NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
615013 | 5x5s | 36061 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 THR 1 H1 THR 1 213.628 -21.301 -14.799 2 H2 THR 1 H2 THR 1 212.022 -20.828 -14.426 3 H3 THR 1 H3 THR 1 213.331 -19.782 -14.064 4 HA THR 1 HA THR 1 213.742 -19.327 -16.268 5 HB THR 1 HB THR 1 213.564 -21.592 -17.116 6 HG1 THR 1 HG1 THR 1 213.224 -20.698 -18.966 7 HG21 THR 1 HG21 THR 1 211.522 -22.738 -17.516 8 HG22 THR 1 HG22 THR 1 210.572 -21.350 -16.986 9 HG23 THR 1 HG23 THR 1 211.536 -22.255 -15.820 10 HA PRO 2 HA PRO 2 210.303 -16.531 -15.863 11 HB2 PRO 2 HB2 PRO 2 210.929 -14.847 -17.881 12 HB3 PRO 2 HB3 PRO 2 211.830 -14.885 -16.361 13 HG2 PRO 2 HG2 PRO 2 212.513 -16.129 -18.998 14 HG3 PRO 2 HG3 PRO 2 213.560 -15.253 -17.865 15 HD2 PRO 2 HD2 PRO 2 213.483 -17.969 -18.012 16 HD3 PRO 2 HD3 PRO 2 213.853 -17.088 -16.518 17 H SER 3 H SER 3 211.113 -17.947 -19.004 18 HA SER 3 HA SER 3 209.871 -18.614 -20.775 19 HB2 SER 3 HB2 SER 3 207.880 -19.761 -20.330 20 HB3 SER 3 HB3 SER 3 208.728 -19.829 -18.787 21 HG SER 3 HG SER 3 206.486 -18.307 -19.527 22 H ALA 4 H ALA 4 207.624 -18.158 -21.955 23 HA ALA 4 HA ALA 4 206.892 -15.338 -21.692 24 HB1 ALA 4 HB1 ALA 4 208.795 -15.722 -23.384 25 HB2 ALA 4 HB2 ALA 4 207.411 -14.749 -23.883 26 HB3 ALA 4 HB3 ALA 4 207.543 -16.429 -24.406 27 H SER 5 H SER 5 204.807 -15.770 -21.106 28 HA SER 5 HA SER 5 203.201 -17.748 -22.402 29 HB2 SER 5 HB2 SER 5 202.761 -17.130 -20.078 30 HB3 SER 5 HB3 SER 5 202.406 -15.473 -20.566 31 HG SER 5 HG SER 5 200.904 -17.811 -20.975 32 H GLY 6 H GLY 6 202.651 -14.217 -22.197 33 HA2 GLY 6 HA2 GLY 6 202.252 -14.015 -25.051 34 HA3 GLY 6 HA3 GLY 6 200.767 -13.891 -24.121 35 H LEU 7 H LEU 7 204.036 -12.647 -23.443 36 HA LEU 7 HA LEU 7 202.870 -9.944 -23.335 37 HB2 LEU 7 HB2 LEU 7 203.811 -11.164 -21.205 38 HB3 LEU 7 HB3 LEU 7 205.361 -10.667 -21.856 39 HG LEU 7 HG LEU 7 204.070 -8.311 -21.966 40 HD11 LEU 7 HD11 LEU 7 202.160 -9.743 -20.739 41 HD12 LEU 7 HD12 LEU 7 202.411 -8.019 -20.464 42 HD13 LEU 7 HD13 LEU 7 203.076 -9.198 -19.334 43 HD21 LEU 7 HD21 LEU 7 205.789 -9.637 -19.956 44 HD22 LEU 7 HD22 LEU 7 205.029 -8.116 -19.484 45 HD23 LEU 7 HD23 LEU 7 206.068 -8.178 -20.908 46 H THR 8 H THR 8 203.667 -8.482 -24.707 47 HA THR 8 HA THR 8 206.390 -8.824 -25.742 48 HB THR 8 HB THR 8 205.659 -8.321 -28.026 49 HG1 THR 8 HG1 THR 8 203.799 -7.379 -28.192 50 HG21 THR 8 HG21 THR 8 203.758 -10.450 -27.677 51 HG22 THR 8 HG22 THR 8 205.227 -10.749 -26.749 52 HG23 THR 8 HG23 THR 8 205.325 -10.457 -28.485 53 H LYS 9 H LYS 9 203.563 -6.644 -25.917 54 HA LYS 9 HA LYS 9 205.314 -4.327 -26.017 55 HB2 LYS 9 HB2 LYS 9 203.011 -4.762 -27.259 56 HB3 LYS 9 HB3 LYS 9 202.350 -4.079 -25.781 57 HG2 LYS 9 HG2 LYS 9 203.043 -2.001 -26.272 58 HG3 LYS 9 HG3 LYS 9 204.555 -2.556 -26.993 59 HD2 LYS 9 HD2 LYS 9 203.679 -2.631 -29.068 60 HD3 LYS 9 HD3 LYS 9 202.141 -3.280 -28.500 61 HE2 LYS 9 HE2 LYS 9 201.225 -1.276 -28.767 62 HE3 LYS 9 HE3 LYS 9 202.311 -0.638 -27.535 63 HZ1 LYS 9 HZ1 LYS 9 202.932 0.680 -29.241 64 HZ2 LYS 9 HZ2 LYS 9 202.459 -0.420 -30.434 65 HZ3 LYS 9 HZ3 LYS 9 203.932 -0.628 -29.630 66 H VAL 10 H VAL 10 205.632 -2.869 -24.409 67 HA VAL 10 HA VAL 10 204.822 -3.663 -21.737 68 HB VAL 10 HB VAL 10 206.264 -1.734 -21.004 69 HG11 VAL 10 HG11 VAL 10 207.178 -3.935 -20.954 70 HG12 VAL 10 HG12 VAL 10 208.404 -2.865 -21.636 71 HG13 VAL 10 HG13 VAL 10 207.465 -3.919 -22.694 72 HG21 VAL 10 HG21 VAL 10 207.479 -1.641 -23.712 73 HG22 VAL 10 HG22 VAL 10 207.419 -0.408 -22.453 74 HG23 VAL 10 HG23 VAL 10 205.996 -0.724 -23.446 75 H ALA 11 H ALA 11 203.436 -2.593 -20.415 76 HA ALA 11 HA ALA 11 201.521 -0.842 -21.593 77 HB1 ALA 11 HB1 ALA 11 200.486 -2.064 -19.991 78 HB2 ALA 11 HB2 ALA 11 200.904 -0.667 -19.000 79 HB3 ALA 11 HB3 ALA 11 201.908 -2.118 -18.951 80 H THR 12 H THR 12 201.449 1.314 -21.658 81 HA THR 12 HA THR 12 203.561 2.817 -20.290 82 HB THR 12 HB THR 12 202.493 4.665 -21.896 83 HG1 THR 12 HG1 THR 12 201.033 3.765 -23.096 84 HG21 THR 12 HG21 THR 12 204.579 2.646 -22.336 85 HG22 THR 12 HG22 THR 12 204.647 4.404 -22.458 86 HG23 THR 12 HG23 THR 12 203.973 3.453 -23.781 87 H VAL 13 H VAL 13 203.160 4.385 -18.817 88 HA VAL 13 HA VAL 13 200.531 4.465 -17.631 89 HB VAL 13 HB VAL 13 202.961 6.092 -16.870 90 HG11 VAL 13 HG11 VAL 13 201.843 6.810 -15.052 91 HG12 VAL 13 HG12 VAL 13 200.986 5.283 -14.842 92 HG13 VAL 13 HG13 VAL 13 200.418 6.457 -16.029 93 HG21 VAL 13 HG21 VAL 13 202.267 3.750 -15.238 94 HG22 VAL 13 HG22 VAL 13 203.843 4.360 -15.742 95 HG23 VAL 13 HG23 VAL 13 202.883 3.378 -16.849 96 H SER 14 H SER 14 199.002 5.950 -17.944 97 HA SER 14 HA SER 14 197.884 7.784 -18.655 98 HB2 SER 14 HB2 SER 14 199.290 9.123 -17.255 99 HB3 SER 14 HB3 SER 14 200.626 9.036 -18.401 100 HG SER 14 HG SER 14 199.820 10.833 -19.132 101 H ALA 15 H ALA 15 200.898 8.591 -20.371 102 HA ALA 15 HA ALA 15 200.240 7.420 -22.831 103 HB1 ALA 15 HB1 ALA 15 199.783 9.828 -23.904 104 HB2 ALA 15 HB2 ALA 15 199.049 10.082 -22.320 105 HB3 ALA 15 HB3 ALA 15 198.489 8.765 -23.352 106 H ALA 16 H ALA 16 202.012 7.413 -24.082 107 HA ALA 16 HA ALA 16 203.846 9.597 -24.231 108 HB1 ALA 16 HB1 ALA 16 205.756 8.625 -23.179 109 HB2 ALA 16 HB2 ALA 16 204.896 7.114 -22.880 110 HB3 ALA 16 HB3 ALA 16 204.431 8.581 -22.018 111 H SER 17 H SER 17 203.776 9.463 -26.427 112 HA