 15 HD11 ILE 15 -3.851 0.768 -9.704 768 HD12 ILE 15 HD12 ILE 15 -2.185 0.239 -9.934 769 HD13 ILE 15 HD13 ILE 15 -3.121 0.842 -11.307 770 H TRP 16 H TRP 16 1.066 2.252 -12.942 771 HA TRP 16 HA TRP 16 2.404 4.672 -13.405 772 HB2 TRP 16 HB2 TRP 16 3.416 2.313 -13.220 773 HB3 TRP 16 HB3 TRP 16 2.938 2.061 -14.900 774 HD1 TRP 16 HD1 TRP 16 5.526 3.888 -12.751 775 HE1 TRP 16 HE1 TRP 16 7.359 4.850 -14.271 776 HE3 TRP 16 HE3 TRP 16 3.396 2.964 -17.323 777 HZ2 TRP 16 HZ2 TRP 16 7.853 5.185 -17.019 778 HZ3 TRP 16 HZ3 TRP 16 4.614 3.651 -19.347 779 HH2 TRP 16 HH2 TRP 16 6.791 4.742 -19.199 780 H GLU 17 H GLU 17 0.705 2.533 -15.675 781 HA GLU 17 HA GLU 17 1.155 3.904 -18.083 782 HB2 GLU 17 HB2 GLU 17 0.366 1.558 -17.948 783 HB3 GLU 17 HB3 GLU 17 -1.171 2.103 -17.288 784 HG2 GLU 17 HG2 GLU 17 -1.618 3.308 -19.425 785 HG3 GLU 17 HG3 GLU 17 -0.110 2.659 -20.068 786 H ALA 18 H ALA 18 -1.463 4.229 -15.691 787 HA ALA 18 HA ALA 18 -3.148 6.012 -17.107 788 HB1 ALA 18 HB1 ALA 18 -2.817 5.682 -14.107 789 HB2 ALA 18 HB2 ALA 18 -3.891 4.738 -15.140 790 HB3 ALA 18 HB3 ALA 18 -4.182 6.464 -14.918 791 H LEU 19 H LEU 19 -0.322 6.560 -15.069 792 HA LEU 19 HA LEU 19 -0.520 9.471 -15.127 793 HB2 LEU 19 HB2 LEU 19 1.584 7.575 -14.026 794 HB3 LEU 19 HB3 LEU 19 1.646 9.325 -13.845 795 HG LEU 19 HG LEU 19 -0.586 7.566 -12.743 796 HD11 LEU 19 HD11 LEU 19 1.524 7.075 -11.606 797 HD12 LEU 19 HD12 LEU 19 0.408 7.915 -10.538 798 HD13 LEU 19 HD13 LEU 19 1.761 8.791 -11.260 799 HD21 LEU 19 HD21 LEU 19 -1.332 9.850 -13.222 800 HD22 LEU 19 HD22 LEU 19 0.015 10.513 -12.294 801 HD23 LEU 19 HD23 LEU 19 -1.246 9.583 -11.481 802 H ASN 20 H ASN 20 0.977 7.006 -17.074 803 HA ASN 20 HA ASN 20 3.156 8.510 -18.128 804 HB2 ASN 20 HB2 ASN 20 3.067 6.041 -18.242 805 HB3 ASN 20 HB3 ASN 20 1.695 6.121 -19.339 806 HD21 ASN 20 HD21 ASN 20 2.598 5.246 -21.158 807 HD22 ASN 20 HD22 ASN 20 3.981 5.890 -21.965 808 H GLY 21 H GLY 21 3.094 10.190 -19.476 809 HA2 GLY 21 HA2 GLY 21 2.512 11.482 -21.325 810 HA3 GLY 21 HA3 GLY 21 1.104 10.478 -21.598 811 H THR 22 H THR 22 1.199 11.478 -18.352 812 HA THR 22 HA THR 22 -0.508 13.866 -18.865 813 HB THR 22 HB THR 22 -1.723 13.426 -16.775 814 HG1 THR 22 HG1 THR 22 -1.292 11.223 -15.811 815 HG21 THR 22 HG21 THR 22 -1.646 10.917 -18.490 816 HG22 THR 22 HG22 THR 22 -2.629 12.351 -18.796 817 HG23 THR 22 HG23 THR 22 -2.937 11.363 -17.368 818 H GLU 23 H GLU 23 -0.472 15.509 -17.115 819 HA GLU 23 HA GLU 23 2.192 16.018 -16.040 820 HB2 GLU 23 HB2 GLU 23 -0.362 17.661 -15.682 821 HB3 GLU 23 HB3 GLU 23 1.268 18.171 -15.271 822 HG2 GLU 23 HG2 GLU 23 0.750 19.290 -17.278 823 HG3 GLU 23 HG3 GLU 23 1.843 17.987 -17.738 824 H GLY 24 H GLY 24 -0.492 14.300 -15.022 825 HA2 GLY 24 HA2 GLY 24 0.005 13.222 -12.740 826 HA3 GLY 24 HA3 GLY 24 -0.198 14.863 -12.137 827 H LEU 25 H LEU 25 -1.773 12.366 -11.650 828 HA LEU 25 HA LEU 25 -4.463 13.480 -12.201 829 HB2 LEU 25 HB2 LEU 25 -3.631 10.565 -12.508 830 HB3 LEU 25 HB3 LEU 25 -5.308 11.083 -12.430 831 HG LEU 25 HG LEU 25 -3.329 11.846 -14.619 832 HD11 LEU 25 HD11 LEU 25 -3.949 9.487 -14.743 833 HD12 LEU 25 HD12 LEU 25 -4.663 10.389 -16.076 834 HD13 LEU 25 HD13 LEU 25 -5.665 9.908 -14.701 835 HD21 LEU 25 HD21 LEU 25 -6.297 12.468 -14.380 836 HD22 LEU 25 HD22 LEU 25 -5.281 12.800 -15.789 837 HD23 LEU 25 HD23 LEU 25 -4.966 13.627 -14.267 838 H THR 26 H THR 26 -6.108 12.807 -10.671 839 HA THR 26 HA THR 26 -5.162 12.380 -7.941 840 HB THR 26 HB THR 26 -7.475 12.733 -7.235 841 HG1 THR 26 HG1 THR 26 -9.166 12.693 -8.593 842 HG21 THR 26 HG21 THR 26 -6.202 14.783 -7.780 843 HG22 THR 26 HG22 THR 26 -7.925 14.985 -8.109 844 HG23 THR 26 HG23 THR 26 -6.801 14.711 -9.441 845 H GLN 27 H GLN 27 -6.181 10.716 -6.543 846 HA GLN 27 HA GLN 27 -5.816 8.112 -7.431 847 HB2 GLN 27 HB2 GLN 27 -6.986 7.410 -5.312 848 HB3 GLN 27 HB3 GLN 27 -5.682 8.566 -5.098 849 HG2 GLN 27 HG2 GLN 27 -7.300 10.381 -4.801 850 HG3 GLN 27 HG3 GLN 27 -8.635 9.262 -5.069 851 HE21 GLN 27 HE21 GLN 27 -7.542 7.078 -3.507 852 HE22 GLN 27 HE22 GLN 27 -7.611 7.567 -1.856 853 H LYS 28 H LYS 28 -8.845 9.921 -7.220 854 HA LYS 28 HA LYS 28 -10.688 7.963 -8.009 855 HB2 LYS 28 HB2 LYS 28 -11.417 10.114 -7.138 856 HB3 LYS 28 HB3 LYS 28 -10.650 10.969 -8.473 857 HG2 LYS 28 HG2 LYS 28 -12.270 9.943 -10.047 858 HG3 LYS 28 HG3 LYS 28 -13.061 9.132 -8.689 859 HD2 LYS 28 HD2 LYS 28 -13.715 11.271 -7.731 860 HD3 LYS 28 HD3 LYS 28 -12.771 12.149 -8.941 861 HE2 LYS 28 HE2 LYS 28 -15.191 10.411 -9.523 862 HE3 LYS 28 HE3 LYS 28 -15.184 12.173 -9.458 863 HZ1 LYS 28 HZ1 LYS 28 -13.624 12.193 -11.313 864 HZ2 LYS 28 HZ2 LYS 28 -15.050 11.383 -11.724 865 HZ3 LYS 28 HZ3 LYS 28 -13.650 10.502 -11.377 866 H GLN 29 H GLN 29 -8.870 10.270 -10.085 867 HA GLN 29 HA GLN 29 -10.156 9.488 -12.523 868 HB2 GLN 29 HB2 GLN 29 -7.619 11.109 -12.120 869 HB3 GLN 29 HB3 GLN 29 -8.508 10.981 -13.636 870 HG2 GLN 29 HG2 GLN 29 -9.592 12.199 -11.074 871 HG3 GLN 29 HG3 GLN 29 -8.904 13.106 -12.415 872 HE21 GLN 29 HE21 GLN 29 -10.783 14.278 -12.760 873 HE22 GLN 29 HE22 GLN 29 -12.213 13.590 -13.434 874 H ILE 30 H ILE 30 -7.134 8.549 -10.989 875 HA ILE 30 HA ILE 30 -5.950 7.141 -13.139 876 HB ILE 30 HB ILE 30 -5.641 6.774 -10.129 877 HG12 ILE 30 HG12 ILE 30 -3.864 8.232 -12.133 878 HG13 ILE 30 HG13 ILE 30 -5.027 9.018 -11.076 879 HG21 ILE 30 HG21 ILE 30 -4.886 4.710 -11.234 880 HG22 ILE 30 HG22 ILE 30 -3.510 5.603 -10.590 881 HG23 ILE 30 HG23 ILE 30 -3.854 5.647 -12.320 882 HD11 ILE 30 HD11 ILE 30 -2.785 9.255 -10.241 883 HD12 ILE 30 HD12 ILE 30 -2.575 7.505 -10.197 884 HD13 ILE 30 HD13 ILE 30 -3.748 8.284 -9.129 885 H LYS 31 H LYS 31 -8.204 6.059 -10.566 886 HA LYS 31 HA LYS 31 -8.242 3.303 -11.170 887 HB2 LYS 31 HB2 LYS 31 -10.433 5.037 -9.978 888 HB3 LYS 31 HB3 LYS 31 -10.504 3.277 -10.047 889 HG2 LYS 31 HG2 LYS 31 -8.455 3.161 -8.639 890 HG3 LYS 31 HG3 LYS 31 -8.454 4.922 -8.522 891 HD2 LYS 31 HD2 LYS 31 -10.625 3.045 -7.507 892 HD3 LYS 31 HD3 LYS 31 -9.455 3.911 -6.512 893 HE2 LYS 31 HE2 LYS 31 -10.444 6.049 -7.169 894 HE3 LYS 31 HE3 LYS 31 -11.559 5.233 -8.262 895 HZ1 LYS 31 HZ1 LYS 31 -11.493 4.988 -5.311 896 HZ2 LYS 31 HZ2 LYS 31 -12.526 4.117 -6.328 897 HZ3 LYS 31 HZ3 LYS 31 -12.655 5.801 -6.229 898 H LYS 32 H LYS 32 -9.967 5.970 -12.720 899 HA LYS 32 HA LYS 32 -11.800 4.446 -14.279 900 HB2 LYS 32 HB2 LYS 32 -11.778 7.000 -13.788 901 HB3 LYS 32 HB3 LYS 32 -10.600 7.134 -15.078 902 HG2 LYS 32 HG2 LYS 32 -13.429 6.068 -15.417 903 HG3 LYS 32 HG3 LYS 32 -12.935 7.727 -15.752 904 HD2 LYS 32 HD2 LYS 32 -11.344 6.830 -17.494 905 HD3 LYS 32 HD3 LYS 32 -12.004 5.218 -17.208 906 HE2 LYS 32 HE2 LYS 32 -13.065 6.151 -19.172 907 HE3 LYS 32 HE3 LYS 32 -14.263 6.094 -17.878 908 HZ1 LYS 32 HZ1 LYS 32 -14.350 8.188 -19.058 909 HZ2 LYS 32 HZ2 LYS 32 -12.723 8.496 -18.715 910 HZ3 LYS 32 HZ3 LYS 32 -13.857 8.448 -17.463 911 H ALA 33 H ALA 33 -8.563 5.796 -15.008 912 HA ALA 33 HA ALA 33 -8.393 4.805 -17.685 913 HB1 ALA 33 HB1 ALA 33 -7.198 6.820 -16.934 914 HB2 ALA 33 HB2 ALA 33 -6.085 5.644 -17.633 915 HB3 ALA 33 HB3 ALA 33 -6.184 5.834 -15.879 916 H THR 34 H THR 34 -7.409 3.461 -14.584 917 HA THR 34 HA THR 34 -5.760 1.329 -15.675 918 HB THR 34 HB THR 34 -5.622 0.510 -13.321 919 HG1 THR 34 HG1 THR 34 -6.835 2.712 -12.212 920 HG21 THR 34 HG21 THR 34 -4.026 2.236 -14.076 921 HG22 THR 34 HG22 THR 34 -4.414 2.425 -12.367 922 HG23 THR 34 HG23 THR 34 -5.144 3.499 -13.561 923 H LYS 35 H LYS 35 -9.111 1.763 -15.061 924 HA LYS 35 HA LYS 35 -10.965 0.478 -15.246 925 HB2 LYS 35 HB2 LYS 35 -9.395 -0.783 -17.035 926 HB3 LYS 35 HB3 LYS 35 -9.465 -2.075 -15.858 927 HG2 LYS 35 HG2 LYS 35 -11.884 -0.828 -17.219 928 HG3 LYS 35 HG3 LYS 35 -11.083 -2.310 -17.738 929 HD2 LYS 35 HD2 LYS 35 -11.639 -3.294 -15.459 930 HD3 LYS 35 HD3 LYS 35 -12.610 -1.854 -15.145 931 HE2 LYS 35 HE2 LYS 35 -14.061 -3.648 -15.905 932 HE3 LYS 35 HE3 LYS 35 -13.996 -2.405 -17.158 933 HZ1 LYS 35 HZ1 LYS 35 -12.485 -4.968 -17.142 934 HZ2 LYS 35 HZ2 LYS 35 -12.334 -3.766 -18.316 935 HZ3 LYS 35 HZ3 LYS 35 -13.798 -4.587 -18.135 936 H LEU 36 H LEU 36 -9.539 0.934 -12.845 937 HA LEU 36 HA LEU 36 -10.451 -1.286 -11.107 938 HB2 LEU 36 HB2 LEU 36 -8.818 1.220 -10.488 939 HB3 LEU 36 HB3 LEU 36 -9.364 0.083 -9.264 940 HG LEU 36 HG LEU 36 -7.436 -0.568 -11.524 941 HD11 LEU 36 HD11 LEU 36 -5.716 -0.711 -9.780 942 HD12 LEU 36 HD12 LEU 36 -6.880 -0.174 -8.565 943 HD13 LEU 36 HD13 LEU 36 -6.408 0.907 -9.879 944 HD21 LEU 36 HD21 LEU 36 -8.779 -2.523 -10.913 945 HD22 LEU 36 HD22 LEU 36 -8.360 -2.314 -9.211 946 HD23 LEU 36 HD23 LEU 36 -7.111 -2.728 -10.388 947 H LYS 37 H LYS 37 -11.393 -0.251 -8.918 948 HA LYS 37 HA LYS 37 -13.141 2.069 -9.317 949 HB2 LYS 37 HB2 LYS 37 -15.166 0.864 -8.596 950 HB3 LYS 37 HB3 LYS 37 -14.515 0.211 -10.093 951 HG2 LYS 37 HG2 LYS 37 -13.511 -1.681 -8.825 952 HG3 LYS 37 HG3 LYS 37 -14.209 -1.038 -7.336 953 HD2 LYS 37 HD2 LYS 37 -15.622 -2.832 -8.158 954 HD3 LYS 37 HD3 LYS 37 -16.486 -1.302 -8.336 955 HE2 LYS 37 HE2 LYS 37 -15.990 -1.251 -10.725 956 HE3 LYS 37 HE3 LYS 37 -14.969 -2.684 -10.582 957 HZ1 LYS 37 HZ1 LYS 37 -17.128 -3.236 -11.460 958 HZ2 LYS 37 HZ2 LYS 37 -17.894 -2.584 -10.099 959 HZ3 LYS 37 HZ3 LYS 37 -16.917 -3.955 -9.945 960 H ALA 38 H ALA 38 -11.599 -0.260 -7.230 961 HA ALA 38 HA ALA 38 -12.317 1.195 -4.773 962 HB1 ALA 38 HB1 ALA 38 -10.903 -1.485 -5.091 963 HB2 ALA 38 HB2 ALA 38 -12.610 -1.250 -4.712 964 HB3 ALA 38 HB3 ALA 38 -11.376 -0.739 -3.559 965 H ASP 39 H ASP 39 -10.912 2.520 -3.791 966 HA ASP 39 HA ASP 39 -8.358 3.235 -4.739 967 HB2 ASP 39 HB2 ASP 39 -9.531 3.637 -1.961 968 HB3 ASP 39 HB3 ASP 39 -8.134 4.494 -2.615 969 H LYS 40 H LYS 40 -9.348 0.694 -2.610 970 HA LYS 40 HA LYS 40 -7.132 -0.095 -1.184 971 HB2 LYS 40 HB2 LYS 40 -9.316 -1.647 -2.616 972 HB3 LYS 40 HB3 LYS 40 -8.100 -2.491 -1.670 973 HG2 LYS 40 HG2 LYS 40 -9.869 -0.305 -0.538 974 HG3 LYS 40 HG3 LYS 40 -10.281 -2.028 -0.481 975 HD2 LYS 40 HD2 LYS 40 -7.882 -0.665 0.802 976 HD3 LYS 40 HD3 LYS 40 -9.269 -1.375 1.633 977 HE2 LYS 40 HE2 LYS 40 -7.172 -2.881 0.022 978 HE3 LYS 40 HE3 LYS 40 -7.326 -2.864 1.778 979 HZ1 LYS 40 HZ1 LYS 40 -8.262 -4.867 0.859 980 HZ2 LYS 40 HZ2 LYS 40 -9.303 -3.981 -0.136 981 HZ3 LYS 40 HZ3 LYS 40 -9.492 -3.928 1.539 982 H ASP 41 H ASP 41 -7.925 -1.161 -4.505 983 HA ASP 41 HA ASP 41 -5.512 -2.633 -4.961 984 HB2 ASP 41 HB2 ASP 41 -7.517 -1.509 -6.963 985 HB3 ASP 41 HB3 ASP 41 -6.320 -2.761 -7.299 986 H PHE 42 H PHE 42 -6.546 0.664 -5.591 987 HA PHE 42 HA PHE 42 -4.403 1.571 -7.173 988 HB2 PHE 42 HB2 PHE 42 -6.404 2.908 -7.025 989 HB3 PHE 42 HB3 PHE 42 -6.274 3.031 -5.273 990 HD1 PHE 42 HD2 PHE 42 -4.514 3.989 -8.429 991 HD2 PHE 42 HD1 PHE 42 -5.152 4.891 -4.296 992 HE1 PHE 42 HE2 PHE 42 -3.214 6.049 -8.669 993 HE2 PHE 42 HE1 PHE 42 -3.834 6.950 -4.551 994 HZ PHE 42 HZ PHE 42 -2.865 7.531 -6.741 995 H PHE 43 H PHE 43 -4.727 1.411 -3.589 996 HA PHE 43 HA PHE 43 -2.384 2.908 -2.957 997 HB2 PHE 43 HB2 PHE 43 -3.820 0.807 -1.271 998 HB3 PHE 43 HB3 PHE 43 -2.590 1.910 -0.662 999 HD1 PHE 43 HD1 PHE 43 -3.575 4.409 -2.212 1000 HD2 PHE 43 HD2 PHE 43 -5.615 1.497 0.178 1001 HE1 PHE 43 HE1 PHE 43 -5.307 6.058 -1.682 1002 HE2 PHE 43 HE2 PHE 43 -7.356 3.155 0.700 1003 HZ PHE 43 HZ PHE 43 -7.204 5.442 -0.225 1004 H LEU 44 H LEU 44 -2.906 -0.587 -3.387 1005 HA LEU 44 HA LEU 44 -0.203 -1.345 -2.751 1006 HB2 LEU 44 HB2 LEU 44 -2.572 -2.815 -3.926 1007 HB3 LEU 44 HB3 LEU 44 -0.988 -3.565 -3.917 1008 HG LEU 44 HG LEU 44 -0.938 -3.265 -1.394 1009 HD11 LEU 44 HD11 LEU 44 -2.601 -1.498 -1.137 1010 HD12 LEU 44 HD12 LEU 44 -3.020 -2.910 -0.171 1011 HD13 LEU 44 HD13 LEU 44 -3.877 -2.592 -1.682 1012 HD21 LEU 44 HD21 LEU 44 -2.337 -5.211 -0.912 1013 HD22 LEU 44 HD22 LEU 44 -1.441 -5.439 -2.412 1014 HD23 LEU 44 HD23 LEU 44 -3.158 -5.031 -2.466 1015 H GLY 45 H GLY 45 -1.873 -0.444 -5.737 1016 HA2 GLY 45 HA2 GLY 45 0.219 -1.165 -7.573 1017 HA3 GLY 45 HA3 GLY 45 -1.096 -0.040 -7.880 1018 H LEU 46 H LEU 46 -0.852 2.089 -6.591 1019 HA LEU 46 HA LEU 46 1.258 3.653 -7.444 1020 HB2 LEU 46 HB2 LEU 46 -0.890 4.561 -6.657 1021 HB3 LEU 46 HB3 LEU 46 -0.545 4.027 -5.020 1022 HG LEU 46 HG LEU 46 1.450 5.628 -5.028 1023 HD11 LEU 46 HD11 LEU 46 1.458 7.460 -6.652 1024 HD12 LEU 46 HD12 LEU 46 0.144 6.690 -7.545 1025 HD13 LEU 46 HD13 LEU 46 1.719 5.898 -7.430 1026 HD21 LEU 46 HD21 LEU 46 -1.291 6.900 -5.301 1027 HD22 LEU 46 HD22 LEU 46 0.111 7.600 -4.493 1028 HD23 LEU 46 HD23 LEU 46 -0.646 6.149 -3.840 1029 H GLY 47 H GLY 47 0.924 2.003 -4.317 1030 HA2 GLY 47 HA2 GLY 47 3.100 3.210 -2.943 1031 HA3 GLY 47 HA3 GLY 47 2.303 1.705 -2.501 1032 H TRP 48 H TRP 48 2.859 0.380 -5.003 1033 HA TRP 48 HA TRP 48 5.445 -0.708 -4.552 1034 HB2 TRP 48 HB2 TRP 48 3.379 -1.848 -5.632 1035 HB3 TRP 48 HB3 TRP 48 3.819 -1.007 -7.118 1036 HD1 TRP 48 HD1 TRP 48 5.983 -1.909 -8.428 1037 HE1 TRP 48 HE1 TRP 48 7.382 -4.045 -8.193 1038 HE3 TRP 48 HE3 TRP 48 4.228 -3.540 -3.912 1039 HZ2 TRP 48 HZ2 TRP 48 7.725 -6.120 -6.344 1040 HZ3 TRP 48 HZ3 TRP 48 5.143 -5.626 -2.972 1041 HH2 TRP 48 HH2 TRP 48 6.854 -6.896 -4.174 1042 H LEU 49 H LEU 49 4.190 1.747 -6.744 1043 HA LEU 49 HA LEU 49 6.490 2.054 -8.416 1044 HB2 LEU 49 HB2 LEU 49 4.055 3.753 -7.867 1045 HB3 LEU 49 HB3 LEU 49 5.361 4.406 -8.834 1046 HG LEU 49 HG LEU 49 4.990 2.867 -10.615 1047 HD11 LEU 49 HD11 LEU 49 3.458 0.966 -10.508 1048 HD12 LEU 49 HD12 LEU 49 3.187 1.284 -8.791 1049 HD13 LEU 49 HD13 LEU 49 4.788 0.811 -9.363 1050 HD21 LEU 49 HD21 LEU 49 2.604 3.143 -11.186 1051 HD22 LEU 49 HD22 LEU 49 3.300 4.631 -10.557 1052 HD23 LEU 49 HD23 LEU 49 2.264 3.643 -9.526 1053 H LEU 50 H LEU 50 5.614 3.389 -5.297 1054 HA LEU 50 HA LEU 50 7.559 5.445 -5.085 1055 HB2 LEU 50 HB2 LEU 50 6.144 3.801 -2.958 1056 HB3 LEU 50 HB3 LEU 50 7.197 5.156 -2.574 1057 HG LEU 50 HG LEU 50 4.632 5.353 -4.211 1058 HD11 LEU 50 HD11 LEU 50 5.130 6.192 -1.335 1059 HD12 LEU 50 HD12 LEU 50 4.133 4.838 -1.875 1060 HD13 LEU 50 HD13 LEU 50 3.658 6.487 -2.269 1061 HD21 LEU 50 HD21 LEU 50 6.488 7.538 -3.202 1062 HD22 LEU 50 HD22 LEU 50 4.938 7.791 -4.007 1063 HD23 LEU 50 HD23 LEU 50 6.266 7.042 -4.882 1064 H ARG 51 H ARG 51 7.747 1.921 -4.432 1065 HA ARG 51 HA ARG 51 10.269 1.951 -3.104 1066 HB2 ARG 51 HB2 ARG 51 10.212 -0.358 -3.083 1067 HB3 ARG 51 HB3 ARG 51 8.510 -0.007 -3.302 1068 HG2 ARG 51 HG2 ARG 51 8.626 -0.628 -5.653 1069 HG3 ARG 51 HG3 ARG 51 10.377 -0.764 -5.579 1070 HD2 ARG 51 HD2 ARG 51 10.074 -2.624 -3.900 1071 HD3 ARG 51 HD3 ARG 51 8.340 -2.549 -4.225 1072 HE ARG 51 HE ARG 51 8.986 -3.027 -6.623 1073 HH11 ARG 51 HH11 ARG 51 10.932 -4.193 -3.987 1074 HH12 ARG 51 HH12 ARG 51 11.533 -5.523 -4.902 1075 HH21 ARG 51 HH21 ARG 51 9.769 -4.765 -7.741 1076 HH22 ARG 51 HH22 ARG 51 10.888 -5.844 -6.989 1077 H GLU 52 H GLU 52 9.403 1.823 -6.493 1078 HA GLU 52 HA GLU 52 12.176 1.587 -7.409 1079 HB2 GLU 52 HB2 GLU 52 9.543 1.738 -8.934 1080 HB3 GLU 52 HB3 GLU 52 11.120 1.498 -9.679 1081 HG2 GLU 52 HG2 GLU 52 11.375 -0.660 -8.608 1082 HG3 GLU 52 HG3 GLU 52 9.917 -0.412 -7.650 1083 H ASP 53 H ASP 53 10.069 4.087 -6.505 1084 HA ASP 53 HA ASP 53 10.065 6.327 -6.617 1085 HB2 ASP 53 HB2 ASP 53 12.938 5.822 -7.460 1086 HB3 ASP 53 HB3 ASP 53 12.305 7.458 -7.287 1087 H LYS 54 H LYS 54 9.051 4.849 -8.851 1088 HA LYS 54 HA LYS 54 9.622 6.291 -11.295 1089 HB2 LYS 54 HB2 LYS 54 7.438 4.273 -10.620 1090 HB3 LYS 54 HB3 LYS 54 7.781 4.887 -12.239 1091 HG2 LYS 54 HG2 LYS 54 10.039 3.877 -12.143 1092 HG3 LYS 54 HG3 LYS 54 9.696 3.262 -10.525 1093 HD2 LYS 54 HD2 LYS 54 8.275 2.463 -13.099 1094 HD3 LYS 54 HD3 LYS 54 9.447 1.489 -12.209 1095 HE2 LYS 54 HE2 LYS 54 7.828 1.552 -10.242 1096 HE3 LYS 54 HE3 LYS 54 6.649 2.270 -11.342 1097 HZ1 LYS 54 HZ1 LYS 54 6.313 -0.079 -11.205 1098 HZ2 LYS 54 HZ2 LYS 54 7.925 -0.401 -11.590 1099 HZ3 LYS 54 HZ3 LYS 54 6.895 0.277 -12.755 1100 H VAL 55 H VAL 55 7.594 6.803 -8.559 1101 HA VAL 55 HA VAL 55 6.170 8.998 -9.919 1102 HB VAL 55 HB VAL 55 4.070 8.576 -8.715 1103 HG11 VAL 55 HG11 VAL 55 4.258 7.629 -10.961 1104 HG12 VAL 55 HG12 VAL 55 3.266 6.591 -9.936 1105 HG13 VAL 55 HG13 VAL 55 4.932 6.137 -10.299 1106 HG21 VAL 55 HG21 VAL 55 3.677 6.451 -7.466 1107 HG22 VAL 55 HG22 VAL 55 4.909 7.458 -6.705 1108 HG23 VAL 55 HG23 VAL 55 5.386 6.047 -7.649 1109 H VAL 56 H VAL 56 5.287 10.565 -8.431 1110 HA VAL 56 HA VAL 56 6.386 10.607 -5.729 1111 HB VAL 56 HB VAL 56 7.915 12.031 -6.950 1112 HG11 VAL 56 HG11 VAL 56 7.216 14.020 -8.229 1113 HG12 VAL 56 HG12 VAL 56 5.524 13.593 -7.967 1114 HG13 VAL 56 HG13 VAL 56 6.561 12.532 -8.923 1115 HG21 VAL 56 HG21 VAL 56 7.322 12.801 -4.685 1116 HG22 VAL 56 HG22 VAL 56 6.005 13.772 -5.344 1117 HG23 VAL 56 HG23 VAL 56 7.678 14.173 -5.740 1118 H THR 57 H THR 57 5.049 11.413 -4.180 1119 HA THR 57 HA THR 57 2.211 11.554 -4.988 1120 HB THR 57 HB THR 57 1.736 10.711 -2.667 1121 HG1 THR 57 HG1 THR 57 3.875 11.484 -1.859 1122 HG21 THR 57 HG21 THR 57 3.612 8.932 -4.267 1123 HG22 THR 57 HG22 THR 57 1.867 9.066 -4.493 1124 HG23 THR 57 HG23 THR 57 2.513 8.387 -2.999 1125 H SER 58 H SER 58 0.861 13.100 -4.137 1126 HA SER 58 HA SER 58 1.811 15.044 -2.153 1127 HB2 SER 58 HB2 SER 58 2.462 15.995 -4.369 1128 HB3 SER 58 HB3 SER 58 0.791 15.878 -4.906 1129 HG SER 58 HG SER 58 1.979 17.673 -3.116 1130 H GLU 59 H GLU 59 0.018 16.567 -1.551 1131 HA GLU 59 HA GLU 59 -2.602 15.163 -1.460 1132 HB2 GLU 59 HB2 GLU 59 -1.398 15.269 0.717 1133 HB3 GLU 59 HB3 GLU 59 -1.332 17.023 0.605 1134 HG2 GLU 59 HG2 GLU 59 -3.830 17.083 0.696 1135 HG3 GLU 59 HG3 GLU 59 -3.835 15.329 0.883 1136 H VAL 60 H VAL 60 -3.898 16.152 -2.927 1137 HA VAL 60 HA VAL 60 -3.986 19.127 -3.058 1138 HB VAL 60 HB VAL 60 -4.154 17.124 -5.347 1139 HG11 VAL 60 HG11 VAL 60 -4.808 20.088 -5.515 1140 HG12 VAL 60 HG12 VAL 60 -5.950 18.762 -5.736 1141 HG13 VAL 60 HG13 VAL 60 -4.639 18.994 -6.892 1142 HG21 VAL 60 HG21 VAL 60 -2.331 19.503 -4.874 1143 HG22 VAL 60 HG22 VAL 60 -2.276 18.434 -6.279 1144 HG23 VAL 60 HG23 VAL 60 -1.883 17.805 -4.676 1145 H GLU 61 H GLU 61 -5.818 19.943 -2.442 1146 HA GLU 61 HA GLU 61 -7.973 20.335 -1.907 1147 HB2 GLU 61 HB2 GLU 61 -8.398 18.946 -4.581 1148 HB3 GLU 61 HB3 GLU 61 -9.536 20.053 -3.808 1149 HG2 GLU 61 HG2 GLU 61 -7.849 21.870 -3.958 1150 HG3 GLU 61 HG3 GLU 61 -6.727 20.760 -4.716 1151 H GLY 62 H GLY 62 -7.034 17.973 -0.662 1152 HA2 GLY 62 HA2 GLY 62 -8.168 16.814 1.039 1153 HA3 GLY 62 HA3 GLY 62 -9.643 16.860 0.098 1154 H GLU 63 H GLU 63 -7.367 15.768 -2.072 1155 HA GLU 63 HA GLU 63 -7.358 12.984 -1.116 1156 HB2 GLU 63 HB2 GLU 63 -8.208 12.042 -3.187 1157 HB3 GLU 63 HB3 GLU 63 -9.386 13.146 -2.494 1158 HG2 GLU 63 HG2 GLU 63 -8.754 14.859 -4.166 1159 HG3 GLU 63 HG3 GLU 63 -7.582 13.735 -4.863 1160 H ILE 64 H ILE 64 -6.140 11.553 -2.873 1161 HA ILE 64 HA ILE 64 -3.433 12.575 -2.771 1162 HB ILE 64 HB ILE 64 -4.456 9.886 -3.795 1163 HG12 ILE 64 HG12 ILE 64 -3.421 10.603 -1.013 1164 HG13 ILE 64 HG13 ILE 64 -5.108 10.313 -1.418 1165 HG21 ILE 64 HG21 ILE 64 -2.153 9.072 -3.389 1166 HG22 ILE 64 HG22 ILE 64 -1.658 10.706 -2.947 1167 HG23 ILE 64 HG23 ILE 64 -2.187 10.363 -4.595 1168 HD11 ILE 64 HD11 ILE 64 -4.128 8.392 -0.315 1169 HD12 ILE 64 HD12 ILE 64 -2.876 8.276 -1.551 1170 HD13 ILE 64 HD13 ILE 64 -4.567 7.983 -1.973 1171 H PHE 65 H PHE 65 -2.428 13.597 -4.408 1172 HA PHE 65 HA PHE 65 -3.197 13.124 -7.243 1173 HB2 PHE 65 HB2 PHE 65 -3.844 15.396 -6.398 1174 HB3 PHE 65 HB3 PHE 65 -2.165 15.717 -6.001 1175 HD1 PHE 65 HD1 PHE 65 -0.487 16.047 -7.865 1176 HD2 PHE 65 HD2 PHE 65 -4.665 15.624 -8.665 1177 HE1 PHE 65 HE1 PHE 65 -0.162 17.016 -10.100 1178 HE2 PHE 65 HE2 PHE 65 -4.328 16.583 -10.898 1179 HZ PHE 65 HZ PHE 65 -2.080 17.283 -11.619 1180 H VAL 66 H VAL 66 -1.579 12.222 -8.380 1181 HA VAL 66 HA VAL 66 1.233 12.386 -7.441 1182 HB VAL 66 HB VAL 66 1.508 9.951 -7.806 1183 HG11 VAL 66 HG11 VAL 66 0.238 9.127 -5.866 1184 HG12 VAL 66 HG12 VAL 66 -0.820 10.537 -5.941 1185 HG13 VAL 66 HG13 VAL 66 0.885 10.736 -5.547 1186 HG21 VAL 66 HG21 VAL 66 -0.206 9.600 -9.535 1187 HG22 VAL 66 HG22 VAL 66 -1.482 9.910 -8.360 1188 HG23 VAL 66 HG23 VAL 66 -0.456 8.483 -8.192 1189 H LYS 67 H LYS 67 2.849 11.723 -9.067 1190 HA LYS 67 HA LYS 67 2.027 11.411 -11.850 1191 HB2 LYS 67 HB2 LYS 67 3.153 13.359 -12.783 1192 HB3 LYS 67 HB3 LYS 67 1.960 13.904 -11.621 1193 HG2 LYS 67 HG2 LYS 67 4.924 13.692 -10.994 1194 HG3 LYS 67 HG3 LYS 67 4.167 15.156 -11.617 1195 HD2 LYS 67 HD2 LYS 67 3.447 13.783 -8.994 1196 HD3 LYS 67 HD3 LYS 67 4.482 15.202 -9.148 1197 HE2 LYS 67 HE2 LYS 67 2.572 16.481 -10.080 1198 HE3 LYS 67 HE3 LYS 67 1.537 15.061 -9.896 1199 HZ1 LYS 67 HZ1 LYS 67 1.322 16.672 -8.081 1200 HZ2 LYS 67 HZ2 LYS 67 2.942 16.429 -7.671 1201 HZ3 LYS 67 HZ3 LYS 67 1.836 15.158 -7.533 1202 H LEU 68 H LEU 68 3.921 11.055 -13.310 1203 HA LEU 68 HA LEU 68 5.830 9.291 -12.131 1204 HB2 LEU 68 HB2 LEU 68 5.803 10.496 -14.927 1205 HB3 LEU 68 HB3 LEU 68 6.837 9.173 -14.409 1206 HG LEU 68 HG LEU 68 3.814 9.109 -14.756 1207 HD11 LEU 68 HD11 LEU 68 4.270 7.404 -16.453 1208 HD12 LEU 68 HD12 LEU 68 6.008 7.577 -16.191 1209 HD13 LEU 68 HD13 LEU 68 5.071 8.924 -16.845 1210 HD21 LEU 68 HD21 LEU 68 3.894 6.734 -14.098 1211 HD22 LEU 68 HD22 LEU 68 4.340 7.802 -12.772 1212 HD23 LEU 68 HD23 LEU 68 5.592 6.914 -13.644 1213 H VAL 69 H VAL 69 7.887 9.652 -11.441 1214 HA VAL 69 HA VAL 69 9.088 12.273 -11.424 1215 HB VAL 69 HB VAL 69 10.341 9.580 -10.686 1216 HG11 VAL 69 HG11 VAL 69 11.378 12.388 -10.095 1217 HG12 VAL 69 HG12 VAL 69 12.109 11.225 -11.202 1218 HG13 VAL 69 HG13 VAL 69 12.072 10.887 -9.470 1219 HG21 VAL 69 HG21 VAL 69 9.158 11.713 -8.879 1220 HG22 VAL 69 HG22 VAL 69 9.926 10.213 -8.349 1221 HG23 VAL 69 HG23 VAL 69 8.419 10.159 -9.262 1222 H LEU 70 H LEU 70 9.076 12.726 -13.734 1223 HA LEU 70 HA LEU 70 10.577 11.253 -15.654 1224 HB2 LEU 70 HB2 LEU 70 9.825 14.205 -15.613 1225 HB3 LEU 70 HB3 LEU 70 10.433 13.348 -17.023 1226 HG LEU 70 HG LEU 70 7.792 12.776 -15.605 1227 HD11 LEU 70 HD11 LEU 70 6.709 13.667 -17.618 1228 HD12 LEU 70 HD12 LEU 70 8.285 14.101 -18.288 1229 HD13 LEU 70 HD13 LEU 70 7.701 14.884 -16.818 1230 HD21 LEU 70 HD21 LEU 70 7.312 11.242 -17.481 1231 HD22 LEU 70 HD22 LEU 70 8.706 10.719 -16.542 1232 HD23 LEU 70 HD23 LEU 70 8.944 11.497 -18.110 1233 H GLU 71 H GLU 71 11.547 13.325 -13.111 1234 HA GLU 71 HA GLU 71 14.046 14.305 -13.850 1235 HB2 GLU 71 HB2 GLU 71 12.793 14.951 -11.832 1236 HB3 GLU 71 HB3 GLU 71 13.034 13.355 -11.143 1237 HG2 GLU 71 HG2 GLU 71 15.441 13.777 -10.956 1238 HG3 GLU 71 HG3 GLU 71 15.236 15.353 -11.721 1239 H HIS 72 H HIS 72 13.189 10.960 -13.038 1240 HA HIS 72 HA HIS 72 15.783 9.970 -12.471 1241 HB2 HIS 72 HB2 HIS 72 14.913 7.706 -13.058 1242 HB3 HIS 72 HB3 HIS 72 13.897 8.578 -11.928 1243 HD1 HIS 72 HD1 HIS 72 11.703 7.448 -12.397 1244 HD2 HIS 72 HD2 HIS 72 13.511 8.803 -15.884 1245 HE1 HIS 72 HE1 HIS 72 9.989 7.148 -14.202 1246 HE2 HIS 72 HE2 HIS 72 11.207 7.716 -16.322 1247 H HIS 73 H HIS 73 14.433 10.949 -15.484 1248 HA HIS 73 HA HIS 73 17.052 10.374 -16.761 1249 HB2 HIS 73 HB2 HIS 73 14.294 10.497 -18.068 1250 HB3 HIS 73 HB3 HIS 73 15.798 10.565 -18.980 1251 HD1 HIS 73 HD1 HIS 73 13.339 8.230 -18.391 1252 HD2 HIS 73 HD2 HIS 73 17.467 8.091 -17.959 1253 HE1 HIS 73 HE1 HIS 73 13.938 5.797 -18.466 1254 HE2 HIS 73 HE2 HIS 73 16.448 5.766 -18.439 1255 H HIS 74 H HIS 74 17.357 12.402 -15.345 1256 HA HIS 74 HA HIS 74 16.424 14.939 -16.191 1257 HB2 HIS 74 HB2 HIS 74 17.491 14.602 -13.993 1258 HB3 HIS 74 HB3 HIS 74 19.022 14.200 -14.758 1259 HD1 HIS 74 HD1 HIS 74 20.439 16.144 -15.669 1260 HD2 HIS 74 HD2 HIS 74 16.892 17.363 -13.886 1261 HE1 HIS 74 HE1 HIS 74 20.648 18.627 -15.403 1262 HE2 HIS 74 HE2 HIS 74 18.544 19.325 -14.210 1263 H HIS 75 H HIS 75 16.551 15.343 -18.349 1264 HA HIS 75 HA HIS 75 18.868 14.653 -19.978 1265 HB2 HIS 75 HB2 HIS 75 16.582 14.240 -20.809 1266 HB3 HIS 75 HB3 HIS 75 16.194 15.951 -20.682 1267 HD1 HIS 75 HD1 HIS 75 16.165 16.991 -22.925 1268 HD2 HIS 75 HD2 HIS 75 19.027 13.988 -22.683 1269 HE1 HIS 75 HE1 HIS 75 17.228 16.902 -25.190 1270 HE2 HIS 75 HE2 HIS 75 18.808 14.951 -25.072 1271 H HIS 76 H HIS 76 20.566 16.017 -19.737 1272 HA HIS 76 HA HIS 76 20.202 18.938 -19.629 1273 HB2 HIS 76 HB2 HIS 76 21.717 17.893 -17.973 1274 HB3 HIS 76 HB3 HIS 76 22.700 17.221 -19.264 1275 HD1 HIS 76 HD1 HIS 76 24.600 18.633 -20.050 1276 HD2 HIS 76 HD2 HIS 76 21.842 20.825 -17.852 1277 HE1 HIS 76 HE1 HIS 76 25.649 20.878 -19.720 1278 HE2 HIS 76 HE2 HIS 76 24.056 22.117 -18.224 1279 H HIS 77 H HIS 77 20.578 20.220 -21.370 1280 HA HIS 77 HA HIS 77 21.092 19.137 -23.982 1281 HB2 HIS 77 HB2 HIS 77 19.516 21.001 -23.624 1282 HB3 HIS 77 HB3 HIS 77 20.811 22.012 -22.994 1283 HD1 HIS 77 HD1 HIS 77 19.902 20.251 -26.266 1284 HD2 HIS 77 HD2 HIS 77 21.922 23.622 -24.923 1285 HE1 HIS 77 HE1 HIS 77 20.561 21.504 -28.335 1286 HE2 HIS 77 HE2 HIS 77 21.902 23.456 -27.503 Start of MODEL 17 1 H1 MET 1 H1 MET 1 15.226 12.195 6.785 2 H2 MET 1 H2 MET 1 15.568 10.980 5.666 3 H3 MET 1 H3 MET 1 14.193 10.871 6.642 4 HA MET 1 HA MET 1 14.686 12.928 4.564 5 HB2 MET 1 HB2 MET 1 12.725 10.591 4.578 6 HB3 MET 1 HB3 MET 1 12.794 11.843 3.347 7 HG2 MET 1 HG2 MET 1 15.126 11.103 2.812 8 HG3 MET 1 HG3 MET 1 14.907 9.764 3.937 9 HE1 MET 1 HE1 MET 1 12.466 10.294 0.038 10 HE2 MET 1 HE2 MET 1 13.795 11.356 0.500 11 HE3 MET 1 HE3 MET 1 12.289 11.370 1.422 12 H LYS 2 H LYS 2 12.547 14.087 4.019 13 HA LYS 2 HA LYS 2 10.912 14.580 6.465 14 HB2 LYS 2 HB2 LYS 2 10.543 16.864 5.638 15 HB3 LYS 2 HB3 LYS 2 12.266 16.543 5.805 16 HG2 LYS 2 HG2 LYS 2 12.520 16.295 3.404 17 HG3 LYS 2 HG3 LYS 2 10.770 16.394 3.163 18 HD2 LYS 2 HD2 LYS 2 10.810 18.733 4.030 19 HD3 LYS 2 HD3 LYS 2 12.569 18.630 4.193 20 HE2 LYS 2 HE2 LYS 2 12.787 18.324 1.761 21 HE3 LYS 2 HE3 LYS 2 11.029 18.342 1.582 22 HZ1 LYS 2 HZ1 LYS 2 11.882 20.467 1.022 23 HZ2 LYS 2 HZ2 LYS 2 12.763 20.581 2.457 24 HZ3 LYS 2 HZ3 LYS 2 11.073 20.628 2.501 25 H MET 3 H MET 3 10.845 13.452 3.234 26 HA MET 3 HA MET 3 8.205 14.265 2.451 27 HB2 MET 3 HB2 MET 3 10.017 12.103 1.298 28 HB3 MET 3 HB3 MET 3 8.560 12.721 0.528 29 HG2 MET 3 HG2 MET 3 9.581 14.928 0.288 30 HG3 MET 3 HG3 MET 3 11.012 14.387 1.162 31 HE1 MET 3 HE1 MET 3 8.907 14.020 -2.157 32 HE2 MET 3 HE2 MET 3 8.953 12.359 -1.564 33 HE3 MET 3 HE3 MET 3 9.836 12.799 -3.026 34 H LEU 4 H LEU 4 6.587 12.527 1.657 35 HA LEU 4 HA LEU 4 5.510 11.184 3.891 36 HB2 LEU 4 HB2 LEU 4 4.795 10.947 0.950 37 HB3 LEU 4 HB3 LEU 4 3.905 10.115 2.211 38 HG LEU 4 HG LEU 4 3.462 12.438 3.245 39 HD11 LEU 4 HD11 LEU 4 3.544 14.387 1.779 40 HD12 LEU 4 HD12 LEU 4 4.323 13.430 0.516 41 HD13 LEU 4 HD13 LEU 4 5.160 13.728 2.042 42 HD21 LEU 4 HD21 LEU 4 1.714 11.154 2.107 43 HD22 LEU 4 HD22 LEU 4 2.214 11.821 0.549 44 HD23 LEU 4 HD23 LEU 4 1.537 12.880 1.790 45 H LYS 5 H LYS 5 7.908 10.039 1.694 46 HA LYS 5 HA LYS 5 7.776 7.240 2.031 47 HB2 LYS 5 HB2 LYS 5 10.200 9.073 1.798 48 HB3 LYS 5 HB3 LYS 5 10.284 7.317 1.692 49 HG2 LYS 5 HG2 LYS 5 8.742 9.093 -0.216 50 HG3 LYS 5 HG3 LYS 5 10.368 8.463 -0.504 51 HD2 LYS 5 HD2 LYS 5 9.279 6.109 -0.153 52 HD3 LYS 5 HD3 LYS 5 7.739 6.946 -0.374 53 HE2 LYS 5 HE2 LYS 5 8.451 5.984 -2.487 54 HE3 LYS 5 HE3 LYS 5 8.559 7.740 -2.604 55 HZ1 LYS 5 HZ1 LYS 5 10.944 7.550 -2.154 56 HZ2 LYS 5 HZ2 LYS 5 10.491 6.742 -3.562 57 HZ3 LYS 5 HZ3 LYS 5 10.806 5.867 -2.145 58 H GLU 6 H GLU 6 9.197 9.763 4.063 59 HA GLU 6 HA GLU 6 10.363 8.119 6.073 60 HB2 GLU 6 HB2 GLU 6 11.064 10.455 5.632 61 HB3 GLU 6 HB3 GLU 6 9.495 11.043 6.156 62 HG2 GLU 6 HG2 GLU 6 11.141 11.425 7.890 63 HG3 GLU 6 HG3 GLU 6 9.954 10.244 8.447 64 H LYS 7 H LYS 7 7.200 9.704 5.767 65 HA LYS 7 HA LYS 7 6.166 9.138 8.359 66 HB2 LYS 7 HB2 LYS 7 5.353 10.824 6.503 67 HB3 LYS 7 HB3 LYS 7 4.426 9.471 5.880 68 HG2 LYS 7 HG2 LYS 7 4.155 10.553 8.710 69 HG3 LYS 7 HG3 LYS 7 3.170 11.104 7.356 70 HD2 LYS 7 HD2 LYS 7 2.288 8.776 7.090 71 HD3 LYS 7 HD3 LYS 7 3.243 8.271 8.488 72 HE2 LYS 7 HE2 LYS 7 1.977 9.871 9.906 73 HE3 LYS 7 HE3 LYS 7 1.007 10.336 8.506 74 HZ1 LYS 7 HZ1 LYS 7 1.127 7.636 9.734 75 HZ2 LYS 7 HZ2 LYS 7 0.216 8.044 8.369 76 HZ3 LYS 7 HZ3 LYS 7 -0.148 8.736 9.867 77 H ALA 8 H ALA 8 5.660 7.537 5.208 78 HA ALA 8 HA ALA 8 4.215 5.269 6.056 79 HB1 ALA 8 HB1 ALA 8 4.832 4.277 3.891 80 HB2 ALA 8 HB2 ALA 8 6.086 5.504 3.670 81 HB3 ALA 8 HB3 ALA 8 4.385 5.975 3.695 82 H GLY 9 H GLY 9 7.714 5.850 5.882 83 HA2 GLY 9 HA2 GLY 9 8.635 3.257 6.579 84 HA3 GLY 9 HA3 GLY 9 9.522 4.757 6.767 85 H ALA 10 H ALA 10 7.633 5.999 8.615 86 HA ALA 10 HA ALA 10 8.444 4.888 11.135 87 HB1 ALA 10 HB1 ALA 10 8.061 7.301 10.833 88 HB2 ALA 10 HB2 ALA 10 7.037 6.662 12.122 89 HB3 ALA 10 HB3 ALA 10 6.348 7.003 10.531 90 H LEU 11 H LEU 11 5.412 4.904 9.298 91 HA LEU 11 HA LEU 11 3.780 3.376 11.038 92 HB2 LEU 11 HB2 LEU 11 3.725 3.633 8.009 93 HB3 LEU 11 HB3 LEU 11 2.430 2.922 8.966 94 HG LEU 11 HG LEU 11 3.335 5.822 9.235 95 HD11 LEU 11 HD11 LEU 11 1.334 6.443 7.963 96 HD12 LEU 11 HD12 LEU 11 0.974 4.739 7.672 97 HD13 LEU 11 HD13 LEU 11 2.435 5.464 6.994 98 HD21 LEU 11 HD21 LEU 11 0.855 4.419 10.299 99 HD22 LEU 11 HD22 LEU 11 1.235 6.136 10.472 100 HD23 LEU 11 HD23 LEU 11 2.251 4.929 11.256 101 H ALA 12 H ALA 12 6.078 2.467 8.515 102 HA ALA 12 HA ALA 12 5.620 -0.310 8.398 103 HB1 ALA 12 HB1 ALA 12 8.224 1.174 7.920 104 HB2 ALA 12 HB2 ALA 12 6.938 0.943 6.737 105 HB3 ALA 12 HB3 ALA 12 7.822 -0.454 7.352 106 H GLY 13 H GLY 13 7.912 1.567 10.374 107 HA2 GLY 13 HA2 GLY 13 9.353 -0.520 11.559 108 HA3 GLY 13 HA3 GLY 13 9.160 1.089 12.228 109 H GLN 14 H GLN 14 6.508 1.199 12.854 110 HA GLN 14 HA GLN 14 6.375 -0.206 15.323 111 HB2 GLN 14 HB2 GLN 14 4.153 0.864 15.579 112 HB3 GLN 14 HB3 GLN 14 5.387 2.009 15.058 113 HG2 GLN 14 HG2 GLN 14 4.547 1.747 12.704 114 HG3 GLN 14 HG3 GLN 14 3.238 0.747 13.335 115 HE21 GLN 14 HE21 GLN 14 4.529 3.978 13.123 116 HE22 GLN 14 HE22 GLN 14 3.107 4.786 13.669 117 H ILE 15 H ILE 15 4.823 -0.808 12.169 118 HA ILE 15 HA ILE 15 3.067 -2.905 13.061 119 HB ILE 15 HB ILE 15 3.983 -2.094 10.263 120 HG12 ILE 15 HG12 ILE 15 1.344 -1.655 11.746 121 HG13 ILE 15 HG13 ILE 15 2.563 -0.425 11.438 122 HG21 ILE 15 HG21 ILE 15 2.173 -3.522 9.342 123 HG22 ILE 15 HG22 ILE 15 1.842 -4.145 10.958 124 HG23 ILE 15 HG23 ILE 15 3.391 -4.483 10.185 125 HD11 ILE 15 HD11 ILE 15 2.123 -0.625 9.022 126 HD12 ILE 15 HD12 ILE 15 0.685 -0.177 9.939 127 HD13 ILE 15 HD13 ILE 15 0.877 -1.831 9.362 128 H TRP 16 H TRP 16 6.280 -2.866 11.515 129 HA TRP 16 HA TRP 16 6.628 -5.665 11.210 130 HB2 TRP 16 HB2 TRP 16 8.001 -3.847 10.069 131 HB3 TRP 16 HB3 TRP 16 8.833 -3.580 11.595 132 HD1 TRP 16 HD1 TRP 16 8.612 -6.080 8.687 133 HE1 TRP 16 HE1 TRP 16 10.597 -7.707 8.818 134 HE3 TRP 16 HE3 TRP 16 10.536 -4.687 13.238 135 HZ2 TRP 16 HZ2 TRP 16 12.696 -8.331 10.592 136 HZ3 TRP 16 HZ3 TRP 16 12.540 -5.855 14.077 137 HH2 TRP 16 HH2 TRP 16 13.598 -7.642 12.778 138 H GLU 17 H GLU 17 7.735 -3.419 13.785 139 HA GLU 17 HA GLU 17 8.872 -5.415 15.474 140 HB2 GLU 17 HB2 GLU 17 8.058 -2.546 16.071 141 HB3 GLU 17 HB3 GLU 17 8.892 -3.584 17.228 142 HG2 GLU 17 HG2 GLU 17 10.780 -3.806 15.621 143 HG3 GLU 17 HG3 GLU 17 9.956 -2.697 14.525 144 H ALA 18 H ALA 18 5.563 -4.247 15.167 145 HA ALA 18 HA ALA 18 4.499 -5.329 17.568 146 HB1 ALA 18 HB1 ALA 18 3.128 -5.060 14.864 147 HB2 ALA 18 HB2 ALA 18 3.215 -3.809 16.105 148 HB3 ALA 18 HB3 ALA 18 2.318 -5.295 16.418 149 H LEU 19 H LEU 19 5.328 -6.858 14.469 150 HA LEU 19 HA LEU 19 4.274 -9.479 15.350 151 HB2 LEU 19 HB2 LEU 19 5.044 -8.437 12.611 152 HB3 LEU 19 HB3 LEU 19 4.789 -10.146 12.907 153 HG LEU 19 HG LEU 19 2.426 -9.602 13.632 154 HD11 LEU 19 HD11 LEU 19 2.703 -7.233 14.174 155 HD12 LEU 19 HD12 LEU 19 1.424 -7.488 12.993 156 HD13 LEU 19 HD13 LEU 19 2.993 -6.870 12.470 157 HD21 LEU 19 HD21 LEU 19 2.871 -10.512 11.414 158 HD22 LEU 19 HD22 LEU 19 3.171 -8.889 10.781 159 HD23 LEU 19 HD23 LEU 19 1.557 -9.335 11.345 160 H ASN 20 H ASN 20 7.367 -7.945 15.252 161 HA ASN 20 HA ASN 20 8.929 -10.132 14.351 162 HB2 ASN 20 HB2 ASN 20 10.895 -8.970 15.078 163 HB3 ASN 20 HB3 ASN 20 9.771 -7.776 14.458 164 HD21 ASN 20 HD21 ASN 20 12.027 -7.284 16.143 165 HD22 ASN 20 HD22 ASN 20 11.430 -6.588 17.605 166 H GLY 21 H GLY 21 9.674 -11.956 15.274 167 HA2 GLY 21 HA2 GLY 21 10.119 -13.552 16.896 168 HA3 GLY 21 HA3 GLY 21 9.607 -12.435 18.147 169 H THR 22 H THR 22 7.400 -12.944 15.492 170 HA THR 22 HA THR 22 5.853 -15.036 16.956 171 HB THR 22 HB THR 22 3.733 -13.986 16.538 172 HG1 THR 22 HG1 THR 22 4.453 -11.640 15.376 173 HG21 THR 22 HG21 THR 22 5.581 -11.741 17.443 174 HG22 THR 22 HG22 THR 22 4.870 -12.974 18.488 175 HG23 THR 22 HG23 THR 22 3.830 -11.798 17.680 176 H GLU 23 H GLU 23 4.071 -15.903 15.474 177 HA GLU 23 HA GLU 23 5.229 -16.789 12.961 178 HB2 GLU 23 HB2 GLU 23 3.455 -18.423 12.884 179 HB3 GLU 23 HB3 GLU 23 4.089 -18.384 14.522 180 HG2 GLU 23 HG2 GLU 23 1.510 -17.052 13.616 181 HG3 GLU 23 HG3 GLU 23 1.625 -18.621 14.393 182 H GLY 24 H GLY 24 3.151 -14.218 13.858 183 HA2 GLY 24 HA2 GLY 24 2.678 -12.686 11.939 184 HA3 GLY 24 HA3 GLY 24 1.945 -14.062 11.133 185 H LEU 25 H LEU 25 0.854 -11.392 11.990 186 HA LEU 25 HA LEU 25 -1.525 -12.311 13.520 187 HB2 LEU 25 HB2 LEU 