SER 17 HA SER 17 203.869 7.056 -27.913 113 HB2 SER 17 HB2 SER 17 204.749 9.735 -28.982 114 HB3 SER 17 HB3 SER 17 203.965 8.414 -29.848 115 HG SER 17 HG SER 17 202.837 10.483 -28.594 116 H SER 18 H SER 18 205.557 5.704 -27.755 117 HA SER 18 HA SER 18 208.267 6.848 -27.916 118 HB2 SER 18 HB2 SER 18 207.699 5.615 -25.800 119 HB3 SER 18 HB3 SER 18 207.509 4.152 -26.766 120 HG SER 18 HG SER 18 209.620 4.418 -25.813 121 H LEU 19 H LEU 19 208.589 6.841 -30.102 122 HA LEU 19 HA LEU 19 208.045 4.441 -31.653 123 HB2 LEU 19 HB2 LEU 19 208.842 7.243 -32.280 124 HB3 LEU 19 HB3 LEU 19 209.246 5.995 -33.441 125 HG LEU 19 HG LEU 19 206.631 5.428 -33.031 126 HD11 LEU 19 HD11 LEU 19 206.414 8.360 -33.221 127 HD12 LEU 19 HD12 LEU 19 206.792 7.714 -31.625 128 HD13 LEU 19 HD13 LEU 19 205.337 7.183 -32.468 129 HD21 LEU 19 HD21 LEU 19 208.131 7.035 -35.015 130 HD22 LEU 19 HD22 LEU 19 206.371 7.124 -35.074 131 HD23 LEU 19 HD23 LEU 19 207.181 5.564 -35.227 132 H ILE 20 H ILE 20 210.738 6.039 -30.133 133 HA ILE 20 HA ILE 20 212.501 3.889 -31.080 134 HB ILE 20 HB ILE 20 214.394 5.435 -31.216 135 HG12 ILE 20 HG12 ILE 20 213.433 7.138 -29.615 136 HG13 ILE 20 HG13 ILE 20 214.172 7.812 -31.072 137 HG21 ILE 20 HG21 ILE 20 213.663 5.162 -33.335 138 HG22 ILE 20 HG22 ILE 20 213.298 6.880 -33.181 139 HG23 ILE 20 HG23 ILE 20 212.023 5.683 -32.958 140 HD11 ILE 20 HD11 ILE 20 212.313 8.969 -31.369 141 HD12 ILE 20 HD12 ILE 20 211.495 8.101 -30.070 142 HD13 ILE 20 HD13 ILE 20 211.481 7.454 -31.712 143 H GLY 21 H GLY 21 213.856 3.022 -29.569 144 HA2 GLY 21 HA2 GLY 21 213.990 4.328 -26.935 145 HA3 GLY 21 HA3 GLY 21 213.441 2.652 -27.046 146 H GLU 22 H GLU 22 215.786 3.954 -25.744 147 HA GLU 22 HA GLU 22 218.003 2.652 -27.153 148 HB2 GLU 22 HB2 GLU 22 217.732 5.050 -25.604 149 HB3 GLU 22 HB3 GLU 22 218.932 4.008 -24.856 150 HG2 GLU 22 HG2 GLU 22 220.126 3.881 -26.952 151 HG3 GLU 22 HG3 GLU 22 218.920 4.927 -27.698 152 H GLY 23 H GLY 23 219.356 1.180 -26.133 153 HA2 GLY 23 HA2 GLY 23 218.063 -0.580 -24.292 154 HA3 GLY 23 HA3 GLY 23 219.716 -0.730 -24.896 155 H PHE 24 H PHE 24 217.768 1.238 -22.642 156 HA PHE 24 HA PHE 24 219.993 2.110 -21.112 157 HB2 PHE 24 HB2 PHE 24 217.049 2.275 -20.910 158 HB3 PHE 24 HB3 PHE 24 217.922 2.359 -19.373 159 HD1 PHE 24 HD1 PHE 24 218.098 4.525 -18.645 160 HD2 PHE 24 HD2 PHE 24 218.564 3.720 -22.799 161 HE1 PHE 24 HE1 PHE 24 218.593 6.901 -19.047 162 HE2 PHE 24 HE2 PHE 24 219.060 6.094 -23.208 163 HZ PHE 24 HZ PHE 24 219.078 7.687 -21.330 164 H MET 25 H MET 25 217.843 -0.665 -20.886 165 HA MET 25 HA MET 25 218.480 -1.522 -18.298 166 HB2 MET 25 HB2 MET 25 217.633 -3.062 -20.749 167 HB3 MET 25 HB3 MET 25 217.822 -3.810 -19.169 168 HG2 MET 25 HG2 MET 25 216.052 -2.561 -18.250 169 HG3 MET 25 HG3 MET 25 216.018 -1.457 -19.623 170 HE1 MET 25 HE1 MET 25 213.974 -3.124 -22.264 171 HE2 MET 25 HE2 MET 25 215.731 -2.975 -22.291 172 HE3 MET 25 HE3 MET 25 214.747 -1.676 -21.620 173 H ALA 26 H ALA 26 220.333 -1.656 -21.225 174 HA ALA 26 HA ALA 26 222.061 -3.797 -20.514 175 HB1 ALA 26 HB1 ALA 26 222.193 -3.461 -22.752 176 HB2 ALA 26 HB2 ALA 26 223.556 -2.453 -22.268 177 HB3 ALA 26 HB3 ALA 26 221.993 -1.714 -22.614 178 H GLN 27 H GLN 27 221.796 -0.686 -19.222 179 HA GLN 27 HA GLN 27 224.613 -0.343 -18.639 180 HB2 GLN 27 HB2 GLN 27 222.585 1.429 -18.980 181 HB3 GLN 27 HB3 GLN 27 222.629 1.329 -17.225 182 HG2 GLN 27 HG2 GLN 27 225.264 1.633 -18.436 183 HG3 GLN 27 HG3 GLN 27 224.167 2.968 -18.777 184 HE21 GLN 27 HE21 GLN 27 226.400 1.793 -16.642 185 HE22 GLN 27 HE22 GLN 27 225.972 2.733 -15.245 186 H CYS 28 H CYS 28 222.647 -2.540 -17.454 187 HA CYS 28 HA CYS 28 222.558 -3.767 -15.552 188 HB2 CYS 28 HB2 CYS 28 224.835 -2.089 -14.503 189 HB3 CYS 28 HB3 CYS 28 224.403 -3.728 -14.037 190 H ASP 29 H ASP 29 220.698 -1.842 -15.679 191 HA ASP 29 HA ASP 29 220.495 -0.923 -12.891 192 HB2 ASP 29 HB2 ASP 29 220.049 0.615 -15.422 193 HB3 ASP 29 HB3 ASP 29 219.048 0.983 -14.010 194 H ASN 30 H ASN 30 219.026 -2.341 -12.083 195 HA ASN 30 HA ASN 30 216.826 -3.301 -13.668 196 HB2 ASN 30 HB2 ASN 30 216.130 -4.493 -11.616 197 HB3 ASN 30 HB3 ASN 30 217.817 -4.790 -12.017 198 HD21 ASN 30 HD21 ASN 30 218.773 -5.149 -10.119 199 HD22 ASN 30 HD22 ASN 30 218.693 -4.093 -8.744 200 HA PRO 31 HA PRO 31 213.751 -0.282 -12.793 201 HB2 PRO 31 HB2 PRO 31 211.767 -2.376 -12.277 202 HB3 PRO 31 HB3 PRO 31 211.843 -1.168 -13.572 203 HG2 PRO 31 HG2 PRO 31 212.285 -3.793 -14.006 204 HG3 PRO 31 HG3 PRO 31 213.067 -2.508 -14.939 205 HD2 PRO 31 HD2 PRO 31 214.170 -4.191 -12.736 206 HD3 PRO 31 HD3 PRO 31 214.968 -3.593 -14.204 207 H THR 32 H THR 32 213.573 0.861 -10.977 208 HA THR 32 HA THR 32 213.226 -0.595 -8.450 209 HB THR 32 HB THR 32 213.970 1.872 -7.639 210 HG1 THR 32 HG1 THR 32 215.472 1.443 -10.004 211 HG21 THR 32 HG21 THR 32 215.780 0.838 -6.855 212 HG22 THR 32 HG22 THR 32 216.285 0.298 -8.456 213 HG23 THR 32 HG23 THR 32 215.070 -0.615 -7.560 214 H ILE 33 H ILE 33 211.106 -0.761 -8.214 215 HA ILE 33 HA ILE 33 209.371 1.597 -8.459 216 HB ILE 33 HB ILE 33 208.822 -0.675 -9.513 217 HG12 ILE 33 HG12 ILE 33 206.538 0.017 -7.764 218 HG13 ILE 33 HG13 ILE 33 207.234 1.354 -8.673 219 HG21 ILE 33 HG21 ILE 33 208.198 -1.327 -6.634 220 HG22 ILE 33 HG22 ILE 33 209.413 -2.098 -7.652 221 HG23 ILE 33 HG23 ILE 33 207.701 -2.290 -8.026 222 HD11 ILE 33 HD11 ILE 33 205.907 0.715 -10.330 223 HD12 ILE 33 HD12 ILE 33 205.566 -0.839 -9.568 224 HD13 ILE 33 HD13 ILE 33 207.016 -0.639 -10.555 225 H GLU 34 H GLU 34 207.708 1.867 -6.785 226 HA GLU 34 HA GLU 34 208.896 2.187 -4.248 227 HB2 GLU 34 HB2 GLU 34 206.487 2.581 -3.475 228 HB3 GLU 34 HB3 GLU 34 207.118 3.652 -4.716 229 HG2 GLU 34 HG2 GLU 34 205.755 2.802 -6.345 230 HG3 GLU 34 HG3 GLU 34 205.611 1.231 -5.559 231 H GLY 35 H GLY 35 209.566 0.523 -3.058 232 HA2 GLY 35 HA2 GLY 35 207.783 -1.814 -2.739 233 HA3 GLY 35 HA3 GLY 35 209.541 -1.888 -2.649 234 H ASP 36 H ASP 36 209.710 -2.718 -0.614 235 HA ASP 36 HA ASP 36 208.554 -1.116 1.574 236 HB2 ASP 36 HB2 ASP 36 208.581 -3.898 1.125 237 HB3 ASP 36 HB3 ASP 36 209.707 -3.612 2.458 238 H GLY 37 H GLY 37 210.807 -0.098 0.294 239 HA2 GLY 37 HA2 GLY 37 213.203 -0.844 1.692 240 HA3 GLY 37 HA3 GLY 37 213.008 0.532 0.617 241 HA PRO 38 HA PRO 38 213.224 1.868 5.164 242 HB2 PRO 38 HB2 PRO 38 215.522 3.318 4.973 243 HB3 PRO 38 HB3 PRO 38 215.488 1.603 5.423 244 HG2 PRO 38 HG2 PRO 38 216.083 2.860 2.772 245 HG3 PRO 38 HG3 PRO 38 216.890 1.500 3.574 246 HD2 PRO 38 HD2 PRO 38 215.086 1.156 1.587 247 HD3 PRO 38 HD3 PRO 38 215.280 -0.010 2.911 248 H ILE 39 H ILE 39 211.400 3.135 4.582 249 HA ILE 39 HA ILE 39 211.579 5.451 2.955 250 HB ILE 39 HB ILE 39 209.502 4.898 5.069 251 HG12 ILE 39 HG12 ILE 39 209.638 2.988 3.554 252 HG13 ILE 39 HG13 ILE 39 208.166 3.901 3.244 253 HG21 ILE 39 HG21 ILE 39 209.167 7.081 4.443 254 HG22 ILE 39 HG22 ILE 39 208.152 6.238 3.270 255 HG23 ILE 39 HG23 ILE 39 209.752 6.817 2.802 256 HD11 ILE 39 HD11 ILE 39 209.969 5.023 1.499 257 HD12 ILE 39 HD12 ILE 39 208.757 3.803 1.105 258 HD13 ILE 39 HD13 ILE 39 210.404 3.313 1.493 259 H GLY 40 H GLY 40 211.410 7.666 3.597 260 HA2 GLY 40 HA2 GLY 40 212.065 9.508 4.798 261 HA3 GLY 40 HA3 GLY 40 211.550 8.616 6.221 262 H LYS 41 H LYS 41 214.042 7.269 4.212 263 HA LYS 41 HA LYS 41 216.080 8.148 6.159 264 HB2 LYS 41 HB2 LYS 41 215.802 5.379 4.972 265 HB3 LYS 41 HB3 LYS 41 217.103 5.912 6.030 266 HG2 LYS 41 HG2 LYS 41 214.340 6.236 7.037 267 HG3 LYS 41 HG3 LYS 41 214.964 4.593 6.909 268 HD2 LYS 41 HD2 LYS 41 217.054 5.632 8.116 269 HD3 LYS 41 HD3 LYS 41 215.886 6.852 8.627 270 HE2 LYS 41 HE2 LYS 41 215.415 3.901 8.985 271 HE3 LYS 41 HE3 LYS 41 216.244 4.882 10.191 272 HZ1 LYS 41 HZ1 LYS 41 213.635 4.490 10.218 273 HZ2 LYS 41 HZ2 LYS 41 213.668 5.871 9.241 274 HZ3 LYS 41 HZ3 LYS 41 214.341 5.916 10.792 275 H THR 42 H THR 42 217.926 8.910 5.324 276 HA THR 42 HA THR 42 218.398 8.559 2.433 277 HB THR 42 HB THR 42 219.121 10.902 4.209 278 HG1 THR 42 HG1 THR 42 217.248 10.655 2.089 279 HG21 THR 42 HG21 THR 42 220.788 11.080 2.666 280 HG22 THR 42 HG22 THR 42 219.493 11.927 1.820 281 HG23 THR 42 HG23 THR 42 219.870 10.253 1.409 282 H LEU 43 H LEU 43 220.463 8.085 1.722 283 HA LEU 43 HA LEU 43 222.374 7.309 3.831 284 HB2 LEU 43 HB2 LEU 43 221.594 6.051 1.257 285 HB3 LEU 43 HB3 LEU 43 223.273 5.918 1.731 286 HG LEU 43 HG LEU 43 222.039 3.947 2.424 287 HD11 LEU 43 HD11 LEU 43 223.788 5.303 3.945 288 HD12 LEU 43 HD12 LEU 43 223.084 3.755 4.412 289 HD13 LEU 43 HD13 LEU 43 222.407 5.256 5.040 290 HD21 LEU 43 HD21 LEU 43 220.238 4.060 4.043 291 HD22 LEU 43 HD22 LEU 43 219.823 4.991 2.605 292 HD23 LEU 43 HD23 LEU 43 220.344 5.820 4.070 293 H TYR 44 H TYR 44 224.460 8.017 3.743 294 HA TYR 44 HA TYR 44 225.213 9.718 1.458 295 HB2 TYR 44 HB2 TYR 44 224.946 10.433 4.245 296 HB3 TYR 44 HB3 TYR 44 226.601 10.683 3.701 297 HD1 TYR 44 HD1 TYR 44 223.320 11.138 1.964 298 HD2 TYR 44 HD2 TYR 44 226.909 12.950 3.358 299 HE1 TYR 44 HE1 TYR 44 222.650 13.257 0.917 300 HE2 TYR 44 HE2 TYR 44 226.247 15.075 2.314 301 HH TYR 44 HH TYR 44 224.419 15.542 0.088 302 H VAL 45 H VAL 45 226.977 9.037 0.456 303 HA VAL 45 HA VAL 45 228.899 7.357 1.924 304 HB VAL 45 HB VAL 45 227.823 6.158 0.095 305 HG11 VAL 45 HG11 VAL 45 229.011 7.493 -2.152 306 HG12 VAL 45 HG12 VAL 45 227.985 8.611 -1.252 307 HG13 VAL 45 HG13 VAL 45 227.318 7.093 -1.854 308 HG21 VAL 45 HG21 VAL 45 230.099 5.549 0.586 309 HG22 VAL 45 HG22 VAL 45 230.709 6.847 -0.445 310 HG23 VAL 45 HG23 VAL 45 229.850 5.482 -1.159 311 H VAL 46 H VAL 46 231.023 7.912 1.977 312 HA VAL 46 HA VAL 46 231.872 10.233 0.378 313 HB VAL 46 HB VAL 46 233.232 11.031 2.267 314 HG11 VAL 46 HG11 VAL 46 230.880 11.818 1.839 315 HG12 VAL 46 HG12 VAL 46 231.468 12.057 3.483 316 HG13 VAL 46 HG13 VAL 46 230.362 10.731 3.128 317 HG21 VAL 46 HG21 VAL 46 232.181 8.569 3.536 318 HG22 VAL 46 HG22 VAL 46 232.315 9.999 4.558 319 HG23 VAL 46 HG23 VAL 46 233.739 9.369 3.730 320 H GLY 47 H GLY 47 233.542 9.771 -0.897 321 HA2 GLY 47 HA2 GLY 47 235.170 7.401 -0.316 322 HA3 GLY 47 HA3 GLY 47 235.087 8.257 -1.861 323 H ASP 48 H ASP 48 237.368 7.425 -0.033 324 HA ASP 48 HA ASP 48 238.832 9.922 -0.270 325 HB2 ASP 48 HB2 ASP 48 237.744 9.662 2.099 326 HB3 ASP 48 HB3 ASP 48 239.047 8.492 2.360 327 H PHE 49 H PHE 49 240.609 9.432 -1.315 328 HA PHE 49 HA PHE 49 242.530 7.591 -0.432 329 HB2 PHE 49 HB2 PHE 49 240.565 6.188 -1.629 330 HB3 PHE 49 HB3 PHE 49 241.539 6.592 -3.047 331 HD1 PHE 49 HD1 PHE 49 241.143 4.393 -0.286 332 HD2 PHE 49 HD2 PHE 49 244.049 6.015 -2.940 333 HE1 PHE 49 HE1 PHE 49 242.657 2.527 0.238 334 HE2 PHE 49 HE2 PHE 49 245.567 4.149 -2.420 335 HZ PHE 49 HZ PHE 49 244.871 2.402 -0.832 336 H ALA 50 H ALA 50 241.423 8.433 -3.717 