25 -0.029 -9.665 13.812 188 HB3 LEU 25 HB3 LEU 25 -1.661 -9.887 14.399 189 HG LEU 25 HG LEU 25 -0.301 -10.087 16.311 190 HD11 LEU 25 HD11 LEU 25 -2.015 -11.806 16.221 191 HD12 LEU 25 HD12 LEU 25 -0.603 -12.357 17.120 192 HD13 LEU 25 HD13 LEU 25 -0.875 -12.931 15.473 193 HD21 LEU 25 HD21 LEU 25 1.686 -11.489 16.539 194 HD22 LEU 25 HD22 LEU 25 1.885 -10.305 15.252 195 HD23 LEU 25 HD23 LEU 25 1.550 -11.990 14.851 196 H THR 26 H THR 26 -3.478 -10.882 13.180 197 HA THR 26 HA THR 26 -3.790 -10.090 10.354 198 HB THR 26 HB THR 26 -6.181 -9.980 10.742 199 HG1 THR 26 HG1 THR 26 -6.399 -10.736 13.327 200 HG21 THR 26 HG21 THR 26 -6.715 -12.252 11.567 201 HG22 THR 26 HG22 THR 26 -5.081 -12.410 12.214 202 HG23 THR 26 HG23 THR 26 -5.333 -12.278 10.471 203 H GLN 27 H GLN 27 -5.135 -8.050 9.939 204 HA GLN 27 HA GLN 27 -3.873 -5.715 10.798 205 HB2 GLN 27 HB2 GLN 27 -5.185 -5.761 8.736 206 HB3 GLN 27 HB3 GLN 27 -6.669 -6.055 9.634 207 HG2 GLN 27 HG2 GLN 27 -6.464 -3.788 10.661 208 HG3 GLN 27 HG3 GLN 27 -5.015 -3.505 9.699 209 HE21 GLN 27 HE21 GLN 27 -5.968 -1.716 8.695 210 HE22 GLN 27 HE22 GLN 27 -7.222 -1.868 7.518 211 H LYS 28 H LYS 28 -6.711 -7.323 12.181 212 HA LYS 28 HA LYS 28 -7.623 -5.429 14.019 213 HB2 LYS 28 HB2 LYS 28 -7.512 -8.460 14.209 214 HB3 LYS 28 HB3 LYS 28 -8.357 -7.463 15.388 215 HG2 LYS 28 HG2 LYS 28 -9.005 -7.540 12.418 216 HG3 LYS 28 HG3 LYS 28 -9.852 -8.471 13.659 217 HD2 LYS 28 HD2 LYS 28 -9.711 -5.423 13.516 218 HD3 LYS 28 HD3 LYS 28 -11.093 -6.410 13.030 219 HE2 LYS 28 HE2 LYS 28 -11.353 -7.201 15.359 220 HE3 LYS 28 HE3 LYS 28 -9.953 -6.243 15.850 221 HZ1 LYS 28 HZ1 LYS 28 -12.518 -5.208 14.795 222 HZ2 LYS 28 HZ2 LYS 28 -11.172 -4.259 15.161 223 HZ3 LYS 28 HZ3 LYS 28 -11.961 -5.103 16.389 224 H GLN 29 H GLN 29 -5.128 -7.951 14.587 225 HA GLN 29 HA GLN 29 -4.504 -7.149 17.264 226 HB2 GLN 29 HB2 GLN 29 -2.972 -8.885 15.292 227 HB3 GLN 29 HB3 GLN 29 -2.387 -8.563 16.915 228 HG2 GLN 29 HG2 GLN 29 -3.404 -10.693 16.990 229 HG3 GLN 29 HG3 GLN 29 -4.512 -9.594 17.805 230 HE21 GLN 29 HE21 GLN 29 -6.510 -9.127 16.808 231 HE22 GLN 29 HE22 GLN 29 -7.134 -10.092 15.522 232 H ILE 30 H ILE 30 -3.073 -6.393 14.115 233 HA ILE 30 HA ILE 30 -0.794 -4.970 15.021 234 HB ILE 30 HB ILE 30 -2.317 -4.606 12.395 235 HG12 ILE 30 HG12 ILE 30 0.077 -6.404 13.010 236 HG13 ILE 30 HG13 ILE 30 -1.575 -6.968 12.804 237 HG21 ILE 30 HG21 ILE 30 -0.785 -2.720 12.838 238 HG22 ILE 30 HG22 ILE 30 -0.192 -3.702 11.499 239 HG23 ILE 30 HG23 ILE 30 0.551 -3.846 13.093 240 HD11 ILE 30 HD11 ILE 30 0.160 -5.696 10.688 241 HD12 ILE 30 HD12 ILE 30 -1.519 -6.198 10.462 242 HD13 ILE 30 HD13 ILE 30 -0.279 -7.399 10.823 243 H LYS 31 H LYS 31 -4.070 -3.890 14.159 244 HA LYS 31 HA LYS 31 -3.661 -1.089 14.432 245 HB2 LYS 31 HB2 LYS 31 -5.495 -1.990 13.085 246 HB3 LYS 31 HB3 LYS 31 -6.210 -2.756 14.498 247 HG2 LYS 31 HG2 LYS 31 -6.814 -0.606 15.443 248 HG3 LYS 31 HG3 LYS 31 -5.913 0.251 14.186 249 HD2 LYS 31 HD2 LYS 31 -7.490 -0.594 12.475 250 HD3 LYS 31 HD3 LYS 31 -8.379 -1.479 13.717 251 HE2 LYS 31 HE2 LYS 31 -8.980 0.667 14.804 252 HE3 LYS 31 HE3 LYS 31 -8.071 1.546 13.576 253 HZ1 LYS 31 HZ1 LYS 31 -10.482 1.480 13.171 254 HZ2 LYS 31 HZ2 LYS 31 -10.399 -0.199 12.994 255 HZ3 LYS 31 HZ3 LYS 31 -9.585 0.807 11.907 256 H LYS 32 H LYS 32 -4.652 -3.610 16.688 257 HA LYS 32 HA LYS 32 -5.382 -1.932 18.883 258 HB2 LYS 32 HB2 LYS 32 -6.012 -4.382 18.551 259 HB3 LYS 32 HB3 LYS 32 -4.372 -4.815 19.000 260 HG2 LYS 32 HG2 LYS 32 -6.195 -3.257 20.866 261 HG3 LYS 32 HG3 LYS 32 -6.226 -5.019 20.788 262 HD2 LYS 32 HD2 LYS 32 -3.840 -5.089 21.448 263 HD3 LYS 32 HD3 LYS 32 -3.796 -3.321 21.503 264 HE2 LYS 32 HE2 LYS 32 -5.548 -5.077 23.268 265 HE3 LYS 32 HE3 LYS 32 -4.019 -4.348 23.759 266 HZ1 LYS 32 HZ1 LYS 32 -4.995 -2.157 23.373 267 HZ2 LYS 32 HZ2 LYS 32 -5.884 -3.033 24.512 268 HZ3 LYS 32 HZ3 LYS 32 -6.466 -2.869 22.936 269 H ALA 33 H ALA 33 -2.344 -3.580 17.978 270 HA ALA 33 HA ALA 33 -0.824 -2.846 20.283 271 HB1 ALA 33 HB1 ALA 33 1.113 -3.689 19.017 272 HB2 ALA 33 HB2 ALA 33 0.150 -3.711 17.535 273 HB3 ALA 33 HB3 ALA 33 -0.263 -4.787 18.873 274 H THR 34 H THR 34 -0.844 -1.557 16.968 275 HA THR 34 HA THR 34 0.974 0.618 17.416 276 HB THR 34 HB THR 34 0.284 1.379 15.134 277 HG1 THR 34 HG1 THR 34 -1.261 -0.688 14.416 278 HG21 THR 34 HG21 THR 34 2.018 -0.391 15.285 279 HG22 THR 34 HG22 THR 34 1.009 -0.610 13.855 280 HG23 THR 34 HG23 THR 34 0.759 -1.631 15.272 281 H LYS 35 H LYS 35 -2.445 0.182 17.759 282 HA LYS 35 HA LYS 35 -4.166 1.408 18.504 283 HB2 LYS 35 HB2 LYS 35 -2.431 2.089 20.253 284 HB3 LYS 35 HB3 LYS 35 -2.150 3.551 19.320 285 HG2 LYS 35 HG2 LYS 35 -4.514 4.220 19.684 286 HG3 LYS 35 HG3 LYS 35 -4.776 2.759 20.637 287 HD2 LYS 35 HD2 LYS 35 -2.865 5.036 21.331 288 HD3 LYS 35 HD3 LYS 35 -4.432 4.736 22.087 289 HE2 LYS 35 HE2 LYS 35 -3.599 2.584 22.968 290 HE3 LYS 35 HE3 LYS 35 -2.036 2.861 22.197 291 HZ1 LYS 35 HZ1 LYS 35 -1.723 4.792 23.589 292 HZ2 LYS 35 HZ2 LYS 35 -2.016 3.426 24.540 293 HZ3 LYS 35 HZ3 LYS 35 -3.238 4.568 24.306 294 H LEU 36 H LEU 36 -3.235 1.639 15.729 295 HA LEU 36 HA LEU 36 -3.635 4.381 14.863 296 HB2 LEU 36 HB2 LEU 36 -3.344 3.621 12.578 297 HB3 LEU 36 HB3 LEU 36 -2.085 3.004 13.624 298 HG LEU 36 HG LEU 36 -3.514 0.776 13.616 299 HD11 LEU 36 HD11 LEU 36 -4.532 2.041 11.055 300 HD12 LEU 36 HD12 LEU 36 -5.498 1.622 12.473 301 HD13 LEU 36 HD13 LEU 36 -4.728 0.351 11.530 302 HD21 LEU 36 HD21 LEU 36 -1.915 1.639 11.181 303 HD22 LEU 36 HD22 LEU 36 -2.285 -0.030 11.636 304 HD23 LEU 36 HD23 LEU 36 -1.265 0.962 12.677 305 H LYS 37 H LYS 37 -5.290 4.946 13.151 306 HA LYS 37 HA LYS 37 -7.941 4.073 14.141 307 HB2 LYS 37 HB2 LYS 37 -7.451 6.440 14.512 308 HB3 LYS 37 HB3 LYS 37 -7.071 6.671 12.809 309 HG2 LYS 37 HG2 LYS 37 -9.431 6.171 12.220 310 HG3 LYS 37 HG3 LYS 37 -9.801 5.947 13.934 311 HD2 LYS 37 HD2 LYS 37 -9.252 8.305 14.378 312 HD3 LYS 37 HD3 LYS 37 -8.807 8.541 12.682 313 HE2 LYS 37 HE2 LYS 37 -11.136 8.071 12.004 314 HE3 LYS 37 HE3 LYS 37 -11.578 7.789 13.691 315 HZ1 LYS 37 HZ1 LYS 37 -12.198 9.986 13.014 316 HZ2 LYS 37 HZ2 LYS 37 -10.618 10.342 12.533 317 HZ3 LYS 37 HZ3 LYS 37 -10.970 10.087 14.167 318 H ALA 38 H ALA 38 -6.396 5.138 11.077 319 HA ALA 38 HA ALA 38 -8.711 4.151 9.544 320 HB1 ALA 38 HB1 ALA 38 -7.764 5.404 7.650 321 HB2 ALA 38 HB2 ALA 38 -6.332 5.799 8.607 322 HB3 ALA 38 HB3 ALA 38 -7.911 6.433 9.078 323 H ASP 39 H ASP 39 -8.623 2.583 7.969 324 HA ASP 39 HA ASP 39 -6.658 0.579 7.797 325 HB2 ASP 39 HB2 ASP 39 -8.597 1.501 5.622 326 HB3 ASP 39 HB3 ASP 39 -7.756 -0.049 5.658 327 H LYS 40 H LYS 40 -6.969 3.669 6.246 328 HA LYS 40 HA LYS 40 -5.402 3.476 3.970 329 HB2 LYS 40 HB2 LYS 40 -5.923 5.872 5.778 330 HB3 LYS 40 HB3 LYS 40 -5.277 5.981 4.142 331 HG2 LYS 40 HG2 LYS 40 -7.977 4.760 4.816 332 HG3 LYS 40 HG3 LYS 40 -7.749 6.451 4.345 333 HD2 LYS 40 HD2 LYS 40 -7.076 4.008 2.651 334 HD3 LYS 40 HD3 LYS 40 -8.472 5.068 2.432 335 HE2 LYS 40 HE2 LYS 40 -5.569 5.935 2.172 336 HE3 LYS 40 HE3 LYS 40 -6.641 5.557 0.826 337 HZ1 LYS 40 HZ1 LYS 40 -6.448 7.952 1.285 338 HZ2 LYS 40 HZ2 LYS 40 -7.146 7.707 2.802 339 HZ3 LYS 40 HZ3 LYS 40 -8.038 7.385 1.407 340 H ASP 41 H ASP 41 -4.302 4.650 7.214 341 HA ASP 41 HA ASP 41 -1.588 5.065 6.279 342 HB2 ASP 41 HB2 ASP 41 -1.053 5.637 8.616 343 HB3 ASP 41 HB3 ASP 41 -2.481 6.499 8.058 344 H PHE 42 H PHE 42 -3.340 2.477 7.903 345 HA PHE 42 HA PHE 42 -1.240 0.723 8.530 346 HB2 PHE 42 HB2 PHE 42 -3.506 0.222 9.251 347 HB3 PHE 42 HB3 PHE 42 -4.080 0.144 7.591 348 HD1 PHE 42 HD1 PHE 42 -1.849 -1.575 10.051 349 HD2 PHE 42 HD2 PHE 42 -4.046 -1.937 6.394 350 HE1 PHE 42 HE1 PHE 42 -1.405 -3.988 10.007 351 HE2 PHE 42 HE2 PHE 42 -3.597 -4.357 6.368 352 HZ PHE 42 HZ PHE 42 -2.271 -5.382 8.176 353 H PHE 43 H PHE 43 -2.909 1.224 5.395 354 HA PHE 43 HA PHE 43 -1.523 -0.790 3.938 355 HB2 PHE 43 HB2 PHE 43 -2.866 1.719 2.859 356 HB3 PHE 43 HB3 PHE 43 -2.372 0.332 1.890 357 HD1 PHE 43 HD2 PHE 43 -3.268 -1.934 3.660 358 HD2 PHE 43 HD1 PHE 43 -5.213 1.730 2.604 359 HE1 PHE 43 HE2 PHE 43 -5.457 -2.981 4.060 360 HE2 PHE 43 HE1 PHE 43 -7.394 0.675 3.004 361 HZ PHE 43 HZ PHE 43 -7.518 -1.678 3.722 362 H LEU 44 H LEU 44 -0.704 2.607 4.566 363 HA LEU 44 HA LEU 44 1.559 2.690 2.789 364 HB2 LEU 44 HB2 LEU 44 0.574 4.465 5.027 365 HB3 LEU 44 HB3 LEU 44 2.198 4.704 4.409 366 HG LEU 44 HG LEU 44 1.294 5.143 2.138 367 HD11 LEU 44 HD11 LEU 44 -1.097 5.465 1.731 368 HD12 LEU 44 HD12 LEU 44 -1.465 4.907 3.365 369 HD13 LEU 44 HD13 LEU 44 -0.747 3.800 2.194 370 HD21 LEU 44 HD21 LEU 44 1.679 7.036 3.653 371 HD22 LEU 44 HD22 LEU 44 0.025 6.900 4.257 372 HD23 LEU 44 HD23 LEU 44 0.316 7.344 2.575 373 H GLY 45 H GLY 45 1.115 1.710 6.161 374 HA2 GLY 45 HA2 GLY 45 3.902 1.350 6.800 375 HA3 GLY 45 HA3 GLY 45 2.532 0.711 7.690 376 H LEU 46 H LEU 46 1.339 -1.101 6.401 377 HA LEU 46 HA LEU 46 2.960 -3.375 6.122 378 HB2 LEU 46 HB2 LEU 46 0.541 -3.436 6.667 379 HB3 LEU 46 HB3 LEU 46 0.154 -2.879 5.047 380 HG LEU 46 HG LEU 46 1.139 -4.999 4.117 381 HD11 LEU 46 HD11 LEU 46 1.599 -6.886 5.619 382 HD12 LEU 46 HD12 LEU 46 1.381 -5.831 7.018 383 HD13 LEU 46 HD13 LEU 46 2.708 -5.542 5.889 384 HD21 LEU 46 HD21 LEU 46 -1.290 -4.831 4.476 385 HD22 LEU 46 HD22 LEU 46 -1.101 -5.455 6.116 386 HD23 LEU 46 HD23 LEU 46 -0.716 -6.479 4.731 387 H GLY 47 H GLY 47 1.798 -1.097 3.713 388 HA2 GLY 47 HA2 GLY 47 2.571 -2.487 1.341 389 HA3 GLY 47 HA3 GLY 47 2.266 -0.760 1.482 390 H TRP 48 H TRP 48 4.252 -0.263 3.528 391 HA TRP 48 HA TRP 48 6.659 -0.082 2.015 392 HB2 TRP 48 HB2 TRP 48 5.927 1.497 3.907 393 HB3 TRP 48 HB3 TRP 48 6.462 0.254 5.034 394 HD1 TRP 48 HD1 TRP 48 9.168 -0.164 5.192 395 HE1 TRP 48 HE1 TRP 48 11.164 1.275 4.463 396 HE3 TRP 48 HE3 TRP 48 6.700 3.202 2.246 397 HZ2 TRP 48 HZ2 TRP 48 11.638 3.530 2.853 398 HZ3 TRP 48 HZ3 TRP 48 7.994 4.982 1.150 399 HH2 TRP 48 HH2 TRP 48 10.421 5.152 1.450 400 H LEU 49 H LEU 49 5.482 -2.352 4.476 401 HA LEU 49 HA LEU 49 7.833 -3.926 4.739 402 HB2 LEU 49 HB2 LEU 49 4.902 -4.418 5.266 403 HB3 LEU 49 HB3 LEU 49 6.009 -5.770 5.341 404 HG LEU 49 HG LEU 49 7.205 -4.820 7.220 405 HD11 LEU 49 HD11 LEU 49 6.660 -2.665 8.219 406 HD12 LEU 49 HD12 LEU 49 5.512 -2.344 6.912 407 HD13 LEU 49 HD13 LEU 49 7.236 -2.484 6.562 408 HD21 LEU 49 HD21 LEU 49 5.449 -4.697 8.927 409 HD22 LEU 49 HD22 LEU 49 5.100 -5.985 7.777 410 HD23 LEU 49 HD23 LEU 49 4.224 -4.454 7.675 411 H LEU 50 H LEU 50 5.203 -4.007 2.346 412 HA LEU 50 HA LEU 50 6.017 -6.344 0.917 413 HB2 LEU 50 HB2 LEU 50 4.366 -3.932 0.081 414 HB3 LEU 50 HB3 LEU 50 4.668 -5.282 -1.002 415 HG LEU 50 HG LEU 50 3.157 -5.450 1.644 416 HD11 LEU 50 HD11 LEU 50 1.160 -5.826 0.269 417 HD12 LEU 50 HD12 LEU 50 2.106 -5.605 -1.206 418 HD13 LEU 50 HD13 LEU 50 1.880 -4.255 -0.088 419 HD21 LEU 50 HD21 LEU 50 2.616 -7.762 0.960 420 HD22 LEU 50 HD22 LEU 50 4.348 -7.541 1.180 421 HD23 LEU 50 HD23 LEU 50 3.670 -7.599 -0.449 422 H ARG 51 H ARG 51 6.761 -2.865 0.482 423 HA ARG 51 HA ARG 51 8.438 -3.262 -1.820 424 HB2 ARG 51 HB2 ARG 51 8.855 -0.940 -1.779 425 HB3 ARG 51 HB3 ARG 51 7.201 -1.123 -1.266 426 HG2 ARG 51 HG2 ARG 51 7.605 0.106 0.568 427 HG3 ARG 51 HG3 ARG 51 8.844 -1.020 1.097 428 HD2 ARG 51 HD2 ARG 51 9.386 1.196 -0.895 429 HD3 ARG 51 HD3 ARG 51 9.551 1.408 0.848 430 HE ARG 51 HE ARG 51 11.130 -0.683 0.516 431 HH11 ARG 51 HH11 ARG 51 10.964 2.156 -1.469 432 HH12 ARG 51 HH12 ARG 51 12.637 2.097 -1.853 433 HH21 ARG 51 HH21 ARG 51 13.257 -0.695 0.029 434 HH22 ARG 51 HH22 ARG 51 13.923 0.499 -1.026 435 H GLU 52 H GLU 52 8.972 -3.525 1.564 436 HA GLU 52 HA GLU 52 11.898 -3.586 1.352 437 HB2 GLU 52 HB2 GLU 52 9.944 -3.798 3.661 438 HB3 GLU 52 HB3 GLU 52 11.649 -4.176 3.869 439 HG2 GLU 52 HG2 GLU 52 10.541 -1.500 2.959 440 HG3 GLU 52 HG3 GLU 52 11.104 -1.878 4.589 441 H ASP 53 H ASP 53 9.369 -5.747 0.850 442 HA ASP 53 HA ASP 53 9.209 -7.941 0.371 443 HB2 ASP 53 HB2 ASP 53 12.255 -7.999 0.421 444 HB3 ASP 53 HB3 ASP 53 11.205 -9.194 -0.341 445 H LYS 54 H LYS 54 9.667 -6.977 3.265 446 HA LYS 54 HA LYS 54 10.724 -9.394 4.571 447 HB2 LYS 54 HB2 LYS 54 10.379 -6.528 5.440 448 HB3 LYS 54 HB3 LYS 54 10.394 -7.769 6.687 449 HG2 LYS 54 HG2 LYS 54 12.608 -8.531 5.945 450 HG3 LYS 54 HG3 LYS 54 12.607 -7.329 4.649 451 HD2 LYS 54 HD2 LYS 54 12.394 -6.570 7.596 452 HD3 LYS 54 HD3 LYS 54 13.943 -6.757 6.767 453 HE2 LYS 54 HE2 LYS 54 11.753 -4.805 5.980 454 HE3 LYS 54 HE3 LYS 54 13.243 -4.400 6.841 455 HZ1 LYS 54 HZ1 LYS 54 13.450 -3.927 4.496 456 HZ2 LYS 54 HZ2 LYS 54 13.080 -5.526 4.089 457 HZ3 LYS 54 HZ3 LYS 54 14.507 -5.173 4.917 458 H VAL 55 H VAL 55 7.784 -8.833 3.425 459 HA VAL 55 HA VAL 55 6.629 -10.526 5.569 460 HB VAL 55 HB VAL 55 4.365 -9.509 5.196 461 HG11 VAL 55 HG11 VAL 55 5.665 -8.884 7.172 462 HG12 VAL 55 HG12 VAL 55 4.720 -7.512 6.591 463 HG13 VAL 55 HG13 VAL 55 6.453 -7.587 6.268 464 HG21 VAL 55 HG21 VAL 55 4.733 -8.494 2.988 465 HG22 VAL 55 HG22 VAL 55 5.883 -7.350 3.685 466 HG23 VAL 55 HG23 VAL 55 4.177 -7.276 4.141 467 H VAL 56 H VAL 56 5.196 -12.091 5.005 468 HA VAL 56 HA VAL 56 4.391 -12.468 2.202 469 HB VAL 56 HB VAL 56 4.303 -14.525 4.456 470 HG11 VAL 56 HG11 VAL 56 3.945 -16.190 2.642 471 HG12 VAL 56 HG12 VAL 56 3.910 -14.884 1.455 472 HG13 VAL 56 HG13 VAL 56 2.653 -14.986 2.692 473 HG21 VAL 56 HG21 VAL 56 6.271 -15.608 3.405 474 HG22 VAL 56 HG22 VAL 56 6.650 -13.981 3.978 475 HG23 VAL 56 HG23 VAL 56 6.389 -14.272 2.255 476 H THR 57 H THR 57 2.254 -12.063 1.748 477 HA THR 57 HA THR 57 0.419 -11.473 4.006 478 HB THR 57 HB THR 57 -0.913 -10.179 2.281 479 HG1 THR 57 HG1 THR 57 -0.308 -10.191 0.247 480 HG21 THR 57 HG21 THR 57 0.623 -8.252 2.157 481 HG22 THR 57 HG22 THR 57 1.977 -9.292 2.601 482 HG23 THR 57 HG23 THR 57 0.678 -8.994 3.759 483 H SER 58 H SER 58 -1.748 -12.118 3.928 484 HA SER 58 HA SER 58 -2.759 -14.119 2.094 485 HB2 SER 58 HB2 SER 58 -1.253 -15.476 3.591 486 HB3 SER 58 HB3 SER 58 -2.181 -14.932 4.990 487 HG SER 58 HG SER 58 -3.120 -16.818 4.479 488 H GLU 59 H GLU 59 -4.968 -14.971 3.005 489 HA GLU 59 HA GLU 59 -6.365 -12.827 4.537 490 HB2 GLU 59 HB2 GLU 59 -7.006 -12.774 2.155 491 HB3 GLU 59 HB3 GLU 59 -7.423 -14.484 2.208 492 HG2 GLU 59 HG2 GLU 59 -9.213 -13.928 3.891 493 HG3 GLU 59 HG3 GLU 59 -8.842 -12.218 3.650 494 H VAL 60 H VAL 60 -7.121 -13.537 6.442 495 HA VAL 60 HA VAL 60 -8.151 -16.315 6.727 496 HB VAL 60 HB VAL 60 -6.921 -14.449 8.811 497 HG11 VAL 60 HG11 VAL 60 -7.440 -16.162 10.546 498 HG12 VAL 60 HG12 VAL 60 -8.404 -17.054 9.366 499 HG13 VAL 60 HG13 VAL 60 -8.904 -15.440 9.873 500 HG21 VAL 60 HG21 VAL 60 -5.318 -15.805 7.516 501 HG22 VAL 60 HG22 VAL 60 -6.191 -17.276 7.962 502 HG23 VAL 60 HG23 VAL 60 -5.365 -16.333 9.204 503 H GLU 61 H GLU 61 -10.314 -16.330 6.540 504 HA GLU 61 HA GLU 61 -12.531 -15.956 6.843 505 HB2 GLU 61 HB2 GLU 61 -11.650 -14.560 9.411 506 HB3 GLU 61 HB3 GLU 61 -13.249 -15.228 9.092 507 HG2 GLU 61 HG2 GLU 61 -10.681 -16.836 9.281 508 HG3 GLU 61 HG3 GLU 61 -11.841 -16.654 10.583 509 H GLY 62 H GLY 62 -11.279 -14.015 5.158 510 HA2 GLY 62 HA2 GLY 62 -11.942 -12.118 3.998 511 HA3 GLY 62 HA3 GLY 62 -13.213 -11.863 5.176 512 H GLU 63 H GLU 63 -10.182 -12.206 6.650 513 HA GLU 63 HA GLU 63 -9.866 -9.272 6.997 514 HB2 GLU 63 HB2 GLU 63 -10.592 -10.472 9.042 515 HB3 GLU 63 HB3 GLU 63 -9.226 -11.570 8.915 516 HG2 GLU 63 HG2 GLU 63 -8.838 -9.914 10.652 517 HG3 GLU 63 HG3 GLU 63 -7.672 -9.716 9.344 518 H ILE 64 H ILE 64 -7.768 -8.382 6.887 519 HA ILE 64 HA ILE 64 -5.855 -9.735 5.227 520 HB ILE 64 HB ILE 64 -5.660 -7.056 6.685 521 HG12 ILE 64 HG12 ILE 64 -6.156 -7.695 3.743 522 HG13 ILE 64 HG13 ILE 64 -7.383 -7.163 4.887 523 HG21 ILE 64 HG21 ILE 64 -3.379 -7.920 6.337 524 HG22 ILE 64 HG22 ILE 64 -3.685 -6.550 5.270 525 HG23 ILE 64 HG23 ILE 64 -3.724 -8.194 4.626 526 HD11 ILE 64 HD11 ILE 64 -5.003 -5.547 3.954 527 HD12 ILE 64 HD12 ILE 64 -6.228 -5.005 5.108 528 HD13 ILE 64 HD13 ILE 64 -6.679 -5.352 3.440 529 H PHE 65 H PHE 65 -4.774 -11.414 6.071 530 HA PHE 65 HA PHE 65 -3.437 -11.248 8.710 531 HB2 PHE 65 HB2 PHE 65 -4.784 -13.297 8.280 532 HB3 PHE 65 HB3 PHE 65 -3.843 -13.631 6.831 533 HD1 PHE 65 HD2 PHE 65 -3.677 -13.462 10.549 534 HD2 PHE 65 HD1 PHE 65 -1.706 -14.771 6.985 535 HE1 PHE 65 HE2 PHE 65 -2.076 -14.741 11.900 536 HE2 PHE 65 HE1 PHE 65 -0.104 -16.047 8.347 537 HZ PHE 65 HZ PHE 65 -0.286 -16.031 10.804 538 H VAL 66 H VAL 66 -1.203 -11.160 8.833 539 HA VAL 66 HA VAL 66 0.419 -11.656 6.427 540 HB VAL 66 HB VAL 66 -0.065 -9.236 6.417 541 HG11 VAL 66 HG11 VAL 66 0.754 -7.720 8.180 542 HG12 VAL 66 HG12 VAL 66 1.282 -9.103 9.138 543 HG13 VAL 66 HG13 VAL 66 -0.437 -8.859 8.821 544 HG21 VAL 66 HG21 VAL 66 2.832 -9.827 7.113 545 HG22 VAL 66 HG22 VAL 66 2.251 -8.403 6.250 546 HG23 VAL 66 HG23 VAL 66 2.090 -10.000 5.520 547 H LYS 67 H LYS 67 2.627 -12.184 6.832 548 HA LYS 67 HA LYS 67 3.478 -12.519 9.656 549 HB2 LYS 67 HB2 LYS 67 4.393 -14.766 9.113 550 HB3 LYS 67 HB3 LYS 67 2.646 -14.708 8.933 551 HG2 LYS 67 HG2 LYS 67 2.926 -14.492 6.471 552 HG3 LYS 67 HG3 LYS 67 4.672 -14.631 6.674 553 HD2 LYS 67 HD2 LYS 67 2.664 -16.783 7.478 554 HD3 LYS 67 HD3 LYS 67 3.542 -16.757 5.951 555 HE2 LYS 67 HE2 LYS 67 4.738 -18.274 7.328 556 HE3 LYS 67 HE3 LYS 67 5.695 -16.799 7.351 557 HZ1 LYS 67 HZ1 LYS 67 4.806 -16.282 9.524 558 HZ2 LYS 67 HZ2 LYS 67 5.485 -17.829 9.534 559 HZ3 LYS 67 HZ3 LYS 67 3.805 -17.647 9.482 560 H LEU 68 H LEU 68 5.786 -12.323 9.965 561 HA LEU 68 HA LEU 68 7.071 -10.703 7.916 562 HB2 LEU 68 HB2 LEU 68 8.227 -11.605 10.579 563 HB3 LEU 68 HB3 LEU 68 8.890 -10.367 9.520 564 HG LEU 68 HG LEU 68 6.355 -10.206 11.197 565 HD11 LEU 68 HD11 LEU 68 8.905 -8.561 11.262 566 HD12 LEU 68 HD12 LEU 68 8.458 -9.837 12.399 567 HD13 LEU 68 HD13 LEU 68 7.496 -8.368 12.311 568 HD21 LEU 68 HD21 LEU 68 5.858 -9.127 9.065 569 HD22 LEU 68 HD22 LEU 68 7.336 -8.167 9.166 570 HD23 LEU 68 HD23 LEU 68 6.035 -7.919 10.335 571 H VAL 69 H VAL 69 8.567 -11.406 6.427 572 HA VAL 69 HA VAL 69 10.056 -13.856 6.590 573 HB VAL 69 HB VAL 69 10.713 -11.260 5.090 574 HG11 VAL 69 HG11 VAL 69 12.265 -12.617 3.711 575 HG12 VAL 69 HG12 VAL 69 11.953 -14.019 4.737 576 HG13 VAL 69 HG13 VAL 69 12.761 -12.600 5.407 577 HG21 VAL 69 HG21 VAL 69 8.585 -12.268 4.334 578 HG22 VAL 69 HG22 VAL 69 9.398 -13.814 4.071 579 HG23 VAL 69 HG23 VAL 69 9.825 -12.414 3.084 580 H LEU 70 H LEU 70 11.356 -14.237 8.310 581 HA LEU 70 HA LEU 70 12.060 -12.334 10.222 582 HB2 LEU 70 HB2 LEU 70 13.407 -14.052 11.346 583 HB3 LEU 70 HB3 LEU 70 11.817 -14.636 10.900 584 HG LEU 70 HG LEU 70 14.302 -15.313 9.260 585 HD11 LEU 70 HD11 LEU 70 14.417 -17.455 10.441 586 HD12 LEU 70 HD12 LEU 70 13.123 -16.946 11.530 587 HD13 LEU 70 HD13 LEU 70 14.677 -16.108 11.548 588 HD21 LEU 70 HD21 LEU 70 11.592 -16.678 9.438 589 HD22 LEU 70 HD22 LEU 70 12.960 -17.217 8.458 590 HD23 LEU 70 HD23 LEU 70 12.169 -15.685 8.097 591 H GLU 71 H GLU 71 13.202 -10.624 9.600 592 HA GLU 71 HA GLU 71 15.780 -10.738 8.234 593 HB2 GLU 71 HB2 GLU 71 14.146 -8.897 7.828 594 HB3 GLU 71 HB3 GLU 71 14.246 -8.430 9.516 595 HG2 GLU 71 HG2 GLU 71 15.524 -6.863 8.217 596 HG3 GLU 71 HG3 GLU 71 16.646 -7.829 9.171 597 H HIS 72 H HIS 72 17.766 -9.965 9.212 598 HA HIS 72 HA HIS 72 18.261 -10.658 11.950 599 HB2 HIS 72 HB2 HIS 72 19.941 -9.082 9.941 600 HB3 HIS 72 HB3 HIS 72 20.520 -9.569 11.531 601 HD1 HIS 72 HD1 HIS 72 21.986 -10.502 9.040 602 HD2 HIS 72 HD2 HIS 72 18.983 -12.716 10.869 603 HE1 HIS 72 HE1 HIS 72 22.437 -12.883 8.403 604 HE2 HIS 72 HE2 HIS 72 20.700 -14.211 9.644 605 H HIS 73 H HIS 73 19.020 -9.183 13.654 606 HA HIS 73 HA HIS 73 17.372 -6.907 14.106 607 HB2 HIS 73 HB2 HIS 73 19.874 -7.893 15.542 608 HB3 HIS 73 HB3 HIS 73 18.919 -6.521 16.109 609 HD1 HIS 73 HD1 HIS 73 17.154 -7.109 17.756 610 HD2 HIS 73 HD2 HIS 73 18.138 -10.365 15.366 611 HE1 HIS 73 HE1 HIS 73 15.785 -9.023 18.630 612 HE2 HIS 73 HE2 HIS 73 16.300 -10.938 17.093 613 H HIS 74 H HIS 74 20.561 -7.242 12.682 614 HA HIS 74 HA HIS 74 20.707 -4.347 12.138 615 HB2 HIS 74 HB2 HIS 74 22.643 -6.604 11.443 616 HB3 HIS 74 HB3 HIS 74 22.899 -4.905 11.050 617 HD1 HIS 74 HD1 HIS 74 23.852 -3.420 12.869 618 HD2 HIS 74 HD2 HIS 74 22.826 -7.192 14.260 619 HE1 HIS 74 HE1 HIS 74 24.775 -3.554 15.198 620 HE2 HIS 74 HE2 HIS 74 23.988 -5.771 16.074 621 H HIS 75 H HIS 75 18.902 -4.138 10.803 622 HA HIS 75 HA HIS 75 18.321 -5.708 8.490 623 HB2 HIS 75 HB2 HIS 75 16.685 -3.897 7.950 624 HB3 HIS 75 HB3 HIS 75 16.564 -4.429 9.622 625 HD1 HIS 75 HD1 HIS 75 17.549 -1.469 7.536 626 HD2 HIS 75 HD2 HIS 75 17.280 -2.489 11.556 627 HE1 HIS 75 HE1 HIS 75 17.826 0.680 8.792 628 HE2 HIS 75 HE2 HIS 75 17.770 0.026 11.216 629 H HIS 76 H HIS 76 18.038 -4.555 6.277 630 HA HIS 76 HA HIS 76 20.631 -3.491 5.397 631 HB2 HIS 76 HB2 HIS 76 18.172 -4.157 3.714 632 HB3 HIS 76 HB3 HIS 76 19.817 -3.907 3.130 633 HD1 HIS 76 HD1 HIS 76 21.601 -5.734 4.273 634 HD2 HIS 76 HD2 HIS 76 17.585 -6.783 4.070 635 HE1 HIS 76 HE1 HIS 76 21.543 -8.224 4.556 636 HE2 HIS 76 HE2 HIS 76 19.095 -8.794 4.636 637 H HIS 77 H HIS 77 20.776 -1.513 4.063 638 HA HIS 77 HA HIS 77 18.813 0.556 4.913 639 HB2 HIS 77 HB2 HIS 77 21.227 0.799 5.657 640 HB3 HIS 77 HB3 HIS 77 21.685 0.986 3.972 641 HD1 HIS 77 HD1 HIS 77 20.965 3.212 2.795 642 HD2 HIS 77 HD2 HIS 77 20.128 3.100 6.864 643 HE1 HIS 77 HE1 HIS 77 20.436 5.571 3.431 644 HE2 HIS 77 HE2 HIS 77 20.100 5.511 5.919 645 H1 MET 1 H MET 1 5.556 -15.172 -10.462 646 HA MET 1 HA MET 1 3.582 -15.079 -11.593 647 HB2 MET 1 HB2 MET 1 3.771 -18.085 -11.100 648 HB3 MET 1 HB3 MET 1 2.637 -17.347 -12.227 649 HG2 MET 1 HG2 MET 1 5.657 -17.212 -12.425 650 HG3 MET 1 HG3 MET 1 4.596 -18.241 -13.389 651 HE1 MET 1 HE1 MET 1 2.823 -17.275 -15.181 652 HE2 MET 1 HE2 MET 1 2.631 -15.557 -15.526 653 HE3 MET 1 HE3 MET 1 2.113 -16.206 -13.971 654 H LYS 2 H LYS 2 3.048 -17.510 -9.023 655 HA LYS 2 HA LYS 2 0.253 -16.860 -8.709 656 HB2 LYS 2 HB2 LYS 2 1.157 -19.177 -8.510 657 HB3 LYS 2 HB3 LYS 2 2.048 -18.698 -7.070 658 HG2 LYS 2 HG2 LYS 2 -0.129 -18.212 -5.932 659 HG3 LYS 2 HG3 LYS 2 -0.980 -18.796 -7.367 660 HD2 LYS 2 HD2 LYS 2 0.903 -20.432 -5.614 661 HD3 LYS 2 HD3 LYS 2 -0.858 -20.528 -5.596 662 HE2 LYS 2 HE2 LYS 2 -0.822 -21.339 -7.951 663 HE3 LYS 2 HE3 LYS 2 0.942 -21.264 -7.942 664 HZ1 LYS 2 HZ1 LYS 2 0.107 -23.497 -7.529 665 HZ2 LYS 2 HZ2 LYS 2 -0.702 -22.957 -6.146 666 HZ3 LYS 2 HZ3 LYS 2 0.986 -22.912 -6.204 667 H MET 3 H MET 3 3.224 -15.994 -7.060 668 HA MET 3 HA MET 3 2.307 -15.367 -4.497 669 HB2 MET 3 HB2 MET 3 4.645 -14.236 -6.072 670 HB3 MET 3 HB3 MET 3 4.361 -13.845 -4.378 671 HG2 MET 3 HG2 MET 3 4.915 -16.602 -5.516 672 HG3 MET 3 HG3 MET 3 6.021 -15.613 -4.562 673 HE1 MET 3 HE1 MET 3 4.062 -14.435 -2.277 674 HE2 MET 3 HE2 MET 3 5.654 -15.108 -1.919 675 HE3 MET 3 HE3 MET 3 4.240 -15.662 -1.022 676 H LEU 4 H LEU 4 1.544 -13.576 -3.459 677 HA LEU 4 HA LEU 4 -0.083 -11.720 -4.847 678 HB2 LEU 4 HB2 LEU 4 0.817 -11.744 -1.942 679 HB3 LEU 4 HB3 LEU 4 -0.349 -10.602 -2.583 680 HG LEU 4 HG LEU 4 -1.816 -12.618 -3.198 681 HD11 LEU 4 HD11 LEU 4 -1.477 -14.725 -1.992 682 HD12 LEU 4 HD12 LEU 4 0.062 -14.133 -1.361 683 HD13 LEU 4 HD13 LEU 4 -0.138 -14.400 -3.094 684 HD21 LEU 4 HD21 LEU 4 -2.332 -11.165 -1.295 685 HD22 LEU 4 HD22 LEU 4 -1.275 -12.122 -0.252 686 HD23 LEU 4 HD23 LEU 4 -2.739 -12.843 -0.928 687 H LYS 5 H LYS 5 3.259 -11.591 -4.009 688 HA LYS 5 HA LYS 5 3.762 -8.798 -4.240 689 HB2 LYS 5 HB2 LYS 5 5.385 -10.440 -3.291 690 HB3 LYS 5 HB3 LYS 5 5.570 -11.161 -4.891 691 HG2 LYS 5 HG2 LYS 5 6.538 -9.089 -5.755 692 HG3 LYS 5 HG3 LYS 5 6.294 -8.296 -4.198 693 HD2 LYS 5 HD2 LYS 5 8.115 -10.685 -4.688 694 HD3 LYS 5 HD3 LYS 5 8.649 -9.004 -4.584 695 HE2 LYS 5 HE2 LYS 5 7.832 -8.907 -2.239 696 HE3 LYS 5 HE3 LYS 5 7.336 -10.599 -2.355 697 HZ1 LYS 5 HZ1 LYS 5 9.470 -10.408 -1.295 698 HZ2 LYS 5 HZ2 LYS 5 10.100 -9.558 -2.613 699 HZ3 LYS 5 HZ3 LYS 5 9.654 -11.182 -2.787 700 H GLU 6 H GLU 6 3.780 -11.471 -6.609 701 HA GLU 6 HA GLU 6 4.495 -9.924 -8.895 702 HB2 GLU 6 HB2 GLU 6 3.029 -12.600 -8.804 703 HB3 GLU 6 HB3 GLU 6 3.817 -11.903 -10.221 704 HG2 GLU 6 HG2 GLU 6 5.182 -12.849 -7.675 705 HG3 GLU 6 HG3 GLU 6 5.184 -13.676 -9.230 706 H LYS 7 H LYS 7 1.445 -10.862 -7.421 707 HA LYS 7 HA LYS 7 -0.403 -9.801 -9.281 708 HB2 LYS 7 HB2 LYS 7 -0.992 -11.397 -7.495 709 HB3 LYS 7 HB3 LYS 7 -0.592 -10.218 -6.262 710 HG2 LYS 7 HG2 LYS 7 -2.803 -9.609 -8.228 711 HG3 LYS 7 HG3 LYS 7 -3.106 -10.735 -6.902 712 HD2 LYS 7 HD2 LYS 7 -2.351 -8.920 -5.298 713 HD3 LYS 7 HD3 LYS 7 -2.270 -7.813 -6.672 714 HE2 LYS 7 HE2 LYS 7 -4.769 -9.258 -5.720 715 HE3 LYS 7 HE3 LYS 7 -4.377 -7.569 -5.404 716 HZ1 LYS 7 HZ1 LYS 7 -4.434 -7.170 -7.805 717 HZ2 LYS 7 HZ2 LYS 7 -5.913 -7.734 -7.222 718 HZ3 LYS 7 HZ3 LYS 7 -4.886 -8.776 -8.068 719 H ALA 8 H ALA 8 1.138 -8.334 -6.404 720 HA ALA 8 HA ALA 8 0.123 -5.709 -6.599 721 HB1 ALA 8 HB1 ALA 8 2.022 -5.028 -5.194 722 HB2 ALA 8 HB2 ALA 8 2.847 -6.554 -5.540 723 HB3 ALA 8 HB3 ALA 8 1.341 -6.553 -4.619 724 H GLY 9 H GLY 9 2.924 -7.214 -8.186 725 HA2 GLY 9 HA2 GLY 9 3.942 -4.928 -9.540 726 HA3 GLY 9 HA3 GLY 9 4.228 -6.605 -9.972 727 H ALA 10 H ALA 10 1.483 -7.332 -10.429 728 HA ALA 10 HA ALA 10 1.042 -6.533 -13.115 729 HB1 ALA 10 HB1 ALA 10 0.228 -8.684 -12.229 730 HB2 ALA 10 HB2 ALA 10 -1.097 -7.751 -12.933 731 HB3 ALA 10 HB3 ALA 10 -0.905 -7.832 -11.179 732 H LEU 11 H LEU 11 -0.381 -5.502 -10.042 733 HA LEU 11 HA LEU 11 -2.245 -3.592 -11.022 734 HB2 LEU 11 HB2 LEU 11 -0.805 -3.703 -8.341 735 HB3 LEU 11 HB3 LEU 11 -2.233 -2.732 -8.685 736 HG LEU 11 HG LEU 11 -2.164 -5.779 -8.776 737 HD11 LEU 11 HD11 LEU 11 -3.430 -5.724 -6.671 738 HD12 LEU 11 HD12 LEU 11 -3.228 -3.971 -6.592 739 HD13 LEU 11 HD13 LEU 11 -1.819 -5.031 -6.494 740 HD21 LEU 11 HD21 LEU 11 -4.518 -3.867 -8.932 741 HD22 LEU 11 HD22 LEU 11 -4.617 -5.630 -8.873 742 HD23 LEU 11 HD23 LEU 11 -3.871 -4.839 -10.258 743 H ALA 12 H ALA 12 1.164 -3.350 -10.032 744 HA ALA 12 HA ALA 12 1.531 -0.577 -10.035 745 HB1 ALA 12 HB1 ALA 12 3.581 -2.687 -10.798 746 HB2 ALA 12 HB2 ALA 12 3.180 -2.190 -9.154 747 HB3 ALA 12 HB3 ALA 12 3.926 -1.033 -10.259 748 H GLY 13 H GLY 13 1.960 -2.867 -12.740 749 HA2 GLY 13 HA2 GLY 13 2.931 -1.113 -14.700 750 HA3 GLY 13 HA3 GLY 13 2.085 -2.615 -15.010 751 H GLN 14 H GLN 14 -0.446 -2.201 -14.233 752 HA GLN 14 HA GLN 14 -1.539 -0.666 -16.360 753 HB2 GLN 14 HB2 GLN 14 -3.757 -1.299 -15.413 754 HB3 GLN 14 HB3 GLN 14 -2.669 -2.671 -15.593 755 HG2 GLN 14 HG2 GLN 14 -2.147 -2.509 -13.141 756 HG3 GLN 14 HG3 GLN 14 -3.370 -1.246 -13.007 757 HE21 GLN 14 HE21 GLN 14 -4.556 -2.523 -11.529 758 HE22 GLN 14 HE22 GLN 14 -5.472 -3.893 -12.039 759 H ILE 15 H ILE 15 -1.316 -0.001 -12.845 760 HA ILE 15 HA ILE 15 -2.817 2.420 -12.817 761 HB ILE 15 HB ILE 15 -0.686 1.373 -10.908 762 HG12 ILE 15 HG12 ILE 15 -3.725 1.508 -10.586 763 HG13 ILE 15 HG13 ILE 15 -2.847 0.068 -11.098 764 HG21 ILE 15 HG21 ILE 15 -2.488 3.793 -10.490 765 HG22 ILE 15 HG22 ILE 15 -0.733 3.821 -10.677 766 HG23 ILE 15 HG23 ILE 15 -1.454 3.066 -9.255 767 HD11 ILE 15 HD11 ILE 15 -2.575 1.451 -8.431 768 HD12 ILE 15 HD12 ILE 15 -1.694 0.008 -8.943 769 HD13 ILE 15 HD13 ILE 15 -3.446 -0.048 -8.757 770 H TRP 16 H TRP 16 0.690 1.810 -13.159 771 HA TRP 16 HA TRP 16 1.536 4.482 -13.376 772 HB2 TRP 16 HB2 TRP 16 3.126 2.577 -13.084 773 HB3 TRP 16 HB3 TRP 16 2.792 2.049 -14.734 774 HD1 TRP 16 HD1 TRP 16 4.455 4.939 -12.806 775 HE1 TRP 16 HE1 TRP 16 6.054 6.193 -14.392 776 HE3 TRP 16 HE3 TRP 16 3.362 2.494 -17.162 777 HZ2 TRP 16 HZ2 TRP 16 6.748 6.164 -17.128 778 HZ3 TRP 16 HZ3 TRP 16 4.519 3.171 -19.226 779 HH2 TRP 16 HH2 TRP 16 6.176 4.979 -19.207 780 H GLU 17 H GLU 17 0.326 2.233 -15.892 781 HA GLU 17 HA GLU 17 0.740 3.949 -18.120 782 HB2 GLU 17 HB2 GLU 17 -1.091 1.566 -17.733 783 HB3 GLU 17 HB3 GLU 17 -0.981 2.436 -19.264 784 HG2 GLU 17 HG2 GLU 17 1.406 1.913 -19.427 785 HG3 GLU 17 HG3 GLU 17 1.347 1.085 -17.865 786 H ALA 18 H ALA 18 -1.890 3.821 -15.781 787 HA ALA 18 HA ALA 18 -3.702 5.598 -17.086 788 HB1 ALA 18 HB1 ALA 18 -4.341 4.274 -15.103 789 HB2 ALA 18 HB2 ALA 18 -4.634 5.994 -14.831 790 HB3 ALA 18 HB3 ALA 18 -3.224 5.210 -14.108 791 H LEU 19 H LEU 19 -0.823 6.127 -15.076 792 HA LEU 19 HA LEU 19 -0.987 9.034 -15.156 793 HB2 LEU 19 HB2 LEU 19 0.997 7.091 -13.946 794 HB3 LEU 19 HB3 LEU 19 1.353 8.805 -14.026 795 HG LEU 19 HG LEU 19 -0.666 9.276 -12.617 796 HD11 LEU 19 HD11 LEU 19 -2.032 7.313 -13.140 797 HD12 LEU 19 HD12 LEU 19 -1.789 7.472 -11.402 798 HD13 LEU 19 HD13 LEU 19 -0.873 6.269 -12.313 799 HD21 LEU 19 HD21 LEU 19 0.292 8.512 -10.494 800 HD22 LEU 19 HD22 LEU 19 1.560 9.084 -11.575 801 HD23 LEU 19 HD23 LEU 19 1.309 7.349 -11.348 802 H ASN 20 H ASN 20 0.352 6.609 -17.196 803 HA ASN 20 HA ASN 20 2.741 7.837 -18.086 804 HB2 ASN 20 HB2 ASN 20 2.314 5.437 -18.368 805 HB3 ASN 20 HB3 ASN 20 0.981 5.770 -19.460 806 HD21 ASN 20 HD21 ASN 20 1.963 4.503 -21.076 807 HD22 ASN 20 HD22 ASN 20 3.347 5.046 -21.952 808 H GLY 21 H GLY 21 3.074 9.517 -19.401 809 HA2 GLY 21 HA2 GLY 21 2.717 10.891 -21.317 810 HA3 GLY 21 HA3 GLY 21 1.021 10.433 -21.337 811 H THR 22 H THR 22 0.788 10.862 -18.412 812 HA THR 22 HA THR 22 0.576 13.819 -18.320 813 HB THR 22 HB THR 22 -0.680 11.826 -16.368 814 HG1 THR 22 HG1 THR 22 -1.781 11.216 -18.080 815 HG21 THR 22 HG21 THR 22 -2.357 13.607 -15.994 816 HG22 THR 22 HG22 THR 22 -1.508 14.661 -17.124 817 HG23 THR 22 HG23 THR 22 -0.734 14.189 -15.609 818 H GLU 23 H GLU 23 0.925 14.706 -15.922 819 HA GLU 23 HA GLU 23 3.495 13.649 -14.888 820 HB2 GLU 23 HB2 GLU 23 3.957 15.901 -14.085 821 HB3 GLU 23 HB3 GLU 23 3.512 15.970 -15.786 822 HG2 GLU 23 HG2 GLU 23 1.172 16.617 -15.044 823 HG3 GLU 23 HG3 GLU 23 1.810 16.755 -13.405 824 H GLY 24 H GLY 24 0.298 13.348 -14.119 825 HA2 GLY 24 HA2 GLY 24 0.371 12.452 -11.561 826 HA3 GLY 24 HA3 GLY 24 0.276 14.187 -11.329 827 H LEU 25 H LEU 25 -1.590 11.652 -11.028 828 HA LEU 25 HA LEU 25 -4.090 13.037 -11.888 829 HB2 LEU 25 HB2 LEU 25 -3.535 10.039 -12.001 830 HB3 LEU 25 HB3 LEU 25 -5.158 10.702 -12.033 831 HG LEU 25 HG LEU 25 -4.457 11.943 -14.183 832 HD11 LEU 25 HD11 LEU 25 -2.168 9.967 -14.093 833 HD12 LEU 25 HD12 LEU 25 -2.044 11.726 -14.021 834 HD13 LEU 25 HD13 LEU 25 -2.632 10.947 -15.484 835 HD21 LEU 25 HD21 LEU 25 -4.610 8.908 -14.228 836 HD22 LEU 25 HD22 LEU 25 -4.910 9.977 -15.603 837 HD23 LEU 25 HD23 LEU 25 -5.981 10.025 -14.203 838 H THR 26 H THR 26 -5.986 12.593 -10.531 839 HA THR 26 HA THR 26 -5.413 11.992 -7.722 840 HB THR 26 HB THR 26 -7.701 12.579 -7.218 841 HG1 THR 26 HG1 THR 26 -9.291 12.744 -8.718 842 HG21 THR 26 HG21 THR 26 -6.256 14.533 -7.663 843 HG22 THR 26 HG22 THR 26 -7.929 14.856 -8.122 844 HG23 THR 26 HG23 THR 26 -6.730 14.493 -9.365 845 H GLN 27 H GLN 27 -6.709 10.322 -6.539 846 HA GLN 27 HA GLN 27 -6.446 7.761 -7.619 847 HB2 GLN 27 HB2 GLN 27 -6.539 8.178 -5.189 848 HB3 GLN 27 HB3 GLN 27 -8.228 8.657 -5.312 849 HG2 GLN 27 HG2 GLN 27 -8.751 6.315 -6.107 850 HG3 GLN 27 HG3 GLN 27 -7.076 5.884 -5.767 851 HE21 GLN 27 HE21 GLN 27 -7.652 4.364 -4.206 852 HE22 GLN 27 HE22 GLN 27 -8.325 4.795 -2.679 853 H LYS 28 H LYS 28 -9.359 9.783 -7.347 854 HA LYS 28 HA LYS 28 -11.297 8.028 -8.359 855 HB2 LYS 28 HB2 LYS 28 -11.797 10.176 -7.218 856 HB3 LYS 28 HB3 LYS 28 -11.182 11.062 -8.611 857 HG2 LYS 28 HG2 LYS 28 -13.009 10.163 -10.004 858 HG3 LYS 28 HG3 LYS 28 -13.607 9.230 -8.627 859 HD2 LYS 28 HD2 LYS 28 -14.073 11.333 -7.402 860 HD3 LYS 28 HD3 LYS 28 -13.452 12.272 -8.765 861 HE2 LYS 28 HE2 LYS 28 -15.901 12.235 -8.801 862 HE3 LYS 28 HE3 LYS 28 -15.269 11.362 -10.196 863 HZ1 LYS 28 HZ1 LYS 28 -17.087 10.172 -9.192 864 HZ2 LYS 28 HZ2 LYS 28 -16.305 10.142 -7.694 865 HZ3 LYS 28 HZ3 LYS 28 -15.664 9.284 -8.998 866 H GLN 29 H GLN 29 -9.166 10.296 -10.134 867 HA GLN 29 HA GLN 29 -10.152 9.848 -12.771 868 HB2 GLN 29 HB2 GLN 29 -7.387 10.720 -11.836 869 HB3 GLN 29 HB3 GLN 29 -7.927 10.766 -13.515 870 HG2 GLN 29 HG2 GLN 29 -9.652 12.408 -12.928 871 HG3 GLN 29 HG3 GLN 29 -9.152 12.344 -11.235 872 HE21 GLN 29 HE21 GLN 29 -8.577 14.529 -11.163 873 HE22 GLN 29 HE22 GLN 29 -7.215 15.174 -12.008 874 H ILE 30 H ILE 30 -7.589 8.316 -10.880 875 HA ILE 30 HA ILE 30 -6.494 6.671 -12.929 876 HB ILE 30 HB ILE 30 -6.348 6.400 -9.891 877 HG12 ILE 30 HG12 ILE 30 -4.275 7.545 -11.816 878 HG13 ILE 30 HG13 ILE 30 -5.453 8.543 -10.975 879 HG21 ILE 30 HG21 ILE 30 -5.787 4.236 -10.927 880 HG22 ILE 30 HG22 ILE 30 -4.335 4.986 -10.261 881 HG23 ILE 30 HG23 ILE 30 -4.629 5.027 -12.003 882 HD11 ILE 30 HD11 ILE 30 -3.297 8.619 -9.901 883 HD12 ILE 30 HD12 ILE 30 -3.307 6.870 -9.682 884 HD13 ILE 30 HD13 ILE 30 -4.487 7.875 -8.833 885 H LYS 31 H LYS 31 -8.862 6.003 -10.325 886 HA LYS 31 HA LYS 31 -9.359 3.273 -10.871 887 HB2 LYS 31 HB2 LYS 31 -11.161 5.354 -9.569 888 HB3 LYS 31 HB3 LYS 31 -11.515 3.626 -9.602 889 HG2 LYS 31 HG2 LYS 31 -9.450 3.179 -8.315 890 HG3 LYS 31 HG3 LYS 31 -9.089 4.904 -8.289 891 HD2 LYS 31 HD2 LYS 31 -10.031 4.446 -6.163 892 HD3 LYS 31 HD3 LYS 31 -11.330 5.217 -7.067 893 HE2 LYS 31 HE2 LYS 31 -11.059 2.205 -6.724 894 HE3 LYS 31 HE3 LYS 31 -12.025 3.229 -5.666 895 HZ1 LYS 31 HZ1 LYS 31 -12.469 2.711 -8.554 896 HZ2 LYS 31 HZ2 LYS 31 -13.311 3.883 -7.672 897 HZ3 LYS 31 HZ3 LYS 31 -13.448 2.250 -7.257 898 H LYS 32 H LYS 32 -10.667 6.191 -12.367 899 HA LYS 32 HA LYS 32 -12.662 4.915 -13.975 900 HB2 LYS 32 HB2 LYS 32 -12.733 7.331 -13.573 901 HB3 LYS 32 HB3 LYS 32 -11.175 7.545 -14.356 902 HG2 LYS 32 HG2 LYS 32 -12.940 8.284 -15.848 903 HG3 LYS 32 HG3 LYS 32 -12.165 6.852 -16.521 904 HD2 LYS 32 HD2 LYS 32 -14.510 6.560 -16.871 905 HD3 LYS 32 HD3 LYS 32 -14.088 5.481 -15.541 906 HE2 LYS 32 HE2 LYS 32 -16.177 6.598 -15.021 907 HE3 LYS 32 HE3 LYS 32 -14.932 7.219 -13.937 908 HZ1 LYS 32 HZ1 LYS 32 -14.731 9.166 -15.352 909 HZ2 LYS 32 HZ2 LYS 32 -16.326 8.988 -14.823 910 HZ3 LYS 32 HZ3 LYS 32 -15.904 8.564 -16.404 911 H ALA 33 H ALA 33 -9.251 5.797 -14.601 912 HA ALA 33 HA ALA 33 -9.206 5.034 -17.356 913 HB1 ALA 33 HB1 ALA 33 -7.672 6.705 -16.400 914 HB2 ALA 33 HB2 ALA 33 -6.784 5.415 -17.214 915 HB3 ALA 33 HB3 ALA 33 -6.880 5.447 -15.449 916 H THR 34 H THR 34 -8.004 3.404 -14.434 917 HA THR 34 HA THR 34 -7.168 0.983 -15.794 918 HB THR 34 HB THR 34 -6.805 0.183 -13.315 919 HG1 THR 34 HG1 THR 34 -6.707 2.823 -12.541 920 HG21 THR 34 HG21 THR 34 -4.712 1.456 -13.091 921 HG22 THR 34 HG22 THR 34 -5.262 2.619 -14.298 922 HG23 THR 34 HG23 THR 34 -4.932 0.950 -14.768 923 H LYS 35 H LYS 35 -10.064 2.125 -14.310 924 HA LYS 35 HA LYS 35 -12.131 1.271 -13.982 925 HB2 LYS 35 HB2 LYS 35 -11.191 -0.859 -15.938 926 HB3 LYS 35 HB3 LYS 35 -12.873 -0.582 -15.491 927 HG2 LYS 35 HG2 LYS 35 -12.958 1.508 -16.621 928 HG3 LYS 35 HG3 LYS 35 -11.200 1.633 -16.717 929 HD2 LYS 35 HD2 LYS 35 -12.913 -0.378 -18.244 930 HD3 LYS 35 HD3 LYS 35 -12.223 1.103 -18.915 931 HE2 LYS 35 HE2 LYS 35 -9.931 0.215 -18.385 932 HE3 LYS 35 HE3 LYS 35 -10.676 -1.291 -17.849 933 HZ1 LYS 35 HZ1 LYS 35 -11.573 -1.556 -20.102 934 HZ2 LYS 35 HZ2 LYS 35 -9.885 -1.509 -20.073 935 HZ3 LYS 35 HZ3 LYS 35 -10.754 -0.155 -20.584 936 H LEU 36 H LEU 36 -10.769 0.815 -11.852 937 HA LEU 36 HA LEU 36 -11.553 -1.929 -10.996 938 HB2 LEU 36 HB2 LEU 36 -9.764 -2.152 -9.485 939 HB3 LEU 36 HB3 LEU 36 -9.037 -1.611 -10.973 940 HG LEU 36 HG LEU 36 -9.502 0.129 -8.523 941 HD11 LEU 36 HD11 LEU 36 -7.083 0.001 -8.136 942 HD12 LEU 36 HD12 LEU 36 -6.925 -1.137 -9.478 943 HD13 LEU 36 HD13 LEU 36 -7.838 -1.590 -8.036 944 HD21 LEU 36 HD21 LEU 36 -8.059 1.759 -9.584 945 HD22 LEU 36 HD22 LEU 36 -9.484 1.435 -10.566 946 HD23 LEU 36 HD23 LEU 36 -7.931 0.728 -11.013 947 H LYS 37 H LYS 37 -12.701 -2.173 -9.115 948 HA LYS 37 HA LYS 37 -14.117 0.181 -8.136 949 HB2 LYS 37 HB2 LYS 37 -15.346 -1.906 -8.711 950 HB3 LYS 37 HB3 LYS 37 -14.489 -2.761 -7.433 951 HG2 LYS 37 HG2 LYS 37 -15.537 -1.264 -5.753 952 HG3 LYS 37 HG3 LYS 37 -16.400 -0.431 -7.045 953 HD2 LYS 37 HD2 LYS 37 -16.744 -3.379 -6.333 954 HD3 LYS 37 HD3 LYS 37 -17.808 -2.079 -5.798 955 HE2 LYS 37 HE2 LYS 37 -18.947 -3.049 -7.625 956 HE3 LYS 37 HE3 LYS 37 -18.210 -1.607 -8.313 957 HZ1 LYS 37 HZ1 LYS 37 -16.487 -2.967 -9.270 958 HZ2 LYS 37 HZ2 LYS 37 -17.994 -3.566 -9.729 959 HZ3 LYS 37 HZ3 LYS 37 -17.105 -4.354 -8.528 960 H ALA 38 H ALA 38 -12.152 -2.472 -6.719 961 HA ALA 38 HA ALA 38 -12.126 -1.436 -4.082 962 HB1 ALA 38 HB1 ALA 38 -10.432 -3.155 -3.637 963 HB2 ALA 38 HB2 ALA 38 -10.235 -3.434 -5.369 964 HB3 ALA 38 HB3 ALA 38 -11.768 -3.814 -4.580 965 H ASP 39 H ASP 39 -11.150 0.346 -3.430 966 HA ASP 39 HA ASP 39 -8.989 1.765 -4.558 967 HB2 ASP 39 HB2 ASP 39 -9.773 1.649 -1.617 968 HB3 ASP 39 HB3 ASP 39 -8.911 2.958 -2.428 969 H LYS 40 H LYS 40 -9.104 -1.031 -2.515 970 HA LYS 40 HA LYS 40 -6.673 -1.067 -1.176 971 HB2 LYS 40 HB2 LYS 40 -8.055 -3.529 -2.329 972 HB3 LYS 40 HB3 LYS 40 -7.026 -3.452 -0.895 973 HG2 LYS 40 HG2 LYS 40 -9.753 -2.147 -1.188 974 HG3 LYS 40 HG3 LYS 40 -9.436 -3.673 -0.355 975 HD2 LYS 40 HD2 LYS 40 -8.050 -2.462 1.311 976 HD3 LYS 40 HD3 LYS 40 -8.334 -0.943 0.451 977 HE2 LYS 40 HE2 LYS 40 -10.756 -1.131 0.918 978 HE3 LYS 40 HE3 LYS 40 -10.481 -2.657 1.765 979 HZ1 LYS 40 HZ1 LYS 40 -10.697 -0.757 3.251 980 HZ2 LYS 40 HZ2 LYS 40 -9.330 -0.043 2.560 981 HZ3 LYS 40 HZ3 LYS 40 -9.189 -1.507 3.400 982 H ASP 41 H ASP 41 -7.426 -2.492 -4.362 983 HA ASP 41 HA ASP 41 -4.847 -3.494 -4.976 984 HB2 ASP 41 HB2 ASP 41 -7.136 -2.709 -6.820 985 HB3 ASP 41 HB3 ASP 41 -5.714 -3.616 -7.332 986 H PHE 42 H PHE 42 -6.315 -0.311 -5.502 987 HA PHE 42 HA PHE 42 -4.308 0.859 -7.098 988 HB2 PHE 42 HB2 PHE 42 -6.390 2.056 -6.820 989 HB3 PHE 42 HB3 PHE 42 -6.190 2.121 -5.072 990 HD1 PHE 42 HD2 PHE 42 -4.413 3.210 -8.206 991 HD2 PHE 42 HD1 PHE 42 -5.356 4.128 -4.134 992 HE1 PHE 42 HE2 PHE 42 -3.278 5.372 -8.421 993 HE2 PHE 42 HE1 PHE 42 -4.205 6.291 -4.360 994 HZ PHE 42 HZ PHE 42 -3.169 6.916 -6.509 995 H PHE 43 H PHE 43 -4.581 0.600 -3.541 996 HA PHE 43 HA PHE 43 -2.250 2.124 -2.912 997 HB2 PHE 43 HB2 PHE 43 -3.508 -0.027 -1.159 998 HB3 PHE 43 HB3 PHE 43 -2.513 1.327 -0.627 999 HD1 PHE 43 HD1 PHE 43 -3.748 3.618 -2.101 1000 HD2 PHE 43 HD2 PHE 43 -5.579 0.307 -0.109 1001 HE1 PHE 43 HE1 PHE 43 -5.773 4.961 -1.720 1002 HE2 PHE 43 HE2 PHE 43 -7.598 1.643 0.264 1003 HZ PHE 43 HZ PHE 43 -7.695 3.972 -0.537 1004 H LEU 44 H LEU 44 -2.753 -1.366 -3.385 1005 HA LEU 44 HA LEU 44 -0.185 -2.304 -2.620 1006 HB2 LEU 44 HB2 LEU 44 -2.444 -3.423 -4.272 1007 HB3 LEU 44 HB3 LEU 44 -0.898 -4.244 -4.346 1008 HG LEU 44 HG LEU 44 -0.968 -4.708 -1.934 1009 HD11 LEU 44 HD11 LEU 44 -3.655 -3.315 -1.854 1010 HD12 LEU 44 HD12 LEU 44 -2.162 -2.728 -1.123 1011 HD13 LEU 44 HD13 LEU 44 -2.905 -4.212 -0.532 1012 HD21 LEU 44 HD21 LEU 44 -2.817 -6.319 -1.902 1013 HD22 LEU 44 HD22 LEU 44 -2.003 -6.336 -3.465 1014 HD23 LEU 44 HD23 LEU 44 -3.561 -5.522 -3.293 1015 H GLY 45 H GLY 45 -1.487 -1.451 -5.852 1016 HA2 GLY 45 HA2 GLY 45 0.895 -1.880 -7.352 1017 HA3 GLY 45 HA3 GLY 45 -0.468 -0.885 -7.841 1018 H LEU 46 H LEU 46 -0.466 1.049 -5.875 1019 HA LEU 46 HA LEU 46 1.450 2.944 -6.751 1020 HB2 LEU 46 HB2 LEU 46 -0.788 3.523 -5.876 1021 HB3 LEU 46 HB3 LEU 46 -0.338 2.930 -4.287 1022 HG LEU 46 HG LEU 46 1.377 4.768 -4.133 1023 HD11 LEU 46 HD11 LEU 46 1.289 6.649 -5.710 1024 HD12 LEU 46 HD12 LEU 46 0.138 5.766 -6.715 1025 HD13 LEU 46 HD13 LEU 46 1.784 5.156 -6.509 1026 HD21 LEU 46 HD21 LEU 46 -1.474 5.718 -4.591 1027 HD22 LEU 46 HD22 LEU 46 -0.226 6.574 -3.681 1028 HD23 LEU 46 HD23 LEU 46 -0.838 5.031 -3.093 1029 H GLY 47 H GLY 47 1.393 0.736 -4.036 1030 HA2 GLY 47 HA2 GLY 47 3.563 1.801 -2.504 1031 HA3 GLY 47 HA3 GLY 47 2.901 0.174 -2.381 1032 H TRP 48 H TRP 48 3.322 -0.506 -5.154 1033 HA TRP 48 HA TRP 48 6.068 -1.321 -5.180 1034 HB2 TRP 48 HB2 TRP 48 4.056 -2.544 -6.265 1035 HB3 TRP 48 HB3 TRP 48 4.185 -1.376 -7.580 1036 HD1 TRP 48 HD1 TRP 48 6.392 -1.595 -9.183 1037 HE1 TRP 48 HE1 TRP 48 8.100 -3.485 -9.502 1038 HE3 TRP 48 HE3 TRP 48 5.153 -4.460 -5.159 1039 HZ2 TRP 48 HZ2 TRP 48 8.811 -5.902 -8.225 1040 HZ3 TRP 48 HZ3 TRP 48 6.378 -6.548 -4.771 1041 HH2 TRP 48 HH2 TRP 48 8.166 -7.270 -6.271 1042 H LEU 49 H LEU 49 4.218 1.224 -6.836 1043 HA LEU 49 HA LEU 49 6.286 2.315 -8.420 1044 HB2 LEU 49 HB2 LEU 49 3.696 3.372 -7.294 1045 HB3 LEU 49 HB3 LEU 49 4.791 4.492 -8.067 1046 HG LEU 49 HG LEU 49 4.529 3.456 -10.218 1047 HD11 LEU 49 HD11 LEU 49 3.239 1.442 -10.637 1048 HD12 LEU 49 HD12 LEU 49 3.019 1.217 -8.893 1049 HD13 LEU 49 HD13 LEU 49 4.634 1.131 -9.603 1050 HD21 LEU 49 HD21 LEU 49 2.655 4.924 -9.534 1051 HD22 LEU 49 HD22 LEU 49 1.785 3.521 -8.912 1052 HD23 LEU 49 HD23 LEU 49 2.123 3.659 -10.640 1053 H LEU 50 H LEU 50 5.523 2.765 -4.995 1054 HA LEU 50 HA LEU 50 7.336 4.883 -4.417 1055 HB2 LEU 50 HB2 LEU 50 6.077 2.796 -2.617 1056 HB3 LEU 50 HB3 LEU 50 7.085 4.092 -1.998 1057 HG LEU 50 HG LEU 50 4.441 4.486 -3.480 1058 HD11 LEU 50 HD11 LEU 50 5.047 4.803 -0.518 1059 HD12 LEU 50 HD12 LEU 50 4.077 3.523 -1.254 1060 HD13 LEU 50 HD13 LEU 50 3.519 5.192 -1.316 1061 HD21 LEU 50 HD21 LEU 50 4.637 6.856 -2.829 1062 HD22 LEU 50 HD22 LEU 50 5.975 6.366 -3.864 1063 HD23 LEU 50 HD23 LEU 50 6.229 6.545 -2.121 1064 H ARG 51 H ARG 51 7.876 1.294 -4.361 1065 HA ARG 51 HA ARG 51 10.507 1.491 -3.198 1066 HB2 ARG 51 HB2 ARG 51 10.860 -0.856 -3.815 1067 HB3 ARG 51 HB3 ARG 51 9.292 -0.618 -3.084 1068 HG2 ARG 51 HG2 ARG 51 8.251 -0.686 -5.348 1069 HG3 ARG 51 HG3 ARG 51 9.833 -1.066 -6.024 1070 HD2 ARG 51 HD2 ARG 51 8.400 -2.738 -3.934 1071 HD3 ARG 51 HD3 ARG 51 8.354 -3.053 -5.667 1072 HE ARG 51 HE ARG 51 10.953 -3.100 -5.307 1073 HH11 ARG 51 HH11 ARG 51 8.535 -4.538 -3.291 1074 HH12 ARG 51 HH12 ARG 51 9.584 -5.804 -2.764 1075 HH21 ARG 51 HH21 ARG 51 12.264 -4.733 -4.605 1076 HH22 ARG 51 HH22 ARG 51 11.659 -5.900 -3.479 1077 H GLU 52 H GLU 52 9.309 1.567 -6.473 1078 HA GLU 52 HA GLU 52 11.905 1.488 -7.754 1079 HB2 GLU 52 HB2 GLU 52 9.169 2.256 -8.865 1080 HB3 GLU 52 HB3 GLU 52 10.605 1.875 -9.819 1081 HG2 GLU 52 HG2 GLU 52 10.567 -0.439 -8.994 1082 HG3 GLU 52 HG3 GLU 52 9.180 -0.071 -7.969 1083 H ASP 53 H ASP 53 9.832 3.878 -6.357 1084 HA ASP 53 HA ASP 53 10.099 6.028 -5.768 1085 HB2 ASP 53 HB2 ASP 53 12.505 5.381 -5.343 1086 HB3 ASP 53 HB3 ASP 53 12.900 5.896 -6.980 1087 H LYS 54 H LYS 54 9.229 5.055 -8.491 1088 HA LYS 54 HA LYS 54 9.773 7.226 -10.333 1089 HB2 LYS 54 HB2 LYS 54 8.107 6.029 -11.815 1090 HB3 LYS 54 HB3 LYS 54 9.502 5.073 -11.335 1091 HG2 LYS 54 HG2 LYS 54 8.241 3.744 -9.829 1092 HG3 LYS 54 HG3 LYS 54 6.881 4.866 -9.835 1093 HD2 LYS 54 HD2 LYS 54 6.500 2.731 -11.137 1094 HD3 LYS 54 HD3 LYS 54 6.231 4.213 -12.049 1095 HE2 LYS 54 HE2 LYS 54 7.414 2.562 -13.415 1096 HE3 LYS 54 HE3 LYS 54 8.450 3.954 -13.117 1097 HZ1 LYS 54 HZ1 LYS 54 9.602 2.697 -11.425 1098 HZ2 LYS 54 HZ2 LYS 54 9.621 1.854 -12.886 1099 HZ3 LYS 54 HZ3 LYS 54 8.563 1.384 -11.658 1100 H VAL 55 H VAL 55 7.643 6.917 -7.712 1101 HA VAL 55 HA VAL 55 6.035 9.180 -8.735 1102 HB VAL 55 HB VAL 55 3.968 8.429 -7.700 1103 HG11 VAL 55 HG11 VAL 55 5.078 6.228 -9.473 1104 HG12 VAL 55 HG12 VAL 55 4.333 7.731 -10.024 1105 HG13 VAL 55 HG13 VAL 55 3.369 6.537 -9.151 1106 HG21 VAL 55 HG21 VAL 55 3.718 6.175 -6.667 1107 HG22 VAL 55 HG22 VAL 55 4.839 7.198 -5.769 1108 HG23 VAL 55 HG23 VAL 55 5.460 5.924 -6.821 1109 H VAL 56 H VAL 56 5.041 10.478 -7.135 1110 HA VAL 56 HA VAL 56 5.941 10.217 -4.348 1111 HB VAL 56 HB VAL 56 5.959 12.733 -4.156 1112 HG11 VAL 56 HG11 VAL 56 7.959 11.629 -6.168 1113 HG12 VAL 56 HG12 VAL 56 8.100 11.537 -4.412 1114 HG13 VAL 56 HG13 VAL 56 8.165 13.104 -5.219 1115 HG21 VAL 56 HG21 VAL 56 4.536 13.288 -6.104 1116 HG22 VAL 56 HG22 VAL 56 5.784 12.692 -7.200 1117 HG23 VAL 56 HG23 VAL 56 6.089 14.125 -6.213 1118 H THR 57 H THR 57 4.351 10.645 -2.798 1119 HA THR 57 HA THR 57 1.573 10.715 -3.820 1120 HB THR 57 HB THR 57 0.954 9.846 -1.528 1121 HG1 THR 57 HG1 THR 57 2.430 9.672 -0.011 1122 HG21 THR 57 HG21 THR 57 1.822 7.552 -1.850 1123 HG22 THR 57 HG22 THR 57 2.999 8.159 -3.016 1124 HG23 THR 57 HG23 THR 57 1.273 8.248 -3.377 1125 H SER 58 H SER 58 0.099 12.209 -3.121 1126 HA SER 58 HA SER 58 0.771 14.305 -1.186 1127 HB2 SER 58 HB2 SER 58 0.198 14.915 -4.131 1128 HB3 SER 58 HB3 SER 58 0.225 16.133 -2.854 1129 HG SER 58 HG SER 58 2.505 14.673 -2.815 1130 H GLU 59 H GLU 59 -1.116 15.877 -1.001 1131 HA GLU 59 HA GLU 59 -3.744 14.572 -1.468 1132 HB2 GLU 59 HB2 GLU 59 -3.189 14.424 0.904 1133 HB3 GLU 59 HB3 GLU 59 -2.774 16.126 0.973 1134 HG2 GLU 59 HG2 GLU 59 -5.598 15.363 0.232 1135 HG3 GLU 59 HG3 GLU 59 -5.096 15.201 1.912 1136 H VAL 60 H VAL 60 -4.953 15.721 -2.827 1137 HA VAL 60 HA VAL 60 -4.816 18.689 -2.840 1138 HB VAL 60 HB VAL 60 -5.219 16.772 -5.177 1139 HG11 VAL 60 HG11 VAL 60 -5.809 19.762 -5.214 1140 HG12 VAL 60 HG12 VAL 60 -6.987 18.466 -5.433 1141 HG13 VAL 60 HG13 VAL 60 -5.725 18.720 -6.638 1142 HG21 VAL 60 HG21 VAL 60 -2.888 17.386 -4.630 1143 HG22 VAL 60 HG22 VAL 60 -3.300 19.098 -4.778 1144 HG23 VAL 60 HG23 VAL 60 -3.368 18.049 -6.196 1145 H GLU 61 H GLU 61 -6.490 19.451 -1.837 1146 HA GLU 61 HA GLU 61 -8.559 19.933 -1.071 1147 HB2 GLU 61 HB2 GLU 61 -9.337 19.071 -3.883 1148 HB3 GLU 61 HB3 GLU 61 -10.227 20.199 -2.858 1149 HG2 GLU 61 HG2 GLU 61 -7.446 20.619 -4.017 1150 HG3 GLU 61 HG3 GLU 61 -8.926 21.378 -4.586 1151 H GLY 62 H GLY 62 -7.900 17.450 -0.121 1152 HA2 GLY 62 HA2 GLY 62 -9.018 15.949 1.273 1153 HA3 GLY 62 HA3 GLY 62 -10.522 16.343 0.473 1154 H GLU 63 H GLU 63 -8.295 15.611 -1.892 1155 HA GLU 63 HA GLU 63 -9.098 12.749 -2.064 1156 HB2 GLU 63 HB2 GLU 63 -10.206 14.147 -3.749 1157 HB3 GLU 63 HB3 GLU 63 -8.681 14.874 -4.226 1158 HG2 GLU 63 HG2 GLU 63 -9.388 13.319 -5.917 1159 HG3 GLU 63 HG3 GLU 63 -7.936 12.702 -5.137 1160 H ILE 64 H ILE 64 -7.518 11.232 -2.737 1161 HA ILE 64 HA ILE 64 -4.743 11.757 -2.268 1162 HB ILE 64 HB ILE 64 -5.981 9.369 -3.734 1163 HG12 ILE 64 HG12 ILE 64 -5.314 9.656 -0.772 1164 HG13 ILE 64 HG13 ILE 64 -6.938 9.655 -1.455 1165 HG21 ILE 64 HG21 ILE 64 -3.920 8.148 -3.134 1166 HG22 ILE 64 HG22 ILE 64 -3.256 9.611 -2.402 1167 HG23 ILE 64 HG23 ILE 64 -3.555 9.553 -4.140 1168 HD11 ILE 64 HD11 ILE 64 -4.989 7.345 -1.461 1169 HD12 ILE 64 HD12 ILE 64 -6.587 7.332 -2.211 1170 HD13 ILE 64 HD13 ILE 64 -6.434 7.520 -0.467 1171 H PHE 65 H PHE 65 -3.293 12.661 -3.666 1172 HA PHE 65 HA PHE 65 -3.718 12.489 -6.601 1173 HB2 PHE 65 HB2 PHE 65 -4.310 14.754 -5.757 1174 HB3 PHE 65 HB3 PHE 65 -2.716 14.914 -5.036 1175 HD1 PHE 65 HD2 PHE 65 -4.442 14.468 -8.327 1176 HD2 PHE 65 HD1 PHE 65 -0.934 15.860 -6.324 1177 HE1 PHE 65 HE2 PHE 65 -3.637 15.459 -10.423 1178 HE2 PHE 65 HE1 PHE 65 -0.145 16.857 -8.426 1179 HZ PHE 65 HZ PHE 65 -1.489 16.658 -10.474 1180 H VAL 66 H VAL 66 -2.092 11.308 -7.442 1181 HA VAL 66 HA VAL 66 0.599 11.390 -6.179 1182 HB VAL 66 HB VAL 66 0.959 9.071 -6.915 1183 HG11 VAL 66 HG11 VAL 66 -1.622 9.389 -5.324 1184 HG12 VAL 66 HG12 VAL 66 0.019 9.441 -4.671 1185 HG13 VAL 66 HG13 VAL 66 -0.607 7.943 -5.359 1186 HG21 VAL 66 HG21 VAL 66 -0.902 7.684 -7.831 1187 HG22 VAL 66 HG22 VAL 66 -0.449 8.986 -8.932 1188 HG23 VAL 66 HG23 VAL 66 -1.910 9.131 -7.953 1189 H LYS 67 H LYS 67 2.403 11.629 -7.461 1190 HA LYS 67 HA LYS 67 1.950 12.383 -10.313 1191 HB2 LYS 67 HB2 LYS 67 3.865 13.684 -8.319 1192 HB3 LYS 67 HB3 LYS 67 3.679 14.139 -10.013 1193 HG2 LYS 67 HG2 LYS 67 1.341 14.831 -9.550 1194 HG3 LYS 67 HG3 LYS 67 1.564 14.414 -7.846 1195 HD2 LYS 67 HD2 LYS 67 3.125 16.539 -9.381 1196 HD3 LYS 67 HD3 LYS 67 1.804 16.856 -8.253 1197 HE2 LYS 67 HE2 LYS 67 3.134 16.012 -6.387 1198 HE3 LYS 67 HE3 LYS 67 4.412 15.488 -7.487 1199 HZ1 LYS 67 HZ1 LYS 67 4.803 17.771 -8.079 1200 HZ2 LYS 67 HZ2 LYS 67 4.963 17.561 -6.412 1201 HZ3 LYS 67 HZ3 LYS 67 3.574 18.291 -7.044 1202 H LEU 68 H LEU 68 3.873 12.169 -11.716 1203 HA LEU 68 HA LEU 68 5.539 9.856 -11.048 1204 HB2 LEU 68 HB2 LEU 68 5.293 11.515 -13.591 1205 HB3 LEU 68 HB3 LEU 68 6.342 10.112 -13.433 1206 HG LEU 68 HG LEU 68 3.295 10.078 -13.242 1207 HD11 LEU 68 HD11 LEU 68 3.344 8.830 -15.347 1208 HD12 LEU 68 HD12 LEU 68 5.103 8.971 -15.422 1209 HD13 LEU 68 HD13 LEU 68 4.092 10.415 -15.541 1210 HD21 LEU 68 HD21 LEU 68 3.491 7.624 -13.128 1211 HD22 LEU 68 HD22 LEU 68 4.276 8.393 -11.753 1212 HD23 LEU 68 HD23 LEU 68 5.253 7.754 -13.077 1213 H VAL 69 H VAL 69 6.198 11.814 -9.309 1214 HA VAL 69 HA VAL 69 7.710 13.254 -8.430 1215 HB VAL 69 HB VAL 69 9.777 11.923 -10.247 1216 HG11 VAL 69 HG11 VAL 69 10.673 13.830 -8.949 1217 HG12 VAL 69 HG12 VAL 69 11.355 12.311 -8.372 1218 HG13 VAL 69 HG13 VAL 69 10.079 13.109 -7.450 1219 HG21 VAL 69 HG21 VAL 69 8.451 10.145 -9.198 1220 HG22 VAL 69 HG22 VAL 69 8.697 10.863 -7.603 1221 HG23 VAL 69 HG23 VAL 69 10.070 10.193 -8.492 1222 H LEU 70 H LEU 70 6.197 14.267 -10.579 1223 HA LEU 70 HA LEU 70 8.013 16.217 -11.888 1224 HB2 LEU 70 HB2 LEU 70 5.552 14.855 -13.044 1225 HB3 LEU 70 HB3 LEU 70 6.365 16.217 -13.804 1226 HG LEU 70 HG LEU 70 7.598 13.468 -13.337 1227 HD11 LEU 70 HD11 LEU 70 5.876 13.399 -15.066 1228 HD12 LEU 70 HD12 LEU 70 7.475 13.207 -15.775 1229 HD13 LEU 70 HD13 LEU 70 6.632 14.753 -15.915 1230 HD21 LEU 70 HD21 LEU 70 9.312 15.216 -13.226 1231 HD22 LEU 70 HD22 LEU 70 8.761 15.894 -14.760 1232 HD23 LEU 70 HD23 LEU 70 9.486 14.284 -14.713 1233 H GLU 71 H GLU 71 7.459 18.297 -11.825 1234 HA GLU 71 HA GLU 71 4.847 19.377 -11.611 1235 HB2 GLU 71 HB2 GLU 71 4.988 20.453 -9.400 1236 HB3 GLU 71 HB3 GLU 71 5.071 18.706 -9.226 1237 HG2 GLU 71 HG2 GLU 71 7.538 18.882 -8.946 1238 HG3 GLU 71 HG3 GLU 71 7.406 20.637 -9.044 1239 H HIS 72 H HIS 72 4.958 21.835 -11.462 1240 HA HIS 72 HA HIS 72 7.401 22.786 -12.862 1241 HB2 HIS 72 HB2 HIS 72 5.866 24.449 -13.984 1242 HB3 HIS 72 HB3 HIS 72 5.538 22.769 -14.386 1243 HD1 HIS 72 HD1 HIS 72 3.297 21.754 -13.563 1244 HD2 HIS 72 HD2 HIS 72 3.777 25.773 -12.611 1245 HE1 HIS 72 HE1 HIS 72 1.031 22.551 -12.844 1246 HE2 HIS 72 HE2 HIS 72 1.307 25.020 -12.511 1247 H HIS 73 H HIS 73 6.995 22.835 -9.927 1248 HA HIS 73 HA HIS 73 8.019 25.514 -9.559 1249 HB2 HIS 73 HB2 HIS 73 6.457 25.960 -7.536 1250 HB3 HIS 73 HB3 HIS 73 5.823 26.221 -9.151 1251 HD1 HIS 73 HD1 HIS 73 5.786 23.270 -6.683 1252 HD2 HIS 73 HD2 HIS 73 3.296 25.284 -9.338 1253 HE1 HIS 73 HE1 HIS 73 3.537 22.191 -6.448 1254 HE2 HIS 73 HE2 HIS 73 2.021 23.528 -7.936 1255 H HIS 74 H HIS 74 9.906 25.091 -8.621 1256 HA HIS 74 HA HIS 74 10.405 22.832 -6.922 1257 HB2 HIS 74 HB2 HIS 74 12.709 24.012 -6.589 1258 HB3 HIS 74 HB3 HIS 74 12.289 23.394 -8.174 1259 HD1 HIS 74 HD1 HIS 74 13.643 24.909 -9.604 1260 HD2 HIS 74 HD2 HIS 74 11.343 27.038 -6.878 1261 HE1 HIS 74 HE1 HIS 74 13.919 27.318 -10.238 1262 HE2 HIS 74 HE2 HIS 74 12.370 28.557 -8.697 1263 H HIS 75 H HIS 75 8.868 23.110 -5.310 1264 HA HIS 75 HA HIS 75 8.778 25.301 -3.479 1265 HB2 HIS 75 HB2 HIS 75 7.106 23.911 -2.254 1266 HB3 HIS 75 HB3 HIS 75 6.750 24.052 -3.967 1267 HD1 HIS 75 HD1 HIS 75 5.771 21.758 -1.946 1268 HD2 HIS 75 HD2 HIS 75 8.737 21.399 -4.831 1269 HE1 HIS 75 HE1 HIS 75 5.893 19.311 -2.491 1270 HE2 HIS 75 HE2 HIS 75 7.490 19.179 -4.422 1271 H HIS 76 H HIS 76 10.752 25.589 -2.430 1272 HA HIS 76 HA HIS 76 11.785 23.531 -0.621 1273 HB2 HIS 76 HB2 HIS 76 12.664 26.389 -1.180 1274 HB3 HIS 76 HB3 HIS 76 13.408 25.399 0.073 1275 HD1 HIS 76 HD1 HIS 76 15.091 23.642 -0.647 1276 HD2 HIS 76 HD2 HIS 76 13.204 25.472 -3.868 1277 HE1 HIS 76 HE1 HIS 76 16.323 22.852 -2.682 1278 HE2 HIS 76 HE2 HIS 76 15.194 23.994 -4.613 1279 H HIS 77 H HIS 77 9.810 26.467 -0.446 1280 HA HIS 77 HA HIS 77 9.422 26.083 2.467 1281 HB2 HIS 77 HB2 HIS 77 8.235 28.292 2.405 1282 HB3 HIS 77 HB3 HIS 77 9.914 28.381 1.915 1283 HD1 HIS 77 HD1 HIS 77 10.106 30.146 0.195 1284 HD2 HIS 77 HD2 HIS 77 6.613 27.949 -0.305 1285 HE1 HIS 77 HE1 HIS 77 8.971 31.131 -1.812 1286 HE2 HIS 77 HE2 HIS 77 6.891 29.767 -2.126 Start of MODEL 18 1 H1 MET 1 H1 MET 1 13.777 11.258 1.190 2 H2 MET 1 H2 MET 1 14.119 11.584 2.811 3 H3 MET 1 H3 MET 1 15.293 11.868 1.629 4 HA MET 1 HA MET 1 14.344 13.926 2.338 5 HB2 MET 1 HB2 MET 1 13.512 13.087 -0.474 6 HB3 MET 1 HB3 MET 1 13.523 14.757 0.087 7 HG2 MET 1 HG2 MET 1 15.944 14.618 0.477 8 HG3 MET 1 HG3 MET 1 15.938 12.944 -0.075 9 HE1 MET 1 HE1 MET 1 17.917 13.589 -1.796 10 HE2 MET 1 HE2 MET 1 17.865 15.271 -1.262 11 HE3 MET 1 HE3 MET 1 17.777 14.887 -2.980 12 H LYS 2 H LYS 2 12.541 15.244 2.745 13 HA LYS 2 HA LYS 2 10.663 13.918 4.282 14 HB2 LYS 2 HB2 LYS 2 11.477 16.212 4.670 15 HB3 LYS 2 HB3 LYS 2 10.564 16.786 3.281 16 HG2 LYS 2 HG2 LYS 2 8.463 16.388 4.384 17 HG3 LYS 2 HG3 LYS 2 9.243 15.496 5.694 18 HD2 LYS 2 HD2 LYS 2 9.626 18.466 5.119 19 HD3 LYS 2 HD3 LYS 2 8.567 17.802 6.367 20 HE2 LYS 2 HE2 LYS 2 10.513 16.827 7.524 21 HE3 LYS 2 HE3 LYS 2 11.582 17.404 6.245 22 HZ1 LYS 2 HZ1 LYS 2 9.963 19.131 8.023 23 HZ2 LYS 2 HZ2 LYS 2 11.051 19.660 6.841 24 HZ3 LYS 2 HZ3 LYS 2 11.613 18.822 8.200 25 H MET 3 H MET 3 8.941 12.783 3.772 26 HA MET 3 HA MET 3 6.830 13.556 2.003 27 HB2 MET 3 HB2 MET 3 8.646 12.829 0.370 28 HB3 MET 3 HB3 MET 3 8.589 11.223 1.071 29 HG2 MET 3 HG2 MET 3 6.262 10.981 0.299 30 HG3 MET 3 HG3 MET 3 6.320 12.598 -0.400 31 HE1 MET 3 HE1 MET 3 9.280 12.689 -1.643 32 HE2 MET 3 HE2 MET 3 7.850 13.249 -2.513 33 HE3 MET 3 HE3 MET 3 8.966 12.120 -3.283 34 H LEU 4 H LEU 4 5.053 11.887 2.021 35 HA LEU 4 HA LEU 4 4.680 10.473 4.441 36 HB2 LEU 4 HB2 LEU 4 2.606 9.778 3.648 37 HB3 LEU 4 HB3 LEU 4 2.893 11.199 2.664 38 HG LEU 4 HG LEU 4 3.284 8.316 1.739 39 HD11 LEU 4 HD11 LEU 4 0.927 8.806 2.086 40 HD12 LEU 4 HD12 LEU 4 1.289 8.618 0.374 41 HD13 LEU 4 HD13 LEU 4 1.043 10.233 1.047 42 HD21 LEU 4 HD21 LEU 4 4.807 9.793 0.539 43 HD22 LEU 4 HD22 LEU 4 3.480 10.878 0.120 44 HD23 LEU 4 HD23 LEU 4 3.523 9.239 -0.535 45 H LYS 5 H LYS 5 6.496 9.580 1.721 46 HA LYS 5 HA LYS 5 6.485 6.747 1.804 47 HB2 LYS 5 HB2 LYS 5 7.297 8.233 -0.078 48 HB3 LYS 5 HB3 LYS 5 8.697 8.646 0.911 49 HG2 LYS 5 HG2 LYS 5 9.471 6.326 0.841 50 HG3 LYS 5 HG3 LYS 5 8.024 5.848 -0.052 51 HD2 LYS 5 HD2 LYS 5 9.878 6.062 -1.611 52 HD3 LYS 5 HD3 LYS 5 8.704 7.340 -1.930 53 HE2 LYS 5 HE2 LYS 5 10.969 8.229 -2.063 54 HE3 LYS 5 HE3 LYS 5 10.143 8.936 -0.677 55 HZ1 LYS 5 HZ1 LYS 5 12.444 8.217 -0.234 56 HZ2 LYS 5 HZ2 LYS 5 11.980 6.617 -0.501 57 HZ3 LYS 5 HZ3 LYS 5 11.308 7.490 0.786 58 H GLU 6 H GLU 6 8.428 9.231 3.424 59 HA GLU 6 HA GLU 6 10.255 7.513 4.784 60 HB2 GLU 6 HB2 GLU 6 9.449 10.292 5.741 61 HB3 GLU 6 HB3 GLU 6 10.989 9.467 5.982 62 HG2 GLU 6 HG2 GLU 6 9.927 10.586 3.360 63 HG3 GLU 6 HG3 GLU 6 11.176 11.307 4.371 64 H LYS 7 H LYS 7 7.193 9.068 5.655 65 HA LYS 7 HA LYS 7 6.804 8.128 8.275 66 HB2 LYS 7 HB2 LYS 7 5.367 9.842 7.220 67 HB3 LYS 7 HB3 LYS 7 4.761 8.650 6.077 68 HG2 LYS 7 HG2 LYS 7 3.995 7.392 8.313 69 HG3 LYS 7 HG3 LYS 7 4.097 9.022 8.989 70 HD2 LYS 7 HD2 LYS 7 2.522 9.823 7.242 71 HD3 LYS 7 HD3 LYS 7 2.438 8.184 6.577 72 HE2 LYS 7 HE2 LYS 7 1.519 7.406 8.789 73 HE3 LYS 7 HE3 LYS 7 1.490 9.086 9.325 74 HZ1 LYS 7 HZ1 LYS 7 0.002 8.013 6.993 75 HZ2 LYS 7 HZ2 LYS 7 -0.073 9.593 7.578 76 HZ3 LYS 7 HZ3 LYS 7 -0.660 8.316 8.518 77 H ALA 8 H ALA 8 6.000 6.616 5.151 78 HA ALA 8 HA ALA 8 4.679 4.294 6.067 79 HB1 ALA 8 HB1 ALA 8 5.099 3.390 3.811 80 HB2 ALA 8 HB2 ALA 8 6.283 4.667 3.506 81 HB3 ALA 8 HB3 ALA 8 4.580 5.074 3.731 82 H GLY 9 H GLY 9 8.100 5.005 5.536 83 HA2 GLY 9 HA2 GLY 9 9.170 2.424 6.154 84 HA3 GLY 9 HA3 GLY 9 10.038 3.952 6.190 85 H ALA 10 H ALA 10 8.414 5.281 8.131 86 HA ALA 10 HA ALA 10 9.564 4.429 10.588 87 HB1 ALA 10 HB1 ALA 10 8.979 6.784 10.135 88 HB2 ALA 10 HB2 ALA 10 8.198 6.216 11.615 89 HB3 ALA 10 HB3 ALA 10 7.264 6.367 10.121 90 H LEU 11 H LEU 11 6.262 4.178 9.286 91 HA LEU 11 HA LEU 11 5.071 2.760 11.455 92 HB2 LEU 11 HB2 LEU 11 4.229 2.923 8.530 93 HB3 LEU 11 HB3 LEU 11 3.222 2.306 9.836 94 HG LEU 11 HG LEU 11 4.213 5.177 9.579 95 HD11 LEU 11 HD11 LEU 11 1.887 5.765 9.088 96 HD12 LEU 11 HD12 LEU 11 1.437 4.058 9.103 97 HD13 LEU 11 HD13 LEU 11 2.552 4.671 7.878 98 HD21 LEU 11 HD21 LEU 11 2.715 5.689 11.467 99 HD22 LEU 11 HD22 LEU 11 3.971 4.546 11.932 100 HD23 LEU 11 HD23 LEU 11 2.327 3.975 11.637 101 H ALA 12 H ALA 12 6.754 1.783 8.512 102 HA ALA 12 HA ALA 12 6.267 -0.981 8.489 103 HB1 ALA 12 HB1 ALA 12 8.809 0.451 7.635 104 HB2 ALA 12 HB2 ALA 12 7.369 0.218 6.644 105 HB3 ALA 12 HB3 ALA 12 8.314 -1.182 7.153 106 H GLY 13 H GLY 13 8.800 0.859 10.159 107 HA2 GLY 13 HA2 GLY 13 10.302 -1.212 11.281 108 HA3 GLY 13 HA3 GLY 13 10.150 0.402 11.953 109 H GLN 14 H GLN 14 7.602 0.579 12.813 110 HA GLN 14 HA GLN 14 7.654 -0.926 15.248 111 HB2 GLN 14 HB2 GLN 14 5.585 0.314 15.832 112 HB3 GLN 14 HB3 GLN 14 6.857 1.379 15.239 113 HG2 GLN 14 HG2 GLN 14 5.718 1.360 12.992 114 HG3 GLN 14 HG3 GLN 14 4.397 0.457 13.731 115 HE21 GLN 14 HE21 GLN 14 6.016 3.549 13.563 116 HE22 GLN 14 HE22 GLN 14 4.762 4.463 14.323 117 H ILE 15 H ILE 15 5.685 -1.214 12.275 118 HA ILE 15 HA ILE 15 3.914 -3.261 13.200 119 HB ILE 15 HB ILE 15 4.742 -2.421 10.389 120 HG12 ILE 15 HG12 ILE 15 2.150 -2.036 11.964 121 HG13 ILE 15 HG13 ILE 15 3.362 -0.797 11.661 122 HG21 ILE 15 HG21 ILE 15 4.139 -4.809 10.248 123 HG22 ILE 15 HG22 ILE 15 2.925 -3.810 9.453 124 HG23 ILE 15 HG23 ILE 15 2.605 -4.481 11.050 125 HD11 ILE 15 HD11 ILE 15 1.438 -0.501 10.234 126 HD12 ILE 15 HD12 ILE 15 1.617 -2.132 9.592 127 HD13 ILE 15 HD13 ILE 15 2.849 -0.912 9.261 128 H TRP 16 H TRP 16 7.057 -3.383 11.538 129 HA TRP 16 HA TRP 16 7.420 -6.157 11.362 130 HB2 TRP 16 HB2 TRP 16 8.924 -4.464 10.282 131 HB3 TRP 16 HB3 TRP 16 9.565 -4.034 11.865 132 HD1 TRP 16 HD1 TRP 16 9.670 -6.836 9.244 133 HE1 TRP 16 HE1 TRP 16 11.662 -8.385 9.749 134 HE3 TRP 16 HE3 TRP 16 11.133 -4.868 13.746 135 HZ2 TRP 16 HZ2 TRP 16 13.590 -8.744 11.774 136 HZ3 TRP 16 HZ3 TRP 16 13.060 -5.879 14.906 137 HH2 TRP 16 HH2 TRP 16 14.259 -7.781 13.941 138 H GLU 17 H GLU 17 8.182 -3.908 14.045 139 HA GLU 17 HA GLU 17 9.374 -5.810 15.803 140 HB2 GLU 17 HB2 GLU 17 8.098 -3.116 16.434 141 HB3 GLU 17 HB3 GLU 17 9.004 -4.081 17.599 142 HG2 GLU 17 HG2 GLU 17 10.971 -3.950 15.983 143 HG3 GLU 17 HG3 GLU 17 10.046 -2.742 15.094 144 H ALA 18 H ALA 18 6.007 -4.891 15.300 145 HA ALA 18 HA ALA 18 4.854 -6.226 17.552 146 HB1 ALA 18 HB1 ALA 18 3.616 -5.652 14.827 147 HB2 ALA 18 HB2 ALA 18 3.598 -4.567 16.218 148 HB3 ALA 18 HB3 ALA 18 2.732 -6.101 16.293 149 H LEU 19 H LEU 19 5.771 -7.290 14.301 150 HA LEU 19 HA LEU 19 4.807 -10.025 14.652 151 HB2 LEU 19 HB2 LEU 19 6.329 -8.663 12.400 152 HB3 LEU 19 HB3 LEU 19 5.756 -10.325 12.334 153 HG LEU 19 HG LEU 19 3.967 -7.864 12.571 154 HD11 LEU 19 HD11 LEU 19 5.017 -7.958 10.367 155 HD12 LEU 19 HD12 LEU 19 3.300 -8.331 10.246 156 HD13 LEU 19 HD13 LEU 19 4.491 -9.632 10.155 157 HD21 LEU 19 HD21 LEU 19 2.098 -9.435 12.183 158 HD22 LEU 19 HD22 LEU 19 2.965 -9.811 13.666 159 HD23 LEU 19 HD23 LEU 19 3.225 -10.794 12.222 160 H ASN 20 H ASN 20 7.771 -8.309 15.227 161 HA ASN 20 HA ASN 20 9.677 -10.344 14.813 162 HB2 ASN 20 HB2 ASN 20 10.247 -7.928 15.068 163 HB3 ASN 20 HB3 ASN 20 9.877 -8.032 16.786 164 HD21 ASN 20 HD21 ASN 20 11.977 -7.534 17.450 165 HD22 ASN 20 HD22 ASN 20 13.319 -8.592 17.206 166 H GLY 21 H GLY 21 10.145 -12.159 15.906 167 HA2 GLY 21 HA2 GLY 21 10.241 -13.779 17.529 168 HA3 GLY 21 HA3 GLY 21 9.960 -12.536 18.733 169 H THR 22 H THR 22 7.552 -12.704 16.299 170 HA THR 22 HA THR 22 5.676 -14.138 18.100 171 HB THR 22 HB THR 22 4.903 -11.875 16.188 172 HG1 THR 22 HG1 THR 22 5.493 -10.488 17.666 173 HG21 THR 22 HG21 THR 22 3.035 -13.358 16.845 174 HG22 THR 22 HG22 THR 22 2.852 -11.760 17.574 175 HG23 THR 22 HG23 THR 22 3.429 -13.111 18.550 176 H GLU 23 H GLU 23 4.119 -15.479 17.145 177 HA GLU 23 HA GLU 23 4.735 -16.848 14.741 178 HB2 GLU 23 HB2 GLU 23 2.556 -18.023 15.135 179 HB3 GLU 23 HB3 GLU 23 3.592 -17.977 16.560 180 HG2 GLU 23 HG2 GLU 23 2.261 -16.154 17.517 181 HG3 GLU 23 HG3 GLU 23 1.254 -16.098 16.068 182 H GLY 24 H GLY 24 2.799 -13.986 15.298 183 HA2 GLY 24 HA2 GLY 24 2.418 -12.644 13.244 184 HA3 GLY 24 HA3 GLY 24 1.721 -14.085 12.526 185 H LEU 25 H LEU 25 0.547 -11.436 12.895 186 HA LEU 25 HA LEU 25 -1.852 -12.134 14.501 187 HB2 LEU 25 HB2 LEU 25 -0.613 -9.354 14.275 188 HB3 LEU 25 HB3 LEU 25 -2.118 -9.726 15.075 189 HG LEU 25 HG LEU 25 -0.594 -9.366 16.818 190 HD11 LEU 25 HD11 LEU 25 -1.940 -11.355 17.204 191 HD12 LEU 25 HD12 LEU 25 -0.375 -11.468 18.006 192 HD13 LEU 25 HD13 LEU 25 -0.668 -12.370 16.517 193 HD21 LEU 25 HD21 LEU 25 1.458 -11.107 15.428 194 HD22 LEU 25 HD22 LEU 25 1.653 -10.317 16.994 195 HD23 LEU 25 HD23 LEU 25 1.473 -9.346 15.537 196 H THR 26 H THR 26 -3.828 -10.997 13.775 197 HA THR 26 HA THR 26 -4.082 -10.664 10.911 198 HB THR 26 HB THR 26 -6.446 -10.056 11.355 199 HG1 THR 26 HG1 THR 26 -7.152 -9.535 13.284 200 HG21 THR 26 HG21 THR 26 -5.897 -12.451 11.213 201 HG22 THR 26 HG22 THR 26 -7.207 -12.172 12.360 202 HG23 THR 26 HG23 THR 26 -5.575 -12.491 12.953 203 H GLN 27 H GLN 27 -5.272 -8.635 10.065 204 HA GLN 27 HA GLN 27 -3.460 -6.521 10.164 205 HB2 GLN 27 HB2 GLN 27 -5.002 -5.313 8.673 206 HB3 GLN 27 HB3 GLN 27 -4.796 -6.982 8.194 207 HG2 GLN 27 HG2 GLN 27 -7.057 -6.868 7.899 208 HG3 GLN 27 HG3 GLN 27 -7.077 -7.262 9.615 209 HE21 GLN 27 HE21 GLN 27 -7.544 -4.710 7.247 210 HE22 GLN 27 HE22 GLN 27 -8.354 -3.616 8.309 211 H LYS 28 H LYS 28 -6.610 -6.746 11.812 212 HA LYS 28 HA LYS 28 -6.628 -4.202 13.054 213 HB2 LYS 28 HB2 LYS 28 -8.587 -5.811 12.875 214 HB3 LYS 28 HB3 LYS 28 -7.878 -6.759 14.168 215 HG2 LYS 28 HG2 LYS 28 -8.681 -3.847 14.533 216 HG3 LYS 28 HG3 LYS 28 -9.813 -5.177 14.769 217 HD2 LYS 28 HD2 LYS 28 -8.280 -6.097 16.547 218 HD3 LYS 28 HD3 LYS 28 -7.252 -4.677 16.353 219 HE2 LYS 28 HE2 LYS 28 -8.691 -4.363 18.283 220 HE3 LYS 28 HE3 LYS 28 -9.191 -3.238 17.018 221 HZ1 LYS 28 HZ1 LYS 28 -11.070 -4.334 18.091 222 HZ2 LYS 28 HZ2 LYS 28 -10.491 -5.845 17.601 223 HZ3 LYS 28 HZ3 LYS 28 -10.997 -4.713 16.449 224 H GLN 29 H GLN 29 -5.336 -7.338 14.205 225 HA GLN 29 HA GLN 29 -4.821 -6.522 16.875 226 HB2 GLN 29 HB2 GLN 29 -3.566 -8.806 15.311 227 HB3 GLN 29 HB3 GLN 29 -3.442 -8.593 17.054 228 HG2 GLN 29 HG2 GLN 29 -6.026 -9.072 15.536 229 HG3 GLN 29 HG3 GLN 29 -5.091 -10.313 16.363 230 HE21 GLN 29 HE21 GLN 29 -6.719 -10.883 17.766 231 HE22 GLN 29 HE22 GLN 29 -7.302 -9.862 19.029 232 H ILE 30 H ILE 30 -2.682 -6.594 14.011 233 HA ILE 30 HA ILE 30 -0.311 -5.710 15.348 234 HB ILE 30 HB ILE 30 -1.049 -5.266 12.421 235 HG12 ILE 30 HG12 ILE 30 0.501 -7.599 13.631 236 HG13 ILE 30 HG13 ILE 30 -1.175 -7.683 13.097 237 HG21 ILE 30 HG21 ILE 30 0.851 -3.872 13.140 238 HG22 ILE 30 HG22 ILE 30 1.398 -5.137 12.041 239 HG23 ILE 30 HG23 ILE 30 1.681 -5.296 13.775 240 HD11 ILE 30 HD11 ILE 30 -0.457 -7.202 10.806 241 HD12 ILE 30 HD12 ILE 30 0.312 -8.647 11.463 242 HD13 ILE 30 HD13 ILE 30 1.223 -7.141 11.351 243 H LYS 31 H LYS 31 -2.853 -4.012 13.515 244 HA LYS 31 HA LYS 31 -1.922 -1.373 13.648 245 HB2 LYS 31 HB2 LYS 31 -3.920 -2.385 12.313 246 HB3 LYS 31 HB3 LYS 31 -4.873 -2.141 13.773 247 HG2 LYS 31 HG2 LYS 31 -4.140 0.332 13.616 248 HG3 LYS 31 HG3 LYS 31 -3.586 -0.060 11.990 249 HD2 LYS 31 HD2 LYS 31 -5.784 0.910 11.820 250 HD3 LYS 31 HD3 LYS 31 -5.928 -0.808 11.438 251 HE2 LYS 31 HE2 LYS 31 -6.848 -1.265 13.652 252 HE3 LYS 31 HE3 LYS 31 -6.562 0.402 14.162 253 HZ1 LYS 31 HZ1 LYS 31 -8.421 -0.459 12.019 254 HZ2 LYS 31 HZ2 LYS 31 -8.148 1.136 12.508 255 HZ3 LYS 31 HZ3 LYS 31 -8.858 0.036 13.574 256 H LYS 32 H LYS 32 -3.740 -3.271 15.975 257 HA LYS 32 HA LYS 32 -4.349 -1.260 17.902 258 HB2 LYS 32 HB2 LYS 32 -5.574 -3.421 17.706 259 HB3 LYS 32 HB3 LYS 32 -4.123 -4.291 18.178 260 HG2 LYS 32 HG2 LYS 32 -5.650 -4.172 20.056 261 HG3 LYS 32 HG3 LYS 32 -4.207 -3.217 20.413 262 HD2 LYS 32 HD2 LYS 32 -5.446 -1.148 19.819 263 HD3 LYS 32 HD3 LYS 32 -6.884 -2.111 19.469 264 HE2 LYS 32 HE2 LYS 32 -6.937 -2.841 21.852 265 HE3 LYS 32 HE3 LYS 32 -5.532 -1.818 22.176 266 HZ1 LYS 32 HZ1 LYS 32 -7.583 -0.718 22.781 267 HZ2 LYS 32 HZ2 LYS 32 -8.178 -0.877 21.208 268 HZ3 LYS 32 HZ3 LYS 32 -6.836 0.107 21.511 269 H ALA 33 H ALA 33 -1.767 -3.718 17.653 270 HA ALA 33 HA ALA 33 -0.418 -3.168 20.094 271 HB1 ALA 33 HB1 ALA 33 1.387 -4.570 19.183 272 HB2 ALA 33 HB2 ALA 33 0.674 -4.463 17.569 273 HB3 ALA 33 HB3 ALA 33 -0.189 -5.297 18.862 274 H THR 34 H THR 34 -0.123 -1.817 16.870 275 HA THR 34 HA THR 34 2.296 -0.276 17.460 276 HB THR 34 HB THR 34 2.116 0.486 15.087 277 HG1 THR 34 HG1 THR 34 0.132 -1.344 14.446 278 HG21 THR 34 HG21 THR 34 3.363 -1.594 15.579 279 HG22 THR 34 HG22 THR 34 2.558 -1.687 14.014 280 HG23 THR 34 HG23 THR 34 1.875 -2.533 15.403 281 H LYS 35 H LYS 35 -0.986 0.175 18.004 282 HA LYS 35 HA LYS 35 -2.164 1.895 18.923 283 HB2 LYS 35 HB2 LYS 35 0.430 3.480 18.754 284 HB3 LYS 35 HB3 LYS 35 -1.005 3.998 19.634 285 HG2 LYS 35 HG2 LYS 35 -0.742 2.314 21.293 286 HG3 LYS 35 HG3 LYS 35 0.387 1.385 20.301 287 HD2 LYS 35 HD2 LYS 35 0.972 4.132 21.485 288 HD3 LYS 35 HD3 LYS 35 1.496 2.598 22.186 289 HE2 LYS 35 HE2 LYS 35 2.861 2.125 20.200 290 HE3 LYS 35 HE3 LYS 35 2.275 3.595 19.419 291 HZ1 LYS 35 HZ1 LYS 35 4.459 3.889 20.369 292 HZ2 LYS 35 HZ2 LYS 35 3.881 3.494 21.910 293 HZ3 LYS 35 HZ3 LYS 35 3.337 4.900 21.133 294 H LEU 36 H LEU 36 -1.774 1.516 15.984 295 HA LEU 36 HA LEU 36 -2.385 4.120 14.800 296 HB2 LEU 36 HB2 LEU 36 -2.373 1.323 13.586 297 HB3 LEU 36 HB3 LEU 36 -2.608 2.809 12.675 298 HG LEU 36 HG LEU 36 -0.064 2.042 14.175 299 HD11 LEU 36 HD11 LEU 36 0.950 1.716 11.953 300 HD12 LEU 36 HD12 LEU 36 -0.613 2.012 11.184 301 HD13 LEU 36 HD13 LEU 36 -0.391 0.605 12.227 302 HD21 LEU 36 HD21 LEU 36 -0.352 4.467 14.117 303 HD22 LEU 36 HD22 LEU 36 -0.605 4.429 12.371 304 HD23 LEU 36 HD23 LEU 36 0.964 3.985 13.048 305 H LYS 37 H LYS 37 -4.430 4.874 14.419 306 HA LYS 37 HA LYS 37 -6.749 3.370 15.394 307 HB2 LYS 37 HB2 LYS 37 -6.364 5.765 16.054 308 HB3 LYS 37 HB3 LYS 37 -6.585 6.240 14.373 309 HG2 LYS 37 HG2 LYS 37 -8.912 5.396 14.441 310 HG3 LYS 37 HG3 LYS 37 -8.679 4.902 16.122 311 HD2 LYS 37 HD2 LYS 37 -8.281 7.301 16.733 312 HD3 LYS 37 HD3 LYS 37 -8.597 7.755 15.053 313 HE2 LYS 37 HE2 LYS 37 -10.586 6.400 16.916 314 HE3 LYS 37 HE3 LYS 37 -10.576 8.114 16.495 315 HZ1 LYS 37 HZ1 LYS 37 -10.941 5.877 14.576 316 HZ2 LYS 37 HZ2 LYS 37 -10.967 7.523 14.198 317 HZ3 LYS 37 HZ3 LYS 37 -12.175 6.865 15.180 318 H ALA 38 H ALA 38 -5.568 4.827 12.392 319 HA ALA 38 HA ALA 38 -7.918 3.969 10.845 320 HB1 ALA 38 HB1 ALA 38 -7.017 