337 HA ALA 50 HA ALA 50 244.024 9.737 -4.154 338 HB1 ALA 50 HB1 ALA 50 242.348 9.098 -6.493 339 HB2 ALA 50 HB2 ALA 50 242.980 7.718 -5.596 340 HB3 ALA 50 HB3 ALA 50 244.087 8.921 -6.256 341 H ASP 51 H ASP 51 240.556 10.211 -4.253 342 HA ASP 51 HA ASP 51 240.990 12.940 -5.249 343 HB2 ASP 51 HB2 ASP 51 238.487 12.898 -5.727 344 HB3 ASP 51 HB3 ASP 51 239.503 11.862 -6.736 345 H ALA 52 H ALA 52 238.487 11.408 -3.168 346 HA ALA 52 HA ALA 52 237.830 11.895 -1.029 347 HB1 ALA 52 HB1 ALA 52 240.307 12.556 -0.702 348 HB2 ALA 52 HB2 ALA 52 239.107 13.197 0.419 349 HB3 ALA 52 HB3 ALA 52 239.727 14.213 -0.881 350 H SER 53 H SER 53 236.825 12.923 -3.505 351 HA SER 53 HA SER 53 236.099 15.637 -3.374 352 HB2 SER 53 HB2 SER 53 234.907 13.263 -4.793 353 HB3 SER 53 HB3 SER 53 234.199 14.872 -4.928 354 HG SER 53 HG SER 53 236.336 13.863 -6.190 355 H TRP 54 H TRP 54 234.506 12.738 -2.113 356 HA TRP 54 HA TRP 54 232.772 12.436 -0.673 357 HB2 TRP 54 HB2 TRP 54 233.569 15.230 0.187 358 HB3 TRP 54 HB3 TRP 54 232.429 14.204 1.067 359 HD1 TRP 54 HD1 TRP 54 234.535 11.592 0.320 360 HE1 TRP 54 HE1 TRP 54 236.490 11.281 1.965 361 HE3 TRP 54 HE3 TRP 54 234.524 16.225 2.484 362 HZ2 TRP 54 HZ2 TRP 54 237.846 12.797 3.923 363 HZ3 TRP 54 HZ3 TRP 54 236.181 16.713 4.234 364 HH2 TRP 54 HH2 TRP 54 237.807 15.034 4.938 365 H LYS 55 H LYS 55 231.933 13.009 -3.176 366 HA LYS 55 HA LYS 55 229.879 15.083 -2.976 367 HB2 LYS 55 HB2 LYS 55 231.234 13.672 -5.208 368 HB3 LYS 55 HB3 LYS 55 229.557 14.128 -5.469 369 HG2 LYS 55 HG2 LYS 55 230.430 16.456 -4.561 370 HG3 LYS 55 HG3 LYS 55 231.964 15.831 -5.168 371 HD2 LYS 55 HD2 LYS 55 229.422 15.976 -6.787 372 HD3 LYS 55 HD3 LYS 55 230.700 17.191 -6.830 373 HE2 LYS 55 HE2 LYS 55 232.281 15.563 -7.652 374 HE3 LYS 55 HE3 LYS 55 231.092 14.272 -7.485 375 HZ1 LYS 55 HZ1 LYS 55 229.761 15.913 -9.076 376 HZ2 LYS 55 HZ2 LYS 55 230.806 14.721 -9.667 377 HZ3 LYS 55 HZ3 LYS 55 231.335 16.323 -9.541 378 H GLN 56 H GLN 56 227.718 14.683 -3.006 379 HA GLN 56 HA GLN 56 226.742 11.980 -3.470 380 HB2 GLN 56 HB2 GLN 56 227.067 13.029 -0.837 381 HB3 GLN 56 HB3 GLN 56 225.344 12.953 -1.175 382 HG2 GLN 56 HG2 GLN 56 227.277 10.659 -1.455 383 HG3 GLN 56 HG3 GLN 56 226.182 10.925 -0.089 384 HE21 GLN 56 HE21 GLN 56 225.097 8.981 -0.414 385 HE22 GLN 56 HE22 GLN 56 224.025 8.728 -1.742 386 H LYS 57 H LYS 57 225.659 12.685 -5.274 387 HA LYS 57 HA LYS 57 224.131 15.039 -5.453 388 HB2 LYS 57 HB2 LYS 57 223.779 12.470 -7.010 389 HB3 LYS 57 HB3 LYS 57 223.164 14.049 -7.474 390 HG2 LYS 57 HG2 LYS 57 225.455 14.880 -7.688 391 HG3 LYS 57 HG3 LYS 57 226.069 13.292 -7.225 392 HD2 LYS 57 HD2 LYS 57 225.063 12.290 -9.185 393 HD3 LYS 57 HD3 LYS 57 224.325 13.832 -9.628 394 HE2 LYS 57 HE2 LYS 57 226.297 13.456 -10.974 395 HE3 LYS 57 HE3 LYS 57 226.578 14.806 -9.878 396 HZ1 LYS 57 HZ1 LYS 57 228.131 13.660 -8.719 397 HZ2 LYS 57 HZ2 LYS 57 228.312 12.849 -10.191 398 HZ3 LYS 57 HZ3 LYS 57 227.391 12.157 -8.953 399 HA PRO 58 HA PRO 58 220.563 13.953 -3.028 400 HB2 PRO 58 HB2 PRO 58 218.819 15.800 -4.030 401 HB3 PRO 58 HB3 PRO 58 220.095 16.187 -2.859 402 HG2 PRO 58 HG2 PRO 58 220.070 16.559 -5.829 403 HG3 PRO 58 HG3 PRO 58 220.660 17.656 -4.569 404 HD2 PRO 58 HD2 PRO 58 222.327 16.114 -6.029 405 HD3 PRO 58 HD3 PRO 58 222.654 16.515 -4.331 406 H HIS 59 H HIS 59 220.195 14.399 -6.537 407 HA HIS 59 HA HIS 59 217.709 13.144 -6.840 408 HB2 HIS 59 HB2 HIS 59 219.428 14.415 -8.522 409 HB3 HIS 59 HB3 HIS 59 219.646 12.735 -9.032 410 HD1 HIS 59 HD1 HIS 59 218.355 12.602 -11.152 411 HD2 HIS 59 HD2 HIS 59 216.213 14.509 -8.143 412 HE1 HIS 59 HE1 HIS 59 216.068 13.016 -12.113 413 HE2 HIS 59 HE2 HIS 59 214.811 14.231 -10.300 414 H ARG 60 H ARG 60 220.881 11.802 -6.333 415 HA ARG 60 HA ARG 60 219.744 9.096 -6.585 416 HB2 ARG 60 HB2 ARG 60 222.632 9.788 -7.126 417 HB3 ARG 60 HB3 ARG 60 221.819 8.261 -7.432 418 HG2 ARG 60 HG2 ARG 60 220.776 9.036 -9.327 419 HG3 ARG 60 HG3 ARG 60 220.851 10.721 -8.809 420 HD2 ARG 60 HD2 ARG 60 223.369 10.540 -9.072 421 HD3 ARG 60 HD3 ARG 60 223.067 9.002 -9.896 422 HE ARG 60 HE ARG 60 221.582 11.232 -10.962 423 HH11 ARG 60 HH11 ARG 60 224.586 9.436 -11.129 424 HH12 ARG 60 HH12 ARG 60 224.928 9.923 -12.754 425 HH21 ARG 60 HH21 ARG 60 222.043 11.871 -13.100 426 HH22 ARG 60 HH22 ARG 60 223.486 11.305 -13.871 427 H ALA 61 H ALA 61 220.290 11.114 -4.307 428 HA ALA 61 HA ALA 61 222.307 10.008 -2.660 429 HB1 ALA 61 HB1 ALA 61 220.771 11.208 -0.849 430 HB2 ALA 61 HB2 ALA 61 220.098 11.948 -2.300 431 HB3 ALA 61 HB3 ALA 61 221.818 12.108 -1.946 432 H TYR 62 H TYR 62 219.033 9.059 -3.306 433 HA TYR 62 HA TYR 62 219.355 6.663 -1.794 434 HB2 TYR 62 HB2 TYR 62 217.485 6.990 -0.238 435 HB3 TYR 62 HB3 TYR 62 218.766 8.159 0.048 436 HD1 TYR 62 HD1 TYR 62 215.346 7.794 -0.073 437 HD2 TYR 62 HD2 TYR 62 218.395 10.420 -1.456 438 HE1 TYR 62 HE1 TYR 62 213.699 9.612 -0.241 439 HE2 TYR 62 HE2 TYR 62 216.757 12.244 -1.626 440 HH TYR 62 HH TYR 62 214.045 12.426 -0.164 441 H ARG 63 H ARG 63 218.702 5.322 -3.346 442 HA ARG 63 HA ARG 63 216.204 5.927 -4.777 443 HB2 ARG 63 HB2 ARG 63 218.275 3.870 -5.550 444 HB3 ARG 63 HB3 ARG 63 216.939 4.459 -6.524 445 HG2 ARG 63 HG2 ARG 63 218.336 6.756 -5.929 446 HG3 ARG 63 HG3 ARG 63 219.605 5.553 -6.159 447 HD2 ARG 63 HD2 ARG 63 219.004 6.737 -8.243 448 HD3 ARG 63 HD3 ARG 63 218.750 4.999 -8.342 