5.362 9.028 321 HB2 ALA 38 HB2 ALA 38 -5.568 5.699 9.986 322 HB3 ALA 38 HB3 ALA 38 -7.141 6.287 10.529 323 H ASP 39 H ASP 39 -7.856 2.513 9.247 324 HA ASP 39 HA ASP 39 -6.011 0.394 9.104 325 HB2 ASP 39 HB2 ASP 39 -7.345 -0.359 7.162 326 HB3 ASP 39 HB3 ASP 39 -8.394 0.179 8.467 327 H LYS 40 H LYS 40 -6.239 3.383 7.319 328 HA LYS 40 HA LYS 40 -4.688 2.930 5.052 329 HB2 LYS 40 HB2 LYS 40 -4.948 5.512 6.654 330 HB3 LYS 40 HB3 LYS 40 -4.423 5.402 4.972 331 HG2 LYS 40 HG2 LYS 40 -7.155 4.574 6.017 332 HG3 LYS 40 HG3 LYS 40 -6.797 6.108 5.211 333 HD2 LYS 40 HD2 LYS 40 -6.202 4.890 3.139 334 HD3 LYS 40 HD3 LYS 40 -6.475 3.344 3.952 335 HE2 LYS 40 HE2 LYS 40 -8.612 5.460 3.531 336 HE3 LYS 40 HE3 LYS 40 -8.371 4.059 2.485 337 HZ1 LYS 40 HZ1 LYS 40 -8.817 2.626 4.400 338 HZ2 LYS 40 HZ2 LYS 40 -10.120 3.660 4.085 339 HZ3 LYS 40 HZ3 LYS 40 -9.076 3.988 5.377 340 H ASP 41 H ASP 41 -3.620 3.938 8.285 341 HA ASP 41 HA ASP 41 -0.874 4.404 7.654 342 HB2 ASP 41 HB2 ASP 41 -2.243 3.820 10.314 343 HB3 ASP 41 HB3 ASP 41 -0.563 4.343 10.157 344 H PHE 42 H PHE 42 -2.683 1.564 8.734 345 HA PHE 42 HA PHE 42 -0.486 -0.188 9.161 346 HB2 PHE 42 HB2 PHE 42 -2.713 -0.749 10.017 347 HB3 PHE 42 HB3 PHE 42 -3.368 -0.811 8.382 348 HD1 PHE 42 HD1 PHE 42 -0.840 -2.445 10.618 349 HD2 PHE 42 HD2 PHE 42 -3.348 -2.874 7.176 350 HE1 PHE 42 HE1 PHE 42 -0.240 -4.820 10.466 351 HE2 PHE 42 HE2 PHE 42 -2.744 -5.253 7.045 352 HZ PHE 42 HZ PHE 42 -1.190 -6.228 8.688 353 H PHE 43 H PHE 43 -2.407 0.569 6.223 354 HA PHE 43 HA PHE 43 -1.238 -1.338 4.474 355 HB2 PHE 43 HB2 PHE 43 -2.496 1.355 3.810 356 HB3 PHE 43 HB3 PHE 43 -2.103 0.119 2.619 357 HD1 PHE 43 HD2 PHE 43 -3.044 -2.376 3.815 358 HD2 PHE 43 HD1 PHE 43 -4.832 1.510 3.918 359 HE1 PHE 43 HE2 PHE 43 -5.261 -3.395 4.123 360 HE2 PHE 43 HE1 PHE 43 -7.039 0.483 4.214 361 HZ PHE 43 HZ PHE 43 -7.261 -1.971 4.317 362 H LEU 44 H LEU 44 -0.312 2.045 5.167 363 HA LEU 44 HA LEU 44 1.807 2.314 3.320 364 HB2 LEU 44 HB2 LEU 44 1.034 3.728 5.862 365 HB3 LEU 44 HB3 LEU 44 2.651 4.011 5.249 366 HG LEU 44 HG LEU 44 1.711 4.840 3.106 367 HD11 LEU 44 HD11 LEU 44 -0.662 5.341 2.837 368 HD12 LEU 44 HD12 LEU 44 -1.022 4.566 4.380 369 HD13 LEU 44 HD13 LEU 44 -0.400 3.608 3.036 370 HD21 LEU 44 HD21 LEU 44 2.270 6.436 4.880 371 HD22 LEU 44 HD22 LEU 44 0.638 6.301 5.541 372 HD23 LEU 44 HD23 LEU 44 0.887 6.997 3.939 373 H GLY 45 H GLY 45 1.876 1.255 6.741 374 HA2 GLY 45 HA2 GLY 45 4.676 0.794 6.940 375 HA3 GLY 45 HA3 GLY 45 3.438 0.121 7.988 376 H LEU 46 H LEU 46 1.986 -1.501 6.423 377 HA LEU 46 HA LEU 46 3.516 -3.875 6.265 378 HB2 LEU 46 HB2 LEU 46 1.114 -3.929 6.727 379 HB3 LEU 46 HB3 LEU 46 0.756 -3.219 5.162 380 HG LEU 46 HG LEU 46 1.569 -5.278 4.028 381 HD11 LEU 46 HD11 LEU 46 3.238 -6.012 5.637 382 HD12 LEU 46 HD12 LEU 46 2.090 -7.303 5.301 383 HD13 LEU 46 HD13 LEU 46 1.976 -6.398 6.813 384 HD21 LEU 46 HD21 LEU 46 -0.553 -5.858 6.126 385 HD22 LEU 46 HD22 LEU 46 -0.292 -6.762 4.632 386 HD23 LEU 46 HD23 LEU 46 -0.824 -5.084 4.562 387 H GLY 47 H GLY 47 2.514 -1.574 3.787 388 HA2 GLY 47 HA2 GLY 47 3.121 -3.022 1.435 389 HA3 GLY 47 HA3 GLY 47 3.051 -1.269 1.576 390 H TRP 48 H TRP 48 5.122 -1.115 3.596 391 HA TRP 48 HA TRP 48 7.475 -1.117 1.927 392 HB2 TRP 48 HB2 TRP 48 6.820 0.601 3.780 393 HB3 TRP 48 HB3 TRP 48 7.455 -0.583 4.918 394 HD1 TRP 48 HD1 TRP 48 10.167 -1.161 4.650 395 HE1 TRP 48 HE1 TRP 48 12.079 0.284 3.739 396 HE3 TRP 48 HE3 TRP 48 7.411 2.404 2.250 397 HZ2 TRP 48 HZ2 TRP 48 12.390 2.618 2.227 398 HZ3 TRP 48 HZ3 TRP 48 8.592 4.220 1.095 399 HH2 TRP 48 HH2 TRP 48 11.038 4.340 1.086 400 H LEU 49 H LEU 49 6.210 -3.174 4.526 401 HA LEU 49 HA LEU 49 8.487 -4.844 4.917 402 HB2 LEU 49 HB2 LEU 49 5.521 -5.194 5.369 403 HB3 LEU 49 HB3 LEU 49 6.575 -6.577 5.551 404 HG LEU 49 HG LEU 49 7.713 -5.619 7.431 405 HD11 LEU 49 HD11 LEU 49 7.284 -3.383 8.294 406 HD12 LEU 49 HD12 LEU 49 6.255 -3.041 6.894 407 HD13 LEU 49 HD13 LEU 49 7.981 -3.356 6.675 408 HD21 LEU 49 HD21 LEU 49 4.749 -5.016 7.726 409 HD22 LEU 49 HD22 LEU 49 5.895 -5.291 9.045 410 HD23 LEU 49 HD23 LEU 49 5.502 -6.600 7.933 411 H LEU 50 H LEU 50 5.983 -4.800 2.491 412 HA LEU 50 HA LEU 50 6.505 -7.322 1.263 413 HB2 LEU 50 HB2 LEU 50 5.103 -4.860 0.169 414 HB3 LEU 50 HB3 LEU 50 5.077 -6.447 -0.586 415 HG LEU 50 HG LEU 50 3.846 -5.715 2.105 416 HD11 LEU 50 HD11 LEU 50 1.687 -6.160 1.028 417 HD12 LEU 50 HD12 LEU 50 2.498 -6.457 -0.512 418 HD13 LEU 50 HD13 LEU 50 2.554 -4.852 0.224 419 HD21 LEU 50 HD21 LEU 50 2.958 -8.015 2.168 420 HD22 LEU 50 HD22 LEU 50 4.716 -7.996 2.212 421 HD23 LEU 50 HD23 LEU 50 3.878 -8.420 0.716 422 H ARG 51 H ARG 51 7.780 -4.003 0.608 423 HA ARG 51 HA ARG 51 8.915 -4.523 -1.905 424 HB2 ARG 51 HB2 ARG 51 10.232 -2.523 -1.718 425 HB3 ARG 51 HB3 ARG 51 8.663 -2.228 -0.990 426 HG2 ARG 51 HG2 ARG 51 9.574 -2.178 1.211 427 HG3 ARG 51 HG3 ARG 51 11.100 -2.888 0.691 428 HD2 ARG 51 HD2 ARG 51 10.083 -0.137 -0.113 429 HD3 ARG 51 HD3 ARG 51 11.265 -0.458 1.161 430 HE ARG 51 HE ARG 51 12.482 -1.622 -0.865 431 HH11 ARG 51 HH11 ARG 51 10.967 1.492 -0.801 432 HH12 ARG 51 HH12 ARG 51 11.968 2.110 -2.063 433 HH21 ARG 51 HH21 ARG 51 13.760 -0.799 -2.426 434 HH22 ARG 51 HH22 ARG 51 13.538 0.824 -2.963 435 H GLU 52 H GLU 52 10.156 -5.415 1.215 436 HA GLU 52 HA GLU 52 12.691 -6.375 0.021 437 HB2 GLU 52 HB2 GLU 52 12.037 -5.826 2.949 438 HB3 GLU 52 HB3 GLU 52 13.592 -6.393 2.334 439 HG2 GLU 52 HG2 GLU 52 13.820 -4.290 1.031 440 HG3 GLU 52 HG3 GLU 52 12.290 -3.723 1.700 441 H ASP 53 H ASP 53 9.656 -7.457 1.123 442 HA ASP 53 HA ASP 53 8.698 -9.489 1.429 443 HB2 ASP 53 HB2 ASP 53 11.225 -10.503 0.071 444 HB3 ASP 53 HB3 ASP 53 9.802 -11.494 0.384 445 H LYS 54 H LYS 54 10.126 -8.321 3.560 446 HA LYS 54 HA LYS 54 11.493 -10.362 5.089 447 HB2 LYS 54 HB2 LYS 54 11.504 -8.669 6.892 448 HB3 LYS 54 HB3 LYS 54 12.062 -7.988 5.367 449 HG2 LYS 54 HG2 LYS 54 9.744 -7.015 5.037 450 HG3 LYS 54 HG3 LYS 54 9.341 -7.571 6.664 451 HD2 LYS 54 HD2 LYS 54 9.948 -5.204 6.727 452 HD3 LYS 54 HD3 LYS 54 11.173 -6.147 7.581 453 HE2 LYS 54 HE2 LYS 54 12.597 -6.066 5.512 454 HE3 LYS 54 HE3 LYS 54 11.387 -5.022 4.764 455 HZ1 LYS 54 HZ1 LYS 54 13.176 -3.726 5.644 456 HZ2 LYS 54 HZ2 LYS 54 13.002 -4.418 7.178 457 HZ3 LYS 54 HZ3 LYS 54 11.784 -3.423 6.558 458 H VAL 55 H VAL 55 8.275 -9.847 4.336 459 HA VAL 55 HA VAL 55 7.330 -11.518 6.583 460 HB VAL 55 HB VAL 55 5.165 -10.322 6.624 461 HG11 VAL 55 HG11 VAL 55 6.862 -9.658 8.260 462 HG12 VAL 55 HG12 VAL 55 5.876 -8.273 7.794 463 HG13 VAL 55 HG13 VAL 55 7.505 -8.453 7.138 464 HG21 VAL 55 HG21 VAL 55 5.110 -9.469 4.318 465 HG22 VAL 55 HG22 VAL 55 6.431 -8.353 4.672 466 HG23 VAL 55 HG23 VAL 55 4.864 -8.143 5.459 467 H VAL 56 H VAL 56 5.437 -12.770 6.085 468 HA VAL 56 HA VAL 56 4.761 -13.095 3.245 469 HB VAL 56 HB VAL 56 4.017 -15.455 3.819 470 HG11 VAL 56 HG11 VAL 56 6.976 -14.850 4.233 471 HG12 VAL 56 HG12 VAL 56 6.167 -15.053 2.678 472 HG13 VAL 56 HG13 VAL 56 6.302 -16.420 3.785 473 HG21 VAL 56 HG21 VAL 56 3.775 -15.205 6.267 474 HG22 VAL 56 HG22 VAL 56 5.511 -14.934 6.430 475 HG23 VAL 56 HG23 VAL 56 4.911 -16.506 5.894 476 H THR 57 H THR 57 2.779 -12.681 2.633 477 HA THR 57 HA THR 57 0.641 -12.143 4.603 478 HB THR 57 HB THR 57 -0.445 -10.854 2.679 479 HG1 THR 57 HG1 THR 57 1.734 -10.313 1.254 480 HG21 THR 57 HG21 THR 57 0.998 -8.855 2.870 481 HG22 THR 57 HG22 THR 57 2.283 -9.840 3.572 482 HG23 THR 57 HG23 THR 57 0.761 -9.623 4.441 483 H SER 58 H SER 58 -1.209 -13.287 4.499 484 HA SER 58 HA SER 58 -1.648 -15.299 2.378 485 HB2 SER 58 HB2 SER 58 -0.873 -16.407 4.464 486 HB3 SER 58 HB3 SER 58 -2.166 -15.626 5.375 487 HG SER 58 HG SER 58 -3.015 -17.557 4.888 488 H GLU 59 H GLU 59 -3.796 -15.712 1.831 489 HA GLU 59 HA GLU 59 -5.737 -13.578 2.463 490 HB2 GLU 59 HB2 GLU 59 -5.212 -14.055 0.062 491 HB3 GLU 59 HB3 GLU 59 -5.761 -15.714 0.275 492 HG2 GLU 59 HG2 GLU 59 -8.042 -14.821 0.822 493 HG3 GLU 59 HG3 GLU 59 -7.450 -13.200 0.456 494 H VAL 60 H VAL 60 -6.799 -14.129 4.305 495 HA VAL 60 HA VAL 60 -7.889 -16.883 4.626 496 HB VAL 60 HB VAL 60 -6.771 -15.074 6.828 497 HG11 VAL 60 HG11 VAL 60 -7.291 -16.917 8.414 498 HG12 VAL 60 HG12 VAL 60 -8.085 -17.814 7.118 499 HG13 VAL 60 HG13 VAL 60 -8.760 -16.279 7.669 500 HG21 VAL 60 HG21 VAL 60 -5.017 -16.216 5.514 501 HG22 VAL 60 HG22 VAL 60 -5.796 -17.772 5.819 502 HG23 VAL 60 HG23 VAL 60 -5.093 -16.862 7.158 503 H GLU 61 H GLU 61 -9.979 -16.782 4.334 504 HA GLU 61 HA GLU 61 -12.176 -16.270 4.388 505 HB2 GLU 61 HB2 GLU 61 -11.561 -14.896 7.040 506 HB3 GLU 61 HB3 GLU 61 -13.092 -15.622 6.547 507 HG2 GLU 61 HG2 GLU 61 -11.893 -17.863 6.482 508 HG3 GLU 61 HG3 GLU 61 -10.491 -17.056 7.155 509 H GLY 62 H GLY 62 -10.628 -14.462 2.873 510 HA2 GLY 62 HA2 GLY 62 -11.098 -12.587 1.588 511 HA3 GLY 62 HA3 GLY 62 -12.342 -12.116 2.727 512 H GLU 63 H GLU 63 -9.861 -12.601 4.724 513 HA GLU 63 HA GLU 63 -9.291 -9.708 4.878 514 HB2 GLU 63 HB2 GLU 63 -10.384 -10.992 6.806 515 HB3 GLU 63 HB3 GLU 63 -8.862 -11.839 7.024 516 HG2 GLU 63 HG2 GLU 63 -7.752 -9.639 7.447 517 HG3 GLU 63 HG3 GLU 63 -9.328 -8.855 7.317 518 H ILE 64 H ILE 64 -7.163 -8.937 5.383 519 HA ILE 64 HA ILE 64 -4.930 -10.474 4.315 520 HB ILE 64 HB ILE 64 -4.961 -7.672 5.525 521 HG12 ILE 64 HG12 ILE 64 -5.091 -8.477 2.578 522 HG13 ILE 64 HG13 ILE 64 -6.446 -7.862 3.516 523 HG21 ILE 64 HG21 ILE 64 -2.796 -7.339 4.357 524 HG22 ILE 64 HG22 ILE 64 -2.829 -9.019 3.819 525 HG23 ILE 64 HG23 ILE 64 -2.701 -8.647 5.539 526 HD11 ILE 64 HD11 ILE 64 -5.278 -5.715 3.777 527 HD12 ILE 64 HD12 ILE 64 -5.516 -6.143 2.084 528 HD13 ILE 64 HD13 ILE 64 -3.927 -6.339 2.823 529 H PHE 65 H PHE 65 -4.085 -11.976 5.650 530 HA PHE 65 HA PHE 65 -3.402 -11.324 8.468 531 HB2 PHE 65 HB2 PHE 65 -4.678 -13.436 8.180 532 HB3 PHE 65 HB3 PHE 65 -3.494 -14.016 7.016 533 HD1 PHE 65 HD2 PHE 65 -4.015 -13.192 10.613 534 HD2 PHE 65 HD1 PHE 65 -1.444 -15.092 7.766 535 HE1 PHE 65 HE2 PHE 65 -2.714 -14.194 12.446 536 HE2 PHE 65 HE1 PHE 65 -0.148 -16.086 9.608 537 HZ PHE 65 HZ PHE 65 -0.778 -15.636 11.947 538 H VAL 66 H VAL 66 -1.214 -11.079 8.993 539 HA VAL 66 HA VAL 66 0.827 -11.948 7.051 540 HB VAL 66 HB VAL 66 0.395 -9.664 6.362 541 HG11 VAL 66 HG11 VAL 66 0.666 -7.713 7.841 542 HG12 VAL 66 HG12 VAL 66 0.957 -8.785 9.211 543 HG13 VAL 66 HG13 VAL 66 -0.619 -8.782 8.419 544 HG21 VAL 66 HG21 VAL 66 3.025 -9.773 7.895 545 HG22 VAL 66 HG22 VAL 66 2.654 -8.689 6.556 546 HG23 VAL 66 HG23 VAL 66 2.748 -10.426 6.280 547 H LYS 67 H LYS 67 2.899 -12.286 7.831 548 HA LYS 67 HA LYS 67 3.625 -11.802 10.625 549 HB2 LYS 67 HB2 LYS 67 4.070 -14.191 11.116 550 HB3 LYS 67 HB3 LYS 67 2.362 -13.920 10.779 551 HG2 LYS 67 HG2 LYS 67 2.726 -14.751 8.452 552 HG3 LYS 67 HG3 LYS 67 4.405 -15.111 8.883 553 HD2 LYS 67 HD2 LYS 67 3.520 -16.646 10.693 554 HD3 LYS 67 HD3 LYS 67 1.893 -16.371 10.053 555 HE2 LYS 67 HE2 LYS 67 2.844 -18.466 9.184 556 HE3 LYS 67 HE3 LYS 67 2.602 -17.304 7.874 557 HZ1 LYS 67 HZ1 LYS 67 4.970 -16.721 8.062 558 HZ2 LYS 67 HZ2 LYS 67 4.732 -18.342 7.661 559 HZ3 LYS 67 HZ3 LYS 67 5.166 -17.921 9.233 560 H LEU 68 H LEU 68 6.005 -12.585 10.978 561 HA LEU 68 HA LEU 68 7.669 -11.880 8.759 562 HB2 LEU 68 HB2 LEU 68 8.404 -13.305 11.347 563 HB3 LEU 68 HB3 LEU 68 9.573 -12.721 10.172 564 HG LEU 68 HG LEU 68 7.757 -11.061 11.959 565 HD11 LEU 68 HD11 LEU 68 9.869 -10.162 12.836 566 HD12 LEU 68 HD12 LEU 68 10.784 -11.216 11.754 567 HD13 LEU 68 HD13 LEU 68 9.783 -11.911 13.032 568 HD21 LEU 68 HD21 LEU 68 8.719 -9.041 10.906 569 HD22 LEU 68 HD22 LEU 68 7.757 -9.984 9.772 570 HD23 LEU 68 HD23 LEU 68 9.520 -10.050 9.698 571 H VAL 69 H VAL 69 9.311 -13.252 7.741 572 HA VAL 69 HA VAL 69 8.310 -15.844 6.882 573 HB VAL 69 HB VAL 69 11.019 -14.613 6.185 574 HG11 VAL 69 HG11 VAL 69 10.834 -15.939 4.097 575 HG12 VAL 69 HG12 VAL 69 9.308 -16.623 4.665 576 HG13 VAL 69 HG13 VAL 69 10.806 -16.974 5.531 577 HG21 VAL 69 HG21 VAL 69 9.966 -13.597 4.188 578 HG22 VAL 69 HG22 VAL 69 9.293 -12.942 5.682 579 HG23 VAL 69 HG23 VAL 69 8.380 -14.130 4.753 580 H LEU 70 H LEU 70 8.330 -16.811 9.021 581 HA LEU 70 HA LEU 70 10.970 -17.613 10.129 582 HB2 LEU 70 HB2 LEU 70 8.235 -17.500 11.476 583 HB3 LEU 70 HB3 LEU 70 9.715 -18.044 12.254 584 HG LEU 70 HG LEU 70 9.168 -15.217 11.255 585 HD11 LEU 70 HD11 LEU 70 9.314 -16.257 14.108 586 HD12 LEU 70 HD12 LEU 70 7.860 -15.737 13.254 587 HD13 LEU 70 HD13 LEU 70 9.121 -14.567 13.624 588 HD21 LEU 70 HD21 LEU 70 11.544 -15.748 11.029 589 HD22 LEU 70 HD22 LEU 70 11.619 -16.284 12.709 590 HD23 LEU 70 HD23 LEU 70 11.299 -14.589 12.335 591 H GLU 71 H GLU 71 9.583 -18.828 7.860 592 HA GLU 71 HA GLU 71 8.368 -21.307 8.440 593 HB2 GLU 71 HB2 GLU 71 9.687 -20.090 6.008 594 HB3 GLU 71 HB3 GLU 71 9.227 -21.781 5.965 595 HG2 GLU 71 HG2 GLU 71 7.608 -19.977 4.997 596 HG3 GLU 71 HG3 GLU 71 6.956 -21.327 5.918 597 H HIS 72 H HIS 72 9.577 -22.441 10.022 598 HA HIS 72 HA HIS 72 12.292 -23.259 9.700 599 HB2 HIS 72 HB2 HIS 72 10.997 -23.341 11.879 600 HB3 HIS 72 HB3 HIS 72 10.106 -24.723 11.249 601 HD1 HIS 72 HD1 HIS 72 13.544 -23.696 12.384 602 HD2 HIS 72 HD2 HIS 72 11.482 -27.164 11.397 603 HE1 HIS 72 HE1 HIS 72 15.054 -25.580 13.044 604 HE2 HIS 72 HE2 HIS 72 13.733 -27.664 12.574 605 H HIS 73 H HIS 73 9.178 -24.902 8.978 606 HA HIS 73 HA HIS 73 10.137 -26.959 7.317 607 HB2 HIS 73 HB2 HIS 73 7.883 -26.938 6.254 608 HB3 HIS 73 HB3 HIS 73 7.770 -26.862 8.004 609 HD1 HIS 73 HD1 HIS 73 6.392 -25.341 5.054 610 HD2 HIS 73 HD2 HIS 73 7.297 -23.994 8.882 611 HE1 HIS 73 HE1 HIS 73 5.041 -23.250 5.371 612 HE2 HIS 73 HE2 HIS 73 5.467 -22.560 7.748 613 H HIS 74 H HIS 74 11.189 -26.898 5.405 614 HA HIS 74 HA HIS 74 12.326 -24.415 4.623 615 HB2 HIS 74 HB2 HIS 74 12.584 -27.165 3.345 616 HB3 HIS 74 HB3 HIS 74 13.592 -25.774 2.942 617 HD1 HIS 74 HD1 HIS 74 14.896 -24.744 5.158 618 HD2 HIS 74 HD2 HIS 74 13.684 -28.715 5.320 619 HE1 HIS 74 HE1 HIS 74 16.242 -25.777 7.004 620 HE2 HIS 74 HE2 HIS 74 15.482 -28.174 7.105 621 H HIS 75 H HIS 75 10.229 -26.653 2.686 622 HA HIS 75 HA HIS 75 8.980 -24.415 1.331 623 HB2 HIS 75 HB2 HIS 75 9.671 -25.058 -0.974 624 HB3 HIS 75 HB3 HIS 75 11.037 -24.546 0.001 625 HD1 HIS 75 HD1 HIS 75 12.949 -26.178 0.271 626 HD2 HIS 75 HD2 HIS 75 9.616 -27.913 -1.510 627 HE1 HIS 75 HE1 HIS 75 13.718 -28.416 -0.558 628 HE2 HIS 75 HE2 HIS 75 11.681 -29.470 -1.582 629 H HIS 76 H HIS 76 7.338 -25.095 -0.273 630 HA HIS 76 HA HIS 76 6.477 -27.899 -0.254 631 HB2 HIS 76 HB2 HIS 76 5.287 -26.744 1.680 632 HB3 HIS 76 HB3 HIS 76 4.522 -25.670 0.515 633 HD1 HIS 76 HD1 HIS 76 2.933 -26.963 -1.305 634 HD2 HIS 76 HD2 HIS 76 3.952 -29.088 2.120 635 HE1 HIS 76 HE1 HIS 76 1.286 -28.850 -1.177 636 HE2 HIS 76 HE2 HIS 76 1.873 -30.077 0.942 637 H HIS 77 H HIS 77 5.975 -28.436 -2.305 638 HA HIS 77 HA HIS 77 5.664 -26.444 -4.416 639 HB2 HIS 77 HB2 HIS 77 7.138 -28.393 -4.745 640 HB3 HIS 77 HB3 HIS 77 5.792 -29.492 -4.482 641 HD1 HIS 77 HD1 HIS 77 4.060 -29.734 -6.429 642 HD2 HIS 77 HD2 HIS 77 7.319 -27.315 -7.340 643 HE1 HIS 77 HE1 HIS 77 4.030 -29.484 -8.915 644 HE2 HIS 77 HE2 HIS 77 5.915 -27.914 -9.433 645 H1 MET 1 H MET 1 2.436 -17.557 -7.865 646 HA MET 1 HA MET 1 2.646 -15.305 -8.063 647 HB2 MET 1 HB2 MET 1 1.923 -14.366 -10.319 648 HB3 MET 1 HB3 MET 1 2.985 -15.765 -10.385 649 HG2 MET 1 HG2 MET 1 1.285 -16.015 -12.064 650 HG3 MET 1 HG3 MET 1 0.993 -17.210 -10.800 651 HE1 MET 1 HE1 MET 1 -1.241 -16.638 -12.913 652 HE2 MET 1 HE2 MET 1 -2.668 -16.430 -11.900 653 HE3 MET 1 HE3 MET 1 -1.500 -17.699 -11.526 654 H LYS 2 H LYS 2 -0.184 -16.577 -7.233 655 HA LYS 2 HA LYS 2 -1.920 -14.218 -7.454 656 HB2 LYS 2 HB2 LYS 2 -2.504 -16.946 -6.219 657 HB3 LYS 2 HB3 LYS 2 -3.688 -15.708 -6.629 658 HG2 LYS 2 HG2 LYS 2 -3.029 -15.976 -9.042 659 HG3 LYS 2 HG3 LYS 2 -1.990 -17.317 -8.567 660 HD2 LYS 2 HD2 LYS 2 -5.030 -17.191 -8.346 661 HD3 LYS 2 HD3 LYS 2 -4.100 -18.144 -9.497 662 HE2 LYS 2 HE2 LYS 2 -4.729 -19.742 -7.903 663 HE3 LYS 2 HE3 LYS 2 -3.108 -19.310 -7.363 664 HZ1 LYS 2 HZ1 LYS 2 -4.069 -17.875 -5.697 665 HZ2 LYS 2 HZ2 LYS 2 -4.719 -19.425 -5.553 666 HZ3 LYS 2 HZ3 LYS 2 -5.631 -18.192 -6.261 667 H MET 3 H MET 3 0.433 -14.011 -5.800 668 HA MET 3 HA MET 3 -0.171 -14.218 -2.987 669 HB2 MET 3 HB2 MET 3 2.115 -14.484 -3.971 670 HB3 MET 3 HB3 MET 3 2.093 -12.803 -4.479 671 HG2 MET 3 HG2 MET 3 3.463 -13.043 -2.519 672 HG3 MET 3 HG3 MET 3 2.017 -12.121 -2.098 673 HE1 MET 3 HE1 MET 3 3.048 -14.341 1.094 674 HE2 MET 3 HE2 MET 3 2.926 -12.688 0.492 675 HE3 MET 3 HE3 MET 3 4.174 -13.767 -0.136 676 H LEU 4 H LEU 4 -0.417 -12.415 -1.511 677 HA LEU 4 HA LEU 4 -2.082 -10.275 -2.428 678 HB2 LEU 4 HB2 LEU 4 -0.769 -10.766 0.271 679 HB3 LEU 4 HB3 LEU 4 -1.863 -9.432 -0.029 680 HG LEU 4 HG LEU 4 -3.065 -11.159 1.140 681 HD11 LEU 4 HD11 LEU 4 -3.945 -11.139 -1.754 682 HD12 LEU 4 HD12 LEU 4 -4.355 -9.950 -0.515 683 HD13 LEU 4 HD13 LEU 4 -4.934 -11.607 -0.366 684 HD21 LEU 4 HD21 LEU 4 -3.354 -13.448 0.316 685 HD22 LEU 4 HD22 LEU 4 -1.657 -13.086 0.622 686 HD23 LEU 4 HD23 LEU 4 -2.264 -13.116 -1.036 687 H LYS 5 H LYS 5 1.332 -10.532 -1.654 688 HA LYS 5 HA LYS 5 2.084 -7.815 -2.002 689 HB2 LYS 5 HB2 LYS 5 3.502 -9.575 -0.936 690 HB3 LYS 5 HB3 LYS 5 3.694 -10.365 -2.489 691 HG2 LYS 5 HG2 LYS 5 4.616 -7.509 -2.143 692 HG3 LYS 5 HG3 LYS 5 5.599 -8.814 -1.487 693 HD2 LYS 5 HD2 LYS 5 4.802 -8.484 -4.413 694 HD3 LYS 5 HD3 LYS 5 6.377 -8.080 -3.724 695 HE2 LYS 5 HE2 LYS 5 6.658 -10.498 -3.103 696 HE3 LYS 5 HE3 LYS 5 5.138 -10.849 -3.929 697 HZ1 LYS 5 HZ1 LYS 5 6.119 -10.020 -5.975 698 HZ2 LYS 5 HZ2 LYS 5 7.013 -11.300 -5.338 699 HZ3 LYS 5 HZ3 LYS 5 7.574 -9.714 -5.177 700 H GLU 6 H GLU 6 1.692 -10.527 -4.264 701 HA GLU 6 HA GLU 6 3.058 -9.313 -6.453 702 HB2 GLU 6 HB2 GLU 6 2.415 -11.891 -5.849 703 HB3 GLU 6 HB3 GLU 6 1.139 -11.560 -7.006 704 HG2 GLU 6 HG2 GLU 6 2.982 -12.581 -8.165 705 HG3 GLU 6 HG3 GLU 6 2.884 -10.893 -8.673 706 H LYS 7 H LYS 7 -0.406 -9.662 -5.651 707 HA LYS 7 HA LYS 7 -1.470 -8.646 -8.064 708 HB2 LYS 7 HB2 LYS 7 -3.594 -8.272 -6.768 709 HB3 LYS 7 HB3 LYS 7 -2.932 -9.887 -6.616 710 HG2 LYS 7 HG2 LYS 7 -3.644 -9.431 -4.441 711 HG3 LYS 7 HG3 LYS 7 -1.929 -9.058 -4.365 712 HD2 LYS 7 HD2 LYS 7 -2.960 -7.305 -3.166 713 HD3 LYS 7 HD3 LYS 7 -2.610 -6.590 -4.732 714 HE2 LYS 7 HE2 LYS 7 -5.323 -7.643 -3.858 715 HE3 LYS 7 HE3 LYS 7 -4.844 -5.950 -3.860 716 HZ1 LYS 7 HZ1 LYS 7 -4.501 -6.201 -6.302 717 HZ2 LYS 7 HZ2 LYS 7 -6.100 -6.338 -5.788 718 HZ3 LYS 7 HZ3 LYS 7 -5.228 -7.724 -6.197 719 H ALA 8 H ALA 8 -0.279 -7.000 -5.193 720 HA ALA 8 HA ALA 8 -1.130 -4.350 -5.772 721 HB1 ALA 8 HB1 ALA 8 0.614 -3.642 -4.177 722 HB2 ALA 8 HB2 ALA 8 1.334 -5.255 -4.234 723 HB3 ALA 8 HB3 ALA 8 -0.280 -5.033 -3.556 724 H GLY 9 H GLY 9 1.728 -6.208 -6.778 725 HA2 GLY 9 HA2 GLY 9 3.095 -4.128 -8.195 726 HA3 GLY 9 HA3 GLY 9 3.385 -5.853 -8.328 727 H ALA 10 H ALA 10 0.846 -6.686 -9.194 728 HA ALA 10 HA ALA 10 0.897 -6.323 -11.983 729 HB1 ALA 10 HB1 ALA 10 -0.112 -8.296 -10.896 730 HB2 ALA 10 HB2 ALA 10 -1.256 -7.528 -11.999 731 HB3 ALA 10 HB3 ALA 10 -1.410 -7.288 -10.256 732 H LEU 11 H LEU 11 -1.144 -4.831 -9.485 733 HA LEU 11 HA LEU 11 -2.640 -3.092 -11.204 734 HB2 LEU 11 HB2 LEU 11 -2.097 -2.901 -8.216 735 HB3 LEU 11 HB3 LEU 11 -3.313 -1.970 -9.085 736 HG LEU 11 HG LEU 11 -3.318 -5.001 -8.795 737 HD11 LEU 11 HD11 LEU 11 -5.017 -2.954 -7.352 738 HD12 LEU 11 HD12 LEU 11 -3.729 -3.937 -6.650 739 HD13 LEU 11 HD13 LEU 11 -5.192 -4.710 -7.254 740 HD21 LEU 11 HD21 LEU 11 -5.418 -3.171 -9.998 741 HD22 LEU 11 HD22 LEU 11 -5.588 -4.910 -9.739 742 HD23 LEU 11 HD23 LEU 11 -4.388 -4.307 -10.877 743 H ALA 12 H ALA 12 0.373 -2.746 -9.362 744 HA ALA 12 HA ALA 12 0.719 0.046 -9.463 745 HB1 ALA 12 HB1 ALA 12 3.077 -0.374 -8.970 746 HB2 ALA 12 HB2 ALA 12 2.891 -2.075 -9.431 747 HB3 ALA 12 HB3 ALA 12 2.046 -1.444 -8.016 748 H GLY 13 H GLY 13 1.757 -2.469 -11.750 749 HA2 GLY 13 HA2 GLY 13 3.254 -0.953 -13.555 750 HA3 GLY 13 HA3 GLY 13 2.349 -2.400 -13.965 751 H GLN 14 H GLN 14 -0.237 -1.738 -13.765 752 HA GLN 14 HA GLN 14 -0.679 -0.203 -16.142 753 HB2 GLN 14 HB2 GLN 14 -3.095 -0.680 -15.789 754 HB3 GLN 14 HB3 GLN 14 -2.100 -2.126 -15.686 755 HG2 GLN 14 HG2 GLN 14 -2.238 -2.041 -13.222 756 HG3 GLN 14 HG3 GLN 14 -3.230 -0.590 -13.329 757 HE21 GLN 14 HE21 GLN 14 -3.560 -3.380 -15.470 758 HE22 GLN 14 HE22 GLN 14 -5.104 -3.864 -14.884 759 H ILE 15 H ILE 15 -1.116 0.544 -12.679 760 HA ILE 15 HA ILE 15 -2.466 3.034 -12.969 761 HB ILE 15 HB ILE 15 -0.693 1.995 -10.710 762 HG12 ILE 15 HG12 ILE 15 -3.731 2.291 -10.901 763 HG13 ILE 15 HG13 ILE 15 -2.851 0.778 -11.081 764 HG21 ILE 15 HG21 ILE 15 -2.373 4.536 -10.675 765 HG22 ILE 15 HG22 ILE 15 -0.612 4.453 -10.615 766 HG23 ILE 15 HG23 ILE 15 -1.568 3.825 -9.274 767 HD11 ILE 15 HD11 ILE 15 -3.001 2.449 -8.569 768 HD12 ILE 15 HD12 ILE 15 -2.129 0.923 -8.744 769 HD13 ILE 15 HD13 ILE 15 -3.885 0.958 -8.895 770 H TRP 16 H TRP 16 1.000 2.223 -12.749 771 HA TRP 16 HA TRP 16 2.048 4.836 -12.948 772 HB2 TRP 16 HB2 TRP 16 3.381 2.856 -12.199 773 HB3 TRP 16 HB3 TRP 16 3.343 2.215 -13.840 774 HD1 TRP 16 HD1 TRP 16 4.914 5.031 -11.757 775 HE1 TRP 16 HE1 TRP 16 6.923 6.007 -13.048 776 HE3 TRP 16 HE3 TRP 16 4.359 2.513 -16.188 777 HZ2 TRP 16 HZ2 TRP 16 8.109 5.754 -15.596 778 HZ3 TRP 16 HZ3 TRP 16 5.967 2.946 -18.006 779 HH2 TRP 16 HH2 TRP 16 7.805 4.537 -17.713 780 H GLU 17 H GLU 17 1.282 2.416 -15.474 781 HA GLU 17 HA GLU 17 2.217 3.837 -17.742 782 HB2 GLU 17 HB2 GLU 17 0.052 1.702 -17.508 783 HB3 GLU 17 HB3 GLU 17 0.652 2.316 -19.049 784 HG2 GLU 17 HG2 GLU 17 2.899 1.498 -18.534 785 HG3 GLU 17 HG3 GLU 17 2.353 0.936 -16.957 786 H ALA 18 H ALA 18 -0.901 3.925 -16.062 787 HA ALA 18 HA ALA 18 -2.317 5.648 -17.828 788 HB1 ALA 18 HB1 ALA 18 -2.640 5.327 -14.821 789 HB2 ALA 18 HB2 ALA 18 -3.437 4.347 -16.052 790 HB3 ALA 18 HB3 ALA 18 -3.819 6.064 -15.913 791 H LEU 19 H LEU 19 -0.047 6.267 -15.183 792 HA LEU 19 HA LEU 19 -0.306 9.152 -15.156 793 HB2 LEU 19 HB2 LEU 19 1.811 7.317 -13.966 794 HB3 LEU 19 HB3 LEU 19 1.675 9.038 -13.624 795 HG LEU 19 HG LEU 19 -0.460 6.977 -12.917 796 HD11 LEU 19 HD11 LEU 19 1.587 6.554 -11.639 797 HD12 LEU 19 HD12 LEU 19 0.306 7.171 -10.598 798 HD13 LEU 19 HD13 LEU 19 1.623 8.236 -11.101 799 HD21 LEU 19 HD21 LEU 19 -1.413 8.773 -11.515 800 HD22 LEU 19 HD22 LEU 19 -1.383 9.222 -13.215 801 HD23 LEU 19 HD23 LEU 19 -0.185 9.895 -12.109 802 H ASN 20 H ASN 20 1.700 6.826 -16.867 803 HA ASN 20 HA ASN 20 3.940 8.482 -17.424 804 HB2 ASN 20 HB2 ASN 20 3.989 5.970 -17.453 805 HB3 ASN 20 HB3 ASN 20 3.048 5.991 -18.942 806 HD21 ASN 20 HD21 ASN 20 4.716 4.946 -20.100 807 HD22 ASN 20 HD22 ASN 20 6.181 5.746 -20.530 808 H GLY 21 H GLY 21 4.268 9.988 -18.947 809 HA2 GLY 21 HA2 GLY 21 3.984 11.219 -20.921 810 HA3 GLY 21 HA3 GLY 21 2.544 10.295 -21.310 811 H THR 22 H THR 22 1.264 10.672 -18.754 812 HA THR 22 HA THR 22 -0.012 13.244 -19.164 813 HB THR 22 HB THR 22 -0.556 11.359 -16.821 814 HG1 THR 22 HG1 THR 22 -1.537 9.958 -18.080 815 HG21 THR 22 HG21 THR 22 -2.877 12.144 -17.067 816 HG22 THR 22 HG22 THR 22 -2.413 13.144 -18.443 817 HG23 THR 22 HG23 THR 22 -1.787 13.514 -16.834 818 H GLU 23 H GLU 23 -0.282 14.848 -17.439 819 HA GLU 23 HA GLU 23 2.116 15.346 -15.867 820 HB2 GLU 23 HB2 GLU 23 1.194 17.549 -15.399 821 HB3 GLU 23 HB3 GLU 23 1.048 17.201 -17.114 822 HG2 GLU 23 HG2 GLU 23 -1.222 16.996 -15.104 823 HG3 GLU 23 HG3 GLU 23 -0.909 18.383 -16.131 824 H GLY 24 H GLY 24 -0.235 13.307 -15.204 825 HA2 GLY 24 HA2 GLY 24 -0.228 12.216 -13.043 826 HA3 GLY 24 HA3 GLY 24 -0.222 13.796 -12.277 827 H LEU 25 H LEU 25 -2.090 11.546 -11.955 828 HA LEU 25 HA LEU 25 -4.640 12.872 -12.727 829 HB2 LEU 25 HB2 LEU 25 -4.150 9.857 -12.640 830 HB3 LEU 25 HB3 LEU 25 -5.701 10.623 -12.898 831 HG LEU 25 HG LEU 25 -4.586 11.659 -15.041 832 HD11 LEU 25 HD11 LEU 25 -2.706 9.327 -14.593 833 HD12 LEU 25 HD12 LEU 25 -2.277 11.038 -14.556 834 HD13 LEU 25 HD13 LEU 25 -2.824 10.305 -16.059 835 HD21 LEU 25 HD21 LEU 25 -5.200 9.684 -16.397 836 HD22 LEU 25 HD22 LEU 25 -6.404 10.033 -15.159 837 HD23 LEU 25 HD23 LEU 25 -5.268 8.701 -14.928 838 H THR 26 H THR 26 -6.452 12.474 -11.257 839 HA THR 26 HA THR 26 -5.732 12.149 -8.446 840 HB THR 26 HB THR 26 -8.108 12.572 -7.922 841 HG1 THR 26 HG1 THR 26 -9.627 12.881 -9.599 842 HG21 THR 26 HG21 THR 26 -6.725 14.576 -8.332 843 HG22 THR 26 HG22 THR 26 -8.390 14.838 -8.855 844 HG23 THR 26 HG23 THR 26 -7.133 14.516 -10.051 845 H GLN 27 H GLN 27 -7.137 10.681 -7.070 846 HA GLN 27 HA GLN 27 -6.957 7.974 -7.661 847 HB2 GLN 27 HB2 GLN 27 -8.506 7.634 -5.729 848 HB3 GLN 27 HB3 GLN 27 -7.223 8.789 -5.379 849 HG2 GLN 27 HG2 GLN 27 -8.793 10.660 -5.720 850 HG3 GLN 27 HG3 GLN 27 -10.081 9.524 -6.109 851 HE21 GLN 27 HE21 GLN 27 -10.969 8.264 -4.425 852 HE22 GLN 27 HE22 GLN 27 -10.778 8.710 -2.770 853 H LYS 28 H LYS 28 -9.636 10.179 -8.246 854 HA LYS 28 HA LYS 28 -11.621 8.438 -9.209 855 HB2 LYS 28 HB2 LYS 28 -11.878 10.896 -8.628 856 HB3 LYS 28 HB3 LYS 28 -11.064 11.294 -10.134 857 HG2 LYS 28 HG2 LYS 28 -13.429 11.561 -10.462 858 HG3 LYS 28 HG3 LYS 28 -12.914 10.140 -11.384 859 HD2 LYS 28 HD2 LYS 28 -13.755 8.662 -9.599 860 HD3 LYS 28 HD3 LYS 28 -14.206 10.064 -8.624 861 HE2 LYS 28 HE2 LYS 28 -15.813 10.723 -10.429 862 HE3 LYS 28 HE3 LYS 28 -15.416 9.224 -11.277 863 HZ1 LYS 28 HZ1 LYS 28 -16.225 7.977 -9.403 864 HZ2 LYS 28 HZ2 LYS 28 -17.421 9.048 -9.928 865 HZ3 LYS 28 HZ3 LYS 28 -16.531 9.393 -8.536 866 H GLN 29 H GLN 29 -9.140 10.266 -11.009 867 HA GLN 29 HA GLN 29 -10.073 9.589 -13.619 868 HB2 GLN 29 HB2 GLN 29 -7.395 10.727 -12.754 869 HB3 GLN 29 HB3 GLN 29 -8.022 10.738 -14.401 870 HG2 GLN 29 HG2 GLN 29 -9.779 12.277 -13.783 871 HG3 GLN 29 HG3 GLN 29 -9.351 12.152 -12.074 872 HE21 GLN 29 HE21 GLN 29 -8.886 14.328 -11.823 873 HE22 GLN 29 HE22 GLN 29 -7.538 15.099 -12.564 874 H ILE 30 H ILE 30 -7.361 8.351 -11.646 875 HA ILE 30 HA ILE 30 -6.151 6.677 -13.572 876 HB ILE 30 HB ILE 30 -6.207 6.297 -10.540 877 HG12 ILE 30 HG12 ILE 30 -4.109 7.635 -12.314 878 HG13 ILE 30 HG13 ILE 30 -5.246 8.487 -11.278 879 HG21 ILE 30 HG21 ILE 30 -5.555 4.195 -11.659 880 HG22 ILE 30 HG22 ILE 30 -4.173 4.907 -10.830 881 HG23 ILE 30 HG23 ILE 30 -4.317 5.052 -12.583 882 HD11 ILE 30 HD11 ILE 30 -3.038 8.416 -10.294 883 HD12 ILE 30 HD12 ILE 30 -3.029 6.655 -10.355 884 HD13 ILE 30 HD13 ILE 30 -4.172 7.497 -9.303 885 H LYS 31 H LYS 31 -8.858 6.058 -11.344 886 HA LYS 31 HA LYS 31 -9.120 3.262 -11.779 887 HB2 LYS 31 HB2 LYS 31 -11.125 5.329 -10.828 888 HB3 LYS 31 HB3 LYS 31 -11.496 3.605 -10.910 889 HG2 LYS 31 HG2 LYS 31 -9.600 3.157 -9.364 890 HG3 LYS 31 HG3 LYS 31 -9.329 4.900 -9.228 891 HD2 LYS 31 HD2 LYS 31 -11.612 5.175 -8.289 892 HD3 LYS 31 HD3 LYS 31 -11.877 3.428 -8.428 893 HE2 LYS 31 HE2 LYS 31 -11.277 4.020 -6.140 894 HE3 LYS 31 HE3 LYS 31 -10.001 3.039 -6.859 895 HZ1 LYS 31 HZ1 LYS 31 -9.118 4.923 -5.617 896 HZ2 LYS 31 HZ2 LYS 31 -9.963 6.003 -6.609 897 HZ3 LYS 31 HZ3 LYS 31 -8.727 5.053 -7.260 898 H LYS 32 H LYS 32 -10.271 5.982 -13.695 899 HA LYS 32 HA LYS 32 -12.082 4.552 -15.379 900 HB2 LYS 32 HB2 LYS 32 -11.867 7.101 -15.174 901 HB3 LYS 32 HB3 LYS 32 -10.411 6.999 -16.145 902 HG2 LYS 32 HG2 LYS 32 -13.161 6.114 -17.117 903 HG3 LYS 32 HG3 LYS 32 -12.505 7.730 -17.373 904 HD2 LYS 32 HD2 LYS 32 -10.627 6.740 -18.685 905 HD3 LYS 32 HD3 LYS 32 -11.315 5.133 -18.442 906 HE2 LYS 32 HE2 LYS 32 -11.912 5.890 -20.652 907 HE3 LYS 32 HE3 LYS 32 -13.373 5.899 -19.665 908 HZ1 LYS 32 HZ1 LYS 32 -13.188 7.882 -21.022 909 HZ2 LYS 32 HZ2 LYS 32 -11.704 8.268 -20.310 910 HZ3 LYS 32 HZ3 LYS 32 -13.115 8.281 -19.380 911 H ALA 33 H ALA 33 -8.637 5.443 -15.774 912 HA ALA 33 HA ALA 33 -8.274 4.241 -18.328 913 HB1 ALA 33 HB1 ALA 33 -6.890 6.102 -17.490 914 HB2 ALA 33 HB2 ALA 33 -5.893 4.739 -17.998 915 HB3 ALA 33 HB3 ALA 33 -6.174 5.034 -16.278 916 H THR 34 H THR 34 -7.423 3.126 -15.060 917 HA THR 34 HA THR 34 -6.314 0.586 -15.920 918 HB THR 34 HB THR 34 -6.052 0.117 -13.493 919 HG1 THR 34 HG1 THR 34 -6.816 2.609 -12.617 920 HG21 THR 34 HG21 THR 34 -4.498 1.952 -12.937 921 HG22 THR 34 HG22 THR 34 -5.174 2.938 -14.236 922 HG23 THR 34 HG23 THR 34 -4.294 1.453 -14.617 923 H LYS 35 H LYS 35 -9.415 1.788 -14.965 924 HA LYS 35 HA LYS 35 -11.493 0.940 -14.853 925 HB2 LYS 35 HB2 LYS 35 -10.236 -1.525 -16.118 926 HB3 LYS 35 HB3 LYS 35 -11.967 -1.375 -15.819 927 HG2 LYS 35 HG2 LYS 35 -12.115 0.530 -17.339 928 HG3 LYS 35 HG3 LYS 35 -10.362 0.533 -17.566 929 HD2 LYS 35 HD2 LYS 35 -12.215 -1.753 -18.373 930 HD3 LYS 35 HD3 LYS 35 -11.624 -0.501 -19.471 931 HE2 LYS 35 HE2 LYS 35 -9.299 -1.240 -19.065 932 HE3 LYS 35 HE3 LYS 35 -9.882 -2.476 -17.949 933 HZ1 LYS 35 HZ1 LYS 35 -9.391 -3.333 -20.163 934 HZ2 LYS 35 HZ2 LYS 35 -10.577 -2.328 -20.826 935 HZ3 LYS 35 HZ3 LYS 35 -11.013 -3.555 -19.747 936 H LEU 36 H LEU 36 -9.804 0.895 -12.591 937 HA LEU 36 HA LEU 36 -10.350 -1.511 -11.045 938 HB2 LEU 36 HB2 LEU 36 -9.105 1.156 -10.263 939 HB3 LEU 36 HB3 LEU 36 -9.352 -0.159 -9.122 940 HG LEU 36 HG LEU 36 -7.541 -0.210 -11.567 941 HD11 LEU 36 HD11 LEU 36 -5.701 -0.408 -9.952 942 HD12 LEU 36 HD12 LEU 36 -6.842 -0.278 -8.612 943 HD13 LEU 36 HD13 LEU 36 -6.610 1.083 -9.712 944 HD21 LEU 36 HD21 LEU 36 -6.856 -2.470 -10.847 945 HD22 LEU 36 HD22 LEU 36 -8.557 -2.414 -11.292 946 HD23 LEU 36 HD23 LEU 36 -8.095 -2.450 -9.588 947 H LYS 37 H LYS 37 -12.105 -1.895 -9.897 948 HA LYS 37 HA LYS 37 -14.281 0.019 -9.698 949 HB2 LYS 37 HB2 LYS 37 -14.722 -2.323 -10.344 950 HB3 LYS 37 HB3 LYS 37 -14.047 -2.892 -8.821 951 HG2 LYS 37 HG2 LYS 37 -15.899 -1.826 -7.587 952 HG3 LYS 37 HG3 LYS 37 -16.565 -1.210 -9.105 953 HD2 LYS 37 HD2 LYS 37 -16.918 -3.535 -9.892 954 HD3 LYS 37 HD3 LYS 37 -16.226 -4.153 -8.389 955 HE2 LYS 37 HE2 LYS 37 -18.764 -2.488 -8.598 956 HE3 LYS 37 HE3 LYS 37 -18.700 -4.239 -8.388 957 HZ1 LYS 37 HZ1 LYS 37 -17.540 -3.882 -6.280 958 HZ2 LYS 37 HZ2 LYS 37 -19.066 -3.151 -6.287 959 HZ3 LYS 37 HZ3 LYS 37 -17.677 -2.208 -6.480 960 H ALA 38 H ALA 38 -12.297 -1.881 -7.413 961 HA ALA 38 HA ALA 38 -13.333 -0.396 -5.096 962 HB1 ALA 38 HB1 ALA 38 -11.411 -2.754 -5.179 963 HB2 ALA 38 HB2 ALA 38 -13.156 -2.852 -4.928 964 HB3 ALA 38 HB3 ALA 38 -12.141 -2.048 -3.729 965 H ASP 39 H ASP 39 -12.265 1.241 -4.177 966 HA ASP 39 HA ASP 39 -9.699 2.214 -4.888 967 HB2 ASP 39 HB2 ASP 39 -9.930 3.612 -2.761 968 HB3 ASP 39 HB3 ASP 39 -11.239 3.781 -3.924 969 H LYS 40 H LYS 40 -10.732 -0.171 -2.587 970 HA LYS 40 HA LYS 40 -8.528 -0.420 -0.883 971 HB2 LYS 40 HB2 LYS 40 -10.379 -2.623 -1.887 972 HB3 LYS 40 HB3 LYS 40 -9.375 -2.705 -0.436 973 HG2 LYS 40 HG2 LYS 40 -11.622 -0.709 -0.892 974 HG3 LYS 40 HG3 LYS 40 -11.771 -2.199 0.045 975 HD2 LYS 40 HD2 LYS 40 -10.217 -1.372 1.726 976 HD3 LYS 40 HD3 LYS 40 -9.800 0.026 0.729 977 HE2 LYS 40 HE2 LYS 40 -11.347 0.621 2.578 978 HE3 LYS 40 HE3 LYS 40 -12.052 0.936 0.992 979 HZ1 LYS 40 HZ1 LYS 40 -13.334 -1.076 1.175 980 HZ2 LYS 40 HZ2 LYS 40 -13.620 -0.106 2.529 981 HZ3 LYS 40 HZ3 LYS 40 -12.615 -1.461 2.655 982 H ASP 41 H ASP 41 -9.012 -1.811 -4.123 983 HA ASP 41 HA ASP 41 -6.521 -3.246 -4.270 984 HB2 ASP 41 HB2 ASP 41 -8.452 -2.242 -6.410 985 HB3 ASP 41 HB3 ASP 41 -6.983 -3.125 -6.808 986 H PHE 42 H PHE 42 -7.652 -0.072 -5.322 987 HA PHE 42 HA PHE 42 -5.432 0.835 -6.751 988 HB2 PHE 42 HB2 PHE 42 -7.567 1.949 -6.950 989 HB3 PHE 42 HB3 PHE 42 -7.590 2.354 -5.238 990 HD1 PHE 42 HD2 PHE 42 -5.622 2.989 -8.371 991 HD2 PHE 42 HD1 PHE 42 -6.826 4.487 -4.546 992 HE1 PHE 42 HE2 PHE 42 -4.565 5.143 -8.873 993 HE2 PHE 42 HE1 PHE 42 -5.758 6.640 -5.063 994 HZ PHE 42 HZ PHE 42 -4.630 6.970 -7.229 995 H PHE 43 H PHE 43 -6.056 1.085 -3.230 996 HA PHE 43 HA PHE 43 -3.946 2.869 -2.574 997 HB2 PHE 43 HB2 PHE 43 -5.305 0.777 -0.821 998 HB3 PHE 43 HB3 PHE 43 -4.247 2.050 -0.217 999 HD1 PHE 43 HD1 PHE 43 -5.224 4.356 -1.923 1000 HD2 PHE 43 HD2 PHE 43 -7.364 1.343 0.241 1001 HE1 PHE 43 HE1 PHE 43 -7.134 5.878 -1.693 1002 HE2 PHE 43 HE2 PHE 43 -9.279 2.870 0.459 1003 HZ PHE 43 HZ PHE 43 -9.169 5.141 -0.502 1004 H LEU 44 H LEU 44 -4.029 -0.669 -2.785 1005 HA LEU 44 HA LEU 44 -1.374 -1.121 -1.785 1006 HB2 LEU 44 HB2 LEU 44 -3.428 -2.843 -3.185 1007 HB3 LEU 44 HB3 LEU 44 -1.789 -3.440 -3.012 1008 HG LEU 44 HG LEU 44 -1.962 -3.266 -0.545 1009 HD11 LEU 44 HD11 LEU 44 -4.853 -2.454 -0.944 1010 HD12 LEU 44 HD12 LEU 44 -3.560 -1.431 -0.319 1011 HD13 LEU 44 HD13 LEU 44 -4.083 -2.841 0.596 1012 HD21 LEU 44 HD21 LEU 44 -3.462 -5.167 -0.179 1013 HD22 LEU 44 HD22 LEU 44 -2.510 -5.394 -1.645 1014 HD23 LEU 44 HD23 LEU 44 -4.205 -4.912 -1.762 1015 H GLY 45 H GLY 45 -2.759 -0.820 -5.063 1016 HA2 GLY 45 HA2 GLY 45 -0.390 -1.320 -6.569 1017 HA3 GLY 45 HA3 GLY 45 -1.803 -0.441 -7.129 1018 H LEU 46 H LEU 46 -1.871 1.712 -5.465 1019 HA LEU 46 HA LEU 46 0.092 3.498 -6.537 1020 HB2 LEU 46 HB2 LEU 46 -2.297 4.106 -6.003 1021 HB3 LEU 46 HB3 LEU 46 -1.917 3.970 -4.295 1022 HG LEU 46 HG LEU 46 -0.243 5.836 -4.569 1023 HD11 LEU 46 HD11 LEU 46 0.231 5.591 -6.949 1024 HD12 LEU 46 HD12 LEU 46 -0.310 7.226 -6.594 1025 HD13 LEU 46 HD13 LEU 46 -1.417 6.082 -7.357 1026 HD21 LEU 46 HD21 LEU 46 -3.101 6.554 -5.317 1027 HD22 LEU 46 HD22 LEU 46 -1.898 7.656 -4.644 1028 HD23 LEU 46 HD23 LEU 46 -2.487 6.304 -3.680 1029 H GLY 47 H GLY 47 -0.294 1.808 -3.508 1030 HA2 GLY 47 HA2 GLY 47 1.670 3.147 -1.914 1031 HA3 GLY 47 HA3 GLY 47 0.985 1.555 -1.607 1032 H TRP 48 H TRP 48 1.746 0.417 -4.137 1033 HA TRP 48 HA TRP 48 4.431 -0.403 -3.757 1034 HB2 TRP 48 HB2 TRP 48 2.644 -1.686 -5.026 1035 HB3 TRP 48 HB3 TRP 48 2.814 -0.535 -6.343 1036 HD1 TRP 48 HD1 TRP 48 5.498 -0.449 -7.381 1037 HE1 TRP 48 HE1 TRP 48 7.041 -2.423 -7.862 1038 HE3 TRP 48 HE3 TRP 48 3.191 -4.003 -4.534 1039 HZ2 TRP 48 HZ2 TRP 48 7.251 -5.136 -7.197 1040 HZ3 TRP 48 HZ3 TRP 48 4.122 -6.280 -4.527 1041 HH2 TRP 48 HH2 TRP 48 6.111 -6.841 -5.832 1042 H LEU 49 H LEU 49 2.973 2.084 -5.886 1043 HA LEU 49 HA LEU 49 5.247 2.905 -7.311 1044 HB2 LEU 49 HB2 LEU 49 2.665 4.253 -6.572 1045 HB3 LEU 49 HB3 LEU 49 3.927 5.236 -7.282 1046 HG LEU 49 HG LEU 49 3.870 4.005 -9.356 1047 HD11 LEU 49 HD11 LEU 49 1.957 2.071 -8.055 1048 HD12 LEU 49 HD12 LEU 49 3.629 1.749 -8.531 1049 HD13 LEU 49 HD13 LEU 49 2.419 2.091 -9.764 1050 HD21 LEU 49 HD21 LEU 49 1.017 4.471 -8.427 1051 HD22 LEU 49 HD22 LEU 49 1.568 4.383 -10.106 1052 HD23 LEU 49 HD23 LEU 49 2.108 5.704 -9.074 1053 H LEU 50 H LEU 50 4.315 3.730 -4.012 1054 HA LEU 50 HA LEU 50 6.264 5.742 -3.508 1055 HB2 LEU 50 HB2 LEU 50 4.930 3.809 -1.581 1056 HB3 LEU 50 HB3 LEU 50 5.912 5.182 -1.084 1057 HG LEU 50 HG LEU 50 3.245 5.312 -2.561 1058 HD11 LEU 50 HD11 LEU 50 3.958 6.106 0.285 1059 HD12 LEU 50 HD12 LEU 50 2.982 4.719 -0.209 1060 HD13 LEU 50 HD13 LEU 50 2.394 6.355 -0.499 1061 HD21 LEU 50 HD21 LEU 50 3.415 7.770 -2.324 1062 HD22 LEU 50 HD22 LEU 50 4.689 7.120 -3.349 1063 HD23 LEU 50 HD23 LEU 50 5.054 7.602 -1.688 1064 H ARG 51 H ARG 51 6.431 2.147 -3.107 1065 HA ARG 51 HA ARG 51 9.090 2.107 -2.037 1066 HB2 ARG 51 HB2 ARG 51 8.981 -0.221 -2.105 1067 HB3 ARG 51 HB3 ARG 51 7.269 0.171 -2.136 1068 HG2 ARG 51 HG2 ARG 51 7.311 -0.123 -4.638 1069 HG3 ARG 51 HG3 ARG 51 8.985 -0.640 -4.514 1070 HD2 ARG 51 HD2 ARG 51 7.461 -2.555 -4.689 1071 HD3 ARG 51 HD3 ARG 51 8.299 -2.556 -3.134 1072 HE ARG 51 HE ARG 51 5.740 -1.255 -3.067 1073 HH11 ARG 51 HH11 ARG 51 7.189 -4.384 -2.922 1074 HH12 ARG 51 HH12 ARG 51 5.919 -5.034 -1.959 1075 HH21 ARG 51 HH21 ARG 51 4.112 -2.130 -1.843 1076 HH22 ARG 51 HH22 ARG 51 4.212 -3.776 -1.343 1077 H GLU 52 H GLU 52 7.799 2.341 -5.255 1078 HA GLU 52 HA GLU 52 10.241 1.812 -6.703 1079 HB2 GLU 52 HB2 GLU 52 7.626 3.113 -7.582 1080 HB3 GLU 52 HB3 GLU 52 8.929 2.620 -8.658 1081 HG2 GLU 52 HG2 GLU 52 7.311 0.732 -6.925 1082 HG3 GLU 52 HG3 GLU 52 6.998 1.059 -8.628 1083 H ASP 53 H ASP 53 8.869 4.522 -5.083 1084 HA ASP 53 HA ASP 53 9.060 6.724 -5.032 1085 HB2 ASP 53 HB2 ASP 53 11.316 7.717 -4.913 1086 HB3 ASP 53 HB3 ASP 53 11.187 6.243 -3.976 1087 H LYS 54 H LYS 54 8.355 5.599 -7.603 1088 HA LYS 54 HA LYS 54 9.340 7.503 -9.606 1089 HB2 LYS 54 HB2 LYS 54 7.312 5.235 -9.816 1090 HB3 LYS 54 HB3 LYS 54 7.786 6.264 -11.168 1091 HG2 LYS 54 HG2 LYS 54 10.152 5.478 -10.860 1092 HG3 LYS 54 HG3 LYS 54 9.574 4.347 -9.631 1093 HD2 LYS 54 HD2 LYS 54 8.705 4.387 -12.555 1094 HD3 LYS 54 HD3 LYS 54 9.878 3.269 -11.855 1095 HE2 LYS 54 HE2 LYS 54 8.101 2.341 -10.391 1096 HE3 LYS 54 HE3 LYS 54 6.938 3.466 -11.091 1097 HZ1 LYS 54 HZ1 LYS 54 8.391 1.332 -12.546 1098 HZ2 LYS 54 HZ2 LYS 54 7.284 2.410 -13.233 1099 HZ3 LYS 54 HZ3 LYS 54 6.770 1.289 -12.075 1100 H VAL 55 H VAL 55 7.078 7.766 -7.180 1101 HA VAL 55 HA VAL 55 5.632 9.872 -8.671 1102 HB VAL 55 HB VAL 55 3.508 9.409 -7.502 1103 HG11 VAL 55 HG11 VAL 55 3.828 8.449 -9.744 1104 HG12 VAL 55 HG12 VAL 55 2.812 7.403 -8.750 1105 HG13 VAL 55 HG13 VAL 55 4.501 6.978 -9.034 1106 HG21 VAL 55 HG21 VAL 55 3.150 7.309 -6.225 1107 HG22 VAL 55 HG22 VAL 55 4.367 8.330 -5.456 1108 HG23 VAL 55 HG23 VAL 55 4.865 6.917 -6.388 1109 H VAL 56 H VAL 56 4.694 11.535 -7.393 1110 HA VAL 56 HA VAL 56 5.463 11.764 -4.561 1111 HB VAL 56 HB VAL 56 6.903 13.329 -5.799 1112 HG11 VAL 56 HG11 VAL 56 5.578 13.632 -7.848 1113 HG12 VAL 56 HG12 VAL 56 6.021 15.196 -7.164 1114 HG13 VAL 56 HG13 VAL 56 4.381 14.579 -6.958 1115 HG21 VAL 56 HG21 VAL 56 6.132 14.054 -3.577 1116 HG22 VAL 56 HG22 VAL 56 4.716 14.825 -4.295 1117 HG23 VAL 56 HG23 VAL 56 6.330 15.449 -4.641 1118 H THR 57 H THR 57 3.755 12.357 -3.205 1119 HA THR 57 HA THR 57 1.076 12.312 -4.473 1120 HB THR 57 HB THR 57 0.198 11.427 -2.376 1121 HG1 THR 57 HG1 THR 57 1.274 11.533 -0.531 1122 HG21 THR 57 HG21 THR 57 1.438 9.296 -2.150 1123 HG22 THR 57 HG22 THR 57 2.789 9.978 -3.055 1124 HG23 THR 57 HG23 THR 57 1.236 9.725 -3.852 1125 H SER 58 H SER 58 -0.598 13.583 -3.587 1126 HA SER 58 HA SER 58 -0.200 15.779 -1.765 1127 HB2 SER 58 HB2 SER 58 -0.604 17.597 -3.439 1128 HB3 SER 58 HB3 SER 58 0.898 16.744 -3.791 1129 HG SER 58 HG SER 58 -1.063 15.494 -5.085 1130 H GLU 59 H GLU 59 -2.278 17.201 -1.798 1131 HA GLU 59 HA GLU 59 -4.640 15.599 -2.629 1132 HB2 GLU 59 HB2 GLU 59 -4.456 15.952 -0.124 1133 HB3 GLU 59 HB3 GLU 59 -4.588 17.687 -0.403 1134 HG2 GLU 59 HG2 GLU 59 -6.811 17.163 -1.602 1135 HG3 GLU 59 HG3 GLU 59 -6.677 15.549 -0.914 1136 H VAL 60 H VAL 60 -5.283 16.415 -4.528 1137 HA VAL 60 HA VAL 60 -5.470 19.352 -4.923 1138 HB VAL 60 HB VAL 60 -5.203 17.086 -6.944 1139 HG11 VAL 60 HG11 VAL 60 -5.877 19.982 -7.602 1140 HG12 VAL 60 HG12 VAL 60 -6.910 18.579 -7.878 1141 HG13 VAL 60 HG13 VAL 60 -5.404 18.751 -8.778 1142 HG21 VAL 60 HG21 VAL 60 -3.523 19.577 -6.467 1143 HG22 VAL 60 HG22 VAL 60 -3.206 18.338 -7.685 1144 HG23 VAL 60 HG23 VAL 60 -3.101 17.933 -5.970 1145 H GLU 61 H GLU 61 -7.374 20.174 -4.707 1146 HA GLU 61 HA GLU 61 -9.565 20.638 -4.608 1147 HB2 GLU 61 HB2 GLU 61 -9.800 18.613 -6.872 1148 HB3 GLU 61 HB3 GLU 61 -10.930 19.920 -6.517 1149 HG2 GLU 61 HG2 GLU 61 -8.046 20.266 -7.387 1150 HG3 GLU 61 HG3 GLU 61 -9.434 20.418 -8.442 1151 H GLY 62 H GLY 62 -8.618 18.479 -2.872 1152 HA2 GLY 62 HA2 GLY 62 -9.798 17.538 -1.058 1153 HA3 GLY 62 HA3 GLY 62 -11.235 17.416 -2.054 1154 H GLU 63 H GLU 63 -8.789 16.138 -3.930 1155 HA GLU 63 HA GLU 63 -9.231 13.368 -2.929 1156 HB2 GLU 63 HB2 GLU 63 -8.963 14.298 -5.819 1157 HB3 GLU 63 HB3 GLU 63 -8.931 12.611 -5.315 1158 HG2 GLU 63 HG2 GLU 63 -11.256 12.984 -4.342 1159 HG3 GLU 63 HG3 GLU 63 -11.257 14.541 -5.178 1160 H ILE 64 H ILE 64 -7.569 11.805 -3.495 1161 HA ILE 64 HA ILE 64 -4.865 12.681 -3.046 1162 HB ILE 64 HB ILE 64 -5.911 9.932 -3.887 1163 HG12 ILE 64 HG12 ILE 64 -5.232 10.934 -1.078 1164 HG13 ILE 64 HG13 ILE 64 -6.867 10.758 -1.709 1165 HG21 ILE 64 HG21 ILE 64 -3.764 9.036 -3.033 1166 HG22 ILE 64 HG22 ILE 64 -3.202 10.678 -2.714 1167 HG23 ILE 64 HG23 ILE 64 -3.508 10.158 -4.374 1168 HD11 ILE 64 HD11 ILE 64 -6.541 8.338 -1.891 1169 HD12 ILE 64 HD12 ILE 64 -6.269 8.914 -0.248 1170 HD13 ILE 64 HD13 ILE 64 -4.895 8.507 -1.273 1171 H PHE 65 H PHE 65 -3.473 13.333 -4.564 1172 HA PHE 65 HA PHE 65 -3.837 12.673 -7.428 1173 HB2 PHE 65 HB2 PHE 65 -4.669 14.973 -6.930 1174 HB3 PHE 65 HB3 PHE 65 -3.104 15.397 -6.254 1175 HD1 PHE 65 HD2 PHE 65 -4.985 14.781 -9.363 1176 HD2 PHE 65 HD1 PHE 65 -1.172 15.839 -7.754 1177 HE1 PHE 65 HE2 PHE 65 -4.258 15.544 -11.576 1178 HE2 PHE 65 HE1 PHE 65 -0.458 16.603 -9.981 1179 HZ PHE 65 HZ PHE 65 -1.997 16.455 -11.888 1180 H VAL 66 H VAL 66 -2.012 11.920 -8.357 1181 HA VAL 66 HA VAL 66 0.597 12.260 -6.977 1182 HB VAL 66 HB VAL 66 1.205 9.937 -7.674 1183 HG11 VAL 66 HG11 VAL 66 -0.124 8.766 -5.947 1184 HG12 VAL 66 HG12 VAL 66 -1.285 10.095 -5.927 1185 HG13 VAL 66 HG13 VAL 66 0.374 10.364 -5.391 1186 HG21 VAL 66 HG21 VAL 66 -0.334 9.670 -9.592 1187 HG22 VAL 66 HG22 VAL 66 -1.720 9.679 -8.501 1188 HG23 VAL 66 HG23 VAL 66 -0.555 8.355 -8.434 1189 H LYS 67 H LYS 67 2.436 12.343 -8.244 1190 HA LYS 67 HA LYS 67 2.130 12.871 -11.166 1191 HB2 LYS 67 HB2 LYS 67 4.008 14.405 -9.309 1192 HB3 LYS 67 HB3 LYS 67 3.579 14.805 -10.970 1193 HG2 LYS 67 HG2 LYS 67 1.406 15.567 -10.309 1194 HG3 LYS 67 HG3 LYS 67 1.588 14.876 -8.691 1195 HD2 LYS 67 HD2 LYS 67 3.473 16.500 -8.273 1196 HD3 LYS 67 HD3 LYS 67 3.127 17.246 -9.838 1197 HE2 LYS 67 HE2 LYS 67 2.103 18.487 -7.955 1198 HE3 LYS 67 HE3 LYS 67 0.881 17.865 -9.066 1199 HZ1 LYS 67 HZ1 LYS 67 0.280 17.531 -6.739 1200 HZ2 LYS 67 HZ2 LYS 67 1.661 16.589 -6.501 1201 HZ3 LYS 67 HZ3 LYS 67 0.448 16.060 -7.549 1202 H LEU 68 H LEU 68 4.076 12.228 -12.424 1203 HA LEU 68 HA LEU 68 5.766 10.252 -11.142 1204 HB2 LEU 68 HB2 LEU 68 5.878 11.409 -13.948 1205 HB3 LEU 68 HB3 LEU 68 6.919 10.111 -13.378 1206 HG LEU 68 HG LEU 68 3.907 10.010 -13.800 1207 HD11 LEU 68 HD11 LEU 68 4.427 8.259 -15.432 1208 HD12 LEU 68 HD12 LEU 68 6.153 8.455 -15.122 1209 HD13 LEU 68 HD13 LEU 68 5.226 9.776 -15.841 1210 HD21 LEU 68 HD21 LEU 68 3.965 7.664 -13.030 1211 HD22 LEU 68 HD22 LEU 68 4.392 8.785 -11.741 1212 HD23 LEU 68 HD23 LEU 68 5.657 7.857 -12.552 1213 H VAL 69 H VAL 69 6.601 11.722 -9.480 1214 HA VAL 69 HA VAL 69 8.095 13.097 -8.450 1215 HB VAL 69 HB VAL 69 10.047 12.124 -10.595 1216 HG11 VAL 69 HG11 VAL 69 11.049 13.830 -9.098 1217 HG12 VAL 69 HG12 VAL 69 11.778 12.251 -8.817 1218 HG13 VAL 69 HG13 VAL 69 10.583 12.884 -7.682 1219 HG21 VAL 69 HG21 VAL 69 9.191 10.676 -8.063 1220 HG22 VAL 69 HG22 VAL 69 10.477 10.159 -9.158 1221 HG23 VAL 69 HG23 VAL 69 8.807 10.202 -9.721 1222 H LEU 70 H LEU 70 6.459 14.379 -10.477 1223 HA LEU 70 HA LEU 70 7.983 16.293 -11.973 1224 HB2 LEU 70 HB2 LEU 70 5.022 16.333 -11.247 1225 HB3 LEU 70 HB3 LEU 70 5.795 17.340 -12.467 1226 HG LEU 70 HG LEU 70 5.511 14.307 -12.585 1227 HD11 LEU 70 HD11 LEU 70 3.378 15.428 -12.927 1228 HD12 LEU 70 HD12 LEU 70 3.945 14.689 -14.420 1229 HD13 LEU 70 HD13 LEU 70 4.077 16.437 -14.198 1230 HD21 LEU 70 HD21 LEU 70 7.582 14.988 -13.682 1231 HD22 LEU 70 HD22 LEU 70 6.717 16.184 -14.651 1232 HD23 LEU 70 HD23 LEU 70 6.400 14.461 -14.879 1233 H GLU 71 H GLU 71 8.604 18.317 -11.428 1234 HA GLU 71 HA GLU 71 8.808 18.998 -8.656 1235 HB2 GLU 71 HB2 GLU 71 10.581 19.464 -10.402 1236 HB3 GLU 71 HB3 GLU 71 9.545 20.720 -11.063 1237 HG2 GLU 71 HG2 GLU 71 11.129 21.843 -9.714 1238 HG3 GLU 71 HG3 GLU 71 9.639 21.847 -8.779 1239 H HIS 72 H HIS 72 6.811 19.446 -7.754 1240 HA HIS 72 HA HIS 72 5.537 21.984 -8.371 1241 HB2 HIS 72 HB2 HIS 72 4.533 20.218 -9.967 1242 HB3 HIS 72 HB3 HIS 72 3.806 19.487 -8.544 1243 HD1 HIS 72 HD1 HIS 72 3.631 22.530 -10.731 1244 HD2 HIS 72 HD2 HIS 72 1.541 20.830 -7.564 1245 HE1 HIS 72 HE1 HIS 72 1.491 23.831 -10.562 1246 HE2 HIS 72 HE2 HIS 72 0.312 22.876 -8.562 1247 H HIS 73 H HIS 73 3.893 22.580 -6.784 1248 HA HIS 73 HA HIS 73 2.962 22.858 -4.772 1249 HB2 HIS 73 HB2 HIS 73 2.439 20.410 -4.768 1250 HB3 HIS 73 HB3 HIS 73 3.972 20.100 -3.968 1251 HD1 HIS 73 HD1 HIS 73 0.716 21.984 -3.305 1252 HD2 HIS 73 HD2 HIS 73 3.786 20.097 -1.226 1253 HE1 HIS 73 HE1 HIS 73 0.052 22.087 -0.884 1254 HE2 HIS 73 HE2 HIS 73 1.835 20.787 0.327 1255 H HIS 74 H HIS 74 6.149 22.882 -5.366 1256 HA HIS 74 HA HIS 74 7.135 23.567 -2.694 1257 HB2 HIS 74 HB2 HIS 74 8.439 23.868 -5.432 1258 HB3 HIS 74 HB3 HIS 74 9.235 24.212 -3.901 1259 HD1 HIS 74 HD1 HIS 74 10.619 22.352 -3.073 1260 HD2 HIS 74 HD2 HIS 74 7.539 20.968 -5.482 1261 HE1 HIS 74 HE1 HIS 74 10.961 19.878 -3.230 1262 HE2 HIS 74 HE2 HIS 74 9.250 19.122 -4.905 1263 H HIS 75 H HIS 75 7.924 25.706 -2.168 1264 HA HIS 75 HA HIS 75 7.697 27.905 -1.765 1265 HB2 HIS 75 HB2 HIS 75 6.660 28.164 -4.616 1266 HB3 HIS 75 HB3 HIS 75 7.054 29.518 -3.560 1267 HD1 HIS 75 HD1 HIS 75 9.509 30.178 -3.363 1268 HD2 HIS 75 HD2 HIS 75 8.929 26.716 -5.584 1269 HE1 HIS 75 HE1 HIS 75 11.716 29.703 -4.452 1270 HE2 HIS 75 HE2 HIS 75 11.285 27.721 -5.929 1271 H HIS 76 H HIS 76 4.802 27.173 -3.774 1272 HA HIS 76 HA HIS 76 3.017 28.542 -1.979 1273 HB2 HIS 76 HB2 HIS 76 2.641 28.415 -4.471 1274 HB3 HIS 76 HB3 HIS 76 2.297 26.696 -4.302 1275 HD1 HIS 76 HD1 HIS 76 0.872 30.085 -3.536 1276 HD2 HIS 76 HD2 HIS 76 -0.282 26.096 -3.306 1277 HE1 HIS 76 HE1 HIS 76 -1.593 30.124 -3.077 1278 HE2 HIS 76 HE2 HIS 76 -2.286 27.712 -3.020 1279 H HIS 77 H HIS 77 3.015 27.613 -0.012 1280 HA HIS 77 HA HIS 77 2.295 24.768 0.362 1281 HB2 HIS 77 HB2 HIS 77 2.978 25.201 2.762 1282 HB3 HIS 77 HB3 HIS 77 4.278 25.425 1.600 1283 HD1 HIS 77 HD1 HIS 77 5.038 27.897 1.127 1284 HD2 HIS 77 HD2 HIS 77 2.338 27.482 4.262 1285 HE1 HIS 77 HE1 HIS 77 5.111 30.074 2.368 1286 HE2 HIS 77 HE2 HIS 77 3.506 29.789 4.278 Start of MODEL 19 1 H1 MET 1 H1 MET 1 12.497 17.060 1.035 2 H2 MET 1 H2 MET 1 11.010 16.945 0.242 3 H3 MET 1 H3 MET 1 11.400 15.864 1.485 4 HA MET 1 HA MET 1 11.391 17.600 3.099 5 HB2 MET 1 HB2 MET 1 12.197 19.436 1.686 6 HB3 MET 1 HB3 MET 1 10.726 19.393 0.725 7 HG2 MET 1 HG2 MET 1 9.424 20.177 2.637 8 HG3 MET 1 HG3 MET 1 10.862 20.151 3.655 9 HE1 MET 1 HE1 MET 1 12.852 21.912 3.476 10 HE2 MET 1 HE2 MET 1 12.986 23.079 2.159 11 HE3 MET 1 HE3 MET 1 13.135 21.356 1.824 12 H LYS 2 H LYS 2 9.729 16.539 4.062 13 HA LYS 2 HA LYS 2 7.664 16.131 4.870 14 HB2 LYS 2 HB2 LYS 2 7.074 18.678 3.320 15 HB3 LYS 2 HB3 LYS 2 5.855 17.898 4.325 16 HG2 LYS 2 HG2 LYS 2 8.547 18.867 5.356 17 HG3 LYS 2 HG3 LYS 2 7.050 19.806 5.434 18 HD2 LYS 2 HD2 LYS 2 6.016 18.032 6.833 19 HD3 LYS 2 HD3 LYS 2 7.513 17.096 6.754 20 HE2 LYS 2 HE2 LYS 2 7.301 19.881 7.951 21 HE3 LYS 2 HE3 LYS 2 7.223 18.386 8.881 22 HZ1 LYS 2 HZ1 LYS 2 9.431 19.358 8.894 23 HZ2 LYS 2 HZ2 LYS 2 9.520 19.239 7.217 24 HZ3 LYS 2 HZ3 LYS 2 9.441 17.839 8.158 25 H MET 3 H MET 3 8.411 14.860 2.285 26 HA MET 3 HA MET 3 6.021 14.557 0.716 27 HB2 MET 3 HB2 MET 3 8.662 13.045 0.740 28 HB3 MET 3 HB3 MET 3 7.331 12.592 -0.324 29 HG2 MET 3 HG2 MET 3 8.753 15.266 -0.309 30 HG3 MET 3 HG3 MET 3 8.934 13.978 -1.510 31 HE1 MET 3 HE1 MET 3 8.221 16.955 -2.358 32 HE2 MET 3 HE2 MET 3 6.928 16.675 -3.526 33 HE3 MET 3 HE3 MET 3 8.343 15.625 -3.512 34 H LEU 4 H LEU 4 4.566 12.926 0.650 35 HA LEU 4 HA LEU 4 3.847 11.506 2.976 36 HB2 LEU 4 HB2 LEU 4 2.928 11.114 0.100 37 HB3 LEU 4 HB3 LEU 4 2.226 10.262 1.463 38 HG LEU 4 HG LEU 4 1.524 12.507 2.420 39 HD11 LEU 4 HD11 LEU 4 2.291 13.616 -0.298 40 HD12 LEU 4 HD12 LEU 4 3.079 13.989 1.237 41 HD13 LEU 4 HD13 LEU 4 1.405 14.473 0.971 42 HD21 LEU 4 HD21 LEU 4 -0.076 11.061 1.258 43 HD22 LEU 4 HD22 LEU 4 0.363 11.788 -0.292 44 HD23 LEU 4 HD23 LEU 4 -0.429 12.762 0.951 45 H LYS 5 H LYS 5 6.118 10.686 0.510 46 HA LYS 5 HA LYS 5 6.329 7.882 0.657 47 HB2 LYS 5 HB2 LYS 5 7.534 9.289 -0.992 48 HB3 LYS 5 HB3 LYS 5 8.497 10.000 0.295 49 HG2 LYS 5 HG2 LYS 5 9.850 8.394 -0.881 50 HG3 LYS 5 HG3 LYS 5 9.512 7.767 0.735 51 HD2 LYS 5 HD2 LYS 5 7.722 6.318 -0.226 52 HD3 LYS 5 HD3 LYS 5 8.109 6.930 -1.839 53 HE2 LYS 5 HE2 LYS 5 9.939 5.317 -0.027 54 HE3 LYS 5 HE3 LYS 5 9.150 4.751 -1.502 55 HZ1 LYS 5 HZ1 LYS 5 11.445 5.303 -1.902 56 HZ2 LYS 5 HZ2 LYS 5 11.220 6.871 -1.334 57 HZ3 LYS 5 HZ3 LYS 5 10.456 6.369 -2.755 58 H GLU 6 H GLU 6 7.903 10.406 2.607 59 HA GLU 6 HA GLU 6 9.484 8.732 4.266 60 HB2 GLU 6 HB2 GLU 6 9.706 11.281 3.701 61 HB3 GLU 6 HB3 GLU 6 8.563 11.547 5.008 62 HG2 GLU 6 HG2 GLU 6 11.197 10.086 5.401 63 HG3 GLU 6 HG3 GLU 6 11.071 11.839 5.509 64 H LYS 7 H LYS 7 6.210 9.965 4.511 65 HA LYS 7 HA LYS 7 5.702 9.370 7.251 66 HB2 LYS 7 HB2 LYS 7 4.445 10.998 5.679 67 HB3 LYS 7 HB3 LYS 7 3.575 9.591 5.086 68 HG2 LYS 7 HG2 LYS 7 3.632 10.191 8.046 69 HG3 LYS 7 HG3 LYS 7 2.560 11.108 6.993 70 HD2 LYS 7 HD2 LYS 7 2.525 8.068 7.140 71 HD3 LYS 7 HD3 LYS 7 1.537 9.097 8.184 72 HE2 LYS 7 HE2 LYS 7 0.579 10.128 6.044 73 HE3 LYS 7 HE3 LYS 7 1.389 8.826 5.165 74 HZ1 LYS 7 HZ1 LYS 7 -0.640 8.488 7.300 75 HZ2 LYS 7 HZ2 LYS 7 0.129 7.234 6.471 76 HZ3 LYS 7 HZ3 LYS 7 -0.897 8.287 5.644 77 H ALA 8 H ALA 8 4.977 7.618 4.242 78 HA ALA 8 HA ALA 8 3.656 5.364 5.268 79 HB1 ALA 8 HB1 ALA 8 4.229 4.268 3.141 80 HB2 ALA 8 HB2 ALA 8 5.430 5.521 2.810 81 HB3 ALA 8 HB3 ALA 8 3.717 5.938 2.879 82 H GLY 9 H GLY 9 7.136 5.997 4.945 83 HA2 GLY 9 HA2 GLY 9 8.165 3.482 5.725 84 HA3 GLY 9 HA3 GLY 9 8.993 5.024 5.875 85 H ALA 10 H ALA 10 7.217 6.312 7.686 86 HA ALA 10 HA ALA 10 8.156 5.386 10.208 87 HB1 ALA 10 HB1 ALA 10 5.922 7.363 9.617 88 HB2 ALA 10 HB2 ALA 10 7.634 7.757 9.774 89 HB3 ALA 10 HB3 ALA 10 6.739 7.159 11.172 90 H LEU 11 H LEU 11 5.109 4.912 8.479 91 HA LEU 11 HA LEU 11 3.590 3.659 10.540 92 HB2 LEU 11 HB2 LEU 11 3.384 3.403 7.513 93 HB3 LEU 11 HB3 LEU 11 2.158 2.849 8.649 94 HG LEU 11 HG LEU 11 3.017 5.756 8.308 95 HD11 LEU 11 HD11 LEU 11 0.518 4.378 7.284 96 HD12 LEU 11 HD12 LEU 11 1.869 4.961 6.308 97 HD13 LEU 11 HD13 LEU 11 0.867 6.109 7.193 98 HD21 LEU 11 HD21 LEU 11 2.214 5.274 10.582 99 HD22 LEU 11 HD22 LEU 11 0.728 4.577 9.928 100 HD23 LEU 11 HD23 LEU 11 1.071 6.294 9.711 101 H ALA 12 H ALA 12 5.687 2.396 7.973 102 HA ALA 12 HA ALA 12 5.333 -0.357 8.264 103 HB1 ALA 12 HB1 ALA 12 7.867 1.100 7.455 104 HB2 ALA 12 HB2 ALA 12 6.527 0.679 6.388 105 HB3 ALA 12 HB3 ALA 12 7.491 -0.601 7.130 106 H GLY 13 H GLY 13 7.629 1.785 9.937 107 HA2 GLY 13 HA2 GLY 13 9.105 -0.065 11.413 108 HA3 GLY 13 HA3 GLY 13 8.790 1.590 11.906 109 H GLN 14 H GLN 14 5.937 1.360 12.156 110 HA GLN 14 HA GLN 14 5.744 0.349 14.843 111 HB2 GLN 14 HB2 GLN 14 3.473 1.290 13.042 112 HB3 GLN 14 HB3 GLN 14 3.436 1.144 14.801 113 HG2 GLN 14 HG2 GLN 14 5.247 2.919 14.882 114 HG3 GLN 14 HG3 GLN 14 5.012 3.144 13.146 115 HE21 GLN 14 HE21 GLN 14 2.991 3.997 12.427 116 HE22 GLN 14 HE22 GLN 14 1.978 4.896 13.495 117 H ILE 15 H ILE 15 4.381 -0.662 11.708 118 HA ILE 15 HA ILE 15 2.729 -2.764 12.685 119 HB ILE 15 HB ILE 15 3.799 -2.226 9.876 120 HG12 ILE 15 HG12 ILE 15 1.110 -1.572 11.181 121 HG13 ILE 15 HG13 ILE 15 2.382 -0.411 10.812 122 HG21 ILE 15 HG21 ILE 15 2.004 -3.707 9.017 123 HG22 ILE 15 HG22 ILE 15 1.562 -4.138 10.669 124 HG23 ILE 15 HG23 ILE 15 3.138 -4.603 10.031 125 HD11 ILE 15 HD11 ILE 15 0.603 -0.260 9.206 126 HD12 ILE 15 HD12 ILE 15 0.744 -1.976 8.824 127 HD13 ILE 15 HD13 ILE 15 2.056 -0.869 8.417 128 H TRP 16 H TRP 16 6.010 -2.807 11.248 129 HA TRP 16 HA TRP 16 6.524 -5.569 11.369 130 HB2 TRP 16 HB2 TRP 16 7.997 -3.908 10.184 131 HB3 TRP 16 HB3 TRP 16 8.545 -3.307 11.751 132 HD1 TRP 16 HD1 TRP 16 8.844 -6.399 9.464 133 HE1 TRP 16 HE1 TRP 16 10.880 -7.787 10.202 134 HE3 TRP 16 HE3 TRP 16 10.083 -3.845 13.729 135 HZ2 TRP 16 HZ2 TRP 16 12.749 -7.819 12.310 136 HZ3 TRP 16 HZ3 TRP 16 12.004 -4.627 15.060 137 HH2 TRP 16 HH2 TRP 16 13.308 -6.578 14.365 138 H GLU 17 H GLU 17 6.964 -3.004 13.786 139 HA GLU 17 HA GLU 17 8.307 -4.564 15.754 140 HB2 GLU 17 HB2 GLU 17 8.389 -2.055 15.523 141 HB3 GLU 17 HB3 GLU 17 6.745 -1.979 16.147 142 HG2 GLU 17 HG2 GLU 17 7.505 -2.954 18.274 143 HG3 GLU 17 HG3 GLU 17 9.143 -3.077 17.633 144 H ALA 18 H ALA 18 4.908 -3.856 15.117 145 HA ALA 18 HA ALA 18 3.775 -5.042 17.462 146 HB1 ALA 18 HB1 ALA 18 2.525 -4.627 14.720 147 HB2 ALA 18 HB2 ALA 18 2.523 -3.456 16.039 148 HB3 ALA 18 HB3 ALA 18 1.650 -4.979 16.217 149 H LEU 19 H LEU 19 4.757 -6.312 14.302 150 HA LEU 19 HA LEU 19 3.894 -9.039 14.804 151 HB2 LEU 19 HB2 LEU 19 5.688 -7.793 12.690 152 HB3 LEU 19 HB3 LEU 19 5.305 -9.507 12.727 153 HG LEU 19 HG LEU 19 3.235 -7.291 12.405 154 HD11 LEU 19 HD11 LEU 19 4.701 -7.388 10.437 155 HD12 LEU 19 HD12 LEU 19 3.083 -7.964 10.050 156 HD13 LEU 19 HD13 LEU 19 4.398 -9.123 10.273 157 HD21 LEU 19 HD21 LEU 19 2.958 -10.312 12.173 158 HD22 LEU 19 HD22 LEU 19 1.693 -9.134 11.815 159 HD23 LEU 19 HD23 LEU 19 2.302 -9.293 13.459 160 H ASN 20 H ASN 20 6.655 -7.146 15.675 161 HA ASN 20 HA ASN 20 8.569 -9.324 15.889 162 HB2 ASN 20 HB2 ASN 20 9.295 -6.996 15.318 163 HB3 ASN 20 HB3 ASN 20 8.726 -6.435 16.884 164 HD21 ASN 20 HD21 ASN 20 11.128 -8.390 15.257 165 HD22 ASN 20 HD22 ASN 20 12.264 -8.410 16.553 166 H GLY 21 H GLY 21 8.737 -10.651 17.634 167 HA2 GLY 21 HA2 GLY 21 8.590 -11.193 19.978 168 HA3 GLY 21 HA3 GLY 21 7.335 -9.978 20.175 169 H THR 22 H THR 22 6.434 -11.310 17.386 170 HA THR 22 HA THR 22 5.075 -13.730 18.451 171 HB THR 22 HB THR 22 3.060 -13.189 17.080 172 HG1 THR 22 HG1 THR 22 4.393 -10.721 16.577 173 HG21 THR 22 HG21 THR 22 3.740 -10.950 19.019 174 HG22 THR 22 HG22 THR 22 3.009 -12.498 19.440 175 HG23 THR 22 HG23 THR 22 2.118 -11.350 18.438 176 H GLU 23 H GLU 23 4.251 -15.137 16.551 177 HA GLU 23 HA GLU 23 6.396 -15.361 14.545 178 HB2 GLU 23 HB2 GLU 23 5.615 -17.602 14.111 179 HB3 GLU 23 HB3 GLU 23 5.698 -17.384 15.854 180 HG2 GLU 23 HG2 GLU 23 3.281 -17.150 15.986 181 HG3 GLU 23 HG3 GLU 23 3.146 -17.201 14.230 182 H GLY 24 H GLY 24 3.520 -13.747 14.673 183 HA2 GLY 24 HA2 GLY 24 3.070 -12.744 12.319 184 HA3 GLY 24 HA3 GLY 24 2.585 -14.393 11.944 185 H LEU 25 H LEU 25 1.216 -11.604 12.344 186 HA LEU 25 HA LEU 25 -1.111 -12.575 13.901 187 HB2 LEU 25 HB2 LEU 25 -0.015 -9.733 13.818 188 HB3 LEU 25 HB3 LEU 25 -1.521 -10.198 14.596 189 HG LEU 25 HG LEU 25 1.269 -11.092 15.452 190 HD11 LEU 25 HD11 LEU 25 0.884 -8.733 15.951 191 HD12 LEU 25 HD12 LEU 25 0.912 -9.681 17.436 192 HD13 LEU 25 HD13 LEU 25 -0.630 -9.124 16.774 193 HD21 LEU 25 HD21 LEU 25 -0.380 -12.844 15.925 194 HD22 LEU 25 HD22 LEU 25 -1.417 -11.682 16.752 195 HD23 LEU 25 HD23 LEU 25 0.163 -12.092 17.424 196 H THR 26 H THR 26 -3.180 -11.662 13.252 197 HA THR 26 HA THR 26 -3.460 -11.153 10.385 198 HB THR 26 HB THR 26 -5.886 -11.199 10.754 199 HG1 THR 26 HG1 THR 26 -6.799 -11.187 12.757 200 HG21 THR 26 HG21 THR 26 -6.203 -13.452 11.684 201 HG22 THR 26 HG22 THR 26 -4.594 -13.401 12.410 202 HG23 THR 26 HG23 THR 26 -4.774 -13.417 10.651 203 H GLN 27 H GLN 27 -4.939 -9.276 9.726 204 HA GLN 27 HA GLN 27 -3.708 -6.859 10.187 205 HB2 GLN 27 HB2 GLN 27 -5.581 -5.794 9.001 206 HB3 GLN 27 HB3 GLN 27 -5.126 -7.307 8.225 207 HG2 GLN 27 HG2 GLN 27 -7.069 -8.419 9.308 208 HG3 GLN 27 HG3 GLN 27 -7.541 -6.879 10.024 209 HE21 GLN 27 HE21 GLN 27 -8.198 -5.173 8.554 210 HE22 GLN 27 HE22 GLN 27 -8.881 -5.582 7.028 211 H LYS 28 H LYS 28 -6.633 -8.085 11.789 212 HA LYS 28 HA LYS 28 -7.441 -5.869 13.281 213 HB2 LYS 28 HB2 LYS 28 -7.661 -8.830 13.963 214 HB3 LYS 28 HB3 LYS 28 -8.554 -7.557 14.792 215 HG2 LYS 28 HG2 LYS 28 -8.801 -8.240 11.839 216 HG3 LYS 28 HG3 LYS 28 -9.928 -8.738 13.106 217 HD2 LYS 28 HD2 LYS 28 -9.331 -5.855 12.299 218 HD3 LYS 28 HD3 LYS 28 -10.760 -6.773 11.821 219 HE2 LYS 28 HE2 LYS 28 -11.477 -6.913 14.175 220 HE3 LYS 28 HE3 LYS 28 -10.022 -6.056 14.688 221 HZ1 LYS 28 HZ1 LYS 28 -12.156 -4.970 12.947 222 HZ2 LYS 28 HZ2 LYS 28 -10.767 -4.137 13.430 223 HZ3 LYS 28 HZ3 LYS 28 -11.921 -4.599 14.575 224 H GLN 29 H GLN 29 -5.217 -8.471 14.245 225 HA GLN 29 HA GLN 29 -4.894 -7.667 16.962 226 HB2 GLN 29 HB2 GLN 29 -3.171 -9.492 15.237 227 HB3 GLN 29 HB3 GLN 29 -3.067 -9.367 16.994 228 HG2 GLN 29 HG2 GLN 29 -5.343 -10.232 17.226 229 HG3 GLN 29 HG3 GLN 29 -5.538 -10.272 15.474 230 HE21 GLN 29 HE21 GLN 29 -4.526 -11.922 14.305 231 HE22 GLN 29 HE22 GLN 29 -3.859 -13.324 15.064 232 H ILE 30 H ILE 30 -3.116 -6.956 14.021 233 HA ILE 30 HA ILE 30 -0.866 -5.645 15.229 234 HB ILE 30 HB ILE 30 -1.958 -5.356 12.397 235 HG12 ILE 30 HG12 ILE 30 0.236 -7.244 13.369 236 HG13 ILE 30 HG13 ILE 30 -1.434 -7.740 13.113 237 HG21 ILE 30 HG21 ILE 30 -0.376 -3.550 12.954 238 HG22 ILE 30 HG22 ILE 30 0.343 -4.658 11.787 239 HG23 ILE 30 HG23 ILE 30 0.821 -4.736 13.483 240 HD11 ILE 30 HD11 ILE 30 0.441 -6.686 11.007 241 HD12 ILE 30 HD12 ILE 30 -1.237 -7.176 10.749 242 HD13 ILE 30 HD13 ILE 30 -0.037 -8.365 11.256 243 H LYS 31 H LYS 31 -3.891 -4.479 13.704 244 HA LYS 31 HA LYS 31 -3.482 -1.703 13.941 245 HB2 LYS 31 HB2 LYS 31 -6.078 -3.298 13.916 246 HB3 LYS 31 HB3 LYS 31 -6.009 -1.539 13.791 247 HG2 LYS 31 HG2 LYS 31 -4.718 -1.750 11.680 248 HG3 LYS 31 HG3 LYS 31 -4.816 -3.506 11.803 249 HD2 LYS 31 HD2 LYS 31 -6.515 -2.729 10.241 250 HD3 LYS 31 HD3 LYS 31 -7.310 -3.349 11.692 251 HE2 LYS 31 HE2 LYS 31 -7.453 -0.940 12.509 252 HE3 LYS 31 HE3 LYS 31 -6.896 -0.437 10.914 253 HZ1 LYS 31 HZ1 LYS 31 -9.389 -1.897 11.568 254 HZ2 LYS 31 HZ2 LYS 31 -8.840 -1.625 9.994 255 HZ3 LYS 31 HZ3 LYS 31 -9.246 -0.317 10.982 256 H LYS 32 H LYS 32 -4.755 -4.036 16.271 257 HA LYS 32 HA LYS 32 -5.521 -2.185 18.307 258 HB2 LYS 32 HB2 LYS 32 -6.248 -4.648 18.036 259 HB3 LYS 32 HB3 LYS 32 -4.705 -5.093 18.745 260 HG2 LYS 32 HG2 LYS 32 -6.690 -3.288 20.165 261 HG3 LYS 32 HG3 LYS 32 -6.773 -5.044 20.283 262 HD2 LYS 32 HD2 LYS 32 -4.577 -5.123 21.358 263 HD3 LYS 32 HD3 LYS 32 -4.344 -3.393 21.106 264 HE2 LYS 32 HE2 LYS 32 -6.232 -2.915 22.623 265 HE3 LYS 32 HE3 LYS 32 -6.472 -4.646 22.873 266 HZ1 LYS 32 HZ1 LYS 32 -4.314 -4.792 23.878 267 HZ2 LYS 32 HZ2 LYS 32 -5.198 -3.576 24.649 268 HZ3 LYS 32 HZ3 LYS 32 -3.991 -3.170 23.543 269 H ALA 33 H ALA 33 -2.560 -4.117 17.759 270 HA ALA 33 HA ALA 33 -1.160 -3.369 20.115 271 HB1 ALA 33 HB1 ALA 33 0.804 -4.384 19.042 272 HB2 ALA 33 HB2 ALA 33 -0.030 -4.387 17.486 273 HB3 ALA 33 HB3 ALA 33 -0.629 -5.391 18.808 274 H THR 34 H THR 34 -1.258 -1.926 16.897 275 HA THR 34 HA THR 34 0.746 0.131 17.475 276 HB THR 34 HB THR 34 0.214 0.944 15.159 277 HG1 THR 34 HG1 THR 34 -1.279 -1.299 14.524 278 HG21 THR 34 HG21 THR 34 0.759 -2.052 15.284 279 HG22 THR 34 HG22 THR 34 1.978 -0.784 15.444 280 HG23 THR 34 HG23 THR 34 1.115 -0.990 13.918 281 H LYS 35 H LYS 35 -2.635 -0.309 17.807 282 HA LYS 35 HA LYS 35 -4.391 0.912 18.484 283 HB2 LYS 35 HB2 LYS 35 -2.313 2.990 19.265 284 HB3 LYS 35 HB3 LYS 35 -4.011 3.054 19.735 285 HG2 LYS 35 HG2 LYS 35 -3.714 0.870 20.933 286 HG3 LYS 35 HG3 LYS 35 -1.992 0.923 20.537 287 HD2 LYS 35 HD2 LYS 35 -3.493 2.976 22.224 288 HD3 LYS 35 HD3 LYS 35 -2.444 1.702 22.849 289 HE2 LYS 35 HE2 LYS 35 -1.564 4.000 21.061 290 HE3 LYS 35 HE3 LYS 35 -1.284 3.877 22.798 291 HZ1 LYS 35 HZ1 LYS 35 -0.186 2.093 20.699 292 HZ2 LYS 35 HZ2 LYS 35 0.008 1.848 22.358 293 HZ3 LYS 35 HZ3 LYS 35 0.672 3.218 21.625 294 H LEU 36 H LEU 36 -3.560 1.070 15.711 295 HA LEU 36 HA LEU 36 -4.718 3.687 14.927 296 HB2 LEU 36 HB2 LEU 36 -3.893 3.343 12.660 297 HB3 LEU 36 HB3 LEU 36 -2.607 3.283 13.840 298 HG LEU 36 HG LEU 36 -2.830 0.660 13.579 299 HD11 LEU 36 HD11 LEU 36 -4.031 1.522 10.935 300 HD12 LEU 36 HD12 LEU 36 -4.841 0.591 12.197 301 HD13 LEU 36 HD13 LEU 36 -3.468 -0.104 11.341 302 HD21 LEU 36 HD21 LEU 36 -0.839 1.942 12.965 303 HD22 LEU 36 HD22 LEU 36 -1.555 2.353 11.406 304 HD23 LEU 36 HD23 LEU 36 -1.153 0.674 11.782 305 H LYS 37 H LYS 37 -6.638 3.851 13.887 306 HA LYS 37 HA LYS 37 -8.376 1.487 13.874 307 HB2 LYS 37 HB2 LYS 37 -10.229 3.207 13.605 308 HB3 LYS 37 HB3 LYS 37 -9.298 3.314 15.086 309 HG2 LYS 37 HG2 LYS 37 -9.640 5.551 14.434 310 HG3 LYS 37 HG3 LYS 37 -7.970 5.207 13.978 311 HD2 LYS 37 HD2 LYS 37 -8.704 4.882 11.618 312 HD3 LYS 37 HD3 LYS 37 -10.367 5.235 12.091 313 HE2 LYS 37 HE2 LYS 37 -9.656 7.517 12.772 314 HE3 LYS 37 HE3 LYS 37 -8.013 7.148 12.243 315 HZ1 LYS 37 HZ1 LYS 37 -10.413 7.118 10.494 316 HZ2 LYS 37 HZ2 LYS 37 -8.813 6.871 10.004 317 HZ3 LYS 37 HZ3 LYS 37 -9.295 8.380 10.588 318 H ALA 38 H ALA 38 -6.494 3.108 11.614 319 HA ALA 38 HA ALA 38 -8.406 2.919 9.374 320 HB1 ALA 38 HB1 ALA 38 -6.876 4.401 8.160 321 HB2 ALA 38 HB2 ALA 38 -5.722 4.340 9.497 322 HB3 ALA 38 HB3 ALA 38 -7.300 5.098 9.727 323 H ASP 39 H ASP 39 -8.365 0.987 8.346 324 HA ASP 39 HA ASP 39 -6.184 -0.742 7.882 325 HB2 ASP 39 HB2 ASP 39 -8.601 -0.220 6.087 326 HB3 ASP 39 HB3 ASP 39 -7.530 -1.621 5.975 327 H LYS 40 H LYS 40 -7.165 2.227 6.353 328 HA LYS 40 HA LYS 40 -5.817 2.438 3.972 329 HB2 LYS 40 HB2 LYS 40 -6.295 4.462 6.194 330 HB3 LYS 40 HB3 LYS 40 -5.653 4.931 4.626 331 HG2 LYS 40 HG2 LYS 40 -8.260 3.416 4.780 332 HG3 LYS 40 HG3 LYS 40 -8.224 5.151 5.106 333 HD2 LYS 40 HD2 LYS 40 -7.040 3.989 2.553 334 HD3 LYS 40 HD3 LYS 40 -8.757 4.374 2.684 335 HE2 LYS 40 HE2 LYS 40 -7.569 6.229 1.629 336 HE3 LYS 40 HE3 LYS 40 -8.188 6.732 3.194 337 HZ1 LYS 40 HZ1 LYS 40 -5.374 5.948 2.665 338 HZ2 LYS 40 HZ2 LYS 40 -5.996 6.551 4.115 339 HZ3 LYS 40 HZ3 LYS 40 -5.950 7.533 2.744 340 H ASP 41 H ASP 41 -4.475 3.408 7.161 341 HA ASP 41 HA ASP 41 -1.846 3.954 6.065 342 HB2 ASP 41 HB2 ASP 41 -2.867 3.984 8.934 343 HB3 ASP 41 HB3 ASP 41 -1.273 4.551 8.422 344 H PHE 42 H PHE 42 -3.436 1.276 7.604 345 HA PHE 42 HA PHE 42 -1.214 -0.315 8.293 346 HB2 PHE 42 HB2 PHE 42 -3.479 -0.893 9.033 347 HB3 PHE 42 HB3 PHE 42 -4.001 -1.130 7.369 348 HD1 PHE 42 HD1 PHE 42 -1.578 -2.454 9.910 349 HD2 PHE 42 HD2 PHE 42 -3.892 -3.314 6.409 350 HE1 PHE 42 HE1 PHE 42 -0.949 -4.824 10.065 351 HE2 PHE 42 HE2 PHE 42 -3.255 -5.688 6.581 352 HZ PHE 42 HZ PHE 42 -1.784 -6.441 8.410 353 H PHE 43 H PHE 43 -2.938 0.097 5.175 354 HA PHE 43 HA PHE 43 -1.557 -1.898 3.690 355 HB2 PHE 43 HB2 PHE 43 -2.849 0.646 2.616 356 HB3 PHE 43 HB3 PHE 43 -2.406 -0.759 1.653 357 HD1 PHE 43 HD2 PHE 43 -3.404 -2.904 3.652 358 HD2 PHE 43 HD1 PHE 43 -5.196 0.681 2.123 359 HE1 PHE 43 HE2 PHE 43 -5.643 -3.845 4.049 360 HE2 PHE 43 HE1 PHE 43 -7.428 -0.275 2.526 361 HZ PHE 43 HZ PHE 43 -7.647 -2.536 3.483 362 H LEU 44 H LEU 44 -0.847 1.553 4.182 363 HA LEU 44 HA LEU 44 1.313 1.827 2.367 364 HB2 LEU 44 HB2 LEU 44 0.412 3.378 4.797 365 HB3 LEU 44 HB3 LEU 44 1.971 3.752 4.088 366 HG LEU 44 HG LEU 44 0.894 4.340 1.946 367 HD11 LEU 44 HD11 LEU 44 -1.537 4.544 1.708 368 HD12 LEU 44 HD12 LEU 44 -1.763 3.805 3.296 369 HD13 LEU 44 HD13 LEU 44 -1.052 2.869 1.980 370 HD21 LEU 44 HD21 LEU 44 1.275 6.102 3.617 371 HD22 LEU 44 HD22 LEU 44 -0.329 5.818 4.301 372 HD23 LEU 44 HD23 LEU 44 -0.166 6.436 2.656 373 H GLY 45 H GLY 45 1.283 1.059 5.863 374 HA2 GLY 45 HA2 GLY 45 4.102 0.752 6.178 375 HA3 GLY 45 HA3 GLY 45 2.863 0.147 7.266 376 H LEU 46 H LEU 46 1.503 -1.675 5.827 377 HA LEU 46 HA LEU 46 2.998 -4.040 5.937 378 HB2 LEU 46 HB2 LEU 46 0.549 -3.978 6.108 379 HB3 LEU 46 HB3 LEU 46 0.414 -3.427 4.447 380 HG LEU 46 HG LEU 46 1.312 -5.631 3.660 381 HD11 LEU 46 HD11 LEU 46 1.488 -7.521 5.216 382 HD12 LEU 46 HD12 LEU 46 1.195 -6.439 6.579 383 HD13 LEU 46 HD13 LEU 46 2.651 -6.252 5.597 384 HD21 LEU 46 HD21 LEU 46 -1.117 -5.266 3.767 385 HD22 LEU 46 HD22 LEU 46 -1.150 -5.865 5.427 386 HD23 LEU 46 HD23 LEU 46 -0.712 -6.950 4.105 387 H GLY 47 H GLY 47 2.288 -1.949 3.220 388 HA2 GLY 47 HA2 GLY 47 3.226 -3.609 1.073 389 HA3 GLY 47 HA3 GLY 47 2.933 -1.876 0.997 390 H TRP 48 H TRP 48 4.700 -1.204 3.153 391 HA TRP 48 HA TRP 48 7.249 -1.053 1.844 392 HB2 TRP 48 HB2 TRP 48 6.176 0.700 3.381 393 HB3 TRP 48 HB3 TRP 48 6.589 -0.341 4.734 394 HD1 TRP 48 HD1 TRP 48 9.399 -0.867 4.921 395 HE1 TRP 48 HE1 TRP 48 11.317 0.778 4.547 396 HE3 TRP 48 HE3 TRP 48 6.888 2.742 2.307 397 HZ2 TRP 48 HZ2 TRP 48 11.734 3.229 3.325 398 HZ3 TRP 48 HZ3 TRP 48 8.135 4.744 1.588 399 HH2 TRP 48 HH2 TRP 48 10.519 4.995 2.098 400 H LEU 49 H LEU 49 5.889 -3.045 4.463 401 HA LEU 49 HA LEU 49 8.275 -4.418 5.205 402 HB2 LEU 49 HB2 LEU 49 5.325 -4.985 5.485 403 HB3 LEU 49 HB3 LEU 49 6.461 -6.263 5.846 404 HG LEU 49 HG LEU 49 7.407 -5.058 7.703 405 HD11 LEU 49 HD11 LEU 49 6.721 -2.819 8.369 406 HD12 LEU 49 HD12 LEU 49 5.742 -2.680 6.903 407 HD13 LEU 49 HD13 LEU 49 7.498 -2.831 6.788 408 HD21 LEU 49 HD21 LEU 49 4.383 -4.756 7.772 409 HD22 LEU 49 HD22 LEU 49 5.456 -4.804 9.177 410 HD23 LEU 49 HD23 LEU 49 5.283 -6.229 8.155 411 H LEU 50 H LEU 50 5.863 -4.985 2.695 412 HA LEU 50 HA LEU 50 6.924 -7.422 1.659 413 HB2 LEU 50 HB2 LEU 50 5.076 -5.359 0.418 414 HB3 LEU 50 HB3 LEU 50 5.467 -6.897 -0.344 415 HG LEU 50 HG LEU 50 4.043 -6.592 2.337 416 HD11 LEU 50 HD11 LEU 50 2.017 -7.353 1.186 417 HD12 LEU 50 HD12 LEU 50 2.871 -7.352 -0.359 418 HD13 LEU 50 HD13 LEU 50 2.608 -5.836 0.508 419 HD21 LEU 50 HD21 LEU 50 5.357 -8.661 2.237 420 HD22 LEU 50 HD22 LEU 50 4.594 -9.102 0.707 421 HD23 LEU 50 HD23 LEU 50 3.634 -9.016 2.185 422 H ARG 51 H ARG 51 7.597 -3.978 0.889 423 HA ARG 51 HA ARG 51 8.911 -4.359 -1.568 424 HB2 ARG 51 HB2 ARG 51 9.686 -2.139 -1.480 425 HB3 ARG 51 HB3 ARG 51 8.197 -2.094 -0.553 426 HG2 ARG 51 HG2 ARG 51 9.353 -1.788 1.499 427 HG3 ARG 51 HG3 ARG 51 10.869 -2.368 0.838 428 HD2 ARG 51 HD2 ARG 51 10.866 -0.277 -0.626 429 HD3 ARG 51 HD3 ARG 51 9.543 0.307 0.398 430 HE ARG 51 HE ARG 51 11.193 -0.193 2.309 431 HH11 ARG 51 HH11 ARG 51 12.195 1.030 -0.770 432 HH12 ARG 51 HH12 ARG 51 13.631 1.725 -0.115 433 HH21 ARG 51 HH21 ARG 51 13.025 0.661 3.084 434 HH22 ARG 51 HH22 ARG 51 14.091 1.531 2.036 435 H GLU 52 H GLU 52 10.181 -4.600 1.713 436 HA GLU 52 HA GLU 52 12.913 -5.180 0.759 437 HB2 GLU 52 HB2 GLU 52 11.816 -4.525 3.520 438 HB3 GLU 52 HB3 GLU 52 13.497 -4.966 3.222 439 HG2 GLU 52 HG2 GLU 52 13.856 -2.984 1.882 440 HG3 GLU 52 HG3 GLU 52 12.139 -2.585 1.919 441 H ASP 53 H ASP 53 10.112 -6.846 1.666 442 HA ASP 53 HA ASP 53 9.591 -9.022 1.892 443 HB2 ASP 53 HB2 ASP 53 12.453 -9.446 0.943 444 HB3 ASP 53 HB3 ASP 53 11.276 -10.747 1.107 445 H LYS 54 H LYS 54 10.429 -7.607 4.221 446 HA LYS 54 HA LYS 54 11.847 -9.508 5.928 447 HB2 LYS 54 HB2 LYS 54 11.465 -7.803 7.716 448 HB3 LYS 54 HB3 LYS 54 12.281 -7.159 6.298 449 HG2 LYS 54 HG2 LYS 54 10.005 -6.269 5.533 450 HG3 LYS 54 HG3 LYS 54 9.395 -6.705 7.133 451 HD2 LYS 54 HD2 LYS 54 10.012 -4.313 7.038 452 HD3 LYS 54 HD3 LYS 54 11.036 -5.179 8.187 453 HE2 LYS 54 HE2 LYS 54 12.845 -5.280 6.503 454 HE3 LYS 54 HE3 LYS 54 11.817 -4.451 5.338 455 HZ1 LYS 54 HZ1 LYS 54 13.388 -2.963 6.360 456 HZ2 LYS 54 HZ2 LYS 54 12.784 -3.326 7.897 457 HZ3 LYS 54 HZ3 LYS 