449 HE ARG 63 HE ARG 63 216.661 7.052 -8.164 450 HH11 ARG 63 HH11 ARG 63 217.552 3.699 -8.658 451 HH12 ARG 63 HH12 ARG 63 215.994 3.252 -9.262 452 HH21 ARG 63 HH21 ARG 63 214.611 6.445 -8.963 453 HH22 ARG 63 HH22 ARG 63 214.333 4.803 -9.440 454 H TYR 64 H TYR 64 214.452 4.686 -4.503 455 HA TYR 64 HA TYR 64 214.624 2.519 -2.570 456 HB2 TYR 64 HB2 TYR 64 212.335 4.080 -3.744 457 HB3 TYR 64 HB3 TYR 64 212.063 2.602 -2.808 458 HD1 TYR 64 HD1 TYR 64 213.355 6.055 -2.667 459 HD2 TYR 64 HD2 TYR 64 212.314 2.590 -0.427 460 HE1 TYR 64 HE1 TYR 64 213.515 7.357 -0.591 461 HE2 TYR 64 HE2 TYR 64 212.466 3.885 1.655 462 HH TYR 64 HH TYR 64 213.491 5.878 2.512 463 H VAL 65 H VAL 65 214.815 0.495 -3.150 464 HA VAL 65 HA VAL 65 214.080 -0.334 -5.858 465 HB VAL 65 HB VAL 65 215.373 -2.100 -3.789 466 HG11 VAL 65 HG11 VAL 65 214.390 -2.858 -6.093 467 HG12 VAL 65 HG12 VAL 65 215.934 -3.494 -5.525 468 HG13 VAL 65 HG13 VAL 65 215.901 -2.201 -6.723 469 HG21 VAL 65 HG21 VAL 65 216.922 -0.418 -5.747 470 HG22 VAL 65 HG22 VAL 65 217.542 -1.418 -4.435 471 HG23 VAL 65 HG23 VAL 65 216.653 0.059 -4.070 472 H GLY 66 H GLY 66 212.083 -1.103 -6.157 473 HA2 GLY 66 HA2 GLY 66 210.331 -1.729 -4.037 474 HA3 GLY 66 HA3 GLY 66 210.031 -2.055 -5.741 475 H GLU 67 H GLU 67 211.590 -3.248 -2.833 476 HA GLU 67 HA GLU 67 210.723 -5.860 -2.951 477 HB2 GLU 67 HB2 GLU 67 212.971 -5.313 -4.767 478 HB3 GLU 67 HB3 GLU 67 213.257 -6.665 -3.677 479 HG2 GLU 67 HG2 GLU 67 210.636 -6.698 -4.970 480 HG3 GLU 67 HG3 GLU 67 212.000 -6.805 -6.081 481 H ASN 68 H ASN 68 211.554 -3.761 -1.041 482 HA ASN 68 HA ASN 68 212.537 -3.571 1.000 483 HB2 ASN 68 HB2 ASN 68 212.474 -6.525 0.590 484 HB3 ASN 68 HB3 ASN 68 213.488 -5.911 1.889 485 HD21 ASN 68 HD21 ASN 68 212.545 -5.004 3.691 486 HD22 ASN 68 HD22 ASN 68 210.840 -5.096 3.996 487 H THR 69 H THR 69 214.086 -3.455 -1.591 488 HA THR 69 HA THR 69 216.783 -3.920 -0.513 489 HB THR 69 HB THR 69 217.024 -3.567 -3.274 490 HG1 THR 69 HG1 THR 69 214.862 -3.923 -3.633 491 HG21 THR 69 HG21 THR 69 217.203 -6.169 -3.211 492 HG22 THR 69 HG22 THR 69 217.154 -5.922 -1.466 493 HG23 THR 69 HG23 THR 69 218.420 -5.163 -2.430 494 H TYR 70 H TYR 70 218.431 -2.395 -1.056 495 HA TYR 70 HA TYR 70 217.410 0.308 -1.645 496 HB2 TYR 70 HB2 TYR 70 218.131 -0.111 0.753 497 HB3 TYR 70 HB3 TYR 70 219.766 -0.328 0.141 498 HD1 TYR 70 HD1 TYR 70 220.865 1.619 -1.067 499 HD2 TYR 70 HD2 TYR 70 217.275 2.037 1.177 500 HE1 TYR 70 HE1 TYR 70 221.240 4.044 -0.933 501 HE2 TYR 70 HE2 TYR 70 217.637 4.462 1.316 502 HH TYR 70 HH TYR 70 220.406 6.015 -0.270 503 H GLN 71 H GLN 71 218.548 1.543 -3.090 504 HA GLN 71 HA GLN 71 221.082 0.487 -4.113 505 HB2 GLN 71 HB2 GLN 71 218.555 0.689 -5.583 506 HB3 GLN 71 HB3 GLN 71 219.903 1.473 -6.395 507 HG2 GLN 71 HG2 GLN 71 220.998 -0.479 -6.777 508 HG3 GLN 71 HG3 GLN 71 220.350 -1.257 -5.333 509 HE21 GLN 71 HE21 GLN 71 218.937 -2.802 -5.690 510 HE22 GLN 71 HE22 GLN 71 217.915 -2.954 -7.086 511 H ALA 72 H ALA 72 222.562 1.991 -4.705 512 HA ALA 72 HA ALA 72 221.795 4.774 -5.013 513 HB1 ALA 72 HB1 ALA 72 222.300 5.401 -2.945 514 HB2 ALA 72 HB2 ALA 72 223.967 4.902 -3.235 515 HB3 ALA 72 HB3 ALA 72 222.814 3.765 -2.533 516 H VAL 73 H VAL 73 222.767 5.283 -6.872 517 HA VAL 73 HA VAL 73 225.150 3.977 -7.788 518 HB VAL 73 HB VAL 73 225.037 5.536 -9.703 519 HG11 VAL 73 HG11 VAL 73 223.426 4.317 -10.697 520 HG12 VAL 73 HG12 VAL 73 222.222 4.709 -9.469 521 HG13 VAL 73 HG13 VAL 73 223.411 3.444 -9.165 522 HG21 VAL 73 HG21 VAL 73 222.652 6.822 -9.578 523 HG22 VAL 73 HG22 VAL 73 224.204 7.567 -9.199 524 HG23 VAL 73 HG23 VAL 73 223.186 6.944 -7.903 525 H VAL 74 H VAL 74 227.228 4.576 -7.524 526 HA VAL 74 HA VAL 74 227.776 7.310 -6.568 527 HB VAL 74 HB VAL 74 229.597 6.335 -5.129 528 HG11 VAL 74 HG11 VAL 74 228.005 5.596 -3.341 529 HG12 VAL 74 HG12 VAL 74 226.715 5.687 -4.541 530 HG13 VAL 74 HG13 VAL 74 227.609 7.140 -4.094 531 HG21 VAL 74 HG21 VAL 74 229.159 3.922 -4.435 532 HG22 VAL 74 HG22 VAL 74 229.926 4.172 -6.003 533 HG23 VAL 74 HG23 VAL 74 228.208 3.784 -5.914 534 H ASP 75 H ASP 75 229.573 8.308 -7.334 535 HA ASP 75 HA ASP 75 231.167 6.847 -9.339 536 HB2 ASP 75 HB2 ASP 75 229.711 8.702 -10.201 537 HB3 ASP 75 HB3 ASP 75 230.658 9.829 -9.218 538 H GLU 76 H GLU 76 233.228 6.486 -8.784 539 HA GLU 76 HA GLU 76 234.644 8.477 -7.156 540 HB2 GLU 76 HB2 GLU 76 234.897 5.520 -6.627 541 HB3 GLU 76 HB3 GLU 76 235.534 6.845 -5.665 542 HG2 GLU 76 HG2 GLU 76 232.940 7.451 -5.541 543 HG3 GLU 76 HG3 GLU 76 232.810 5.710 -5.776 544 H LYS 77 H LYS 77 237.043 8.058 -7.096 545 HA LYS 77 HA LYS 77 238.082 7.951 -9.707 546 HB2 LYS 77 HB2 LYS 77 239.292 7.993 -6.971 547 HB3 LYS 77 HB3 LYS 77 240.324 7.670 -8.355 548 HG2 LYS 77 HG2 LYS 77 238.543 10.082 -8.180 549 HG3 LYS 77 HG3 LYS 77 240.205 10.064 -7.589 550 HD2 LYS 77 HD2 LYS 77 240.834 10.624 -9.655 551 HD3 LYS 77 HD3 LYS 77 240.373 8.994 -10.148 552 HE2 LYS 77 HE2 LYS 77 238.697 9.788 -11.375 553 HE3 LYS 77 HE3 LYS 77 238.040 10.653 -9.988 554 HZ1 LYS 77 HZ1 LYS 77 239.913 11.619 -12.049 555 HZ2 LYS 77 HZ2 LYS 77 239.866 12.360 -10.530 556 HZ3 LYS 77 HZ3 LYS 77 238.479 12.328 -11.497 557 H ALA 78 H ALA 78 240.059 6.498 -10.221 558 HA ALA 78 HA ALA 78 239.228 3.704 -9.797 559 HB1 ALA 78 HB1 ALA 78 239.344 4.892 -12.148 560 HB2 ALA 78 HB2 ALA 78 239.810 3.203 -11.947 561 HB3 ALA 78 HB3 ALA 