54 11.806 -2.529 6.776 458 H VAL 55 H VAL 55 8.741 -9.214 4.757 459 HA VAL 55 HA VAL 55 7.687 -11.108 6.749 460 HB VAL 55 HB VAL 55 5.448 -10.132 6.711 461 HG11 VAL 55 HG11 VAL 55 6.902 -9.298 8.488 462 HG12 VAL 55 HG12 VAL 55 5.795 -8.029 7.963 463 HG13 VAL 55 HG13 VAL 55 7.481 -7.998 7.442 464 HG21 VAL 55 HG21 VAL 55 5.404 -9.206 4.440 465 HG22 VAL 55 HG22 VAL 55 6.563 -7.956 4.894 466 HG23 VAL 55 HG23 VAL 55 4.945 -7.955 5.599 467 H VAL 56 H VAL 56 5.810 -12.298 5.880 468 HA VAL 56 HA VAL 56 5.350 -12.240 2.995 469 HB VAL 56 HB VAL 56 5.064 -14.778 2.977 470 HG11 VAL 56 HG11 VAL 56 7.893 -13.781 3.508 471 HG12 VAL 56 HG12 VAL 56 7.055 -13.736 1.954 472 HG13 VAL 56 HG13 VAL 56 7.467 -15.288 2.686 473 HG21 VAL 56 HG21 VAL 56 4.895 -15.174 5.405 474 HG22 VAL 56 HG22 VAL 56 6.560 -14.635 5.629 475 HG23 VAL 56 HG23 VAL 56 6.226 -16.115 4.725 476 H THR 57 H THR 57 3.223 -12.600 2.372 477 HA THR 57 HA THR 57 1.235 -12.304 4.557 478 HB THR 57 HB THR 57 -0.218 -11.184 2.797 479 HG1 THR 57 HG1 THR 57 0.852 -10.466 0.890 480 HG21 THR 57 HG21 THR 57 0.981 -9.014 2.818 481 HG22 THR 57 HG22 THR 57 2.451 -9.830 3.353 482 HG23 THR 57 HG23 THR 57 1.030 -9.793 4.401 483 H SER 58 H SER 58 -0.683 -13.393 4.481 484 HA SER 58 HA SER 58 -1.271 -15.351 2.360 485 HB2 SER 58 HB2 SER 58 -1.326 -15.959 5.359 486 HB3 SER 58 HB3 SER 58 -1.902 -17.046 4.092 487 HG SER 58 HG SER 58 0.608 -16.261 3.528 488 H GLU 59 H GLU 59 -3.516 -15.920 2.253 489 HA GLU 59 HA GLU 59 -5.364 -13.883 3.396 490 HB2 GLU 59 HB2 GLU 59 -5.119 -13.834 0.908 491 HB3 GLU 59 HB3 GLU 59 -5.661 -15.509 0.827 492 HG2 GLU 59 HG2 GLU 59 -7.854 -14.840 1.765 493 HG3 GLU 59 HG3 GLU 59 -7.305 -13.163 1.842 494 H VAL 60 H VAL 60 -6.478 -14.717 5.053 495 HA VAL 60 HA VAL 60 -7.252 -17.600 5.069 496 HB VAL 60 HB VAL 60 -6.206 -15.975 7.437 497 HG11 VAL 60 HG11 VAL 60 -7.358 -18.801 7.468 498 HG12 VAL 60 HG12 VAL 60 -8.082 -17.377 8.218 499 HG13 VAL 60 HG13 VAL 60 -6.553 -18.010 8.827 500 HG21 VAL 60 HG21 VAL 60 -5.120 -18.479 6.096 501 HG22 VAL 60 HG22 VAL 60 -4.436 -17.715 7.533 502 HG23 VAL 60 HG23 VAL 60 -4.423 -16.857 5.987 503 H GLU 61 H GLU 61 -9.329 -17.620 4.765 504 HA GLU 61 HA GLU 61 -11.577 -17.322 4.890 505 HB2 GLU 61 HB2 GLU 61 -10.892 -16.797 7.813 506 HB3 GLU 61 HB3 GLU 61 -12.438 -17.386 7.199 507 HG2 GLU 61 HG2 GLU 61 -9.790 -18.857 6.968 508 HG3 GLU 61 HG3 GLU 61 -11.004 -19.186 8.191 509 H GLY 62 H GLY 62 -10.252 -14.880 4.085 510 HA2 GLY 62 HA2 GLY 62 -11.277 -12.844 3.402 511 HA3 GLY 62 HA3 GLY 62 -12.303 -12.886 4.820 512 H GLU 63 H GLU 63 -9.752 -13.465 6.502 513 HA GLU 63 HA GLU 63 -9.042 -10.698 7.017 514 HB2 GLU 63 HB2 GLU 63 -7.956 -13.262 8.279 515 HB3 GLU 63 HB3 GLU 63 -7.557 -11.626 8.804 516 HG2 GLU 63 HG2 GLU 63 -10.053 -11.299 9.230 517 HG3 GLU 63 HG3 GLU 63 -10.224 -13.043 9.000 518 H ILE 64 H ILE 64 -7.271 -9.619 6.325 519 HA ILE 64 HA ILE 64 -5.183 -10.787 4.732 520 HB ILE 64 HB ILE 64 -5.265 -8.065 6.123 521 HG12 ILE 64 HG12 ILE 64 -5.977 -8.764 3.232 522 HG13 ILE 64 HG13 ILE 64 -7.141 -8.390 4.498 523 HG21 ILE 64 HG21 ILE 64 -2.954 -8.694 5.550 524 HG22 ILE 64 HG22 ILE 64 -3.501 -7.378 4.515 525 HG23 ILE 64 HG23 ILE 64 -3.433 -9.024 3.883 526 HD11 ILE 64 HD11 ILE 64 -6.252 -6.110 4.642 527 HD12 ILE 64 HD12 ILE 64 -6.800 -6.501 3.013 528 HD13 ILE 64 HD13 ILE 64 -5.076 -6.487 3.378 529 H PHE 65 H PHE 65 -4.048 -12.339 5.811 530 HA PHE 65 HA PHE 65 -2.926 -11.875 8.487 531 HB2 PHE 65 HB2 PHE 65 -3.899 -14.109 8.016 532 HB3 PHE 65 HB3 PHE 65 -2.789 -14.331 6.667 533 HD1 PHE 65 HD2 PHE 65 -2.894 -13.855 10.378 534 HD2 PHE 65 HD1 PHE 65 -0.618 -15.292 7.050 535 HE1 PHE 65 HE2 PHE 65 -1.232 -14.805 11.918 536 HE2 PHE 65 HE1 PHE 65 1.039 -16.233 8.605 537 HZ PHE 65 HZ PHE 65 0.735 -15.990 11.034 538 H VAL 66 H VAL 66 -0.782 -11.483 8.856 539 HA VAL 66 HA VAL 66 1.200 -11.916 6.721 540 HB VAL 66 HB VAL 66 0.659 -9.552 6.500 541 HG11 VAL 66 HG11 VAL 66 1.300 -9.230 9.449 542 HG12 VAL 66 HG12 VAL 66 -0.305 -9.138 8.724 543 HG13 VAL 66 HG13 VAL 66 0.910 -7.921 8.326 544 HG21 VAL 66 HG21 VAL 66 3.340 -9.883 7.899 545 HG22 VAL 66 HG22 VAL 66 2.888 -8.533 6.856 546 HG23 VAL 66 HG23 VAL 66 3.023 -10.160 6.184 547 H LYS 67 H LYS 67 3.309 -12.382 7.462 548 HA LYS 67 HA LYS 67 3.795 -12.576 10.368 549 HB2 LYS 67 HB2 LYS 67 4.508 -14.941 10.171 550 HB3 LYS 67 HB3 LYS 67 2.813 -14.743 9.745 551 HG2 LYS 67 HG2 LYS 67 3.488 -14.774 7.321 552 HG3 LYS 67 HG3 LYS 67 5.131 -15.154 7.833 553 HD2 LYS 67 HD2 LYS 67 2.665 -16.874 8.344 554 HD3 LYS 67 HD3 LYS 67 3.878 -17.165 7.100 555 HE2 LYS 67 HE2 LYS 67 4.474 -18.666 8.814 556 HE3 LYS 67 HE3 LYS 67 5.570 -17.313 9.072 557 HZ1 LYS 67 HZ1 LYS 67 4.597 -18.126 11.126 558 HZ2 LYS 67 HZ2 LYS 67 3.044 -17.783 10.558 559 HZ3 LYS 67 HZ3 LYS 67 4.139 -16.530 10.838 560 H LEU 68 H LEU 68 6.003 -12.469 10.937 561 HA LEU 68 HA LEU 68 7.862 -11.337 9.106 562 HB2 LEU 68 HB2 LEU 68 8.446 -12.761 11.743 563 HB3 LEU 68 HB3 LEU 68 9.577 -11.741 10.864 564 HG LEU 68 HG LEU 68 7.033 -10.842 12.281 565 HD11 LEU 68 HD11 LEU 68 8.538 -9.557 13.719 566 HD12 LEU 68 HD12 LEU 68 9.943 -10.179 12.849 567 HD13 LEU 68 HD13 LEU 68 8.923 -11.276 13.788 568 HD21 LEU 68 HD21 LEU 68 7.255 -9.544 10.226 569 HD22 LEU 68 HD22 LEU 68 8.934 -9.159 10.609 570 HD23 LEU 68 HD23 LEU 68 7.629 -8.536 11.623 571 H VAL 69 H VAL 69 9.663 -12.265 8.020 572 HA VAL 69 HA VAL 69 9.476 -15.021 7.225 573 HB VAL 69 HB VAL 69 11.766 -13.055 6.738 574 HG11 VAL 69 HG11 VAL 69 12.458 -14.585 4.891 575 HG12 VAL 69 HG12 VAL 69 11.209 -15.732 5.379 576 HG13 VAL 69 HG13 VAL 69 12.554 -15.380 6.465 577 HG21 VAL 69 HG21 VAL 69 9.656 -12.255 5.751 578 HG22 VAL 69 HG22 VAL 69 9.421 -13.802 4.936 579 HG23 VAL 69 HG23 VAL 69 10.770 -12.758 4.477 580 H LEU 70 H LEU 70 9.552 -16.163 9.172 581 HA LEU 70 HA LEU 70 11.909 -16.180 10.870 582 HB2 LEU 70 HB2 LEU 70 9.484 -18.014 10.860 583 HB3 LEU 70 HB3 LEU 70 10.732 -17.985 12.098 584 HG LEU 70 HG LEU 70 8.703 -15.792 11.498 585 HD11 LEU 70 HD11 LEU 70 9.086 -17.523 13.958 586 HD12 LEU 70 HD12 LEU 70 7.788 -17.652 12.769 587 HD13 LEU 70 HD13 LEU 70 7.910 -16.217 13.780 588 HD21 LEU 70 HD21 LEU 70 9.694 -14.519 13.382 589 HD22 LEU 70 HD22 LEU 70 10.812 -14.696 12.033 590 HD23 LEU 70 HD23 LEU 70 11.012 -15.694 13.476 591 H GLU 71 H GLU 71 11.062 -17.652 7.932 592 HA GLU 71 HA GLU 71 12.541 -20.037 7.923 593 HB2 GLU 71 HB2 GLU 71 11.079 -19.429 6.047 594 HB3 GLU 71 HB3 GLU 71 12.051 -18.008 5.693 595 HG2 GLU 71 HG2 GLU 71 12.486 -19.770 4.060 596 HG3 GLU 71 HG3 GLU 71 13.936 -19.449 5.010 597 H HIS 72 H HIS 72 14.665 -20.381 8.179 598 HA HIS 72 HA HIS 72 16.531 -18.159 8.490 599 HB2 HIS 72 HB2 HIS 72 16.995 -21.160 8.840 600 HB3 HIS 72 HB3 HIS 72 18.075 -19.872 9.377 601 HD1 HIS 72 HD1 HIS 72 17.295 -18.453 11.415 602 HD2 HIS 72 HD2 HIS 72 14.802 -21.649 10.521 603 HE1 HIS 72 HE1 HIS 72 15.784 -18.692 13.393 604 HE2 HIS 72 HE2 HIS 72 14.179 -20.509 12.755 605 H HIS 73 H HIS 73 15.819 -20.679 6.201 606 HA HIS 73 HA HIS 73 16.508 -21.254 4.155 607 HB2 HIS 73 HB2 HIS 73 15.636 -18.960 3.734 608 HB3 HIS 73 HB3 HIS 73 17.258 -18.310 3.947 609 HD1 HIS 73 HD1 HIS 73 15.247 -20.473 1.603 610 HD2 HIS 73 HD2 HIS 73 18.861 -18.438 1.664 611 HE1 HIS 73 HE1 HIS 73 16.109 -20.582 -0.739 612 HE2 HIS 73 HE2 HIS 73 18.165 -19.144 -0.720 613 H HIS 74 H HIS 74 18.157 -22.604 5.049 614 HA HIS 74 HA HIS 74 20.952 -21.758 4.914 615 HB2 HIS 74 HB2 HIS 74 19.818 -24.558 5.375 616 HB3 HIS 74 HB3 HIS 74 21.467 -24.022 5.699 617 HD1 HIS 74 HD1 HIS 74 18.224 -24.418 7.276 618 HD2 HIS 74 HD2 HIS 74 21.554 -22.000 7.876 619 HE1 HIS 74 HE1 HIS 74 17.987 -23.513 9.600 620 HE2 HIS 74 HE2 HIS 74 20.048 -22.131 9.974 621 H HIS 75 H HIS 75 22.458 -22.496 3.346 622 HA HIS 75 HA HIS 75 21.402 -23.518 0.818 623 HB2 HIS 75 HB2 HIS 75 24.230 -22.784 1.686 624 HB3 HIS 75 HB3 HIS 75 23.835 -23.411 0.088 625 HD1 HIS 75 HD1 HIS 75 22.501 -21.850 -1.513 626 HD2 HIS 75 HD2 HIS 75 23.551 -20.077 2.099 627 HE1 HIS 75 HE1 HIS 75 22.096 -19.398 -1.828 628 HE2 HIS 75 HE2 HIS 75 22.656 -18.353 0.385 629 H HIS 76 H HIS 76 23.732 -24.635 3.292 630 HA HIS 76 HA HIS 76 22.790 -27.328 3.312 631 HB2 HIS 76 HB2 HIS 76 24.120 -27.320 1.149 632 HB3 HIS 76 HB3 HIS 76 25.561 -26.932 2.080 633 HD1 HIS 76 HD1 HIS 76 23.310 -29.742 1.155 634 HD2 HIS 76 HD2 HIS 76 26.589 -29.103 3.619 635 HE1 HIS 76 HE1 HIS 76 24.166 -32.023 1.734 636 HE2 HIS 76 HE2 HIS 76 26.193 -31.617 3.164 637 H HIS 77 H HIS 77 23.228 -28.126 5.329 638 HA HIS 77 HA HIS 77 24.756 -26.725 7.288 639 HB2 HIS 77 HB2 HIS 77 23.597 -29.547 7.316 640 HB3 HIS 77 HB3 HIS 77 24.345 -28.790 8.717 641 HD1 HIS 77 HD1 HIS 77 22.985 -27.060 9.999 642 HD2 HIS 77 HD2 HIS 77 21.018 -28.514 6.638 643 HE1 HIS 77 HE1 HIS 77 20.607 -26.307 10.235 644 HE2 HIS 77 HE2 HIS 77 19.407 -27.366 8.305 645 H1 MET 1 H MET 1 4.334 -22.186 -6.374 646 HA MET 1 HA MET 1 5.263 -19.940 -6.467 647 HB2 MET 1 HB2 MET 1 3.931 -20.693 -9.099 648 HB3 MET 1 HB3 MET 1 5.212 -19.500 -8.939 649 HG2 MET 1 HG2 MET 1 6.129 -21.568 -9.784 650 HG3 MET 1 HG3 MET 1 6.743 -21.290 -8.155 651 HE1 MET 1 HE1 MET 1 7.520 -23.962 -8.306 652 HE2 MET 1 HE2 MET 1 6.714 -24.137 -9.867 653 HE3 MET 1 HE3 MET 1 6.356 -25.263 -8.558 654 H LYS 2 H LYS 2 2.006 -20.080 -6.073 655 HA LYS 2 HA LYS 2 1.194 -17.505 -7.160 656 HB2 LYS 2 HB2 LYS 2 -0.244 -19.590 -5.470 657 HB3 LYS 2 HB3 LYS 2 -0.963 -18.018 -5.787 658 HG2 LYS 2 HG2 LYS 2 -1.895 -19.608 -7.329 659 HG3 LYS 2 HG3 LYS 2 -0.876 -18.487 -8.230 660 HD2 LYS 2 HD2 LYS 2 0.919 -20.194 -8.330 661 HD3 LYS 2 HD3 LYS 2 -0.079 -21.311 -7.393 662 HE2 LYS 2 HE2 LYS 2 -1.750 -21.346 -9.217 663 HE3 LYS 2 HE3 LYS 2 -0.765 -20.216 -10.150 664 HZ1 LYS 2 HZ1 LYS 2 0.980 -21.858 -10.247 665 HZ2 LYS 2 HZ2 LYS 2 -0.459 -22.513 -10.847 666 HZ3 LYS 2 HZ3 LYS 2 0.082 -22.929 -9.303 667 H MET 3 H MET 3 1.862 -15.673 -6.207 668 HA MET 3 HA MET 3 1.921 -15.459 -3.238 669 HB2 MET 3 HB2 MET 3 3.763 -14.066 -5.235 670 HB3 MET 3 HB3 MET 3 3.764 -13.798 -3.496 671 HG2 MET 3 HG2 MET 3 4.429 -16.157 -3.147 672 HG3 MET 3 HG3 MET 3 4.465 -16.394 -4.894 673 HE1 MET 3 HE1 MET 3 5.656 -13.200 -2.839 674 HE2 MET 3 HE2 MET 3 7.364 -13.578 -2.623 675 HE3 MET 3 HE3 MET 3 6.138 -14.556 -1.816 676 H LEU 4 H LEU 4 0.892 -13.737 -2.309 677 HA LEU 4 HA LEU 4 -0.943 -12.096 -3.722 678 HB2 LEU 4 HB2 LEU 4 0.143 -11.684 -0.910 679 HB3 LEU 4 HB3 LEU 4 -1.309 -10.944 -1.570 680 HG LEU 4 HG LEU 4 -0.902 -13.903 -0.954 681 HD11 LEU 4 HD11 LEU 4 -2.740 -11.860 0.332 682 HD12 LEU 4 HD12 LEU 4 -1.279 -12.551 1.041 683 HD13 LEU 4 HD13 LEU 4 -2.670 -13.583 0.720 684 HD21 LEU 4 HD21 LEU 4 -2.253 -13.705 -2.983 685 HD22 LEU 4 HD22 LEU 4 -3.339 -12.565 -2.183 686 HD23 LEU 4 HD23 LEU 4 -3.251 -14.241 -1.632 687 H LYS 5 H LYS 5 2.414 -11.656 -3.087 688 HA LYS 5 HA LYS 5 2.797 -8.889 -3.357 689 HB2 LYS 5 HB2 LYS 5 4.587 -10.431 -2.702 690 HB3 LYS 5 HB3 LYS 5 4.516 -11.231 -4.268 691 HG2 LYS 5 HG2 LYS 5 5.270 -9.072 -5.331 692 HG3 LYS 5 HG3 LYS 5 5.488 -8.403 -3.710 693 HD2 LYS 5 HD2 LYS 5 6.913 -10.865 -4.802 694 HD3 LYS 5 HD3 LYS 5 7.609 -9.242 -4.731 695 HE2 LYS 5 HE2 LYS 5 6.663 -10.795 -2.296 696 HE3 LYS 5 HE3 LYS 5 8.333 -10.756 -2.863 697 HZ1 LYS 5 HZ1 LYS 5 8.332 -8.348 -2.544 698 HZ2 LYS 5 HZ2 LYS 5 8.012 -9.170 -1.105 699 HZ3 LYS 5 HZ3 LYS 5 6.753 -8.412 -1.943 700 H GLU 6 H GLU 6 2.138 -11.349 -5.796 701 HA GLU 6 HA GLU 6 3.230 -10.081 -8.065 702 HB2 GLU 6 HB2 GLU 6 2.604 -12.554 -7.754 703 HB3 GLU 6 HB3 GLU 6 0.948 -12.094 -8.122 704 HG2 GLU 6 HG2 GLU 6 2.048 -13.003 -10.102 705 HG3 GLU 6 HG3 GLU 6 1.660 -11.297 -10.347 706 H LYS 7 H LYS 7 -0.053 -9.945 -6.680 707 HA LYS 7 HA LYS 7 -1.254 -8.504 -8.839 708 HB2 LYS 7 HB2 LYS 7 -3.137 -8.082 -7.338 709 HB3 LYS 7 HB3 LYS 7 -2.653 -9.767 -7.279 710 HG2 LYS 7 HG2 LYS 7 -1.897 -9.628 -5.082 711 HG3 LYS 7 HG3 LYS 7 -1.556 -7.906 -5.186 712 HD2 LYS 7 HD2 LYS 7 -3.428 -8.238 -3.694 713 HD3 LYS 7 HD3 LYS 7 -3.999 -7.432 -5.150 714 HE2 LYS 7 HE2 LYS 7 -4.278 -10.426 -4.699 715 HE3 LYS 7 HE3 LYS 7 -5.509 -9.266 -4.214 716 HZ1 LYS 7 HZ1 LYS 7 -4.595 -9.872 -6.968 717 HZ2 LYS 7 HZ2 LYS 7 -5.597 -8.565 -6.592 718 HZ3 LYS 7 HZ3 LYS 7 -6.122 -10.143 -6.297 719 H ALA 8 H ALA 8 0.468 -7.463 -5.912 720 HA ALA 8 HA ALA 8 -0.178 -4.698 -5.972 721 HB1 ALA 8 HB1 ALA 8 1.824 -4.390 -4.553 722 HB2 ALA 8 HB2 ALA 8 2.352 -6.034 -4.931 723 HB3 ALA 8 HB3 ALA 8 0.866 -5.773 -4.016 724 H GLY 9 H GLY 9 2.323 -6.608 -7.582 725 HA2 GLY 9 HA2 GLY 9 3.652 -4.454 -8.937 726 HA3 GLY 9 HA3 GLY 9 3.783 -6.164 -9.310 727 H ALA 10 H ALA 10 0.946 -6.597 -9.799 728 HA ALA 10 HA ALA 10 0.769 -5.908 -12.568 729 HB1 ALA 10 HB1 ALA 10 -1.455 -6.988 -12.495 730 HB2 ALA 10 HB2 ALA 10 -1.380 -7.032 -10.730 731 HB3 ALA 10 HB3 ALA 10 -0.233 -7.973 -11.687 732 H LEU 11 H LEU 11 -1.204 -4.898 -9.761 733 HA LEU 11 HA LEU 11 -2.732 -2.856 -10.899 734 HB2 LEU 11 HB2 LEU 11 -1.713 -3.218 -8.055 735 HB3 LEU 11 HB3 LEU 11 -2.848 -1.950 -8.500 736 HG LEU 11 HG LEU 11 -3.414 -4.923 -8.865 737 HD11 LEU 11 HD11 LEU 11 -4.336 -3.112 -6.610 738 HD12 LEU 11 HD12 LEU 11 -3.180 -4.440 -6.480 739 HD13 LEU 11 HD13 LEU 11 -4.860 -4.776 -6.890 740 HD21 LEU 11 HD21 LEU 11 -5.747 -4.206 -9.184 741 HD22 LEU 11 HD22 LEU 11 -4.690 -3.483 -10.391 742 HD23 LEU 11 HD23 LEU 11 -5.265 -2.514 -9.031 743 H ALA 12 H ALA 12 0.541 -2.755 -9.505 744 HA ALA 12 HA ALA 12 1.048 -0.013 -9.568 745 HB1 ALA 12 HB1 ALA 12 2.576 -1.655 -8.536 746 HB2 ALA 12 HB2 ALA 12 3.424 -0.557 -9.629 747 HB3 ALA 12 HB3 ALA 12 3.061 -2.215 -10.140 748 H GLY 13 H GLY 13 1.559 -2.427 -12.147 749 HA2 GLY 13 HA2 GLY 13 2.535 -0.745 -14.177 750 HA3 GLY 13 HA3 GLY 13 1.680 -2.259 -14.434 751 H GLN 14 H GLN 14 -0.830 -1.722 -13.465 752 HA GLN 14 HA GLN 14 -2.101 -0.505 -15.677 753 HB2 GLN 14 HB2 GLN 14 -3.261 -1.120 -12.918 754 HB3 GLN 14 HB3 GLN 14 -4.206 -0.814 -14.378 755 HG2 GLN 14 HG2 GLN 14 -3.331 -2.845 -15.417 756 HG3 GLN 14 HG3 GLN 14 -2.258 -3.118 -14.046 757 HE21 GLN 14 HE21 GLN 14 -5.547 -3.330 -15.182 758 HE22 GLN 14 HE22 GLN 14 -6.146 -4.267 -13.866 759 H ILE 15 H ILE 15 -1.720 0.685 -12.339 760 HA ILE 15 HA ILE 15 -2.945 3.219 -12.617 761 HB ILE 15 HB ILE 15 -0.808 2.250 -10.667 762 HG12 ILE 15 HG12 ILE 15 -3.816 2.574 -10.242 763 HG13 ILE 15 HG13 ILE 15 -3.031 1.046 -10.624 764 HG21 ILE 15 HG21 ILE 15 -2.463 4.795 -10.453 765 HG22 ILE 15 HG22 ILE 15 -0.720 4.707 -10.712 766 HG23 ILE 15 HG23 ILE 15 -1.414 4.152 -9.189 767 HD11 ILE 15 HD11 ILE 15 -3.529 1.214 -8.264 768 HD12 ILE 15 HD12 ILE 15 -2.577 2.692 -8.135 769 HD13 ILE 15 HD13 ILE 15 -1.786 1.160 -8.520 770 H TRP 16 H TRP 16 0.464 2.217 -12.941 771 HA TRP 16 HA TRP 16 1.621 4.770 -13.273 772 HB2 TRP 16 HB2 TRP 16 2.903 2.705 -12.674 773 HB3 TRP 16 HB3 TRP 16 2.667 2.095 -14.309 774 HD1 TRP 16 HD1 TRP 16 4.585 4.783 -12.360 775 HE1 TRP 16 HE1 TRP 16 6.537 5.630 -13.806 776 HE3 TRP 16 HE3 TRP 16 3.450 2.394 -16.738 777 HZ2 TRP 16 HZ2 TRP 16 7.460 5.356 -16.459 778 HZ3 TRP 16 HZ3 TRP 16 4.904 2.753 -18.693 779 HH2 TRP 16 HH2 TRP 16 6.862 4.208 -18.557 780 H GLU 17 H GLU 17 0.343 2.446 -15.639 781 HA GLU 17 HA GLU 17 1.182 3.820 -17.998 782 HB2 GLU 17 HB2 GLU 17 -0.921 1.665 -17.563 783 HB3 GLU 17 HB3 GLU 17 -0.491 2.286 -19.157 784 HG2 GLU 17 HG2 GLU 17 1.813 1.514 -18.881 785 HG3 GLU 17 HG3 GLU 17 1.464 0.968 -17.243 786 H ALA 18 H ALA 18 -1.675 4.125 -15.959 787 HA ALA 18 HA ALA 18 -3.142 5.929 -17.653 788 HB1 ALA 18 HB1 ALA 18 -4.446 6.453 -15.624 789 HB2 ALA 18 HB2 ALA 18 -3.254 5.606 -14.632 790 HB3 ALA 18 HB3 ALA 18 -4.224 4.709 -15.801 791 H LEU 19 H LEU 19 -0.519 6.324 -15.328 792 HA LEU 19 HA LEU 19 -0.549 9.247 -15.376 793 HB2 LEU 19 HB2 LEU 19 1.443 7.296 -14.158 794 HB3 LEU 19 HB3 LEU 19 1.452 9.040 -13.910 795 HG LEU 19 HG LEU 19 -0.711 7.108 -12.968 796 HD11 LEU 19 HD11 LEU 19 1.335 6.909 -11.649 797 HD12 LEU 19 HD12 LEU 19 0.056 7.661 -10.697 798 HD13 LEU 19 HD13 LEU 19 1.357 8.653 -11.366 799 HD21 LEU 19 HD21 LEU 19 -1.727 9.237 -13.571 800 HD22 LEU 19 HD22 LEU 19 -0.535 10.121 -12.614 801 HD23 LEU 19 HD23 LEU 19 -1.702 9.067 -11.818 802 H ASN 20 H ASN 20 0.947 6.678 -17.145 803 HA ASN 20 HA ASN 20 3.291 8.001 -18.075 804 HB2 ASN 20 HB2 ASN 20 3.157 5.552 -18.050 805 HB3 ASN 20 HB3 ASN 20 1.805 5.577 -19.169 806 HD21 ASN 20 HD21 ASN 20 5.234 6.289 -18.862 807 HD22 ASN 20 HD22 ASN 20 5.608 6.086 -20.534 808 H GLY 21 H GLY 21 3.475 9.556 -19.537 809 HA2 GLY 21 HA2 GLY 21 3.096 10.686 -21.574 810 HA3 GLY 21 HA3 GLY 21 1.510 9.943 -21.706 811 H THR 22 H THR 22 0.739 10.605 -18.956 812 HA THR 22 HA THR 22 -0.094 13.385 -19.343 813 HB THR 22 HB THR 22 -1.675 13.030 -17.521 814 HG1 THR 22 HG1 THR 22 -1.382 10.484 -16.848 815 HG21 THR 22 HG21 THR 22 -1.598 10.543 -19.275 816 HG22 THR 22 HG22 THR 22 -2.369 12.076 -19.688 817 HG23 THR 22 HG23 THR 22 -2.993 11.110 -18.351 818 H GLU 23 H GLU 23 -0.242 14.731 -17.243 819 HA GLU 23 HA GLU 23 2.410 14.985 -16.025 820 HB2 GLU 23 HB2 GLU 23 -0.076 16.738 -15.816 821 HB3 GLU 23 HB3 GLU 23 1.516 17.155 -15.182 822 HG2 GLU 23 HG2 GLU 23 2.439 17.318 -17.406 823 HG3 GLU 23 HG3 GLU 23 0.965 16.663 -18.125 824 H GLY 24 H GLY 24 0.003 13.001 -15.265 825 HA2 GLY 24 HA2 GLY 24 -0.292 11.784 -13.286 826 HA3 GLY 24 HA3 GLY 24 0.435 13.089 -12.368 827 H LEU 25 H LEU 25 -2.137 11.539 -12.078 828 HA LEU 25 HA LEU 25 -4.072 13.795 -11.976 829 HB2 LEU 25 HB2 LEU 25 -4.698 10.834 -12.398 830 HB3 LEU 25 HB3 LEU 25 -5.889 12.104 -12.213 831 HG LEU 25 HG LEU 25 -4.871 13.122 -14.391 832 HD11 LEU 25 HD11 LEU 25 -3.766 10.310 -14.687 833 HD12 LEU 25 HD12 LEU 25 -2.823 11.793 -14.530 834 HD13 LEU 25 HD13 LEU 25 -3.825 11.539 -15.954 835 HD21 LEU 25 HD21 LEU 25 -6.420 10.514 -14.561 836 HD22 LEU 25 HD22 LEU 25 -6.323 11.747 -15.822 837 HD23 LEU 25 HD23 LEU 25 -7.113 12.116 -14.289 838 H THR 26 H THR 26 -5.931 13.209 -10.314 839 HA THR 26 HA THR 26 -4.729 12.477 -7.735 840 HB THR 26 HB THR 26 -6.903 13.140 -6.730 841 HG1 THR 26 HG1 THR 26 -8.550 13.968 -8.104 842 HG21 THR 26 HG21 THR 26 -5.239 14.931 -7.089 843 HG22 THR 26 HG22 THR 26 -6.878 15.552 -7.299 844 HG23 THR 26 HG23 THR 26 -5.878 15.215 -8.713 845 H GLN 27 H GLN 27 -6.097 11.044 -6.280 846 HA GLN 27 HA GLN 27 -5.943 8.424 -7.136 847 HB2 GLN 27 HB2 GLN 27 -6.066 9.433 -4.745 848 HB3 GLN 27 HB3 GLN 27 -7.809 9.335 -4.908 849 HG2 GLN 27 HG2 GLN 27 -5.909 6.979 -5.011 850 HG3 GLN 27 HG3 GLN 27 -6.811 7.481 -3.592 851 HE21 GLN 27 HE21 GLN 27 -9.071 7.139 -3.590 852 HE22 GLN 27 HE22 GLN 27 -9.808 5.986 -4.630 853 H LYS 28 H LYS 28 -8.948 10.375 -6.774 854 HA LYS 28 HA LYS 28 -10.809 8.399 -7.553 855 HB2 LYS 28 HB2 LYS 28 -10.989 11.431 -7.574 856 HB3 LYS 28 HB3 LYS 28 -12.366 10.393 -7.943 857 HG2 LYS 28 HG2 LYS 28 -10.828 10.343 -5.320 858 HG3 LYS 28 HG3 LYS 28 -12.333 11.233 -5.590 859 HD2 LYS 28 HD2 LYS 28 -13.537 9.142 -6.033 860 HD3 LYS 28 HD3 LYS 28 -12.041 8.212 -5.908 861 HE2 LYS 28 HE2 LYS 28 -13.242 9.820 -3.623 862 HE3 LYS 28 HE3 LYS 28 -13.496 8.090 -3.868 863 HZ1 LYS 28 HZ1 LYS 28 -10.847 9.370 -3.485 864 HZ2 LYS 28 HZ2 LYS 28 -11.154 7.709 -3.611 865 HZ3 LYS 28 HZ3 LYS 28 -11.719 8.575 -2.280 866 H GLN 29 H GLN 29 -8.949 10.652 -9.507 867 HA GLN 29 HA GLN 29 -10.385 10.244 -11.971 868 HB2 GLN 29 HB2 GLN 29 -7.618 11.409 -11.456 869 HB3 GLN 29 HB3 GLN 29 -8.458 11.459 -13.003 870 HG2 GLN 29 HG2 GLN 29 -9.435 12.765 -10.449 871 HG3 GLN 29 HG3 GLN 29 -8.592 13.594 -11.756 872 HE21 GLN 29 HE21 GLN 29 -11.274 14.057 -10.664 873 HE22 GLN 29 HE22 GLN 29 -12.356 13.915 -12.000 874 H ILE 30 H ILE 30 -7.428 8.886 -10.546 875 HA ILE 30 HA ILE 30 -6.590 7.418 -12.860 876 HB ILE 30 HB ILE 30 -5.784 6.987 -9.949 877 HG12 ILE 30 HG12 ILE 30 -4.308 8.628 -12.060 878 HG13 ILE 30 HG13 ILE 30 -5.406 9.344 -10.888 879 HG21 ILE 30 HG21 ILE 30 -5.184 5.051 -11.355 880 HG22 ILE 30 HG22 ILE 30 -3.732 5.936 -10.889 881 HG23 ILE 30 HG23 ILE 30 -4.385 6.115 -12.518 882 HD11 ILE 30 HD11 ILE 30 -2.877 7.847 -10.238 883 HD12 ILE 30 HD12 ILE 30 -3.974 8.595 -9.073 884 HD13 ILE 30 HD13 ILE 30 -3.096 9.597 -10.229 885 H LYS 31 H LYS 31 -8.231 6.415 -9.804 886 HA LYS 31 HA LYS 31 -8.481 3.667 -10.422 887 HB2 LYS 31 HB2 LYS 31 -10.199 3.543 -8.662 888 HB3 LYS 31 HB3 LYS 31 -8.826 4.503 -8.125 889 HG2 LYS 31 HG2 LYS 31 -10.037 6.556 -8.361 890 HG3 LYS 31 HG3 LYS 31 -11.355 5.767 -9.228 891 HD2 LYS 31 HD2 LYS 31 -10.641 5.261 -6.307 892 HD3 LYS 31 HD3 LYS 31 -11.927 6.336 -6.867 893 HE2 LYS 31 HE2 LYS 31 -12.960 4.311 -8.033 894 HE3 LYS 31 HE3 LYS 31 -11.786 3.314 -7.171 895 HZ1 LYS 31 HZ1 LYS 31 -13.853 5.053 -5.972 896 HZ2 LYS 31 HZ2 LYS 31 -12.692 4.204 -5.096 897 HZ3 LYS 31 HZ3 LYS 31 -13.841 3.369 -6.003 898 H LYS 32 H LYS 32 -10.458 6.434 -11.391 899 HA LYS 32 HA LYS 32 -12.640 4.963 -12.527 900 HB2 LYS 32 HB2 LYS 32 -12.610 7.456 -11.847 901 HB3 LYS 32 HB3 LYS 32 -11.739 7.766 -13.340 902 HG2 LYS 32 HG2 LYS 32 -14.480 6.452 -13.273 903 HG3 LYS 32 HG3 LYS 32 -14.270 8.201 -13.349 904 HD2 LYS 32 HD2 LYS 32 -13.141 8.007 -15.523 905 HD3 LYS 32 HD3 LYS 32 -13.191 6.246 -15.430 906 HE2 LYS 32 HE2 LYS 32 -14.931 7.065 -16.935 907 HE3 LYS 32 HE3 LYS 32 -15.665 6.322 -15.514 908 HZ1 LYS 32 HZ1 LYS 32 -15.284 9.232 -15.922 909 HZ2 LYS 32 HZ2 LYS 32 -16.032 8.504 -14.596 910 HZ3 LYS 32 HZ3 LYS 32 -16.737 8.396 -16.128 911 H ALA 33 H ALA 33 -9.690 6.456 -13.880 912 HA ALA 33 HA ALA 33 -10.053 5.867 -16.604 913 HB1 ALA 33 HB1 ALA 33 -7.645 6.333 -16.846 914 HB2 ALA 33 HB2 ALA 33 -7.426 6.190 -15.098 915 HB3 ALA 33 HB3 ALA 33 -8.405 7.500 -15.761 916 H THR 34 H THR 34 -8.368 4.005 -14.095 917 HA THR 34 HA THR 34 -7.657 1.792 -15.864 918 HB THR 34 HB THR 34 -6.601 0.827 -13.795 919 HG1 THR 34 HG1 THR 34 -6.911 3.157 -12.338 920 HG21 THR 34 HG21 THR 34 -4.835 2.524 -13.509 921 HG22 THR 34 HG22 THR 34 -5.856 3.741 -14.275 922 HG23 THR 34 HG23 THR 34 -5.264 2.369 -15.215 923 H LYS 35 H LYS 35 -10.360 2.677 -14.069 924 HA LYS 35 HA LYS 35 -12.321 1.751 -13.506 925 HB2 LYS 35 HB2 LYS 35 -11.463 -0.504 -15.360 926 HB3 LYS 35 HB3 LYS 35 -13.099 -0.265 -14.753 927 HG2 LYS 35 HG2 LYS 35 -13.149 1.965 -15.907 928 HG3 LYS 35 HG3 LYS 35 -11.562 1.607 -16.585 929 HD2 LYS 35 HD2 LYS 35 -13.093 1.067 -18.316 930 HD3 LYS 35 HD3 LYS 35 -12.640 -0.490 -17.627 931 HE2 LYS 35 HE2 LYS 35 -15.194 1.021 -16.937 932 HE3 LYS 35 HE3 LYS 35 -15.094 -0.268 -18.132 933 HZ1 LYS 35 HZ1 LYS 35 -14.427 -1.784 -16.361 934 HZ2 LYS 35 HZ2 LYS 35 -15.933 -1.088 -16.046 935 HZ3 LYS 35 HZ3 LYS 35 -14.564 -0.542 -15.223 936 H LEU 36 H LEU 36 -10.191 1.353 -11.720 937 HA LEU 36 HA LEU 36 -10.172 -1.206 -10.477 938 HB2 LEU 36 HB2 LEU 36 -9.720 1.529 -9.206 939 HB3 LEU 36 HB3 LEU 36 -9.310 -0.012 -8.462 940 HG LEU 36 HG LEU 36 -8.040 1.158 -10.965 941 HD11 LEU 36 HD11 LEU 36 -6.859 0.801 -8.198 942 HD12 LEU 36 HD12 LEU 36 -7.330 2.328 -8.949 943 HD13 LEU 36 HD13 LEU 36 -6.003 1.389 -9.628 944 HD21 LEU 36 HD21 LEU 36 -6.465 -0.739 -10.898 945 HD22 LEU 36 HD22 LEU 36 -8.121 -1.276 -11.161 946 HD23 LEU 36 HD23 LEU 36 -7.380 -1.458 -9.568 947 H LYS 37 H LYS 37 -11.638 -2.187 -9.143 948 HA LYS 37 HA LYS 37 -14.316 -1.228 -9.108 949 HB2 LYS 37 HB2 LYS 37 -14.840 -3.352 -7.931 950 HB3 LYS 37 HB3 LYS 37 -13.879 -3.585 -9.377 951 HG2 LYS 37 HG2 LYS 37 -12.799 -5.060 -7.981 952 HG3 LYS 37 HG3 LYS 37 -11.842 -3.616 -7.642 953 HD2 LYS 37 HD2 LYS 37 -13.128 -3.220 -5.581 954 HD3 LYS 37 HD3 LYS 37 -14.195 -4.576 -5.955 955 HE2 LYS 37 HE2 LYS 37 -12.582 -5.256 -4.271 956 HE3 LYS 37 HE3 LYS 37 -12.249 -6.120 -5.770 957 HZ1 LYS 37 HZ1 LYS 37 -10.448 -4.629 -6.220 958 HZ2 LYS 37 HZ2 LYS 37 -10.247 -5.284 -4.678 959 HZ3 LYS 37 HZ3 LYS 37 -10.803 -3.698 -4.858 960 H ALA 38 H ALA 38 -11.750 -1.002 -6.794 961 HA ALA 38 HA ALA 38 -13.439 0.681 -5.052 962 HB1 ALA 38 HB1 ALA 38 -11.559 -1.474 -3.990 963 HB2 ALA 38 HB2 ALA 38 -13.323 -1.510 -3.916 964 HB3 ALA 38 HB3 ALA 38 -12.429 -0.290 -3.005 965 H ASP 39 H ASP 39 -12.048 1.968 -3.522 966 HA ASP 39 HA ASP 39 -9.798 3.270 -4.717 967 HB2 ASP 39 HB2 ASP 39 -10.655 3.285 -1.790 968 HB3 ASP 39 HB3 ASP 39 -9.655 4.494 -2.601 969 H LYS 40 H LYS 40 -10.211 0.530 -2.636 970 HA LYS 40 HA LYS 40 -7.719 0.406 -1.340 971 HB2 LYS 40 HB2 LYS 40 -9.618 -1.894 -1.943 972 HB3 LYS 40 HB3 LYS 40 -8.376 -1.864 -0.688 973 HG2 LYS 40 HG2 LYS 40 -9.604 0.073 0.370 974 HG3 LYS 40 HG3 LYS 40 -10.885 -0.148 -0.817 975 HD2 LYS 40 HD2 LYS 40 -11.506 -1.198 1.301 976 HD3 LYS 40 HD3 LYS 40 -11.290 -2.430 0.059 977 HE2 LYS 40 HE2 LYS 40 -9.103 -3.027 0.970 978 HE3 LYS 40 HE3 LYS 40 -9.178 -1.697 2.124 979 HZ1 LYS 40 HZ1 LYS 40 -9.705 -3.772 3.175 980 HZ2 LYS 40 HZ2 LYS 40 -10.960 -4.066 2.082 981 HZ3 LYS 40 HZ3 LYS 40 -11.074 -2.776 3.168 982 H ASP 41 H ASP 41 -8.714 -0.804 -4.503 983 HA ASP 41 HA ASP 41 -6.547 -2.484 -5.173 984 HB2 ASP 41 HB2 ASP 41 -8.077 -0.599 -7.027 985 HB3 ASP 41 HB3 ASP 41 -7.114 -1.986 -7.533 986 H PHE 42 H PHE 42 -6.970 1.016 -5.381 987 HA PHE 42 HA PHE 42 -4.634 1.683 -6.818 988 HB2 PHE 42 HB2 PHE 42 -6.579 3.199 -6.617 989 HB3 PHE 42 HB3 PHE 42 -6.257 3.404 -4.901 990 HD1 PHE 42 HD2 PHE 42 -5.152 4.286 -8.308 991 HD2 PHE 42 HD1 PHE 42 -4.374 4.835 -4.133 992 HE1 PHE 42 HE2 PHE 42 -3.689 6.188 -8.813 993 HE2 PHE 42 HE1 PHE 42 -2.912 6.740 -4.664 994 HZ PHE 42 HZ PHE 42 -2.576 7.415 -7.001 995 H PHE 43 H PHE 43 -5.266 1.464 -3.307 996 HA PHE 43 HA PHE 43 -2.880 2.778 -2.469 997 HB2 PHE 43 HB2 PHE 43 -4.652 0.878 -0.872 998 HB3 PHE 43 HB3 PHE 43 -3.464 1.991 -0.195 999 HD1 PHE 43 HD1 PHE 43 -3.868 4.532 -1.440 1000 HD2 PHE 43 HD2 PHE 43 -6.837 1.628 -0.415 1001 HE1 PHE 43 HE1 PHE 43 -5.577 6.300 -1.329 1002 HE2 PHE 43 HE2 PHE 43 -8.531 3.394 -0.305 1003 HZ PHE 43 HZ PHE 43 -7.905 5.735 -0.768 1004 H LEU 44 H LEU 44 -3.623 -0.628 -3.069 1005 HA LEU 44 HA LEU 44 -1.156 -1.715 -2.083 1006 HB2 LEU 44 HB2 LEU 44 -3.395 -2.780 -3.810 1007 HB3 LEU 44 HB3 LEU 44 -1.904 -3.694 -3.690 1008 HG LEU 44 HG LEU 44 -2.191 -3.912 -1.247 1009 HD11 LEU 44 HD11 LEU 44 -4.840 -2.468 -1.552 1010 HD12 LEU 44 HD12 LEU 44 -3.403 -1.847 -0.736 1011 HD13 LEU 44 HD13 LEU 44 -4.242 -3.253 -0.086 1012 HD21 LEU 44 HD21 LEU 44 -4.075 -5.489 -1.252 1013 HD22 LEU 44 HD22 LEU 44 -3.093 -5.667 -2.705 1014 HD23 LEU 44 HD23 LEU 44 -4.643 -4.825 -2.786 1015 H GLY 45 H GLY 45 -2.292 -0.770 -5.347 1016 HA2 GLY 45 HA2 GLY 45 0.059 -1.452 -6.802 1017 HA3 GLY 45 HA3 GLY 45 -1.176 -0.310 -7.312 1018 H LEU 46 H LEU 46 -0.956 1.565 -5.240 1019 HA LEU 46 HA LEU 46 1.083 3.291 -6.197 1020 HB2 LEU 46 HB2 LEU 46 -1.056 4.129 -5.260 1021 HB3 LEU 46 HB3 LEU 46 -0.616 3.508 -3.677 1022 HG LEU 46 HG LEU 46 1.358 5.115 -3.675 1023 HD11 LEU 46 HD11 LEU 46 1.584 5.468 -6.075 1024 HD12 LEU 46 HD12 LEU 46 1.374 7.000 -5.235 1025 HD13 LEU 46 HD13 LEU 46 0.024 6.295 -6.125 1026 HD21 LEU 46 HD21 LEU 46 0.051 7.103 -3.075 1027 HD22 LEU 46 HD22 LEU 46 -0.685 5.642 -2.420 1028 HD23 LEU 46 HD23 LEU 46 -1.381 6.415 -3.845 1029 H GLY 47 H GLY 47 0.844 1.164 -3.410 1030 HA2 GLY 47 HA2 GLY 47 3.089 1.990 -1.902 1031 HA3 GLY 47 HA3 GLY 47 2.366 0.387 -1.871 1032 H TRP 48 H TRP 48 2.763 -0.211 -4.649 1033 HA TRP 48 HA TRP 48 5.513 -1.055 -4.655 1034 HB2 TRP 48 HB2 TRP 48 3.483 -2.351 -5.624 1035 HB3 TRP 48 HB3 TRP 48 3.624 -1.294 -7.027 1036 HD1 TRP 48 HD1 TRP 48 5.844 -1.631 -8.585 1037 HE1 TRP 48 HE1 TRP 48 7.537 -3.553 -8.758 1038 HE3 TRP 48 HE3 TRP 48 4.614 -4.195 -4.337 1039 HZ2 TRP 48 HZ2 TRP 48 8.250 -5.850 -7.316 1040 HZ3 TRP 48 HZ3 TRP 48 5.847 -6.261 -3.805 1041 HH2 TRP 48 HH2 TRP 48 7.630 -7.074 -5.273 1042 H LEU 49 H LEU 49 3.623 1.426 -6.361 1043 HA LEU 49 HA LEU 49 5.526 2.467 -8.124 1044 HB2 LEU 49 HB2 LEU 49 3.138 3.584 -6.694 1045 HB3 LEU 49 HB3 LEU 49 4.225 4.743 -7.406 1046 HG LEU 49 HG LEU 49 3.846 3.848 -9.642 1047 HD11 LEU 49 HD11 LEU 49 2.242 2.061 -10.061 1048 HD12 LEU 49 HD12 LEU 49 2.080 1.796 -8.318 1049 HD13 LEU 49 HD13 LEU 49 3.627 1.508 -9.123 1050 HD21 LEU 49 HD21 LEU 49 1.214 4.266 -8.179 1051 HD22 LEU 49 HD22 LEU 49 1.467 4.402 -9.922 1052 HD23 LEU 49 HD23 LEU 49 2.251 5.541 -8.830 1053 H LEU 50 H LEU 50 5.082 3.119 -4.682 1054 HA LEU 50 HA LEU 50 7.038 5.148 -4.377 1055 HB2 LEU 50 HB2 LEU 50 5.812 3.261 -2.336 1056 HB3 LEU 50 HB3 LEU 50 6.840 4.626 -1.915 1057 HG LEU 50 HG LEU 50 4.117 4.797 -3.274 1058 HD11 LEU 50 HD11 LEU 50 3.347 5.841 -1.193 1059 HD12 LEU 50 HD12 LEU 50 4.932 5.586 -0.459 1060 HD13 LEU 50 HD13 LEU 50 3.933 4.202 -0.913 1061 HD21 LEU 50 HD21 LEU 50 5.987 7.053 -2.454 1062 HD22 LEU 50 HD22 LEU 50 4.336 7.247 -3.048 1063 HD23 LEU 50 HD23 LEU 50 5.575 6.578 -4.106 1064 H ARG 51 H ARG 51 7.240 1.583 -3.922 1065 HA ARG 51 HA ARG 51 9.963 1.667 -2.969 1066 HB2 ARG 51 HB2 ARG 51 9.912 -0.762 -2.982 1067 HB3 ARG 51 HB3 ARG 51 8.428 -0.144 -2.291 1068 HG2 ARG 51 HG2 ARG 51 7.604 -1.893 -3.564 1069 HG3 ARG 51 HG3 ARG 51 7.452 -0.571 -4.712 1070 HD2 ARG 51 HD2 ARG 51 8.328 -2.521 -5.844 1071 HD3 ARG 51 HD3 ARG 51 9.594 -1.295 -5.773 1072 HE ARG 51 HE ARG 51 9.456 -3.700 -4.051 1073 HH11 ARG 51 HH11 ARG 51 11.384 -1.356 -5.734 1074 HH12 ARG 51 HH12 ARG 51 12.867 -2.047 -5.179 1075 HH21 ARG 51 HH21 ARG 51 11.385 -4.556 -3.385 1076 HH22 ARG 51 HH22 ARG 51 12.867 -3.826 -3.895 1077 H GLU 52 H GLU 52 8.560 1.670 -6.129 1078 HA GLU 52 HA GLU 52 11.089 0.983 -7.453 1079 HB2 GLU 52 HB2 GLU 52 8.360 1.768 -8.554 1080 HB3 GLU 52 HB3 GLU 52 9.760 1.408 -9.561 1081 HG2 GLU 52 HG2 GLU 52 8.475 -0.549 -7.626 1082 HG3 GLU 52 HG3 GLU 52 8.149 -0.479 -9.359 1083 H ASP 53 H ASP 53 9.514 3.779 -6.229 1084 HA ASP 53 HA ASP 53 9.856 6.020 -6.319 1085 HB2 ASP 53 HB2 ASP 53 12.653 5.115 -7.123 1086 HB3 ASP 53 HB3 ASP 53 12.251 6.762 -6.639 1087 H LYS 54 H LYS 54 8.793 4.742 -8.632 1088 HA LYS 54 HA LYS 54 9.826 6.066 -11.018 1089 HB2 LYS 54 HB2 LYS 54 8.300 4.634 -12.223 1090 HB3 LYS 54 HB3 LYS 54 9.037 3.669 -10.952 1091 HG2 LYS 54 HG2 LYS 54 6.782 4.424 -9.645 1092 HG3 LYS 54 HG3 LYS 54 6.187 4.525 -11.296 1093 HD2 LYS 54 HD2 LYS 54 7.076 2.103 -9.731 1094 HD3 LYS 54 HD3 LYS 54 5.598 2.343 -10.654 1095 HE2 LYS 54 HE2 LYS 54 8.366 1.918 -11.845 1096 HE3 LYS 54 HE3 LYS 54 7.121 0.684 -11.689 1097 HZ1 LYS 54 HZ1 LYS 54 5.714 1.942 -13.176 1098 HZ2 LYS 54 HZ2 LYS 54 7.198 1.603 -13.905 1099 HZ3 LYS 54 HZ3 LYS 54 6.892 3.153 -13.321 1100 H VAL 55 H VAL 55 7.775 6.890 -8.520 1101 HA VAL 55 HA VAL 55 6.446 9.064 -10.015 1102 HB VAL 55 HB VAL 55 4.329 8.729 -8.781 1103 HG11 VAL 55 HG11 VAL 55 3.465 6.704 -9.910 1104 HG12 VAL 55 HG12 VAL 55 5.114 6.204 -10.285 1105 HG13 VAL 55 HG13 VAL 55 4.458 7.679 -10.997 1106 HG21 VAL 55 HG21 VAL 55 3.927 6.686 -7.416 1107 HG22 VAL 55 HG22 VAL 55 5.212 7.687 -6.738 1108 HG23 VAL 55 HG23 VAL 55 5.617 6.219 -7.631 1109 H VAL 56 H VAL 56 5.353 10.594 -8.342 1110 HA VAL 56 HA VAL 56 6.470 10.572 -5.652 1111 HB VAL 56 HB VAL 56 7.962 12.102 -6.828 1112 HG11 VAL 56 HG11 VAL 56 5.500 13.649 -7.713 1113 HG12 VAL 56 HG12 VAL 56 6.555 12.687 -8.749 1114 HG13 VAL 56 HG13 VAL 56 7.174 14.148 -7.975 1115 HG21 VAL 56 HG21 VAL 56 7.373 12.715 -4.507 1116 HG22 VAL 56 HG22 VAL 56 6.027 13.694 -5.095 1117 HG23 VAL 56 HG23 VAL 56 7.686 14.155 -5.481 1118 H THR 57 H THR 57 5.114 11.419 -4.057 1119 HA THR 57 HA THR 57 2.270 11.700 -4.850 1120 HB THR 57 HB THR 57 1.740 10.775 -2.555 1121 HG1 THR 57 HG1 THR 57 3.728 11.228 -1.525 1122 HG21 THR 57 HG21 THR 57 2.300 8.414 -3.071 1123 HG22 THR 57 HG22 THR 57 3.414 8.955 -4.328 1124 HG23 THR 57 HG23 THR 57 1.683 9.261 -4.493 1125 H SER 58 H SER 58 1.138 13.378 -4.167 1126 HA SER 58 HA SER 58 2.028 15.202 -2.029 1127 HB2 SER 58 HB2 SER 58 2.706 16.194 -4.218 1128 HB3 SER 58 HB3 SER 58 1.046 16.069 -4.796 1129 HG SER 58 HG SER 58 1.542 18.160 -4.013 1130 H GLU 59 H GLU 59 0.117 16.771 -1.487 1131 HA GLU 59 HA GLU 59 -2.432 15.225 -1.479 1132 HB2 GLU 59 HB2 GLU 59 -1.309 15.528 0.758 1133 HB3 GLU 59 HB3 GLU 59 -1.510 17.270 0.589 1134 HG2 GLU 59 HG2 GLU 59 -3.992 16.920 0.465 1135 HG3 GLU 59 HG3 GLU 59 -3.730 15.200 0.756 1136 H VAL 60 H VAL 60 -3.726 16.074 -3.017 1137 HA VAL 60 HA VAL 60 -4.065 19.023 -3.251 1138 HB VAL 60 HB VAL 60 -4.340 16.828 -5.354 1139 HG11 VAL 60 HG11 VAL 60 -5.276 19.713 -5.660 1140 HG12 VAL 60 HG12 VAL 60 -6.302 18.278 -5.672 1141 HG13 VAL 60 HG13 VAL 60 -5.143 18.539 -6.974 1142 HG21 VAL 60 HG21 VAL 60 -2.070 17.741 -5.024 1143 HG22 VAL 60 HG22 VAL 60 -2.680 19.376 -5.307 1144 HG23 VAL 60 HG23 VAL 60 -2.704 18.189 -6.612 1145 H GLU 61 H GLU 61 -5.845 19.710 -2.293 1146 HA GLU 61 HA GLU 61 -7.986 20.063 -1.662 1147 HB2 GLU 61 HB2 GLU 61 -8.648 18.301 -4.061 1148 HB3 GLU 61 HB3 GLU 61 -9.753 19.430 -3.280 1149 HG2 GLU 61 HG2 GLU 61 -7.193 20.171 -4.733 1150 HG3 GLU 61 HG3 GLU 61 -8.813 20.332 -5.390 1151 H GLY 62 H GLY 62 -6.721 18.015 -0.220 1152 HA2 GLY 62 HA2 GLY 62 -7.275 16.559 1.484 1153 HA3 GLY 62 HA3 GLY 62 -8.953 16.660 0.990 1154 H GLU 63 H GLU 63 -6.854 15.790 -1.572 1155 HA GLU 63 HA GLU 63 -7.398 12.892 -1.242 1156 HB2 GLU 63 HB2 GLU 63 -8.978 13.980 -2.861 1157 HB3 GLU 63 HB3 GLU 63 -7.610 14.503 -3.831 1158 HG2 GLU 63 HG2 GLU 63 -8.666 12.553 -4.833 1159 HG3 GLU 63 HG3 GLU 63 -7.034 12.153 -4.306 1160 H