78 241.047 4.458 -12.022 562 H GLY 79 H GLY 79 240.680 2.141 -9.247 563 HA2 GLY 79 HA2 GLY 79 242.742 1.186 -8.759 564 HA3 GLY 79 HA3 GLY 79 243.509 2.747 -9.059 565 H ALA 80 H ALA 80 241.953 0.689 -6.737 566 HA ALA 80 HA ALA 80 241.874 0.661 -4.470 567 HB1 ALA 80 HB1 ALA 80 244.121 2.548 -4.149 568 HB2 ALA 80 HB2 ALA 80 244.436 1.104 -5.111 569 HB3 ALA 80 HB3 ALA 80 243.867 0.949 -3.450 570 H PHE 81 H PHE 81 240.032 1.647 -3.830 571 HA PHE 81 HA PHE 81 240.262 4.425 -2.961 572 HB2 PHE 81 HB2 PHE 81 237.866 4.786 -3.846 573 HB3 PHE 81 HB3 PHE 81 239.192 4.851 -4.998 574 HD1 PHE 81 HD1 PHE 81 239.680 2.744 -6.361 575 HD2 PHE 81 HD2 PHE 81 236.077 3.337 -4.172 576 HE1 PHE 81 HE1 PHE 81 238.568 1.029 -7.728 577 HE2 PHE 81 HE2 PHE 81 234.963 1.620 -5.536 578 HZ PHE 81 HZ PHE 81 236.207 0.464 -7.315 579 H ARG 82 H ARG 82 239.277 4.843 -1.061 580 HA ARG 82 HA ARG 82 237.746 2.646 0.163 581 HB2 ARG 82 HB2 ARG 82 239.662 4.663 1.268 582 HB3 ARG 82 HB3 ARG 82 238.405 4.018 2.314 583 HG2 ARG 82 HG2 ARG 82 239.233 1.716 1.690 584 HG3 ARG 82 HG3 ARG 82 240.619 2.519 0.939 585 HD2 ARG 82 HD2 ARG 82 240.114 3.506 3.619 586 HD3 ARG 82 HD3 ARG 82 240.368 1.762 3.603 587 HE ARG 82 HE ARG 82 242.561 2.103 2.968 588 HH11 ARG 82 HH11 ARG 82 240.816 5.143 2.869 589 HH12 ARG 82 HH12 ARG 82 242.245 6.099 2.695 590 HH21 ARG 82 HH21 ARG 82 244.443 3.375 2.743 591 HH22 ARG 82 HH22 ARG 82 244.305 5.098 2.625 592 H MET 83 H MET 83 235.811 3.090 1.239 593 HA MET 83 HA MET 83 234.829 5.829 1.289 594 HB2 MET 83 HB2 MET 83 232.644 4.949 0.190 595 HB3 MET 83 HB3 MET 83 234.005 5.388 -0.833 596 HG2 MET 83 HG2 MET 83 234.547 3.159 -1.268 597 HG3 MET 83 HG3 MET 83 233.583 2.568 0.083 598 HE1 MET 83 HE1 MET 83 232.958 0.780 -1.851 599 HE2 MET 83 HE2 MET 83 233.586 1.684 -3.229 600 HE3 MET 83 HE3 MET 83 231.906 1.150 -3.217 601 H GLN 84 H GLN 84 232.753 6.034 2.424 602 HA GLN 84 HA GLN 84 232.062 3.787 4.166 603 HB2 GLN 84 HB2 GLN 84 233.742 5.133 5.375 604 HB3 GLN 84 HB3 GLN 84 232.729 6.555 5.186 605 HG2 GLN 84 HG2 GLN 84 231.393 4.263 6.439 606 HG3 GLN 84 HG3 GLN 84 232.751 4.932 7.357 607 HE21 GLN 84 HE21 GLN 84 231.468 5.762 8.983 608 HE22 GLN 84 HE22 GLN 84 230.425 7.128 8.744 609 H TYR 85 H TYR 85 229.961 3.929 5.102 610 HA TYR 85 HA TYR 85 228.212 5.937 3.835 611 HB2 TYR 85 HB2 TYR 85 228.071 3.055 3.826 612 HB3 TYR 85 HB3 TYR 85 226.636 3.724 4.592 613 HD1 TYR 85 HD1 TYR 85 225.964 6.070 3.140 614 HD2 TYR 85 HD2 TYR 85 227.631 2.450 1.654 615 HE1 TYR 85 HE1 TYR 85 225.010 6.548 0.926 616 HE2 TYR 85 HE2 TYR 85 226.682 2.917 -0.563 617 HH TYR 85 HH TYR 85 224.862 4.226 -1.549 618 H ALA 86 H ALA 86 226.922 7.122 5.131 619 HA ALA 86 HA ALA 86 226.065 6.231 7.712 620 HB1 ALA 86 HB1 ALA 86 228.119 8.435 7.601 621 HB2 ALA 86 HB2 ALA 86 228.342 6.832 8.299 622 HB3 ALA 86 HB3 ALA 86 227.204 7.963 9.032 623 H SER 87 H SER 87 224.517 7.618 8.676 624 HA SER 87 HA SER 87 223.257 9.423 6.766 625 HB2 SER 87 HB2 SER 87 222.222 7.569 8.509 626 HB3 SER 87 HB3 SER 87 221.959 9.088 9.384 627 HG SER 87 HG SER 87 220.439 9.556 8.022 628 H LYS 88 H LYS 88 222.071 11.364 7.958 629 HA LYS 88 HA LYS 88 224.213 12.993 9.039 630 HB2 LYS 88 HB2 LYS 88 222.190 13.549 7.317 631 HB3 LYS 88 HB3 LYS 88 221.506 14.150 8.822 632 HG2 LYS 88 HG2 LYS 88 222.635 15.930 7.656 633 HG3 LYS 88 HG3 LYS 88 223.500 15.551 9.147 634 HD2 LYS 88 HD2 LYS 88 225.212 14.407 7.968 635 HD3 LYS 88 HD3 LYS 88 224.273 14.396 6.474 636 HE2 LYS 88 HE2 LYS 88 224.827 17.053 7.631 637 HE3 LYS 88 HE3 LYS 88 226.230 16.177 7.020 638 HZ1 LYS 88 HZ1 LYS 88 225.520 16.345 4.894 639 HZ2 LYS 88 HZ2 LYS 88 224.721 17.710 5.490 640 HZ3 LYS 88 HZ3 LYS 88 223.877 16.257 5.294 641 H ASP 89 H ASP 89 221.170 11.592 10.137 642 HA ASP 89 HA ASP 89 221.468 12.879 12.750 643 HB2 ASP 89 HB2 ASP 89 219.227 11.527 11.307 644 HB3 ASP 89 HB3 ASP 89 219.204 11.526 13.077 645 H TRP 90 H TRP 90 223.414 10.924 12.072 646 HA TRP 90 HA TRP 90 224.411 9.010 12.799 647 HB2 TRP 90 HB2 TRP 90 222.849 9.792 15.265 648 HB3 TRP 90 HB3 TRP 90 224.082 8.535 15.249 649 HD1 TRP 90 HD1 TRP 90 226.627 9.445 14.478 650 HE1 TRP 90 HE1 TRP 90 227.774 11.662 15.102 651 HE3 TRP 90 HE3 TRP 90 222.498 12.147 15.812 652 HZ2 TRP 90 HZ2 TRP 90 227.026 14.220 16.034 653 HZ3 TRP 90 HZ3 TRP 90 222.800 14.471 16.558 654 HH2 TRP 90 HH2 TRP 90 225.019 15.485 16.666 655 H SER 91 H SER 91 222.145 8.512 11.256 656 HA SER 91 HA SER 91 220.588 6.436 12.555 657 HB2 SER 91 HB2 SER 91 220.368 6.756 9.622 658 HB3 SER 91 HB3 SER 91 219.103 6.690 10.847 659 HG SER 91 HG SER 91 219.023 8.777 10.761 660 HA PRO 92 HA PRO 92 222.378 2.608 11.210 661 HB2 PRO 92 HB2 PRO 92 220.600 2.567 8.797 662 HB3 PRO 92 HB3 PRO 92 220.972 1.265 9.946 663 HG2 PRO 92 HG2 PRO 92 218.670 2.595 10.099 664 HG3 PRO 92 HG3 PRO 92 219.541 2.110 11.565 665 HD2 PRO 92 HD2 PRO 92 219.235 4.801 10.346 666 HD3 PRO 92 HD3 PRO 92 219.471 4.346 12.051 667 H GLN 93 H GLN 93 224.408 2.767 10.505 668 HA GLN 93 HA GLN 93 224.918 3.888 7.829 669 HB2 GLN 93 HB2 GLN 93 227.276 4.202 8.720 670 HB3 GLN 93 HB3 GLN 93 226.040 5.220 9.437 671 HG2 GLN 93 HG2 GLN 93 226.349 2.753 10.900 672 HG3 GLN 93 HG3 GLN 93 227.876 3.623 10.763 673 HE21 GLN 93 HE21 GLN 93 227.912 5.856 11.460 674 HE22 GLN 93 HE22 GLN 93 226.852 6.363 12.740 675 H PHE 94 H PHE 94 227.329 2.998 7.179 676 HA PHE 94 HA