ILE 64 H ILE 64 -5.916 11.464 -2.342 1161 HA ILE 64 HA ILE 64 -3.152 12.288 -2.292 1162 HB ILE 64 HB ILE 64 -4.393 9.649 -3.200 1163 HG12 ILE 64 HG12 ILE 64 -3.115 10.367 -0.519 1164 HG13 ILE 64 HG13 ILE 64 -4.839 10.156 -0.799 1165 HG21 ILE 64 HG21 ILE 64 -1.472 10.276 -2.590 1166 HG22 ILE 64 HG22 ILE 64 -2.149 9.939 -4.185 1167 HG23 ILE 64 HG23 ILE 64 -2.119 8.674 -2.956 1168 HD11 ILE 64 HD11 ILE 64 -3.885 8.214 0.287 1169 HD12 ILE 64 HD12 ILE 64 -2.728 8.004 -1.026 1170 HD13 ILE 64 HD13 ILE 64 -4.455 7.787 -1.326 1171 H PHE 65 H PHE 65 -2.435 13.527 -3.933 1172 HA PHE 65 HA PHE 65 -3.036 12.920 -6.754 1173 HB2 PHE 65 HB2 PHE 65 -3.009 15.306 -6.026 1174 HB3 PHE 65 HB3 PHE 65 -1.344 15.134 -5.486 1175 HD1 PHE 65 HD2 PHE 65 -3.549 15.226 -8.476 1176 HD2 PHE 65 HD1 PHE 65 0.496 15.277 -7.082 1177 HE1 PHE 65 HE2 PHE 65 -2.777 15.861 -10.719 1178 HE2 PHE 65 HE1 PHE 65 1.254 15.911 -9.333 1179 HZ PHE 65 HZ PHE 65 -0.377 16.200 -11.152 1180 H VAL 66 H VAL 66 -1.564 11.813 -8.024 1181 HA VAL 66 HA VAL 66 1.246 11.649 -7.160 1182 HB VAL 66 HB VAL 66 0.215 9.583 -6.300 1183 HG11 VAL 66 HG11 VAL 66 -0.547 8.949 -9.170 1184 HG12 VAL 66 HG12 VAL 66 -1.662 9.351 -7.864 1185 HG13 VAL 66 HG13 VAL 66 -0.723 7.858 -7.791 1186 HG21 VAL 66 HG21 VAL 66 2.563 9.500 -7.038 1187 HG22 VAL 66 HG22 VAL 66 2.052 9.038 -8.663 1188 HG23 VAL 66 HG23 VAL 66 1.769 7.946 -7.306 1189 H LYS 67 H LYS 67 2.756 11.480 -8.801 1190 HA LYS 67 HA LYS 67 1.892 11.414 -11.624 1191 HB2 LYS 67 HB2 LYS 67 3.062 13.540 -12.137 1192 HB3 LYS 67 HB3 LYS 67 1.738 13.797 -11.005 1193 HG2 LYS 67 HG2 LYS 67 3.320 13.906 -9.132 1194 HG3 LYS 67 HG3 LYS 67 4.665 13.590 -10.234 1195 HD2 LYS 67 HD2 LYS 67 4.154 15.715 -11.429 1196 HD3 LYS 67 HD3 LYS 67 2.850 16.034 -10.278 1197 HE2 LYS 67 HE2 LYS 67 4.501 16.096 -8.435 1198 HE3 LYS 67 HE3 LYS 67 5.801 15.773 -9.588 1199 HZ1 LYS 67 HZ1 LYS 67 4.065 18.160 -9.464 1200 HZ2 LYS 67 HZ2 LYS 67 5.135 17.840 -10.732 1201 HZ3 LYS 67 HZ3 LYS 67 5.726 18.080 -9.169 1202 H LEU 68 H LEU 68 3.782 11.253 -13.116 1203 HA LEU 68 HA LEU 68 5.860 9.555 -12.100 1204 HB2 LEU 68 HB2 LEU 68 5.797 10.976 -14.798 1205 HB3 LEU 68 HB3 LEU 68 6.807 9.604 -14.358 1206 HG LEU 68 HG LEU 68 3.821 9.646 -14.905 1207 HD11 LEU 68 HD11 LEU 68 4.347 7.885 -16.516 1208 HD12 LEU 68 HD12 LEU 68 6.053 7.951 -16.067 1209 HD13 LEU 68 HD13 LEU 68 5.284 9.341 -16.838 1210 HD21 LEU 68 HD21 LEU 68 5.327 7.391 -13.540 1211 HD22 LEU 68 HD22 LEU 68 3.689 7.282 -14.192 1212 HD23 LEU 68 HD23 LEU 68 4.028 8.371 -12.851 1213 H VAL 69 H VAL 69 8.149 9.982 -12.052 1214 HA VAL 69 HA VAL 69 8.921 12.540 -11.023 1215 HB VAL 69 HB VAL 69 10.733 10.260 -11.961 1216 HG11 VAL 69 HG11 VAL 69 12.439 11.245 -10.442 1217 HG12 VAL 69 HG12 VAL 69 11.346 12.585 -10.086 1218 HG13 VAL 69 HG13 VAL 69 11.980 12.375 -11.720 1219 HG21 VAL 69 HG21 VAL 69 10.781 9.527 -9.594 1220 HG22 VAL 69 HG22 VAL 69 9.140 9.474 -10.240 1221 HG23 VAL 69 HG23 VAL 69 9.623 10.793 -9.173 1222 H LEU 70 H LEU 70 9.270 14.340 -12.219 1223 HA LEU 70 HA LEU 70 9.245 14.351 -15.075 1224 HB2 LEU 70 HB2 LEU 70 9.735 16.612 -13.103 1225 HB3 LEU 70 HB3 LEU 70 9.613 16.847 -14.834 1226 HG LEU 70 HG LEU 70 7.234 15.919 -14.694 1227 HD11 LEU 70 HD11 LEU 70 6.066 15.960 -12.546 1228 HD12 LEU 70 HD12 LEU 70 7.576 16.327 -11.708 1229 HD13 LEU 70 HD13 LEU 70 7.373 14.776 -12.524 1230 HD21 LEU 70 HD21 LEU 70 6.259 18.044 -13.942 1231 HD22 LEU 70 HD22 LEU 70 7.683 18.321 -14.942 1232 HD23 LEU 70 HD23 LEU 70 7.793 18.496 -13.189 1233 H GLU 71 H GLU 71 11.835 14.194 -12.802 1234 HA GLU 71 HA GLU 71 14.011 15.204 -14.272 1235 HB2 GLU 71 HB2 GLU 71 14.134 14.583 -11.871 1236 HB3 GLU 71 HB3 GLU 71 13.927 12.885 -12.287 1237 HG2 GLU 71 HG2 GLU 71 16.092 12.902 -13.464 1238 HG3 GLU 71 HG3 GLU 71 16.297 14.612 -13.081 1239 H HIS 72 H HIS 72 14.798 14.549 -16.185 1240 HA HIS 72 HA HIS 72 13.683 12.306 -17.586 1241 HB2 HIS 72 HB2 HIS 72 15.850 14.293 -18.387 1242 HB3 HIS 72 HB3 HIS 72 15.144 13.100 -19.479 1243 HD1 HIS 72 HD1 HIS 72 12.626 13.440 -20.127 1244 HD2 HIS 72 HD2 HIS 72 14.274 16.560 -17.938 1245 HE1 HIS 72 HE1 HIS 72 10.990 15.331 -20.321 1246 HE2 HIS 72 HE2 HIS 72 11.958 17.164 -18.903 1247 H HIS 73 H HIS 73 14.319 10.281 -17.292 1248 HA HIS 73 HA HIS 73 17.089 9.616 -16.478 1249 HB2 HIS 73 HB2 HIS 73 14.566 7.910 -16.277 1250 HB3 HIS 73 HB3 HIS 73 16.147 7.512 -15.608 1251 HD1 HIS 73 HD1 HIS 73 13.135 8.282 -14.288 1252 HD2 HIS 73 HD2 HIS 73 16.810 10.177 -13.898 1253 HE1 HIS 73 HE1 HIS 73 12.993 9.569 -12.147 1254 HE2 HIS 73 HE2 HIS 73 15.241 10.665 -11.905 1255 H HIS 74 H HIS 74 18.127 7.771 -17.409 1256 HA HIS 74 HA HIS 74 17.475 7.236 -20.245 1257 HB2 HIS 74 HB2 HIS 74 20.023 6.612 -18.668 1258 HB3 HIS 74 HB3 HIS 74 19.803 6.395 -20.402 1259 HD1 HIS 74 HD1 HIS 74 20.110 8.436 -21.886 1260 HD2 HIS 74 HD2 HIS 74 20.266 9.343 -17.834 1261 HE1 HIS 74 HE1 HIS 74 20.901 10.807 -21.757 1262 HE2 HIS 74 HE2 HIS 74 21.019 11.335 -19.304 1263 H HIS 75 H HIS 75 16.530 5.320 -20.775 1264 HA HIS 75 HA HIS 75 16.452 3.108 -18.781 1265 HB2 HIS 75 HB2 HIS 75 14.373 3.827 -20.907 1266 HB3 HIS 75 HB3 HIS 75 14.241 2.510 -19.743 1267 HD1 HIS 75 HD1 HIS 75 13.167 5.879 -20.224 1268 HD2 HIS 75 HD2 HIS 75 14.322 3.625 -16.930 1269 HE1 HIS 75 HE1 HIS 75 12.271 7.101 -18.224 1270 HE2 HIS 75 HE2 HIS 75 12.818 5.615 -16.276 1271 H HIS 76 H HIS 76 16.121 0.908 -19.708 1272 HA HIS 76 HA HIS 76 17.981 0.125 -21.688 1273 HB2 HIS 76 HB2 HIS 76 17.121 -1.360 -19.858 1274 HB3 HIS 76 HB3 HIS 76 15.546 -1.396 -20.637 1275 HD1 HIS 76 HD1 HIS 76 19.041 -2.735 -20.959 1276 HD2 HIS 76 HD2 HIS 76 15.338 -3.210 -22.782 1277 HE1 HIS 76 HE1 HIS 76 19.263 -4.768 -22.400 1278 HE2 HIS 76 HE2 HIS 76 17.008 -5.062 -23.462 1279 H HIS 77 H HIS 77 17.769 0.973 -23.703 1280 HA HIS 77 HA HIS 77 15.256 1.843 -24.792 1281 HB2 HIS 77 HB2 HIS 77 17.622 2.933 -24.982 1282 HB3 HIS 77 HB3 HIS 77 17.908 1.793 -26.285 1283 HD1 HIS 77 HD1 HIS 77 15.643 1.968 -28.111 1284 HD2 HIS 77 HD2 HIS 77 16.897 5.316 -25.998 1285 HE1 HIS 77 HE1 HIS 77 14.775 3.934 -29.393 1286 HE2 HIS 77 HE2 HIS 77 15.737 5.927 -28.221 Start of MODEL 20 1 H1 MET 1 H1 MET 1 7.515 13.932 9.333 2 H2 MET 1 H2 MET 1 6.631 15.230 8.702 3 H3 MET 1 H3 MET 1 8.308 15.349 8.866 4 HA MET 1 HA MET 1 8.680 13.688 7.223 5 HB2 MET 1 HB2 MET 1 6.851 12.629 5.993 6 HB3 MET 1 HB3 MET 1 6.660 12.314 7.710 7 HG2 MET 1 HG2 MET 1 4.866 13.924 7.863 8 HG3 MET 1 HG3 MET 1 5.141 14.451 6.199 9 HE1 MET 1 HE1 MET 1 2.230 13.588 7.225 10 HE2 MET 1 HE2 MET 1 1.694 12.567 5.891 11 HE3 MET 1 HE3 MET 1 2.556 14.069 5.557 12 H LYS 2 H LYS 2 8.986 14.339 5.030 13 HA LYS 2 HA LYS 2 7.943 17.006 4.302 14 HB2 LYS 2 HB2 LYS 2 10.176 15.323 3.096 15 HB3 LYS 2 HB3 LYS 2 9.598 16.806 2.353 16 HG2 LYS 2 HG2 LYS 2 11.526 17.463 3.528 17 HG3 LYS 2 HG3 LYS 2 10.195 17.981 4.565 18 HD2 LYS 2 HD2 LYS 2 10.536 15.953 5.973 19 HD3 LYS 2 HD3 LYS 2 11.880 15.467 4.936 20 HE2 LYS 2 HE2 LYS 2 12.779 16.514 6.924 21 HE3 LYS 2 HE3 LYS 2 13.051 17.604 5.561 22 HZ1 LYS 2 HZ1 LYS 2 11.117 18.887 6.271 23 HZ2 LYS 2 HZ2 LYS 2 12.273 18.803 7.497 24 HZ3 LYS 2 HZ3 LYS 2 10.881 17.843 7.579 25 H MET 3 H MET 3 7.937 13.649 3.090 26 HA MET 3 HA MET 3 5.864 14.347 1.067 27 HB2 MET 3 HB2 MET 3 7.848 12.019 1.030 28 HB3 MET 3 HB3 MET 3 6.652 12.370 -0.216 29 HG2 MET 3 HG2 MET 3 8.921 14.237 0.529 30 HG3 MET 3 HG3 MET 3 8.980 13.084 -0.802 31 HE1 MET 3 HE1 MET 3 6.615 14.565 -3.451 32 HE2 MET 3 HE2 MET 3 6.389 13.173 -2.395 33 HE3 MET 3 HE3 MET 3 7.964 13.473 -3.134 34 H LEU 4 H LEU 4 4.115 12.860 0.755 35 HA LEU 4 HA LEU 4 2.920 11.806 3.087 36 HB2 LEU 4 HB2 LEU 4 2.181 11.194 0.202 37 HB3 LEU 4 HB3 LEU 4 1.146 10.946 1.602 38 HG LEU 4 HG LEU 4 2.095 13.658 0.573 39 HD11 LEU 4 HD11 LEU 4 0.482 12.630 -0.948 40 HD12 LEU 4 HD12 LEU 4 -0.237 14.008 -0.118 41 HD13 LEU 4 HD13 LEU 4 -0.646 12.365 0.385 42 HD21 LEU 4 HD21 LEU 4 0.522 14.630 2.208 43 HD22 LEU 4 HD22 LEU 4 1.784 13.695 3.007 44 HD23 LEU 4 HD23 LEU 4 0.165 13.016 2.833 45 H LYS 5 H LYS 5 5.037 10.223 0.791 46 HA LYS 5 HA LYS 5 4.480 7.509 1.399 47 HB2 LYS 5 HB2 LYS 5 6.784 7.028 0.563 48 HB3 LYS 5 HB3 LYS 5 5.837 8.024 -0.537 49 HG2 LYS 5 HG2 LYS 5 7.066 10.027 0.166 50 HG3 LYS 5 HG3 LYS 5 7.960 9.092 1.367 51 HD2 LYS 5 HD2 LYS 5 8.094 8.638 -1.644 52 HD3 LYS 5 HD3 LYS 5 9.274 9.560 -0.713 53 HE2 LYS 5 HE2 LYS 5 8.653 6.619 -0.275 54 HE3 LYS 5 HE3 LYS 5 10.019 7.231 -1.212 55 HZ1 LYS 5 HZ1 LYS 5 10.827 8.337 0.802 56 HZ2 LYS 5 HZ2 LYS 5 10.713 6.666 1.010 57 HZ3 LYS 5 HZ3 LYS 5 9.546 7.686 1.690 58 H GLU 6 H GLU 6 6.350 9.926 3.145 59 HA GLU 6 HA GLU 6 8.129 8.246 4.537 60 HB2 GLU 6 HB2 GLU 6 7.092 10.965 5.425 61 HB3 GLU 6 HB3 GLU 6 8.560 10.183 6.005 62 HG2 GLU 6 HG2 GLU 6 8.073 11.138 3.164 63 HG3 GLU 6 HG3 GLU 6 8.985 12.015 4.388 64 H LYS 7 H LYS 7 4.878 9.444 5.452 65 HA LYS 7 HA LYS 7 4.886 8.447 8.121 66 HB2 LYS 7 HB2 LYS 7 2.427 8.839 8.106 67 HB3 LYS 7 HB3 LYS 7 3.344 10.213 7.521 68 HG2 LYS 7 HG2 LYS 7 1.535 10.186 6.053 69 HG3 LYS 7 HG3 LYS 7 2.763 9.325 5.137 70 HD2 LYS 7 HD2 LYS 7 0.717 8.133 4.815 71 HD3 LYS 7 HD3 LYS 7 1.682 7.151 5.907 72 HE2 LYS 7 HE2 LYS 7 -0.572 8.994 6.784 73 HE3 LYS 7 HE3 LYS 7 -0.744 7.264 6.508 74 HZ1 LYS 7 HZ1 LYS 7 0.963 6.932 8.249 75 HZ2 LYS 7 HZ2 LYS 7 -0.472 7.622 8.809 76 HZ3 LYS 7 HZ3 LYS 7 0.896 8.586 8.590 77 H ALA 8 H ALA 8 4.027 6.938 5.051 78 HA ALA 8 HA ALA 8 2.858 4.537 6.063 79 HB1 ALA 8 HB1 ALA 8 3.258 3.627 3.805 80 HB2 ALA 8 HB2 ALA 8 4.321 4.991 3.436 81 HB3 ALA 8 HB3 ALA 8 2.601 5.264 3.720 82 H GLY 9 H GLY 9 6.189 5.506 5.382 83 HA2 GLY 9 HA2 GLY 9 7.489 3.013 5.932 84 HA3 GLY 9 HA3 GLY 9 8.242 4.597 5.875 85 H ALA 10 H ALA 10 6.615 5.805 7.922 86 HA ALA 10 HA ALA 10 7.925 5.067 10.323 87 HB1 ALA 10 HB1 ALA 10 7.039 7.332 9.923 88 HB2 ALA 10 HB2 ALA 10 6.384 6.654 11.416 89 HB3 ALA 10 HB3 ALA 10 5.390 6.704 9.956 90 H LEU 11 H LEU 11 4.557 4.513 9.221 91 HA LEU 11 HA LEU 11 3.705 2.927 11.431 92 HB2 LEU 11 HB2 LEU 11 2.566 2.969 8.612 93 HB3 LEU 11 HB3 LEU 11 1.749 2.365 10.049 94 HG LEU 11 HG LEU 11 2.466 5.259 9.447 95 HD11 LEU 11 HD11 LEU 11 0.061 5.644 9.407 96 HD12 LEU 11 HD12 LEU 11 -0.235 3.923 9.677 97 HD13 LEU 11 HD13 LEU 11 0.553 4.465 8.189 98 HD21 LEU 11 HD21 LEU 11 1.320 5.849 11.560 99 HD22 LEU 11 HD22 LEU 11 2.786 4.911 11.824 100 HD23 LEU 11 HD23 LEU 11 1.208 4.134 11.965 101 H ALA 12 H ALA 12 5.357 2.154 8.440 102 HA ALA 12 HA ALA 12 5.145 -0.643 8.386 103 HB1 ALA 12 HB1 ALA 12 7.207 -0.619 7.062 104 HB2 ALA 12 HB2 ALA 12 7.532 1.047 7.564 105 HB3 ALA 12 HB3 ALA 12 6.129 0.685 6.559 106 H GLY 13 H GLY 13 7.534 1.436 10.036 107 HA2 GLY 13 HA2 GLY 13 9.087 -0.537 11.311 108 HA3 GLY 13 HA3 GLY 13 8.896 1.121 11.851 109 H GLN 14 H GLN 14 6.014 0.935 12.271 110 HA GLN 14 HA GLN 14 5.917 -0.044 14.952 111 HB2 GLN 14 HB2 GLN 14 3.595 0.723 13.135 112 HB3 GLN 14 HB3 GLN 14 3.533 0.600 14.891 113 HG2 GLN 14 HG2 GLN 14 5.256 2.597 13.388 114 HG3 GLN 14 HG3 GLN 14 3.628 2.940 13.960 115 HE21 GLN 14 HE21 GLN 14 4.372 4.638 15.271 116 HE22 GLN 14 HE22 GLN 14 5.265 4.368 16.724 117 H ILE 15 H ILE 15 4.467 -1.230 11.904 118 HA ILE 15 HA ILE 15 3.073 -3.448 13.053 119 HB ILE 15 HB ILE 15 3.812 -2.962 10.128 120 HG12 ILE 15 HG12 ILE 15 1.230 -2.274 11.617 121 HG13 ILE 15 HG13 ILE 15 2.463 -1.109 11.158 122 HG21 ILE 15 HG21 ILE 15 1.932 -4.501 9.587 123 HG22 ILE 15 HG22 ILE 15 1.705 -4.823 11.307 124 HG23 ILE 15 HG23 ILE 15 3.197 -5.320 10.509 125 HD11 ILE 15 HD11 ILE 15 0.758 -2.732 9.269 126 HD12 ILE 15 HD12 ILE 15 2.012 -1.582 8.792 127 HD13 ILE 15 HD13 ILE 15 0.580 -1.019 9.652 128 H TRP 16 H TRP 16 6.150 -3.202 11.242 129 HA TRP 16 HA TRP 16 6.831 -5.923 11.017 130 HB2 TRP 16 HB2 TRP 16 7.971 -3.999 9.821 131 HB3 TRP 16 HB3 TRP 16 8.769 -3.574 11.328 132 HD1 TRP 16 HD1 TRP 16 8.989 -6.025 8.408 133 HE1 TRP 16 HE1 TRP 16 11.150 -7.392 8.600 134 HE3 TRP 16 HE3 TRP 16 10.482 -4.595 13.107 135 HZ2 TRP 16 HZ2 TRP 16 13.210 -7.821 10.455 136 HZ3 TRP 16 HZ3 TRP 16 12.571 -5.540 14.010 137 HH2 TRP 16 HH2 TRP 16 13.907 -7.120 12.709 138 H GLU 17 H GLU 17 7.521 -3.563 13.555 139 HA GLU 17 HA GLU 17 9.208 -5.040 15.241 140 HB2 GLU 17 HB2 GLU 17 8.649 -2.517 15.214 141 HB3 GLU 17 HB3 GLU 17 7.218 -2.910 16.150 142 HG2 GLU 17 HG2 GLU 17 10.026 -3.567 17.077 143 HG3 GLU 17 HG3 GLU 17 9.266 -2.016 17.398 144 H ALA 18 H ALA 18 5.651 -4.739 15.238 145 HA ALA 18 HA ALA 18 5.104 -6.377 17.504 146 HB1 ALA 18 HB1 ALA 18 2.772 -6.344 16.715 147 HB2 ALA 18 HB2 ALA 18 3.298 -5.705 15.153 148 HB3 ALA 18 HB3 ALA 18 3.493 -4.736 16.614 149 H LEU 19 H LEU 19 5.682 -7.173 14.112 150 HA LEU 19 HA LEU 19 4.740 -9.930 14.306 151 HB2 LEU 19 HB2 LEU 19 6.326 -8.596 12.073 152 HB3 LEU 19 HB3 LEU 19 5.474 -10.131 11.968 153 HG LEU 19 HG LEU 19 4.201 -7.378 12.256 154 HD11 LEU 19 HD11 LEU 19 5.066 -7.789 10.013 155 HD12 LEU 19 HD12 LEU 19 3.305 -7.760 10.015 156 HD13 LEU 19 HD13 LEU 19 4.160 -9.304 9.919 157 HD21 LEU 19 HD21 LEU 19 2.828 -10.075 12.087 158 HD22 LEU 19 HD22 LEU 19 2.025 -8.504 12.033 159 HD23 LEU 19 HD23 LEU 19 2.870 -9.007 13.493 160 H ASN 20 H ASN 20 7.751 -8.214 14.724 161 HA ASN 20 HA ASN 20 9.590 -10.349 14.273 162 HB2 ASN 20 HB2 ASN 20 10.196 -7.926 14.145 163 HB3 ASN 20 HB3 ASN 20 9.973 -7.790 15.888 164 HD21 ASN 20 HD21 ASN 20 12.135 -7.115 16.128 165 HD22 ASN 20 HD22 ASN 20 13.460 -8.209 15.996 166 H GLY 21 H GLY 21 10.519 -11.818 15.673 167 HA2 GLY 21 HA2 GLY 21 10.827 -13.159 17.518 168 HA3 GLY 21 HA3 GLY 21 10.227 -11.860 18.531 169 H THR 22 H THR 22 8.080 -12.679 16.058 170 HA THR 22 HA THR 22 6.441 -14.538 17.690 171 HB THR 22 HB THR 22 5.276 -12.149 16.160 172 HG1 THR 22 HG1 THR 22 5.968 -10.925 17.742 173 HG21 THR 22 HG21 THR 22 3.273 -12.487 17.553 174 HG22 THR 22 HG22 THR 22 4.056 -13.834 18.382 175 HG23 THR 22 HG23 THR 22 3.658 -13.968 16.667 176 H GLU 23 H GLU 23 4.695 -15.559 16.213 177 HA GLU 23 HA GLU 23 5.632 -16.011 13.457 178 HB2 GLU 23 HB2 GLU 23 3.427 -17.274 15.119 179 HB3 GLU 23 HB3 GLU 23 3.568 -17.554 13.385 180 HG2 GLU 23 HG2 GLU 23 5.958 -18.364 13.863 181 HG3 GLU 23 HG3 GLU 23 5.488 -18.374 15.570 182 H GLY 24 H GLY 24 4.637 -13.358 14.273 183 HA2 GLY 24 HA2 GLY 24 3.522 -11.675 13.212 184 HA3 GLY 24 HA3 GLY 24 2.808 -12.853 12.119 185 H LEU 25 H LEU 25 1.026 -11.265 12.522 186 HA LEU 25 HA LEU 25 -0.802 -12.144 14.640 187 HB2 LEU 25 HB2 LEU 25 0.100 -9.248 14.304 188 HB3 LEU 25 HB3 LEU 25 -1.325 -9.713 15.214 189 HG LEU 25 HG LEU 25 1.534 -10.484 15.939 190 HD11 LEU 25 HD11 LEU 25 -0.274 -8.390 17.192 191 HD12 LEU 25 HD12 LEU 25 1.174 -8.087 16.227 192 HD13 LEU 25 HD13 LEU 25 1.316 -8.884 17.791 193 HD21 LEU 25 HD21 LEU 25 -0.077 -12.168 16.706 194 HD22 LEU 25 HD22 LEU 25 -1.044 -10.919 17.494 195 HD23 LEU 25 HD23 LEU 25 0.586 -11.275 18.075 196 H THR 26 H THR 26 -3.039 -11.327 14.229 197 HA THR 26 HA THR 26 -3.724 -11.011 11.416 198 HB THR 26 HB THR 26 -6.074 -10.804 12.172 199 HG1 THR 26 HG1 THR 26 -6.490 -10.939 14.484 200 HG21 THR 26 HG21 THR 26 -6.376 -12.994 13.277 201 HG22 THR 26 HG22 THR 26 -4.658 -13.046 13.671 202 HG23 THR 26 HG23 THR 26 -5.173 -13.109 11.984 203 H GLN 27 H GLN 27 -5.107 -9.101 10.716 204 HA GLN 27 HA GLN 27 -3.835 -6.649 11.027 205 HB2 GLN 27 HB2 GLN 27 -5.739 -5.629 9.878 206 HB3 GLN 27 HB3 GLN 27 -5.360 -7.175 9.131 207 HG2 GLN 27 HG2 GLN 27 -7.272 -8.227 10.226 208 HG3 GLN 27 HG3 GLN 27 -7.614 -6.754 11.131 209 HE21 GLN 27 HE21 GLN 27 -8.373 -4.900 9.944 210 HE22 GLN 27 HE22 GLN 27 -9.207 -5.119 8.447 211 H LYS 28 H LYS 28 -6.608 -7.974 12.727 212 HA LYS 28 HA LYS 28 -7.481 -5.846 14.308 213 HB2 LYS 28 HB2 LYS 28 -7.422 -8.810 15.020 214 HB3 LYS 28 HB3 LYS 28 -8.468 -7.596 15.759 215 HG2 LYS 28 HG2 LYS 28 -8.545 -8.332 12.812 216 HG3 LYS 28 HG3 LYS 28 -9.576 -9.076 14.036 217 HD2 LYS 28 HD2 LYS 28 -9.537 -6.098 13.369 218 HD3 LYS 28 HD3 LYS 28 -10.716 -7.256 12.751 219 HE2 LYS 28 HE2 LYS 28 -11.333 -7.756 15.170 220 HE3 LYS 28 HE3 LYS 28 -10.327 -6.382 15.634 221 HZ1 LYS 28 HZ1 LYS 28 -12.689 -6.297 13.847 222 HZ2 LYS 28 HZ2 LYS 28 -11.741 -4.964 14.285 223 HZ3 LYS 28 HZ3 LYS 28 -12.639 -5.785 15.456 224 H GLN 29 H GLN 29 -5.110 -8.386 15.146 225 HA GLN 29 HA GLN 29 -4.504 -7.467 17.778 226 HB2 GLN 29 HB2 GLN 29 -2.843 -9.230 15.931 227 HB3 GLN 29 HB3 GLN 29 -2.603 -9.067 17.668 228 HG2 GLN 29 HG2 GLN 29 -5.138 -10.163 16.415 229 HG3 GLN 29 HG3 GLN 29 -3.781 -11.169 16.912 230 HE21 GLN 29 HE21 GLN 29 -5.167 -12.294 18.341 231 HE22 GLN 29 HE22 GLN 29 -5.668 -11.606 19.847 232 H ILE 30 H ILE 30 -3.075 -6.836 14.620 233 HA ILE 30 HA ILE 30 -0.783 -5.375 15.510 234 HB ILE 30 HB ILE 30 -2.205 -5.432 12.811 235 HG12 ILE 30 HG12 ILE 30 0.393 -6.779 13.683 236 HG13 ILE 30 HG13 ILE 30 -1.167 -7.589 13.642 237 HG21 ILE 30 HG21 ILE 30 -0.953 -3.327 12.981 238 HG22 ILE 30 HG22 ILE 30 -0.154 -4.417 11.849 239 HG23 ILE 30 HG23 ILE 30 0.500 -4.202 13.475 240 HD11 ILE 30 HD11 ILE 30 -1.268 -7.269 11.220 241 HD12 ILE 30 HD12 ILE 30 0.172 -8.158 11.716 242 HD13 ILE 30 HD13 ILE 30 0.300 -6.459 11.264 243 H LYS 31 H LYS 31 -4.064 -4.371 14.471 244 HA LYS 31 HA LYS 31 -3.744 -1.568 14.519 245 HB2 LYS 31 HB2 LYS 31 -6.192 -3.295 15.075 246 HB3 LYS 31 HB3 LYS 31 -6.274 -1.541 14.964 247 HG2 LYS 31 HG2 LYS 31 -5.296 -3.323 12.715 248 HG3 LYS 31 HG3 LYS 31 -6.969 -2.792 12.886 249 HD2 LYS 31 HD2 LYS 31 -4.551 -0.978 12.510 250 HD3 LYS 31 HD3 LYS 31 -5.725 -1.413 11.262 251 HE2 LYS 31 HE2 LYS 31 -6.277 0.184 13.784 252 HE3 LYS 31 HE3 LYS 31 -6.250 0.792 12.131 253 HZ1 LYS 31 HZ1 LYS 31 -8.508 0.445 12.873 254 HZ2 LYS 31 HZ2 LYS 31 -8.186 -1.172 13.230 255 HZ3 LYS 31 HZ3 LYS 31 -8.151 -0.641 11.627 256 H LYS 32 H LYS 32 -4.578 -3.844 17.087 257 HA LYS 32 HA LYS 32 -4.932 -1.978 19.216 258 HB2 LYS 32 HB2 LYS 32 -4.192 -4.933 19.258 259 HB3 LYS 32 HB3 LYS 32 -4.664 -4.007 20.681 260 HG2 LYS 32 HG2 LYS 32 -6.438 -4.452 18.252 261 HG3 LYS 32 HG3 LYS 32 -6.498 -5.424 19.724 262 HD2 LYS 32 HD2 LYS 32 -7.032 -2.420 19.592 263 HD3 LYS 32 HD3 LYS 32 -8.281 -3.670 19.639 264 HE2 LYS 32 HE2 LYS 32 -7.448 -4.404 21.857 265 HE3 LYS 32 HE3 LYS 32 -6.216 -3.141 21.808 266 HZ1 LYS 32 HZ1 LYS 32 -7.953 -1.494 21.788 267 HZ2 LYS 32 HZ2 LYS 32 -8.129 -2.514 23.120 268 HZ3 LYS 32 HZ3 LYS 32 -9.140 -2.694 21.781 269 H ALA 33 H ALA 33 -2.104 -3.826 18.084 270 HA ALA 33 HA ALA 33 -0.311 -3.122 20.195 271 HB1 ALA 33 HB1 ALA 33 1.435 -4.073 18.741 272 HB2 ALA 33 HB2 ALA 33 0.316 -4.067 17.372 273 HB3 ALA 33 HB3 ALA 33 0.002 -5.104 18.766 274 H THR 34 H THR 34 -0.847 -1.767 16.969 275 HA THR 34 HA THR 34 1.345 0.163 17.178 276 HB THR 34 HB THR 34 0.916 0.630 14.789 277 HG1 THR 34 HG1 THR 34 -0.951 -1.377 14.443 278 HG21 THR 34 HG21 THR 34 2.352 -1.320 15.308 279 HG22 THR 34 HG22 THR 34 1.412 -1.599 13.841 280 HG23 THR 34 HG23 THR 34 0.927 -2.367 15.355 281 H LYS 35 H LYS 35 -2.077 0.097 17.592 282 HA LYS 35 HA LYS 35 -3.577 1.602 18.363 283 HB2 LYS 35 HB2 LYS 35 -1.142 3.398 18.759 284 HB3 LYS 35 HB3 LYS 35 -2.750 3.771 19.369 285 HG2 LYS 35 HG2 LYS 35 -1.123 1.328 20.169 286 HG3 LYS 35 HG3 LYS 35 -1.212 2.829 21.096 287 HD2 LYS 35 HD2 LYS 35 -3.612 2.512 21.467 288 HD3 LYS 35 HD3 LYS 35 -3.619 1.086 20.423 289 HE2 LYS 35 HE2 LYS 35 -3.645 0.495 22.832 290 HE3 LYS 35 HE3 LYS 35 -2.213 -0.125 22.010 291 HZ1 LYS 35 HZ1 LYS 35 -0.916 1.652 22.944 292 HZ2 LYS 35 HZ2 LYS 35 -1.719 0.837 24.187 293 HZ3 LYS 35 HZ3 LYS 35 -2.284 2.347 23.659 294 H LEU 36 H LEU 36 -3.421 1.338 15.622 295 HA LEU 36 HA LEU 36 -3.320 3.957 14.340 296 HB2 LEU 36 HB2 LEU 36 -4.009 1.216 13.218 297 HB3 LEU 36 HB3 LEU 36 -3.918 2.683 12.249 298 HG LEU 36 HG LEU 36 -1.595 1.428 13.770 299 HD11 LEU 36 HD11 LEU 36 -0.671 0.858 11.576 300 HD12 LEU 36 HD12 LEU 36 -2.122 1.482 10.784 301 HD13 LEU 36 HD13 LEU 36 -2.227 0.071 11.842 302 HD21 LEU 36 HD21 LEU 36 -1.353 3.855 13.676 303 HD22 LEU 36 HD22 LEU 36 -1.609 3.842 11.930 304 HD23 LEU 36 HD23 LEU 36 -0.173 3.080 12.619 305 H LYS 37 H LYS 37 -4.996 5.183 13.653 306 HA LYS 37 HA LYS 37 -7.548 4.976 14.869 307 HB2 LYS 37 HB2 LYS 37 -8.114 6.977 13.432 308 HB3 LYS 37 HB3 LYS 37 -6.658 7.155 14.401 309 HG2 LYS 37 HG2 LYS 37 -5.253 6.725 12.439 310 HG3 LYS 37 HG3 LYS 37 -6.687 6.458 11.443 311 HD2 LYS 37 HD2 LYS 37 -7.364 8.804 11.756 312 HD3 LYS 37 HD3 LYS 37 -5.987 9.081 12.828 313 HE2 LYS 37 HE2 LYS 37 -5.549 9.950 10.556 314 HE3 LYS 37 HE3 LYS 37 -4.431 8.649 10.965 315 HZ1 LYS 37 HZ1 LYS 37 -6.865 8.347 9.287 316 HZ2 LYS 37 HZ2 LYS 37 -5.750 7.131 9.652 317 HZ3 LYS 37 HZ3 LYS 37 -5.279 8.447 8.710 318 H ALA 38 H ALA 38 -6.427 4.111 11.615 319 HA ALA 38 HA ALA 38 -8.999 2.757 11.059 320 HB1 ALA 38 HB1 ALA 38 -7.616 4.595 9.070 321 HB2 ALA 38 HB2 ALA 38 -9.112 4.952 9.932 322 HB3 ALA 38 HB3 ALA 38 -9.066 3.630 8.761 323 H ASP 39 H ASP 39 -8.882 0.995 9.681 324 HA ASP 39 HA ASP 39 -6.540 -0.557 9.426 325 HB2 ASP 39 HB2 ASP 39 -7.937 -1.852 7.687 326 HB3 ASP 39 HB3 ASP 39 -8.609 -1.726 9.309 327 H LYS 40 H LYS 40 -7.846 1.937 7.401 328 HA LYS 40 HA LYS 40 -6.455 1.781 5.023 329 HB2 LYS 40 HB2 LYS 40 -7.044 4.268 6.673 330 HB3 LYS 40 HB3 LYS 40 -6.672 4.254 4.950 331 HG2 LYS 40 HG2 LYS 40 -8.728 3.157 4.423 332 HG3 LYS 40 HG3 LYS 40 -9.053 2.796 6.116 333 HD2 LYS 40 HD2 LYS 40 -10.477 4.628 5.324 334 HD3 LYS 40 HD3 LYS 40 -9.385 5.176 6.588 335 HE2 LYS 40 HE2 LYS 40 -8.715 5.591 3.658 336 HE3 LYS 40 HE3 LYS 40 -9.754 6.715 4.526 337 HZ1 LYS 40 HZ1 LYS 40 -7.495 7.488 4.534 338 HZ2 LYS 40 HZ2 LYS 40 -6.946 6.051 5.224 339 HZ3 LYS 40 HZ3 LYS 40 -7.944 7.081 6.110 340 H ASP 41 H ASP 41 -5.310 3.129 8.119 341 HA ASP 41 HA ASP 41 -2.734 4.004 7.228 342 HB2 ASP 41 HB2 ASP 41 -3.655 3.291 10.049 343 HB3 ASP 41 HB3 ASP 41 -2.237 4.255 9.637 344 H PHE 42 H PHE 42 -3.984 1.008 8.634 345 HA PHE 42 HA PHE 42 -1.567 -0.434 8.936 346 HB2 PHE 42 HB2 PHE 42 -3.565 -1.256 10.033 347 HB3 PHE 42 HB3 PHE 42 -4.441 -1.358 8.513 348 HD1 PHE 42 HD1 PHE 42 -1.461 -2.799 10.276 349 HD2 PHE 42 HD2 PHE 42 -4.534 -3.436 7.367 350 HE1 PHE 42 HE1 PHE 42 -0.766 -5.136 10.041 351 HE2 PHE 42 HE2 PHE 42 -3.834 -5.783 7.152 352 HZ PHE 42 HZ PHE 42 -1.946 -6.633 8.492 353 H PHE 43 H PHE 43 -3.689 0.061 6.106 354 HA PHE 43 HA PHE 43 -2.442 -1.920 4.434 355 HB2 PHE 43 HB2 PHE 43 -4.121 0.486 3.605 356 HB3 PHE 43 HB3 PHE 43 -3.719 -0.886 2.576 357 HD1 PHE 43 HD2 PHE 43 -4.170 -3.105 4.665 358 HD2 PHE 43 HD1 PHE 43 -6.512 0.309 3.584 359 HE1 PHE 43 HE2 PHE 43 -6.203 -4.255 5.418 360 HE2 PHE 43 HE1 PHE 43 -8.537 -0.848 4.340 361 HZ PHE 43 HZ PHE 43 -8.385 -3.133 5.255 362 H LEU 44 H LEU 44 -1.906 1.549 4.935 363 HA LEU 44 HA LEU 44 0.051 1.904 2.867 364 HB2 LEU 44 HB2 LEU 44 -0.851 3.529 5.245 365 HB3 LEU 44 HB3 LEU 44 0.654 3.973 4.462 366 HG LEU 44 HG LEU 44 -0.533 4.340 2.320 367 HD11 LEU 44 HD11 LEU 44 -2.970 4.349 2.153 368 HD12 LEU 44 HD12 LEU 44 -3.100 3.718 3.796 369 HD13 LEU 44 HD13 LEU 44 -2.361 2.737 2.530 370 HD21 LEU 44 HD21 LEU 44 -0.242 6.239 3.839 371 HD22 LEU 44 HD22 LEU 44 -1.791 5.883 4.610 372 HD23 LEU 44 HD23 LEU 44 -1.738 6.387 2.918 373 H GLY 45 H GLY 45 0.286 1.198 6.365 374 HA2 GLY 45 HA2 GLY 45 3.128 1.177 6.584 375 HA3 GLY 45 HA3 GLY 45 1.998 0.409 7.688 376 H LEU 46 H LEU 46 0.831 -1.555 6.402 377 HA LEU 46 HA LEU 46 2.684 -3.662 6.083 378 HB2 LEU 46 HB2 LEU 46 0.348 -4.036 6.769 379 HB3 LEU 46 HB3 LEU 46 -0.227 -3.463 5.213 380 HG LEU 46 HG LEU 46 0.887 -5.437 4.116 381 HD11 LEU 46 HD11 LEU 46 1.638 -7.330 5.484 382 HD12 LEU 46 HD12 LEU 46 1.419 -6.368 6.948 383 HD13 LEU 46 HD13 LEU 46 2.626 -5.894 5.749 384 HD21 LEU 46 HD21 LEU 46 -1.511 -5.506 4.647 385 HD22 LEU 46 HD22 LEU 46 -1.153 -6.179 6.238 386 HD23 LEU 46 HD23 LEU 46 -0.777 -7.104 4.783 387 H GLY 47 H GLY 47 1.200 -1.500 3.746 388 HA2 GLY 47 HA2 GLY 47 1.890 -2.737 1.310 389 HA3 GLY 47 HA3 GLY 47 1.670 -1.009 1.551 390 H TRP 48 H TRP 48 3.784 -0.753 3.522 391 HA TRP 48 HA TRP 48 6.114 -0.585 1.835 392 HB2 TRP 48 HB2 TRP 48 5.387 1.005 3.815 393 HB3 TRP 48 HB3 TRP 48 6.201 -0.174 4.840 394 HD1 TRP 48 HD1 TRP 48 8.902 -0.684 3.985 395 HE1 TRP 48 HE1 TRP 48 10.619 0.998 3.122 396 HE3 TRP 48 HE3 TRP 48 5.770 3.214 2.909 397 HZ2 TRP 48 HZ2 TRP 48 10.670 3.637 2.146 398 HZ3 TRP 48 HZ3 TRP 48 6.741 5.297 2.030 399 HH2 TRP 48 HH2 TRP 48 9.149 5.511 1.667 400 H LEU 49 H LEU 49 5.055 -2.699 4.500 401 HA LEU 49 HA LEU 49 7.369 -4.329 4.724 402 HB2 LEU 49 HB2 LEU 49 4.443 -4.777 5.341 403 HB3 LEU 49 HB3 LEU 49 5.568 -6.113 5.480 404 HG LEU 49 HG LEU 49 6.793 -5.009 7.264 405 HD11 LEU 49 HD11 LEU 49 6.138 -2.840 8.172 406 HD12 LEU 49 HD12 LEU 49 4.956 -2.646 6.871 407 HD13 LEU 49 HD13 LEU 49 6.681 -2.705 6.499 408 HD21 LEU 49 HD21 LEU 49 3.803 -4.788 7.740 409 HD22 LEU 49 HD22 LEU 49 5.053 -4.902 8.989 410 HD23 LEU 49 HD23 LEU 49 4.771 -6.260 7.901 411 H LEU 50 H LEU 50 4.700 -4.377 2.458 412 HA LEU 50 HA LEU 50 5.350 -6.883 1.204 413 HB2 LEU 50 HB2 LEU 50 3.083 -5.443 1.319 414 HB3 LEU 50 HB3 LEU 50 3.702 -4.735 -0.159 415 HG LEU 50 HG LEU 50 3.111 -7.702 0.262 416 HD11 LEU 50 HD11 LEU 50 1.514 -5.646 -1.295 417 HD12 LEU 50 HD12 LEU 50 1.048 -6.404 0.231 418 HD13 LEU 50 HD13 LEU 50 1.190 -7.382 -1.227 419 HD21 LEU 50 HD21 LEU 50 4.901 -7.393 -1.365 420 HD22 LEU 50 HD22 LEU 50 3.907 -6.257 -2.283 421 HD23 LEU 50 HD23 LEU 50 3.427 -7.950 -2.154 422 H ARG 51 H ARG 51 5.980 -3.437 0.520 423 HA ARG 51 HA ARG 51 6.933 -3.670 -2.098 424 HB2 ARG 51 HB2 ARG 51 7.464 -1.413 -2.018 425 HB3 ARG 51 HB3 ARG 51 6.242 -1.538 -0.771 426 HG2 ARG 51 HG2 ARG 51 7.941 -1.400 0.977 427 HG3 ARG 51 HG3 ARG 51 9.235 -1.480 -0.211 428 HD2 ARG 51 HD2 ARG 51 8.840 0.809 0.652 429 HD3 ARG 51 HD3 ARG 51 8.632 0.684 -1.097 430 HE ARG 51 HE ARG 51 6.208 0.397 0.431 431 HH11 ARG 51 HH11 ARG 51 8.327 2.753 -0.923 432 HH12 ARG 51 HH12 ARG 51 7.059 3.885 -1.212 433 HH21 ARG 51 HH21 ARG 51 4.584 1.853 0.048 434 HH22 ARG 51 HH22 ARG 51 4.949 3.373 -0.681 435 H GLU 52 H GLU 52 8.764 -4.018 0.927 436 HA GLU 52 HA GLU 52 11.299 -4.409 -0.566 437 HB2 GLU 52 HB2 GLU 52 10.821 -4.111 2.433 438 HB3 GLU 52 HB3 GLU 52 12.398 -4.277 1.667 439 HG2 GLU 52 HG2 GLU 52 12.024 -2.130 0.480 440 HG3 GLU 52 HG3 GLU 52 10.474 -1.956 1.308 441 H ASP 53 H ASP 53 8.788 -6.327 0.351 442 HA ASP 53 HA ASP 53 8.403 -8.520 0.719 443 HB2 ASP 53 HB2 ASP 53 9.965 -8.716 -1.279 444 HB3 ASP 53 HB3 ASP 53 11.288 -9.012 -0.154 445 H LYS 54 H LYS 54 8.912 -7.053 2.897 446 HA LYS 54 HA LYS 54 10.799 -8.212 4.763 447 HB2 LYS 54 HB2 LYS 54 8.370 -6.435 5.352 448 HB3 LYS 54 HB3 LYS 54 9.768 -6.677 6.396 449 HG2 LYS 54 HG2 LYS 54 10.258 -5.541 3.661 450 HG3 LYS 54 HG3 LYS 54 9.457 -4.500 4.831 451 HD2 LYS 54 HD2 LYS 54 12.059 -5.897 5.526 452 HD3 LYS 54 HD3 LYS 54 12.061 -4.392 4.601 453 HE2 LYS 54 HE2 LYS 54 10.782 -3.314 6.470 454 HE3 LYS 54 HE3 LYS 54 10.934 -4.812 7.386 455 HZ1 LYS 54 HZ1 LYS 54 13.312 -4.565 7.361 456 HZ2 LYS 54 HZ2 LYS 54 12.594 -3.162 7.987 457 HZ3 LYS 54 HZ3 LYS 54 13.194 -3.172 6.409 458 H VAL 55 H VAL 55 7.430 -8.735 3.892 459 HA VAL 55 HA VAL 55 7.120 -10.813 5.975 460 HB VAL 55 HB VAL 55 4.821 -10.128 6.465 461 HG11 VAL 55 HG11 VAL 55 6.742 -7.805 6.817 462 HG12 VAL 55 HG12 VAL 55 6.561 -9.189 7.899 463 HG13 VAL 55 HG13 VAL 55 5.236 -8.038 7.712 464 HG21 VAL 55 HG21 VAL 55 4.175 -9.140 4.308 465 HG22 VAL 55 HG22 VAL 55 5.260 -7.774 4.584 466 HG23 VAL 55 HG23 VAL 55 3.851 -8.004 5.621 467 H VAL 56 H VAL 56 5.127 -12.137 5.570 468 HA VAL 56 HA VAL 56 4.370 -12.439 2.759 469 HB VAL 56 HB VAL 56 5.719 -14.377 3.365 470 HG11 VAL 56 HG11 VAL 56 3.837 -14.817 5.714 471 HG12 VAL 56 HG12 VAL 56 5.522 -14.299 5.807 472 HG13 VAL 56 HG13 VAL 56 5.131 -15.916 5.217 473 HG21 VAL 56 HG21 VAL 56 4.142 -16.232 2.907 474 HG22 VAL 56 HG22 VAL 56 3.794 -14.837 1.883 475 HG23 VAL 56 HG23 VAL 56 2.778 -15.175 3.285 476 H THR 57 H THR 57 2.224 -12.601 2.305 477 HA THR 57 HA THR 57 0.357 -11.827 4.447 478 HB THR 57 HB THR 57 -1.105 -11.087 2.519 479 HG1 THR 57 HG1 THR 57 -0.277 -12.444 0.895 480 HG21 THR 57 HG21 THR 57 0.376 -9.439 3.609 481 HG22 THR 57 HG22 THR 57 0.259 -9.121 1.876 482 HG23 THR 57 HG23 THR 57 1.702 -9.898 2.532 483 H SER 58 H SER 58 -1.418 -12.978 4.945 484 HA SER 58 HA SER 58 -2.364 -15.291 3.405 485 HB2 SER 58 HB2 SER 58 -0.636 -16.232 4.944 486 HB3 SER 58 HB3 SER 58 -1.454 -15.497 6.323 487 HG SER 58 HG SER 58 -3.139 -16.907 6.078 488 H GLU 59 H GLU 59 -4.445 -16.188 4.512 489 HA GLU 59 HA GLU 59 -5.819 -14.095 6.110 490 HB2 GLU 59 HB2 GLU 59 -7.906 -14.463 4.968 491 HB3 GLU 59 HB3 GLU 59 -6.673 -14.112 3.770 492 HG2 GLU 59 HG2 GLU 59 -7.896 -16.826 4.376 493 HG3 GLU 59 HG3 GLU 59 -8.213 -15.832 2.960 494 H VAL 60 H VAL 60 -6.299 -14.751 8.073 495 HA VAL 60 HA VAL 60 -6.953 -17.592 8.617 496 HB VAL 60 HB VAL 60 -6.006 -15.361 10.470 497 HG11 VAL 60 HG11 VAL 60 -7.051 -18.100 11.329 498 HG12 VAL 60 HG12 VAL 60 -7.780 -16.540 11.714 499 HG13 VAL 60 HG13 VAL 60 -6.203 -16.961 12.383 500 HG21 VAL 60 HG21 VAL 60 -4.160 -16.926 10.965 501 HG22 VAL 60 HG22 VAL 60 -4.249 -16.589 9.234 502 HG23 VAL 60 HG23 VAL 60 -4.867 -18.118 9.869 503 H GLU 61 H GLU 61 -9.039 -17.963 8.396 504 HA GLU 61 HA GLU 61 -11.276 -18.000 8.685 505 HB2 GLU 61 HB2 GLU 61 -10.670 -16.379 11.195 506 HB3 GLU 61 HB3 GLU 61 -12.114 -17.350 10.912 507 HG2 GLU 61 HG2 GLU 61 -9.270 -18.381 11.180 508 HG3 GLU 61 HG3 GLU 61 -10.526 -18.515 12.394 509 H GLY 62 H GLY 62 -10.515 -16.115 6.858 510 HA2 GLY 62 HA2 GLY 62 -11.564 -14.545 5.537 511 HA3 GLY 62 HA3 GLY 62 -12.782 -14.331 6.779 512 H GLU 63 H GLU 63 -9.670 -13.942 8.075 513 HA GLU 63 HA GLU 63 -9.790 -10.980 7.816 514 HB2 GLU 63 HB2 GLU 63 -8.793 -12.527 10.256 515 HB3 GLU 63 HB3 GLU 63 -8.997 -10.779 10.110 516 HG2 GLU 63 HG2 GLU 63 -11.482 -11.197 9.785 517 HG3 GLU 63 HG3 GLU 63 -11.181 -12.884 10.194 518 H ILE 64 H ILE 64 -7.754 -9.850 7.804 519 HA ILE 64 HA ILE 64 -5.710 -11.164 6.262 520 HB ILE 64 HB ILE 64 -5.713 -8.401 7.565 521 HG12 ILE 64 HG12 ILE 64 -6.309 -9.202 4.679 522 HG13 ILE 64 HG13 ILE 64 -7.516 -8.726 5.869 523 HG21 ILE 64 HG21 ILE 64 -3.399 -9.117 7.130 524 HG22 ILE 64 HG22 ILE 64 -3.860 -7.818 6.031 525 HG23 ILE 64 HG23 ILE 64 -3.808 -9.484 5.451 526 HD11 ILE 64 HD11 ILE 64 -5.332 -6.961 4.750 527 HD12 ILE 64 HD12 ILE 64 -6.527 -6.478 5.958 528 HD13 ILE 64 HD13 ILE 64 -7.045 -6.917 4.332 529 H PHE 65 H PHE 65 -3.919 -12.181 6.973 530 HA PHE 65 HA PHE 65 -2.826 -11.711 9.683 531 HB2 PHE 65 HB2 PHE 65 -4.104 -13.854 9.688 532 HB3 PHE 65 HB3 PHE 65 -3.168 -14.429 8.315 533 HD1 PHE 65 HD2 PHE 65 -3.079 -13.718 11.944 534 HD2 PHE 65 HD1 PHE 65 -0.871 -15.278 8.628 535 HE1 PHE 65 HE2 PHE 65 -1.429 -14.681 13.489 536 HE2 PHE 65 HE1 PHE 65 0.772 -16.243 10.183 537 HZ PHE 65 HZ PHE 65 0.496 -15.940 12.612 538 H VAL 66 H VAL 66 -0.735 -11.088 9.522 539 HA VAL 66 HA VAL 66 0.917 -12.004 7.234 540 HB VAL 66 HB VAL 66 1.998 -9.747 7.134 541 HG11 VAL 66 HG11 VAL 66 0.153 -8.603 5.944 542 HG12 VAL 66 HG12 VAL 66 -1.012 -9.709 6.673 543 HG13 VAL 66 HG13 VAL 66 0.201 -10.322 5.549 544 HG21 VAL 66 HG21 VAL 66 -0.217 -8.883 9.047 545 HG22 VAL 66 HG22 VAL 66 0.902 -7.794 8.225 546 HG23 VAL 66 HG23 VAL 66 1.510 -8.943 9.418 547 H LYS 67 H LYS 67 3.169 -12.176 7.592 548 HA LYS 67 HA LYS 67 4.298 -11.725 10.256 549 HB2 LYS 67 HB2 LYS 67 4.984 -14.060 10.646 550 HB3 LYS 67 HB3 LYS 67 3.235 -13.920 10.593 551 HG2 LYS 67 HG2 LYS 67 3.166 -14.884 8.363 552 HG3 LYS 67 HG3 LYS 67 4.934 -14.910 8.283 553 HD2 LYS 67 HD2 LYS 67 4.982 -16.501 10.200 554 HD3 LYS 67 HD3 LYS 67 3.216 -16.491 10.247 555 HE2 LYS 67 HE2 LYS 67 3.111 -17.524 8.043 556 HE3 LYS 67 HE3 LYS 67 4.867 -17.408 7.866 557 HZ1 LYS 67 HZ1 LYS 67 3.408 -19.039 9.871 558 HZ2 LYS 67 HZ2 LYS 67 5.091 -18.890 9.779 559 HZ3 LYS 67 HZ3 LYS 67 4.236 -19.616 8.517 560 H LEU 68 H LEU 68 6.669 -12.256 10.307 561 HA LEU 68 HA LEU 68 7.965 -11.215 8.015 562 HB2 LEU 68 HB2 LEU 68 9.233 -12.728 10.332 563 HB3 LEU 68 HB3 LEU 68 10.081 -11.704 9.183 564 HG LEU 68 HG LEU 68 8.149 -10.840 11.372 565 HD11 LEU 68 HD11 LEU 68 11.045 -10.104 10.864 566 HD12 LEU 68 HD12 LEU 68 10.448 -11.222 12.095 567 HD13 LEU 68 HD13 LEU 68 10.032 -9.512 12.185 568 HD21 LEU 68 HD21 LEU 68 9.265 -9.092 9.155 569 HD22 LEU 68 HD22 LEU 68 8.409 -8.514 10.589 570 HD23 LEU 68 HD23 LEU 68 7.571 -9.521 9.412 571 H VAL 69 H VAL 69 9.299 -12.150 6.478 572 HA VAL 69 HA VAL 69 8.577 -14.612 5.330 573 HB VAL 69 HB VAL 69 11.094 -12.933 4.876 574 HG11 VAL 69 HG11 VAL 69 11.271 -14.025 2.659 575 HG12 VAL 69 HG12 VAL 69 9.935 -15.101 3.079 576 HG13 VAL 69 HG13 VAL 69 11.456 -15.196 3.967 577 HG21 VAL 69 HG21 VAL 69 9.866 -12.011 2.922 578 HG22 VAL 69 HG22 VAL 69 9.035 -11.670 4.439 579 HG23 VAL 69 HG23 VAL 69 8.441 -12.952 3.381 580 H LEU 70 H LEU 70 9.523 -16.664 5.277 581 HA LEU 70 HA LEU 70 10.757 -18.492 5.759 582 HB2 LEU 70 HB2 LEU 70 12.693 -16.659 7.213 583 HB3 LEU 70 HB3 LEU 70 12.966 -18.371 6.928 584 HG LEU 70 HG LEU 70 12.672 -16.291 4.719 585 HD11 LEU 70 HD11 LEU 70 15.206 -17.554 5.809 586 HD12 LEU 70 HD12 LEU 70 14.700 -15.874 6.014 587 HD13 LEU 70 HD13 LEU 70 15.091 -16.481 4.409 588 HD21 LEU 70 HD21 LEU 70 13.517 -18.054 3.223 589 HD22 LEU 70 HD22 LEU 70 12.009 -18.537 3.993 590 HD23 LEU 70 HD23 LEU 70 13.540 -19.200 4.569 591 H GLU 71 H GLU 71 9.774 -16.408 8.407 592 HA GLU 71 HA GLU 71 10.260 -18.134 10.581 593 HB2 GLU 71 HB2 GLU 71 8.311 -15.825 10.251 594 HB3 GLU 71 HB3 GLU 71 8.595 -16.637 11.789 595 HG2 GLU 71 HG2 GLU 71 10.685 -15.154 10.154 596 HG3 GLU 71 HG3 GLU 71 9.888 -14.547 11.602 597 H HIS 72 H HIS 72 9.518 -20.120 10.727 598 HA HIS 72 HA HIS 72 8.362 -22.036 10.464 599 HB2 HIS 72 HB2 HIS 72 7.284 -20.922 12.515 600 HB3 HIS 72 HB3 HIS 72 5.935 -20.501 11.468 601 HD1 HIS 72 HD1 HIS 72 4.483 -22.024 13.132 602 HD2 HIS 72 HD2 HIS 72 7.333 -24.079 10.918 603 HE1 HIS 72 HE1 HIS 72 3.844 -24.435 13.314 604 HE2 HIS 72 HE2 HIS 72 5.732 -25.652 12.204 605 H HIS 73 H HIS 73 8.696 -21.507 8.095 606 HA HIS 73 HA HIS 73 6.271 -20.821 6.588 607 HB2 HIS 73 HB2 HIS 73 8.580 -19.768 6.166 608 HB3 HIS 73 HB3 HIS 73 9.065 -21.310 5.473 609 HD1 HIS 73 HD1 HIS 73 7.333 -18.188 4.697 610 HD2 HIS 73 HD2 HIS 73 7.582 -21.988 3.032 611 HE1 HIS 73 HE1 HIS 73 6.471 -17.951 2.365 612 HE2 HIS 73 HE2 HIS 73 6.521 -20.274 1.410 613 H HIS 74 H HIS 74 4.945 -22.544 6.251 614 HA HIS 74 HA HIS 74 6.057 -24.831 4.730 615 HB2 HIS 74 HB2 HIS 74 3.992 -25.034 6.961 616 HB3 HIS 74 HB3 HIS 74 4.262 -26.314 5.786 617 HD1 HIS 74 HD1 HIS 74 5.200 -25.438 9.080 618 HD2 HIS 74 HD2 HIS 74 7.224 -27.093 5.854 619 HE1 HIS 74 HE1 HIS 74 7.200 -26.590 10.065 620 HE2 HIS 74 HE2 HIS 74 8.282 -27.752 8.121 621 H HIS 75 H HIS 75 2.623 -24.315 5.559 622 HA HIS 75 HA HIS 75 1.801 -23.068 3.158 623 HB2 HIS 75 HB2 HIS 75 0.615 -25.112 2.123 624 HB3 HIS 75 HB3 HIS 75 2.357 -25.022 1.901 625 HD1 HIS 75 HD1 HIS 75 3.806 -26.824 3.043 626 HD2 HIS 75 HD2 HIS 75 -0.264 -27.279 3.746 627 HE1 HIS 75 HE1 HIS 75 3.550 -29.109 4.043 628 HE2 HIS 75 HE2 HIS 75 1.076 -29.397 4.383 629 H HIS 76 H HIS 76 -0.365 -22.512 3.213 630 HA HIS 76 HA HIS 76 -1.778 -22.945 5.741 631 HB2 HIS 76 HB2 HIS 76 -1.479 -20.653 4.667 632 HB3 HIS 76 HB3 HIS 76 -2.582 -21.166 3.397 633 HD1 HIS 76 HD1 HIS 76 -2.609 -20.826 7.197 634 HD2 HIS 76 HD2 HIS 76 -5.183 -20.518 3.959 635 HE1 HIS 76 HE1 HIS 76 -4.769 -19.974 8.140 636 HE2 HIS 76 HE2 HIS 76 -6.230 -19.603 6.139 637 H HIS 77 H HIS 77 -2.000 -23.915 2.400 638 HA HIS 77 HA HIS 77 -4.241 -25.746 3.028 639 HB2 HIS 77 HB2 HIS 77 -3.837 -24.091 0.506 640 HB3 HIS 77 HB3 HIS 77 -4.838 -25.540 0.505 641 HD1 HIS 77 HD1 HIS 77 -7.168 -25.349 1.441 642 HD2 HIS 77 HD2 HIS 77 -4.924 -21.910 2.054 643 HE1 HIS 77 HE1 HIS 77 -8.797 -23.620 2.229 644 HE2 HIS 77 HE2 HIS 77 -7.463 -21.499 2.333 645 H1 MET 1 H MET 1 1.874 -21.433 -6.254 646 HA MET 1 HA MET 1 3.363 -20.896 -8.666 647 HB2 MET 1 HB2 MET 1 1.433 -22.502 -8.558 648 HB3 MET 1 HB3 MET 1 0.346 -21.145 -8.301 649 HG2 MET 1 HG2 MET 1 0.873 -20.270 -10.521 650 HG3 MET 1 HG3 MET 1 2.047 -21.563 -10.778 651 HE1 MET 1 HE1 MET 1 0.490 -24.084 -9.463 652 HE2 MET 1 HE2 MET 1 1.354 -24.171 -10.999 653 HE3 MET 1 HE3 MET 1 -0.313 -24.735 -10.891 654 H LYS 2 H LYS 2 1.216 -19.118 -6.544 655 HA LYS 2 HA LYS 2 2.160 -16.554 -7.482 656 HB2 LYS 2 HB2 LYS 2 -0.161 -15.630 -7.922 657 HB3 LYS 2 HB3 LYS 2 0.421 -16.767 -9.130 658 HG2 LYS 2 HG2 LYS 2 -0.990 -18.533 -8.257 659 HG3 LYS 2 HG3 LYS 2 -1.480 -17.530 -6.890 660 HD2 LYS 2 HD2 LYS 2 -3.214 -17.693 -8.694 661 HD3 LYS 2 HD3 LYS 2 -2.726 -16.037 -8.336 662 HE2 LYS 2 HE2 LYS 2 -2.981 -16.467 -10.775 663 HE3 LYS 2 HE3 LYS 2 -1.347 -15.968 -10.349 664 HZ1 LYS 2 HZ1 LYS 2 -0.655 -18.271 -10.463 665 HZ2 LYS 2 HZ2 LYS 2 -1.343 -17.779 -11.922 666 HZ3 LYS 2 HZ3 LYS 2 -2.225 -18.756 -10.861 667 H MET 3 H MET 3 1.029 -14.731 -6.225 668 HA MET 3 HA MET 3 -0.137 -15.431 -3.646 669 HB2 MET 3 HB2 MET 3 1.641 -14.232 -2.330 670 HB3 MET 3 HB3 MET 3 2.193 -15.725 -3.070 671 HG2 MET 3 HG2 MET 3 3.279 -14.410 -4.868 672 HG3 MET 3 HG3 MET 3 2.761 -12.927 -4.069 673 HE1 MET 3 HE1 MET 3 4.840 -13.199 -0.657 674 HE2 MET 3 HE2 MET 3 3.225 -13.860 -0.902 675 HE3 MET 3 HE3 MET 3 3.627 -12.258 -1.523 676 H LEU 4 H LEU 4 -0.247 -13.269 -2.245 677 HA LEU 4 HA LEU 4 -1.880 -11.403 -3.660 678 HB2 LEU 4 HB2 LEU 4 -0.738 -11.256 -0.846 679 HB3 LEU 4 HB3 LEU 4 -1.899 -10.110 -1.487 680 HG LEU 4 HG LEU 4 -3.524 -12.072 -1.776 681 HD11 LEU 4 HD11 LEU 4 -3.180 -14.103 -0.457 682 HD12 LEU 4 HD12 LEU 4 -1.562 -13.561 -0.001 683 HD13 LEU 4 HD13 LEU 4 -1.926 -13.939 -1.688 684 HD21 LEU 4 HD21 LEU 4 -3.731 -10.445 0.055 685 HD22 LEU 4 HD22 LEU 4 -2.652 -11.419 1.058 686 HD23 LEU 4 HD23 LEU 4 -4.226 -12.056 0.573 687 H LYS 5 H LYS 5 1.506 -11.485 -3.105 688 HA LYS 5 HA LYS 5 2.238 -8.777 -3.494 689 HB2 LYS 5 HB2 LYS 5 3.735 -10.532 -2.596 690 HB3 LYS 5 HB3 LYS 5 3.725 -11.339 -4.158 691 HG2 LYS 5 HG2 LYS 5 4.946 -9.489 -5.170 692 HG3 LYS 5 HG3 LYS 5 4.873 -8.578 -3.656 693 HD2 LYS 5 HD2 LYS 5 6.191 -10.373 -2.534 694 HD3 LYS 5 HD3 LYS 5 6.292 -11.242 -4.069 695 HE2 LYS 5 HE2 LYS 5 7.555 -9.361 -5.043 696 HE3 LYS 5 HE3 LYS 5 7.440 -8.486 -3.513 697 HZ1 LYS 5 HZ1 LYS 5 8.797 -11.090 -3.930 698 HZ2 LYS 5 HZ2 LYS 5 8.678 -10.271 -2.459 699 HZ3 LYS 5 HZ3 LYS 5 9.551 -9.591 -3.736 700 H GLU 6 H GLU 6 1.320 -11.333 -5.720 701 HA GLU 6 HA GLU 6 2.446 -10.392 -8.116 702 HB2 GLU 6 HB2 GLU 6 1.599 -12.684 -7.837 703 HB3 GLU 6 HB3 GLU 6 -0.049 -12.082 -7.689 704 HG2 GLU 6 HG2 GLU 6 0.031 -11.269 -10.016 705 HG3 GLU 6 HG3 GLU 6 1.694 -11.839 -10.160 706 H LYS 7 H LYS 7 -0.903 -10.003 -6.848 707 HA LYS 7 HA LYS 7 -1.819 -8.357 -8.967 708 HB2 LYS 7 HB2 LYS 7 -3.760 -7.834 -7.461 709 HB3 LYS 7 HB3 LYS 7 -3.441 -9.544 -7.670 710 HG2 LYS 7 HG2 LYS 7 -3.911 -9.450 -5.396 711 HG3 LYS 7 HG3 LYS 7 -2.154 -9.341 -5.389 712 HD2 LYS 7 HD2 LYS 7 -2.824 -7.705 -3.830 713 HD3 LYS 7 HD3 LYS 7 -2.493 -6.767 -5.281 714 HE2 LYS 7 HE2 LYS 7 -5.244 -7.606 -4.293 715 HE3 LYS 7 HE3 LYS 7 -4.541 -5.998 -4.140 716 HZ1 LYS 7 HZ1 LYS 7 -5.261 -7.370 -6.670 717 HZ2 LYS 7 HZ2 LYS 7 -4.520 -5.855 -6.570 718 HZ3 LYS 7 HZ3 LYS 7 -6.081 -6.073 -5.959 719 H ALA 8 H ALA 8 -0.137 -7.523 -5.958 720 HA ALA 8 HA ALA 8 -0.476 -4.704 -6.035 721 HB1 ALA 8 HB1 ALA 8 1.485 -4.608 -4.548 722 HB2 ALA 8 HB2 ALA 8 1.870 -6.292 -4.929 723 HB3 ALA 8 HB3 ALA 8 0.385 -5.899 -4.058 724 H GLY 9 H GLY 9 2.152 -6.751 -7.347 725 HA2 GLY 9 HA2 GLY 9 3.701 -4.601 -8.458 726 HA3 GLY 9 HA3 GLY 9 3.961 -6.315 -8.701 727 H ALA 10 H ALA 10 1.387 -6.892 -9.849 728 HA ALA 10 HA ALA 10 1.915 -6.373 -12.589 729 HB1 ALA 10 HB1 ALA 10 -0.622 -7.466 -11.327 730 HB2 ALA 10 HB2 ALA 10 0.781 -8.418 -11.818 731 HB3 ALA 10 HB3 ALA 10 -0.178 -7.577 -13.036 732 H LEU 11 H LEU 11 -0.702 -5.133 -10.448 733 HA LEU 11 HA LEU 11 -2.005 -3.492 -12.360 734 HB2 LEU 11 HB2 LEU 11 -1.928 -3.220 -9.332 735 HB3 LEU 11 HB3 LEU 11 -3.068 -2.388 -10.383 736 HG LEU 11 HG LEU 11 -2.895 -5.415 -10.066 737 HD11 LEU 11 HD11 LEU 11 -4.904 -3.498 -8.862 738 HD12 LEU 11 HD12 LEU 11 -3.665 -4.416 -7.997 739 HD13 LEU 11 HD13 LEU 11 -4.985 -5.263 -8.800 740 HD21 LEU 11 HD21 LEU 11 -4.957 -3.735 -11.525 741 HD22 LEU 11 HD22 LEU 11 -5.030 -5.484 -11.284 742 HD23 LEU 11 HD23 LEU 11 -3.746 -4.786 -12.267 743 H ALA 12 H ALA 12 0.850 -2.944 -10.427 744 HA ALA 12 HA ALA 12 1.183 -0.175 -10.495 745 HB1 ALA 12 HB1 ALA 12 2.639 -1.712 -9.237 746 HB2 ALA 12 HB2 ALA 12 3.590 -0.627 -10.256 747 HB3 ALA 12 HB3 ALA 12 3.332 -2.307 -10.746 748 H GLY 13 H GLY 13 1.899 -2.578 -13.022 749 HA2 GLY 13 HA2 GLY 13 3.177 -0.984 -14.947 750 HA3 GLY 13 HA3 GLY 13 2.225 -2.415 -15.289 751 H GLN 14 H GLN 14 -0.310 -1.711 -14.633 752 HA GLN 14 HA GLN 14 -1.233 -0.165 -16.828 753 HB2 GLN 14 HB2 GLN 14 -2.733 -1.020 -14.313 754 HB3 GLN 14 HB3 GLN 14 -3.487 -0.409 -15.787 755 HG2 GLN 14 HG2 GLN 14 -2.623 -2.362 -17.033 756 HG3 GLN 14 HG3 GLN 14 -1.885 -2.979 -15.554 757 HE21 GLN 14 HE21 GLN 14 -3.251 -3.832 -13.933 758 HE22 GLN 14 HE22 GLN 14 -4.894 -4.252 -14.254 759 H ILE 15 H ILE 15 -0.966 0.587 -13.358 760 HA ILE 15 HA ILE 15 -2.150 3.162 -13.396 761 HB ILE 15 HB ILE 15 -0.194 1.911 -11.419 762 HG12 ILE 15 HG12 ILE 15 -3.228 2.270 -11.306 763 HG13 ILE 15 HG13 ILE 15 -2.394 0.757 -11.635 764 HG21 ILE 15 HG21 ILE 15 -1.796 4.471 -11.041 765 HG22 ILE 15 HG22 ILE 15 -0.045 4.363 -11.201 766 HG23 ILE 15 HG23 ILE 15 -0.844 3.663 -9.795 767 HD11 ILE 15 HD11 ILE 15 -3.210 0.801 -9.376 768 HD12 ILE 15 HD12 ILE 15 -2.347 2.302 -9.045 769 HD13 ILE 15 HD13 ILE 15 -1.447 0.816 -9.363 770 H TRP 16 H TRP 16 1.247 2.133 -13.734 771 HA TRP 16 HA TRP 16 2.499 4.630 -13.951 772 HB2 TRP 16 HB2 TRP 16 3.731 2.458 -13.800 773 HB3 TRP 16 HB3 TRP 16 3.235 2.065 -15.445 774 HD1 TRP 16 HD1 TRP 16 5.554 4.424 -13.501 775 HE1 TRP 16 HE1 TRP 16 7.318 5.382 -15.106 776 HE3 TRP 16 HE3 TRP 16 3.732 2.579 -17.902 777 HZ2 TRP 16 HZ2 TRP 16 7.879 5.358 -17.874 778 HZ3 TRP 16 HZ3 TRP 16 4.930 3.095 -19.989 779 HH2 TRP 16 HH2 TRP 16 6.958 4.461 -19.976 780 H GLU 17 H GLU 17 1.089 2.584 -16.522 781 HA GLU 17 HA GLU 17 1.624 4.240 -18.751 782 HB2 GLU 17 HB2 GLU 17 -0.564 2.159 -18.343 783 HB3 GLU 17 HB3 GLU 17 -0.194 2.908 -19.898 784 HG2 GLU 17 HG2 GLU 17 2.063 1.955 -19.844 785 HG3 GLU 17 HG3 GLU 17 1.738 1.234 -18.266 786 H ALA 18 H ALA 18 -1.090 4.252 -16.481 787 HA ALA 18 HA ALA 18 -2.844 6.009 -17.856 788 HB1 ALA 18 HB1 ALA 18 -3.562 4.615 -15.953 789 HB2 ALA 18 HB2 ALA 18 -3.936 6.315 -15.662 790 HB3 ALA 18 HB3 ALA 18 -2.552 5.564 -14.860 791 H LEU 19 H LEU 19 -0.098 6.620 -15.679 792 HA LEU 19 HA LEU 19 -0.450 9.546 -15.820 793 HB2 LEU 19 HB2 LEU 19 1.363 7.779 -14.141 794 HB3 LEU 19 HB3 LEU 19 1.550 9.523 -14.196 795 HG LEU 19 HG LEU 19 -0.788 9.768 -13.286 796 HD11 LEU 19 HD11 LEU 19 -1.746 7.630 -13.989 797 HD12 LEU 19 HD12 LEU 19 -1.909 7.863 -12.255 798 HD13 LEU 19 HD13 LEU 19 -0.676 6.770 -12.878 799 HD21 LEU 19 HD21 LEU 19 -0.225 9.154 -10.969 800 HD22 LEU 19 HD22 LEU 19 1.129 9.929 -11.784 801 HD23 LEU 19 HD23 LEU 19 1.129 8.179 -11.549 802 H ASN 20 H ASN 20 1.316 7.127 -17.481 803 HA ASN 20 HA ASN 20 3.719 8.405 -18.141 804 HB2 ASN 20 HB2 ASN 20 3.235 6.012 -18.623 805 HB3 ASN 20 HB3 ASN 20 2.125 6.496 -19.903 806 HD21 ASN 20 HD21 ASN 20 3.341 5.418 -21.496 807 HD22 ASN 20 HD22 ASN 20 4.878 5.990 -22.033 808 H GLY 21 H GLY 21 4.194 10.201 -19.301 809 HA2 GLY 21 HA2 GLY 21 4.060 11.945 -20.780 810 HA3 GLY 21 HA3 GLY 21 2.858 11.041 -21.684 811 H THR 22 H THR 22 2.293 11.713 -18.308 812 HA THR 22 HA THR 22 0.225 13.737 -18.992 813 HB THR 22 HB THR 22 0.053 11.610 -16.789 814 HG1 THR 22 HG1 THR 22 -0.253 10.477 -18.624 815 HG21 THR 22 HG21 THR 22 -2.110 13.476 -17.867 816 HG22 THR 22 HG22 THR 22 -1.313 13.647 -16.300 817 HG23 THR 22 HG23 THR 22 -2.327 12.240 -16.626 818 H GLU 23 H GLU 23 -0.081 15.445 -17.601 819 HA GLU 23 HA GLU 23 2.022 16.498 -16.037 820 HB2 GLU 23 HB2 GLU 23 0.360 18.287 -15.504 821 HB3 GLU 23 HB3 GLU 23 0.388 17.883 -17.220 822 HG2 GLU 23 HG2 GLU 23 -1.624 16.378 -16.788 823 HG3 GLU 23 HG3 GLU 23 -1.704 17.082 -15.177 824 H GLY 24 H GLY 24 -0.450 14.259 -15.154 825 HA2 GLY 24 HA2 GLY 24 0.083 13.109 -12.977 826 HA3 GLY 24 HA3 GLY 24 -0.047 14.700 -12.245 827 H LEU 25 H LEU 25 -1.601 12.290 -11.624 828 HA LEU 25 HA LEU 25 -4.340 13.313 -12.083 829 HB2 LEU 25 HB2 LEU 25 -3.477 10.404 -12.408 830 HB3 LEU 25 HB3 LEU 25 -5.140 10.965 -12.431 831 HG LEU 25 HG LEU 25 -3.026 11.656 -14.517 832 HD11 LEU 25 HD11 LEU 25 -3.640 9.297 -14.636 833 HD12 LEU 25 HD12 LEU 25 -4.275 10.170 -16.028 834 HD13 LEU 25 HD13 LEU 25 -5.356 9.716 -14.704 835 HD21 LEU 25 HD21 LEU 25 -5.999 12.288 -14.503 836 HD22 LEU 25 HD22 LEU 25 -4.884 12.597 -15.839 837 HD23 LEU 25 HD23 LEU 25 -4.685 13.449 -14.309 838 H THR 26 H THR 26 -5.883 12.603 -10.445 839 HA THR 26 HA THR 26 -4.753 11.687 -7.863 840 HB THR 26 HB THR 26 -6.915 12.313 -6.861 841 HG1 THR 26 HG1 THR 26 -8.617 13.042 -8.092 842 HG21 THR 26 HG21 THR 26 -5.241 14.126 -7.125 843 HG22 THR 26 HG22 THR 26 -6.891 14.745 -7.245 844 HG23 THR 26 HG23 THR 26 -5.926 14.523 -8.706 845 H GLN 27 H GLN 27 -6.330 10.132 -6.592 846 HA GLN 27 HA GLN 27 -6.129 7.645 -7.852 847 HB2 GLN 27 HB2 GLN 27 -7.210 6.651 -5.931 848 HB3 GLN 27 HB3 GLN 27 -6.140 7.933 -5.394 849 HG2 GLN 27 HG2 GLN 27 -8.065 9.411 -5.009 850 HG3 GLN 27 HG3 GLN 27 -9.160 8.167 -5.609 851 HE21 GLN 27 HE21 GLN 27 -9.529 6.320 -4.310 852 HE22 GLN 27 HE22 GLN 27 -9.132 6.291 -2.634 853 H LYS 28 H LYS 28 -8.953 9.760 -7.673 854 HA LYS 28 HA LYS 28 -10.965 8.044 -8.649 855 HB2 LYS 28 HB2 LYS 28 -11.452 10.230 -7.660 856 HB3 LYS 28 HB3 LYS 28 -10.608 11.051 -8.969 857 HG2 LYS 28 HG2 LYS 28 -12.318 10.312 -10.570 858 HG3 LYS 28 HG3 LYS 28 -13.154 9.416 -9.297 859 HD2 LYS 28 HD2 LYS 28 -12.754 12.436 -9.372 860 HD3 LYS 28 HD3 LYS 28 -14.247 11.590 -9.791 861 HE2 LYS 28 HE2 LYS 28 -14.393 10.729 -7.461 862 HE3 LYS 28 HE3 LYS 28 -12.913 11.603 -7.058 863 HZ1 LYS 28 HZ1 LYS 28 -14.828 12.828 -6.355 864 HZ2 LYS 28 HZ2 LYS 28 -15.483 12.804 -7.914 865 HZ3 LYS 28 HZ3 LYS 28 -14.065 13.670 -7.609 866 H GLN 29 H GLN 29 -8.774 10.223 -10.415 867 HA GLN 29 HA GLN 29 -9.796 9.693 -13.036 868 HB2 GLN 29 HB2 GLN 29 -7.158 10.935 -12.141 869 HB3 GLN 29 HB3 GLN 29 -7.777 10.975 -13.794 870 HG2 GLN 29 HG2 GLN 29 -9.642 12.353 -13.147 871 HG3 GLN 29 HG3 GLN 29 -9.279 12.153 -11.435 872 HE21 GLN 29 HE21 GLN 29 -9.542 14.601 -13.052 873 HE22 GLN 29 HE22 GLN 29 -8.065 15.463 -12.829 874 H ILE 30 H ILE 30 -7.130 8.365 -11.136 875 HA ILE 30 HA ILE 30 -5.883 6.909 -13.272 876 HB ILE 30 HB ILE 30 -5.553 6.483 -10.266 877 HG12 ILE 30 HG12 ILE 30 -3.881 8.247 -12.116 878 HG13 ILE 30 HG13 ILE 30 -5.124 8.861 -11.040 879 HG21 ILE 30 HG21 ILE 30 -3.352 5.512 -10.875 880 HG22 ILE 30 HG22 ILE 30 -3.725 5.718 -12.587 881 HG23 ILE 30 HG23 ILE 30 -4.677 4.601 -11.604 882 HD11 ILE 30 HD11 ILE 30 -2.914 9.205 -10.134 883 HD12 ILE 30 HD12 ILE 30 -2.589 7.473 -10.191 884 HD13 ILE 30 HD13 ILE 30 -3.835 8.104 -9.111 885 H LYS 31 H LYS 31 -8.037 5.925 -10.553 886 HA LYS 31 HA LYS 31 -8.073 3.147 -11.108 887 HB2 LYS 31 HB2 LYS 31 -9.972 2.982 -9.614 888 HB3 LYS 31 HB3 LYS 31 -8.865 4.176 -8.951 889 HG2 LYS 31 HG2 LYS 31 -10.308 5.995 -9.808 890 HG3 LYS 31 HG3 LYS 31 -11.421 4.802 -10.480 891 HD2 LYS 31 HD2 LYS 31 -10.772 5.156 -7.523 892 HD3 LYS 31 HD3 LYS 31 -12.223 5.754 -8.330 893 HE2 LYS 31 HE2 LYS 31 -12.849 3.397 -8.873 894 HE3 LYS 31 HE3 LYS 31 -11.427 2.841 -7.988 895 HZ1 LYS 31 HZ1 LYS 31 -13.371 2.702 -6.625 896 HZ2 LYS 31 HZ2 LYS 31 -13.724 4.335 -6.862 897 HZ3 LYS 31 HZ3 LYS 31 -12.339 3.885 -5.998 898 H LYS 32 H LYS 32 -10.022 5.814 -12.394 899 HA LYS 32 HA LYS 32 -11.891 4.234 -13.872 900 HB2 LYS 32 HB2 LYS 32 -12.334 6.582 -13.196 901 HB3 LYS 32 HB3 LYS 32 -11.032 7.139 -14.238 902 HG2 LYS 32 HG2 LYS 32 -13.233 7.533 -15.252 903 HG3 LYS 32 HG3 LYS 32 -12.266 6.419 -16.225 904 HD2 LYS 32 HD2 LYS 32 -13.529 4.498 -15.217 905 HD3 LYS 32 HD3 LYS 32 -14.527 5.651 -14.323 906 HE2 LYS 32 HE2 LYS 32 -15.652 4.826 -16.370 907 HE3 LYS 32 HE3 LYS 32 -15.389 6.570 -16.426 908 HZ1 LYS 32 HZ1 LYS 32 -13.495 6.228 -17.858 909 HZ2 LYS 32 HZ2 LYS 32 -14.845 5.466 -18.529 910 HZ3 LYS 32 HZ3 LYS 32 -13.656 4.550 -17.754 911 H ALA 33 H ALA 33 -8.766 5.750 -14.660 912 HA ALA 33 HA ALA 33 -8.716 5.169 -17.457 913 HB1 ALA 33 HB1 ALA 33 -7.321 6.919 -16.419 914 HB2 ALA 33 HB2 ALA 33 -6.336 5.777 -17.334 915 HB3 ALA 33 HB3 ALA 33 -6.390 5.684 -15.569 916 H THR 34 H THR 34 -7.654 3.375 -14.613 917 HA THR 34 HA THR 34 -6.349 1.243 -16.163 918 HB THR 34 HB THR 34 -5.668 0.352 -13.928 919 HG1 THR 34 HG1 THR 34 -6.467 2.586 -12.522 920 HG21 THR 34 HG21 THR 34 -5.109 3.333 -14.226 921 HG22 THR 34 HG22 THR 34 -4.204 2.035 -15.016 922 HG23 THR 34 HG23 THR 34 -4.171 2.192 -13.259 923 H LYS 35 H LYS 35 -9.427 1.915 -14.942 924 HA LYS 35 HA LYS 35 -11.402 0.826 -14.881 925 HB2 LYS 35 HB2 LYS 35 -9.946 -1.608 -15.992 926 HB3 LYS 35 HB3 LYS 35 -11.697 -1.420 -15.889 927 HG2 LYS 35 HG2 LYS 35 -11.606 0.452 -17.495 928 HG3 LYS 35 HG3 LYS 35 -9.845 0.315 -17.563 929 HD2 LYS 35 HD2 LYS 35 -10.160 -2.059 -18.421 930 HD3 LYS 35 HD3 LYS 35 -11.892 -1.720 -18.527 931 HE2 LYS 35 HE2 LYS 35 -9.700 -0.234 -20.028 932 HE3 LYS 35 HE3 LYS 35 -10.783 -1.444 -20.712 933 HZ1 LYS 35 HZ1 LYS 35 -11.505 0.803 -21.224 934 HZ2 LYS 35 HZ2 LYS 35 -11.617 1.168 -19.579 935 HZ3 LYS 35 HZ3 LYS 35 -12.648 0.017 -20.258 936 H LEU 36 H LEU 36 -9.265 0.670 -12.730 937 HA LEU 36 HA LEU 36 -9.915 -1.654 -11.128 938 HB2 LEU 36 HB2 LEU 36 -8.446 0.924 -10.434 939 HB3 LEU 36 HB3 LEU 36 -8.662 -0.407 -9.304 940 HG LEU 36 HG LEU 36 -7.098 -0.527 -11.917 941 HD11 LEU 36 HD11 LEU 36 -5.106 -0.766 -10.509 942 HD12 LEU 36 HD12 LEU 36 -6.088 -0.571 -9.054 943 HD13 LEU 36 HD13 LEU 36 -5.928 0.764 -10.201 944 HD21 LEU 36 HD21 LEU 36 -6.407 -2.792 -11.207 945 HD22 LEU 36 HD22 LEU 36 -8.142 -2.687 -11.483 946 HD23 LEU 36 HD23 LEU 36 -7.515 -2.700 -9.834 947 H LYS 37 H LYS 37 -11.920 -1.845 -10.369 948 HA LYS 37 HA LYS 37 -13.752 0.241 -9.738 949 HB2 LYS 37 HB2 LYS 37 -14.495 -2.019 -10.354 950 HB3 LYS 37 HB3 LYS 37 -13.704 -2.697 -8.935 951 HG2 LYS 37 HG2 LYS 37 -15.304 -1.376 -7.493 952 HG3 LYS 37 HG3 LYS 37 -16.130 -0.865 -8.967 953 HD2 LYS 37 HD2 LYS 37 -17.309 -2.750 -7.938 954 HD3 LYS 37 HD3 LYS 37 -16.645 -3.224 -9.503 955 HE2 LYS 37 HE2 LYS 37 -14.743 -4.324 -8.338 956 HE3 LYS 37 HE3 LYS 37 -15.442 -3.876 -6.781 957 HZ1 LYS 37 HZ1 LYS 37 -17.388 -5.207 -7.349 958 HZ2 LYS 37 HZ2 LYS 37 -15.977 -6.132 -7.342 959 HZ3 LYS 37 HZ3 LYS 37 -16.669 -5.662 -8.810 960 H ALA 38 H ALA 38 -11.664 -1.839 -7.728 961 HA ALA 38 HA ALA 38 -12.417 -0.445 -5.257 962 HB1 ALA 38 HB1 ALA 38 -11.125 -2.201 -4.115 963 HB2 ALA 38 HB2 ALA 38 -10.601 -2.846 -5.676 964 HB3 ALA 38 HB3 ALA 38 -12.306 -2.901 -5.224 965 H ASP 39 H ASP 39 -11.177 1.031 -4.270 966 HA ASP 39 HA ASP 39 -8.880 2.223 -5.460 967 HB2 ASP 39 HB2 ASP 39 -9.976 2.578 -2.640 968 HB3 ASP 39 HB3 ASP 39 -8.851 3.665 -3.461 969 H LYS 40 H LYS 40 -9.250 -0.316 -3.113 970 HA LYS 40 HA LYS 40 -6.726 -0.251 -1.829 971 HB2 LYS 40 HB2 LYS 40 -8.452 -2.706 -2.367 972 HB3 LYS 40 HB3 LYS 40 -7.246 -2.527 -1.089 973 HG2 LYS 40 HG2 LYS 40 -9.808 -0.919 -1.335 974 HG3 LYS 40 HG3 LYS 40 -9.565 -2.290 -0.250 975 HD2 LYS 40 HD2 LYS 40 -8.003 -1.075 1.105 976 HD3 LYS 40 HD3 LYS 40 -7.805 0.189 -0.115 977 HE2 LYS 40 HE2 LYS 40 -9.184 0.923 1.814 978 HE3 LYS 40 HE3 LYS 40 -10.063 0.995 0.288 979 HZ1 LYS 40 HZ1 LYS 40 -11.124 -1.115 0.866 980 HZ2 LYS 40 HZ2 LYS 40 -11.430 0.071 2.030 981 HZ3 LYS 40 HZ3 LYS 40 -10.296 -1.139 2.337 982 H ASP 41 H ASP 41 -7.776 -1.736 -4.846 983 HA ASP 41 HA ASP 41 -5.407 -3.150 -5.536 984 HB2 ASP 41 HB2 ASP 41 -7.687 -1.983 -7.187 985 HB3 ASP 41 HB3 ASP 41 -6.388 -2.940 -7.903 986 H PHE 42 H PHE 42 -6.524 0.165 -6.098 987 HA PHE 42 HA PHE 42 -4.335 1.093 -7.648 988 HB2 PHE 42 HB2 PHE 42 -6.326 2.420 -7.709 989 HB3 PHE 42 HB3 PHE 42 -6.409 2.538 -5.954 990 HD1 PHE 42 HD2 PHE 42 -4.331 3.579 -8.892 991 HD2 PHE 42 HD1 PHE 42 -5.426 4.405 -4.840 992 HE1 PHE 42 HE2 PHE 42 -3.055 5.668 -8.959 993 HE2 PHE 42 HE1 PHE 42 -4.128 6.490 -4.921 994 HZ PHE 42 HZ PHE 42 -2.945 7.122 -6.983 995 H PHE 43 H PHE 43 -4.905 1.162 -4.082 996 HA PHE 43 HA PHE 43 -2.688 2.791 -3.414 997 HB2 PHE 43 HB2 PHE 43 -4.153 0.752 -1.684 998 HB3 PHE 43 HB3 PHE 43 -3.002 1.936 -1.069 999 HD1 PHE 43 HD1 PHE 43 -3.769 4.388 -2.573 1000 HD2 PHE 43 HD2 PHE 43 -6.230 1.408 -0.731 1001 HE1 PHE 43 HE1 PHE 43 -5.563 6.041 -2.289 1002 HE2 PHE 43 HE2 PHE 43 -8.022 3.065 -0.457 1003 HZ PHE 43 HZ PHE 43 -7.695 5.386 -1.232 1004 H LEU 44 H LEU 44 -2.951 -0.745 -3.692 1005 HA LEU 44 HA LEU 44 -0.260 -1.310 -2.832 1006 HB2 LEU 44 HB2 LEU 44 -2.469 -2.929 -4.097 1007 HB3 LEU 44 HB3 LEU 44 -0.845 -3.591 -4.099 1008 HG LEU 44 HG LEU 44 -0.780 -3.464 -1.614 1009 HD11 LEU 44 HD11 LEU 44 -3.675 -2.583 -1.749 1010 HD12 LEU 44 HD12 LEU 44 -2.310 -1.603 -1.215 1011 HD13 LEU 44 HD13 LEU 44 -2.784 -3.022 -0.288 1012 HD21 LEU 44 HD21 LEU 44 -2.290 -5.332 -1.153 1013 HD22 LEU 44 HD22 LEU 44 -1.472 -5.551 -2.698 1014 HD23 LEU 44 HD23 LEU 44 -3.158 -5.028 -2.662 1015 H GLY 45 H GLY 45 -1.785 -0.787 -6.013 1016 HA2 GLY 45 HA2 GLY 45 0.448 -1.457 -7.662 1017 HA3 GLY 45 HA3 GLY 45 -0.911 -0.445 -8.119 1018 H LEU 46 H LEU 46 -0.810 1.778 -6.790 1019 HA LEU 46 HA LEU 46 1.337 3.392 -7.545 1020 HB2 LEU 46 HB2 LEU 46 -0.881 4.281 -6.917 1021 HB3 LEU 46 HB3 LEU 46 -0.634 3.772 -5.256 1022 HG LEU 46 HG LEU 46 1.337 5.392 -5.144 1023 HD11 LEU 46 HD11 LEU 46 0.239 6.404 -7.777 1024 HD12 LEU 46 HD12 LEU 46 1.799 5.617 -7.519 1025 HD13 LEU 46 HD13 LEU 46 1.480 7.193 -6.797 1026 HD21 LEU 46 HD21 LEU 46 -1.366 6.667 -5.665 1027 HD22 LEU 46 HD22 LEU 46 -0.027 7.378 -4.762 1028 HD23 LEU 46 HD23 LEU 46 -0.844 5.945 -4.141 1029 H GLY 47 H GLY 47 0.825 1.552 -4.582 1030 HA2 GLY 47 HA2 GLY 47 2.941 2.519 -2.973 1031 HA3 GLY 47 HA3 GLY 47 2.201 0.927 -2.848 1032 H TRP 48 H TRP 48 2.833 0.106 -5.532 1033 HA TRP 48 HA TRP 48 5.559 -0.767 -5.251 1034 HB2 TRP 48 HB2 TRP 48 3.545 -2.053 -6.323 1035 HB3 TRP 48 HB3 TRP 48 3.895 -1.112 -7.769 1036 HD1 TRP 48 HD1 TRP 48 6.236 -1.683 -9.059 1037 HE1 TRP 48 HE1 TRP 48 7.796 -3.730 -8.926 1038 HE3 TRP 48 HE3 TRP 48 4.410 -3.837 -4.787 1039 HZ2 TRP 48 HZ2 TRP 48 8.199 -5.958 -7.239 1040 HZ3 TRP 48 HZ3 TRP 48 5.429 -5.930 -3.978 1041 HH2 TRP 48 HH2 TRP 48 7.283 -6.972 -5.188 1042 H LEU 49 H LEU 49 3.897 1.722 -7.175 1043 HA LEU 49 HA LEU 49 6.141 2.591 -8.699 1044 HB2 LEU 49 HB2 LEU 49 3.563 3.914 -7.825 1045 HB3 LEU 49 HB3 LEU 49 4.803 4.892 -8.582 1046 HG LEU 49 HG LEU 49 4.618 3.683 -10.671 1047 HD11 LEU 49 HD11 LEU 49 2.685 1.807 -9.317 1048 HD12 LEU 49 HD12 LEU 49 4.336 1.427 -9.824 1049 HD13 LEU 49 HD13 LEU 49 3.117 1.818 -11.034 1050 HD21 LEU 49 HD21 LEU 49 2.934 5.433 -10.312 1051 HD22 LEU 49 HD22 LEU 49 1.839 4.252 -9.587 1052 HD23 LEU 49 HD23 LEU 49 2.279 4.126 -11.297 1053 H LEU 50 H LEU 50 5.152 3.194 -5.379 1054 HA LEU 50 HA LEU 50 6.982 5.331 -4.812 1055 HB2 LEU 50 HB2 LEU 50 5.321 3.509 -3.046 1056 HB3 LEU 50 HB3 LEU 50 6.357 4.761 -2.383 1057 HG LEU 50 HG LEU 50 4.032 5.292 -4.283 1058 HD11 LEU 50 HD11 LEU 50 4.133 5.648 -1.263 1059 HD12 LEU 50 HD12 LEU 50 3.185 4.446 -2.145 1060 HD13 LEU 50 HD13 LEU 50 2.817 6.159 -2.327 1061 HD21 LEU 50 HD21 LEU 50 5.756 7.218 -2.680 1062 HD22 LEU 50 HD22 LEU 50 4.352 7.655 -3.660 1063 HD23 LEU 50 HD23 LEU 50 5.789 6.994 -4.432 1064 H ARG 51 H ARG 51 7.165 1.753 -4.308 1065 HA ARG 51 HA ARG 51 9.726 1.815 -3.002 1066 HB2 ARG 51 HB2 ARG 51 9.830 -0.613 -3.368 1067 HB3 ARG 51 HB3 ARG 51 8.275 -0.117 -2.749 1068 HG2 ARG 51 HG2 ARG 51 7.449 -1.538 -4.311 1069 HG3 ARG 51 HG3 ARG 51 7.694 -0.178 -5.396 1070 HD2 ARG 51 HD2 ARG 51 8.605 -2.042 -6.523 1071 HD3 ARG 51 HD3 ARG 51 10.008 -1.172 -5.886 1072 HE ARG 51 HE ARG 51 9.075 -3.208 -4.105 1073 HH11 ARG 51 HH11 ARG 51 11.105 -2.681 -6.859 1074 HH12 ARG 51 HH12 ARG 51 11.942 -4.176 -6.637 1075 HH21 ARG 51 HH21 ARG 51 10.132 -5.085 -3.854 1076 HH22 ARG 51 HH22 ARG 51 11.401 -5.523 -4.945 1077 H GLU 52 H GLU 52 8.773 1.885 -6.344 1078 HA GLU 52 HA GLU 52 11.514 1.606 -7.344 1079 HB2 GLU 52 HB2 GLU 52 8.889 2.251 -8.751 1080 HB3 GLU 52 HB3 GLU 52 10.427 2.000 -9.570 1081 HG2 GLU 52 HG2 GLU 52 9.013 -0.109 -7.899 1082 HG3 GLU 52 HG3 GLU 52 8.858 0.041 -9.648 1083 H ASP 53 H ASP 53 9.608 4.049 -5.989 1084 HA ASP 53 HA ASP 53 9.525 6.244 -5.858 1085 HB2 ASP 53 HB2 ASP 53 11.644 7.521 -5.681 1086 HB3 ASP 53 HB3 ASP 53 11.649 6.046 -4.741 1087 H LYS 54 H LYS 54 9.039 5.105 -8.467 1088 HA LYS 54 HA LYS 54 9.876 7.084 -10.429 1089 HB2 LYS 54 HB2 LYS 54 8.610 5.702 -12.049 1090 HB3 LYS 54 HB3 LYS 54 9.769 4.753 -11.131 1091 HG2 LYS 54 HG2 LYS 54 8.018 3.770 -9.785 1092 HG3 LYS 54 HG3 LYS 54 6.813 4.864 -10.460 1093 HD2 LYS 54 HD2 LYS 54 6.464 2.753 -11.515 1094 HD3 LYS 54 HD3 LYS 54 7.224 3.782 -12.721 1095 HE2 LYS 54 HE2 LYS 54 8.660 1.667 -11.082 1096 HE3 LYS 54 HE3 LYS 54 8.082 1.445 -12.727 1097 HZ1 LYS 54 HZ1 LYS 54 10.198 3.316 -11.829 1098 HZ2 LYS 54 HZ2 LYS 54 9.576 3.268 -13.395 1099 HZ3 LYS 54 HZ3 LYS 54 10.393 1.930 -12.774 1100 H VAL 55 H VAL 55 7.629 7.297 -8.056 1101 HA VAL 55 HA VAL 55 6.229 9.427 -9.569 1102 HB VAL 55 HB VAL 55 4.144 9.089 -8.196 1103 HG11 VAL 55 HG11 VAL 55 4.210 8.293 -10.513 1104 HG12 VAL 55 HG12 VAL 55 3.220 7.229 -9.510 1105 HG13 VAL 55 HG13 VAL 55 4.851 6.736 -9.974 1106 HG21 VAL 55 HG21 VAL 55 3.755 6.929 -7.044 1107 HG22 VAL 55 HG22 VAL 55 5.115 7.795 -6.328 1108 HG23 VAL 55 HG23 VAL 55 5.410 6.432 -7.410 1109 H VAL 56 H VAL 56 5.376 11.149 -8.214 1110 HA VAL 56 HA VAL 56 6.531 11.366 -5.512 1111 HB VAL 56 HB VAL 56 6.533 13.890 -5.823 1112 HG11 VAL 56 HG11 VAL 56 8.387 12.320 -7.652 1113 HG12 VAL 56 HG12 VAL 56 8.632 12.617 -5.929 1114 HG13 VAL 56 HG13 VAL 56 8.668 13.964 -7.069 1115 HG21 VAL 56 HG21 VAL 56 6.170 13.204 -8.774 1116 HG22 VAL 56 HG22 VAL 56 6.523 14.808 -8.124 1117 HG23 VAL 56 HG23 VAL 56 4.984 14.028 -7.755 1118 H THR 57 H THR 57 5.235 12.069 -3.867 1119 HA THR 57 HA THR 57 2.322 12.131 -4.380 1120 HB THR 57 HB THR 57 2.112 11.619 -1.918 1121 HG1 THR 57 HG1 THR 57 4.300 12.522 -1.450 1122 HG21 THR 57 HG21 THR 57 2.906 9.277 -2.019 1123 HG22 THR 57 HG22 THR 57 3.848 9.658 -3.462 1124 HG23 THR 57 HG23 THR 57 2.085 9.750 -3.510 1125 H SER 58 H SER 58 1.155 13.920 -3.971 1126 HA SER 58 HA SER 58 2.058 16.002 -2.091 1127 HB2 SER 58 HB2 SER 58 2.776 16.774 -4.370 1128 HB3 SER 58 HB3 SER 58 1.114 16.625 -4.938 1129 HG SER 58 HG SER 58 0.757 18.538 -4.148 1130 H GLU 59 H GLU 59 0.211 17.444 -1.468 1131 HA GLU 59 HA GLU 59 -2.349 15.927 -1.535 1132 HB2 GLU 59 HB2 GLU 59 -1.223 16.101 0.702 1133 HB3 GLU 59 HB3 GLU 59 -1.399 17.852 0.627 1134 HG2 GLU 59 HG2 GLU 59 -3.865 17.591 0.542 1135 HG3 GLU 59 HG3 GLU 59 -3.675 15.841 0.621 1136 H VAL 60 H VAL 60 -3.618 16.826 -2.999 1137 HA VAL 60 HA VAL 60 -3.945 19.771 -3.133 1138 HB VAL 60 HB VAL 60 -4.639 17.642 -5.221 1139 HG11 VAL 60 HG11 VAL 60 -5.036 20.663 -5.387 1140 HG12 VAL 60 HG12 VAL 60 -6.321 19.456 -5.297 1141 HG13 VAL 60 HG13 VAL 60 -5.276 19.526 -6.716 1142 HG21 VAL 60 HG21 VAL 60 -2.556 19.858 -5.261 1143 HG22 VAL 60 HG22 VAL 60 -2.898 18.749 -6.594 1144 HG23 VAL 60 HG23 VAL 60 -2.223 18.131 -5.083 1145 H GLU 61 H GLU 61 -5.529 20.387 -1.861 1146 HA GLU 61 HA GLU 61 -7.546 20.737 -0.905 1147 HB2 GLU 61 HB2 GLU 61 -8.739 18.972 -3.085 1148 HB3 GLU 61 HB3 GLU 61 -9.547 20.260 -2.194 1149 HG2 GLU 61 HG2 GLU 61 -8.038 21.916 -3.305 1150 HG3 GLU 61 HG3 GLU 61 -7.301 20.604 -4.198 1151 H GLY 62 H GLY 62 -5.986 18.562 0.148 1152 HA2 GLY 62 HA2 GLY 62 -6.308 17.027 1.875 1153 HA3 GLY 62 HA3 GLY 62 -8.014 16.928 1.483 1154 H GLU 63 H GLU 63 -7.287 16.393 -1.409 1155 HA GLU 63 HA GLU 63 -7.218 13.507 -1.219 1156 HB2 GLU 63 HB2 GLU 63 -7.413 15.343 -3.640 1157 HB3 GLU 63 HB3 GLU 63 -7.593 13.592 -3.694 1158 HG2 GLU 63 HG2 GLU 63 -9.406 15.498 -2.172 1159 HG3 GLU 63 HG3 GLU 63 -9.769 14.780 -3.738 1160 H ILE 64 H ILE 64 -5.816 12.100 -2.344 1161 HA ILE 64 HA ILE 64 -3.012 12.809 -2.358 1162 HB ILE 64 HB ILE 64 -4.361 10.215 -3.260 1163 HG12 ILE 64 HG12 ILE 64 -3.061 10.864 -0.574 1164 HG13 ILE 64 HG13 ILE 64 -4.791 10.708 -0.857 1165 HG21 ILE 64 HG21 ILE 64 -2.130 9.156 -3.012 1166 HG22 ILE 64 HG22 ILE 64 -1.422 10.728 -2.632 1167 HG23 ILE 64 HG23 ILE 64 -2.106 10.433 -4.232 1168 HD11 ILE 64 HD11 ILE 64 -4.476 8.331 -1.417 1169 HD12 ILE 64 HD12 ILE 64 -3.900 8.719 0.203 1170 HD13 ILE 64 HD13 ILE 64 -2.744 8.495 -1.108 1171 H PHE 65 H PHE 65 -2.154 13.871 -4.021 1172 HA PHE 65 HA PHE 65 -2.956 13.305 -6.821 1173 HB2 PHE 65 HB2 PHE 65 -3.306 15.666 -6.151 1174 HB3 PHE 65 HB3 PHE 65 -1.628 15.793 -5.639 1175 HD1 PHE 65 HD2 PHE 65 -3.828 15.327 -8.615 1176 HD2 PHE 65 HD1 PHE 65 0.107 16.303 -7.236 1177 HE1 PHE 65 HE2 PHE 65 -3.194 16.011 -10.886 1178 HE2 PHE 65 HE1 PHE 65 0.729 16.986 -9.514 1179 HZ PHE 65 HZ PHE 65 -0.917 16.835 -11.335 1180 H VAL 66 H VAL 66 -1.485 12.169 -7.960 1181 HA VAL 66 HA VAL 66 1.382 12.233 -7.204 1182 HB VAL 66 HB VAL 66 1.528 9.777 -7.807 1183 HG11 VAL 66 HG11 VAL 66 0.639 8.947 -5.650 1184 HG12 VAL 66 HG12 VAL 66 -0.269 10.447 -5.444 1185 HG13 VAL 66 HG13 VAL 66 1.497 10.478 -5.454 1186 HG21 VAL 66 HG21 VAL 66 -0.554 8.417 -7.812 1187 HG22 VAL 66 HG22 VAL 66 -0.535 9.573 -9.144 1188 HG23 VAL 66 HG23 VAL 66 -1.519 9.894 -7.715 1189 H LYS 67 H LYS 67 2.894 11.820 -8.874 1190 HA LYS 67 HA LYS 67 1.991 11.426 -11.626 1191 HB2 LYS 67 HB2 LYS 67 2.943 13.456 -12.569 1192 HB3 LYS 67 HB3 LYS 67 1.789 13.906 -11.319 1193 HG2 LYS 67 HG2 LYS 67 3.688 14.276 -9.746 1194 HG3 LYS 67 HG3 LYS 67 4.811 13.914 -11.062 1195 HD2 LYS 67 HD2 LYS 67 3.779 15.839 -12.353 1196 HD3 LYS 67 HD3 LYS 67 2.853 16.238 -10.898 1197 HE2 LYS 67 HE2 LYS 67 4.816 17.645 -10.973 1198 HE3 LYS 67 HE3 LYS 67 5.025 16.492 -9.658 1199 HZ1 LYS 67 HZ1 LYS 67 6.240 16.296 -12.368 1200 HZ2 LYS 67 HZ2 LYS 67 6.430 15.154 -11.134 1201 HZ3 LYS 67 HZ3 LYS 67 7.045 16.715 -10.944 1202 H LEU 68 H LEU 68 3.750 10.881 -13.078 1203 HA LEU 68 HA LEU 68 5.777 9.324 -11.872 1204 HB2 LEU 68 HB2 LEU 68 5.700 10.322 -14.744 1205 HB3 LEU 68 HB3 LEU 68 6.689 9.003 -14.136 1206 HG LEU 68 HG LEU 68 3.668 9.037 -14.498 1207 HD11 LEU 68 HD11 LEU 68 4.071 7.190 -16.041 1208 HD12 LEU 68 HD12 LEU 68 5.810 7.289 -15.746 1209 HD13 LEU 68 HD13 LEU 68 4.966 8.630 -16.528 1210 HD21 LEU 68 HD21 LEU 68 3.634 6.715 -13.640 1211 HD22 LEU 68 HD22 LEU 68 4.081 7.882 -12.400 1212 HD23 LEU 68 HD23 LEU 68 5.325 6.875 -13.148 1213 H VAL 69 H VAL 69 7.974 9.635 -11.609 1214 HA VAL 69 HA VAL 69 9.074 12.306 -11.569 1215 HB VAL 69 HB VAL 69 10.457 9.609 -11.158 1216 HG11 VAL 69 HG11 VAL 69 11.540 12.413 -10.608 1217 HG12 VAL 69 HG12 VAL 69 12.114 11.304 -11.854 1218 HG13 VAL 69 HG13 VAL 69 12.338 10.904 -10.152 1219 HG21 VAL 69 HG21 VAL 69 9.489 11.644 -9.108 1220 HG22 VAL 69 HG22 VAL 69 10.383 10.165 -8.744 1221 HG23 VAL 69 HG23 VAL 69 8.762 10.067 -9.432 1222 H LEU 70 H LEU 70 8.817 12.958 -13.707 1223 HA LEU 70 HA LEU 70 10.337 11.657 -15.866 1224 HB2 LEU 70 HB2 LEU 70 8.544 14.126 -15.915 1225 HB3 LEU 70 HB3 LEU 70 9.188 13.285 -17.319 1226 HG LEU 70 HG LEU 70 7.151 12.146 -15.354 1227 HD11 LEU 70 HD11 LEU 70 5.528 12.309 -17.179 1228 HD12 LEU 70 HD12 LEU 70 6.735 13.080 -18.213 1229 HD13 LEU 70 HD13 LEU 70 6.169 13.895 -16.752 1230 HD21 LEU 70 HD21 LEU 70 8.559 10.357 -16.244 1231 HD22 LEU 70 HD22 LEU 70 8.256 10.896 -17.897 1232 HD23 LEU 70 HD23 LEU 70 6.934 10.251 -16.920 1233 H GLU 71 H GLU 71 11.987 12.494 -13.916 1234 HA GLU 71 HA GLU 71 13.682 13.717 -13.168 1235 HB2 GLU 71 HB2 GLU 71 14.619 13.448 -15.425 1236 HB3 GLU 71 HB3 GLU 71 13.788 14.910 -15.953 1237 HG2 GLU 71 HG2 GLU 71 15.109 16.260 -14.373 1238 HG3 GLU 71 HG3 GLU 71 15.910 14.805 -13.783 1239 H HIS 72 H HIS 72 11.975 16.093 -15.259 1240 HA HIS 72 HA HIS 72 12.521 18.431 -13.921 1241 HB2 HIS 72 HB2 HIS 72 9.927 17.733 -15.366 1242 HB3 HIS 72 HB3 HIS 72 10.486 19.366 -15.017 1243 HD1 HIS 72 HD1 HIS 72 12.340 20.325 -16.520 1244 HD2 HIS 72 HD2 HIS 72 11.229 16.452 -17.514 1245 HE1 HIS 72 HE1 HIS 72 13.354 19.894 -18.772 1246 HE2 HIS 72 HE2 HIS 72 12.820 17.489 -19.266 1247 H HIS 73 H HIS 73 12.225 18.940 -11.792 1248 HA HIS 73 HA HIS 73 9.583 18.898 -10.594 1249 HB2 HIS 73 HB2 HIS 73 10.022 17.462 -8.721 1250 HB3 HIS 73 HB3 HIS 73 10.541 16.563 -10.142 1251 HD1 HIS 73 HD1 HIS 73 11.681 17.656 -6.861 1252 HD2 HIS 73 HD2 HIS 73 13.515 16.598 -10.431 1253 HE1 HIS 73 HE1 HIS 73 14.079 17.222 -6.282 1254 HE2 HIS 73 HE2 HIS 73 15.153 16.517 -8.437 1255 H HIS 74 H HIS 74 9.431 20.148 -8.663 1256 HA HIS 74 HA HIS 74 11.846 21.603 -7.733 1257 HB2 HIS 74 HB2 HIS 74 8.883 22.267 -7.436 1258 HB3 HIS 74 HB3 HIS 74 10.163 23.144 -6.604 1259 HD1 HIS 74 HD1 HIS 74 11.415 24.915 -7.918 1260 HD2 HIS 74 HD2 HIS 74 8.806 22.702 -10.277 1261 HE1 HIS 74 HE1 HIS 74 11.330 26.107 -10.121 1262 HE2 HIS 74 HE2 HIS 74 9.844 24.690 -11.571 1263 H HIS 75 H HIS 75 11.218 22.196 -5.142 1264 HA HIS 75 HA HIS 75 11.509 19.705 -3.756 1265 HB2 HIS 75 HB2 HIS 75 11.122 22.542 -2.733 1266 HB3 HIS 75 HB3 HIS 75 11.334 21.164 -1.659 1267 HD1 HIS 75 HD1 HIS 75 13.236 23.696 -3.380 1268 HD2 HIS 75 HD2 HIS 75 13.927 19.788 -2.163 1269 HE1 HIS 75 HE1 HIS 75 15.730 23.441 -3.352 1270 HE2 HIS 75 HE2 HIS 75 16.119 21.130 -2.441 1271 H HIS 76 H HIS 76 8.977 22.191 -3.027 1272 HA HIS 76 HA HIS 76 6.766 20.420 -3.386 1273 HB2 HIS 76 HB2 HIS 76 7.864 19.493 -1.247 1274 HB3 HIS 76 HB3 HIS 76 7.379 20.983 -0.453 1275 HD1 HIS 76 HD1 HIS 76 5.938 17.879 -2.039 1276 HD2 HIS 76 HD2 HIS 76 4.690 21.056 0.334 1277 HE1 HIS 76 HE1 HIS 76 3.607 17.302 -1.316 1278 HE2 HIS 76 HE2 HIS 76 2.905 19.192 0.192 1279 H HIS 77 H HIS 77 4.929 21.612 -3.634 1280 HA HIS 77 HA HIS 77 4.744 24.333 -2.449 1281 HB2 HIS 77 HB2 HIS 77 3.135 24.887 -4.289 1282 HB3 HIS 77 HB3 HIS 77 4.745 24.504 -4.879 1283 HD1 HIS 77 HD1 HIS 77 1.361 22.774 -4.501 1284 HD2 HIS 77 HD2 HIS 77 4.764 22.645 -6.881 1285 HE1 HIS 77 HE1 HIS 77 0.855 21.116 -6.308 1286 HE2 HIS 77 HE2 HIS 77 2.824 21.244 -7.858
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