PHE 94 227.206 0.061 7.372 677 HB2 PHE 94 HB2 PHE 94 226.609 0.150 5.185 678 HB3 PHE 94 HB3 PHE 94 227.200 1.792 4.983 679 HD1 PHE 94 HD1 PHE 94 227.910 -1.723 4.546 680 HD2 PHE 94 HD2 PHE 94 229.606 2.176 4.495 681 HE1 PHE 94 HE1 PHE 94 229.841 -2.582 3.286 682 HE2 PHE 94 HE2 PHE 94 231.539 1.328 3.238 683 HZ PHE 94 HZ PHE 94 231.662 -1.053 2.629 684 H THR 95 H THR 95 229.029 -0.874 8.029 685 HA THR 95 HA THR 95 231.570 0.550 7.702 686 HB THR 95 HB THR 95 231.513 -0.852 10.231 687 HG1 THR 95 HG1 THR 95 229.711 1.326 10.060 688 HG21 THR 95 HG21 THR 95 231.771 2.101 9.764 689 HG22 THR 95 HG22 THR 95 233.094 0.958 9.532 690 HG23 THR 95 HG23 THR 95 232.371 1.157 11.129 691 H ALA 96 H ALA 96 232.801 -0.754 6.497 692 HA ALA 96 HA ALA 96 232.492 -3.655 6.762 693 HB1 ALA 96 HB1 ALA 96 234.387 -2.988 4.747 694 HB2 ALA 96 HB2 ALA 96 232.987 -1.929 4.567 695 HB3 ALA 96 HB3 ALA 96 232.773 -3.679 4.559 696 H ASP 97 H ASP 97 233.545 -4.013 8.699 697 HA ASP 97 HA ASP 97 236.241 -3.118 9.141 698 HB2 ASP 97 HB2 ASP 97 234.186 -4.051 10.768 699 HB3 ASP 97 HB3 ASP 97 235.393 -5.344 10.818 700 H GLY 98 H GLY 98 237.846 -3.946 7.954 701 HA2 GLY 98 HA2 GLY 98 239.252 -5.464 6.952 702 HA3 GLY 98 HA3 GLY 98 238.684 -6.606 8.175 703 H LEU 99 H LEU 99 236.570 -5.078 5.830 704 HA LEU 99 HA LEU 99 235.735 -7.675 4.860 705 HB2 LEU 99 HB2 LEU 99 234.044 -6.022 5.372 706 HB3 LEU 99 HB3 LEU 99 234.783 -4.873 4.278 707 HG LEU 99 HG LEU 99 232.655 -6.030 3.492 708 HD11 LEU 99 HD11 LEU 99 234.663 -6.599 1.433 709 HD12 LEU 99 HD12 LEU 99 234.732 -4.980 2.126 710 HD13 LEU 99 HD13 LEU 99 233.241 -5.560 1.385 711 HD21 LEU 99 HD21 LEU 99 232.599 -8.231 2.967 712 HD22 LEU 99 HD22 LEU 99 233.813 -8.318 4.244 713 HD23 LEU 99 HD23 LEU 99 234.312 -8.290 2.553 714 H GLU 100 H GLU 100 236.988 -4.665 3.401 715 HA GLU 100 HA GLU 100 238.056 -4.240 1.441 716 HB2 GLU 100 HB2 GLU 100 239.109 -6.866 2.309 717 HB3 GLU 100 HB3 GLU 100 239.373 -6.463 0.620 718 HG2 GLU 100 HG2 GLU 100 241.191 -5.842 2.270 719 HG3 GLU 100 HG3 GLU 100 240.662 -4.594 1.145 720 H LEU 101 H LEU 101 236.148 -3.955 0.317 721 HA LEU 101 HA LEU 101 234.819 -6.127 -0.993 722 HB2 LEU 101 HB2 LEU 101 233.685 -4.065 -0.215 723 HB3 LEU 101 HB3 LEU 101 234.539 -3.158 -1.460 724 HG LEU 101 HG LEU 101 232.904 -5.489 -2.332 725 HD11 LEU 101 HD11 LEU 101 231.536 -2.876 -1.890 726 HD12 LEU 101 HD12 LEU 101 231.652 -4.035 -0.568 727 HD13 LEU 101 HD13 LEU 101 230.848 -4.489 -2.069 728 HD21 LEU 101 HD21 LEU 101 232.913 -4.439 -4.334 729 HD22 LEU 101 HD22 LEU 101 234.335 -3.643 -3.662 730 HD23 LEU 101 HD23 LEU 101 232.768 -2.834 -3.618 731 H THR 102 H THR 102 234.726 -6.600 -3.156 732 HA THR 102 HA THR 102 236.759 -5.376 -4.892 733 HB THR 102 HB THR 102 236.256 -8.202 -5.464 734 HG1 THR 102 HG1 THR 102 237.351 -9.016 -3.690 735 HG21 THR 102 HG21 THR 102 238.146 -7.672 -6.526 736 HG22 THR 102 HG22 THR 102 238.909 -7.999 -4.970 737 HG23 THR 102 HG23 THR 102 238.514 -6.343 -5.428 738 HA PRO 103 HA PRO 103 233.707 -4.705 -8.001 739 HB2 PRO 103 HB2 PRO 103 235.449 -6.377 -9.772 740 HB3 PRO 103 HB3 PRO 103 234.717 -4.800 -10.085 741 HG2 PRO 103 HG2 PRO 103 237.293 -4.981 -9.469 742 HG3 PRO 103 HG3 PRO 103 236.293 -3.666 -8.807 743 HD2 PRO 103 HD2 PRO 103 237.336 -6.114 -7.469 744 HD3 PRO 103 HD3 PRO 103 237.046 -4.496 -6.801 745 H GLY 104 H GLY 104 231.858 -5.798 -7.609 746 HA2 GLY 104 HA2 GLY 104 230.239 -7.397 -8.093 747 HA3 GLY 104 HA3 GLY 104 231.486 -8.385 -8.860 748 H LYS 105 H LYS 105 231.667 -7.095 -5.577 749 HA LYS 105 HA LYS 105 231.322 -9.831 -4.532 750 HB2 LYS 105 HB2 LYS 105 233.738 -8.819 -4.649 751 HB3 LYS 105 HB3 LYS 105 233.211 -7.899 -3.234 752 HG2 LYS 105 HG2 LYS 105 232.489 -10.578 -2.761 753 HG3 LYS 105 HG3 LYS 105 234.132 -10.603 -3.403 754 HD2 LYS 105 HD2 LYS 105 233.595 -8.532 -1.377 755 HD3 LYS 105 HD3 LYS 105 233.522 -10.195 -0.796 756 HE2 LYS 105 HE2 LYS 105 235.793 -10.220 -2.319 757 HE3 LYS 105 HE3 LYS 105 235.821 -8.591 -1.647 758 HZ1 LYS 105 HZ1 LYS 105 236.202 -9.355 0.419 759 HZ2 LYS 105 HZ2 LYS 105 236.790 -10.721 -0.386 760 HZ3 LYS 105 HZ3 LYS 105 235.218 -10.721 0.236 761 H THR 106 H THR 106 230.460 -10.031 -2.464 762 HA THR 106 HA THR 106 228.653 -7.888 -1.735 763 HB THR 106 HB THR 106 227.827 -9.555 -0.034 764 HG1 THR 106 HG1 THR 106 229.352 -11.492 -1.386 765 HG21 THR 106 HG21 THR 106 226.817 -11.108 -1.633 766 HG22 THR 106 HG22 THR 106 227.899 -10.504 -2.888 767 HG23 THR 106 HG23 THR 106 226.702 -9.430 -2.163 768 H ALA 107 H ALA 107 228.584 -6.801 0.205 769 HA ALA 107 HA ALA 107 230.989 -7.022 1.904 770 HB1 ALA 107 HB1 ALA 107 229.708 -4.678 0.658 771 HB2 ALA 107 HB2 ALA 107 231.391 -4.955 1.105 772 HB3 ALA 107 HB3 ALA 107 230.222 -4.476 2.333 773 H SER 108 H SER 108 230.760 -6.708 4.115 774 HA SER 108 HA SER 108 228.232 -7.554 5.194 775 HB2 SER 108 HB2 SER 108 230.799 -7.944 5.985 776 HB3 SER 108 HB3 SER 108 230.333 -6.627 7.062 777 HG SER 108 HG SER 108 229.801 -9.147 7.388 778 H LEU 109 H LEU 109 226.679 -6.343 6.119 779 HA LEU 109 HA LEU 109 227.056 -3.451 6.176 780 HB2 LEU 109 HB2 LEU 109 225.066 -4.380 5.068 781 HB3 LEU 109 HB3 LEU 109 224.570 -5.114 6.580 782 HG LEU 109 HG LEU 109 224.671 -2.604 7.432 783 HD11 LEU 109 HD11 LEU 109 223.842 -1.086 5.666 784 HD12 LEU 109 HD12 LEU 109 224.173 -2.341 4.472 785 HD13 LEU 109 HD13 LEU 109 225.498 -1.627 5.393 786 HD21 LEU 109 HD21 LEU 109 222.238 -2.424 6.627 787 HD22 LEU 109 HD22 LEU 109 222.678 -3.778 7.665 788 HD23 LEU 109 HD23 LEU 109 222.504 -4.022 5.928 789 H LYS 110 H LYS 110 228.146 -2.906 8.000 790 HA LYS 110 HA LYS 110 227.112 -3.903 10.569 791 HB2 LYS 110 HB2 LYS 110 229.759 -2.521 10.163 792 HB3 LYS 110 HB3 LYS 110 229.247 -3.506 11.526 793 HG2 LYS 110 HG2 LYS 110 229.458 -4.706 8.793 794 HG3 LYS 110 HG3 LYS 110 230.897 -4.484 9.790 795 HD2 LYS 110 HD2 LYS 110 229.091 -5.629 11.533 796 HD3 LYS 110 HD3 LYS 110 228.750 -6.445 10.005 797 HE2 LYS 110 HE2 LYS 110 230.400 -7.765 11.003 798 HE3 LYS 110 HE3 LYS 110 231.281 -6.784 9.833 799 HZ1 LYS 110 HZ1 LYS 110 231.281 -6.620 12.768 800 HZ2 LYS 110 HZ2 LYS 110 231.586 -5.218 11.873 801 HZ3 LYS 110 HZ3 LYS 110 232.584 -6.571 11.689 802 H ARG 111 H ARG 111 228.307 -1.848 12.176 803 HA ARG 111 HA ARG 111 227.023 0.619 11.273 804 HB2 ARG 111 HB2 ARG 111 225.738 -1.094 13.045 805 HB3 ARG 111 HB3 ARG 111 226.454 0.129 14.085 806 HG2 ARG 111 HG2 ARG 111 225.324 1.883 12.892 807 HG3 ARG 111 HG3 ARG 111 224.714 0.732 11.703 808 HD2 ARG 111 HD2 ARG 111 223.967 -0.188 14.286 809 HD3 ARG 111 HD3 ARG 111 223.556 1.522 14.177 810 HE ARG 111 HE ARG 111 221.960 1.021 12.595 811 HH11 ARG 111 HH11 ARG 111 223.938 -1.810 13.183 812 HH12 ARG 111 HH12 ARG 111 222.895 -2.876 12.308 813 HH21 ARG 111 HH21 ARG 111 220.586 -0.395 11.439 814 HH22 ARG 111 HH22 ARG 111 220.994 -2.075 11.318 815 H GLY 112 H GLY 112 227.512 2.469 12.769 816 HA2 GLY 112 HA2 GLY 112 228.934 3.418 14.465 817 HA3 GLY 112 HA3 GLY 112 230.084 2.117 14.163 818 H GLY 113 H GLY 113 229.700 5.317 13.800 819 HA2 GLY 113 HA2 GLY 113 230.787 5.553 11.100 820 HA3 GLY 113 HA3 GLY 113 230.327 6.883 12.169 821 H TYR 114 H TYR 114 232.606 4.152 12.551 822 HA TYR 114 HA TYR 114 234.936 5.737 12.322 823 HB2 TYR 114 HB2 TYR 114 235.631 5.659 14.729 824 HB3 TYR 114 HB3 TYR 114 234.283 6.742 14.404 825 HD1 TYR 114 HD1 TYR 114 235.384 3.775 16.169 826 HD2 TYR 114 HD2 TYR 114 231.977 6.075 15.073 827 HE1 TYR 114 HE1 TYR 114 234.062 2.630 17.897 828 HE2 TYR 114 HE2 TYR 114 230.647 4.939 16.799 829 HH TYR 114 HH TYR 114 231.714 3.466 19.276 830 H GLY 115 H GLY 115 234.064 3.212 11.348 831 HA2 GLY 115 HA2 GLY 115 235.705 1.267 12.816 832 HA3 GLY 115 HA3 GLY 115 234.509 0.883 11.588 833 H GLN 116 H GLN 116 235.698 -0.250 10.150 834 HA GLN 116 HA GLN 116 238.209 0.919 9.179 835 HB2 GLN 116 HB2 GLN 116 237.724 -1.615 9.966 836 HB3 GLN 116 HB3 GLN 116 237.364 -1.762 8.251 837 HG2 GLN 116 HG2 GLN 116 239.515 -1.835 7.751 838 HG3 GLN 116 HG3 GLN 116 239.812 -0.316 8.595 839 HE21 GLN 116 HE21 GLN 116 238.782 -3.500 9.792 840 HE22 GLN 116 HE22 GLN 116 240.103 -3.703 10.885 841 H ASP 117 H ASP 117 238.523 1.466 7.065 842 HA ASP 117 HA ASP 117 236.168 1.954 5.480 843 HB2 ASP 117 HB2 ASP 117 239.082 2.607 5.212 844 HB3 ASP 117 HB3 ASP 117 238.012 2.792 3.827 845 H THR 118 H THR 118 235.756 1.177 3.381 846 HA THR 118 HA THR 118 236.847 -1.497 2.882 847 HB THR 118 HB THR 118 234.670 -0.495 1.157 848 HG1 THR 118 HG1 THR 118 233.558 0.246 2.769 849 HG21 THR 118 HG21 THR 118 235.534 -3.009 2.334 850 HG22 THR 118 HG22 THR 118 234.641 -2.689 0.847 851 HG23 THR 118 HG23 THR 118 233.788 -2.761 2.388 852 H ALA 119 H ALA 119 238.509 -1.632 1.528 853 HA ALA 119 HA ALA 119 238.862 0.412 -0.538 854 HB1 ALA 119 HB1 ALA 119 240.865 -1.741 -0.032 855 HB2 ALA 119 HB2 ALA 119 240.688 -0.430 1.136 856 HB3 ALA 119 HB3 ALA 119 241.111 -0.069 -0.538 857 H VAL 120 H VAL 120 238.510 0.036 -2.630 858 HA VAL 120 HA VAL 120 238.081 -2.751 -3.496 859 HB VAL 120 HB VAL 120 236.799 -0.300 -4.705 860 HG11 VAL 120 HG11 VAL 120 237.135 -2.383 -6.116 861 HG12 VAL 120 HG12 VAL 120 235.485 -1.776 -5.988 862 HG13 VAL 120 HG13 VAL 120 235.985 -3.175 -5.039 863 HG21 VAL 120 HG21 VAL 120 234.728 -1.575 -3.601 864 HG22 VAL 120 HG22 VAL 120 235.634 -0.318 -2.759 865 HG23 VAL 120 HG23 VAL 120 235.977 -2.018 -2.438 866 H THR 121 H THR 121 239.272 -3.496 -5.150 867 HA THR 121 HA THR 121 241.208 -1.695 -6.368 868 HB THR 121 HB THR 121 240.902 -4.679 -6.205 869 HG1 THR 121 HG1 THR 121 242.976 -2.899 -5.444 870 HG21 THR 121 HG21 THR 121 243.352 -4.353 -7.356 871 HG22 THR 121 HG22 THR 121 242.365 -3.203 -8.259 872 HG23 THR 121 HG23 THR 121 241.899 -4.902 -8.191 873 H LEU 122 H LEU 122 240.178 -0.542 -7.940 874 HA LEU 122 HA LEU 122 239.102 -2.084 -10.202 875 HB2 LEU 122 HB2 LEU 122 237.381 -0.866 -8.691 876 HB3 LEU 122 HB3 LEU 122 237.986 0.597 -9.444 877 HG LEU 122 HG LEU 122 237.340 -0.273 -11.652 878 HD11 LEU 122 HD11 LEU 122 235.582 -2.365 -10.795 879 HD12 LEU 122 HD12 LEU 122 237.236 -2.733 -10.309 880 HD13 LEU 122 HD13 LEU 122 236.867 -2.408 -12.001 881 HD21 LEU 122 HD21 LEU 122 235.772 0.924 -9.867 882 HD22 LEU 122 HD22 LEU 122 234.871 -0.581 -10.047 883 HD23 LEU 122 HD23 LEU 122 235.193 0.430 -11.456 884 HA PRO 123 HA PRO 123 242.386 0.483 -12.005 885 HB2 PRO 123 HB2 PRO 123 242.646 -0.954 -14.282 886 HB3 PRO 123 HB3 PRO 123 243.343 -1.477 -12.736 887 HG2 PRO 123 HG2 PRO 123 240.799 -2.349 -14.062 888 HG3 PRO 123 HG3 PRO 123 242.040 -3.335 -13.265 889 HD2 PRO 123 HD2 PRO 123 239.720 -2.633 -12.047 890 HD3 PRO 123 HD3 PRO 123 241.238 -2.870 -11.160 891 H GLU 124 H GLU 124 239.180 0.451 -12.633 892 HA GLU 124 HA GLU 124 239.462 2.244 -14.948 893 HB2 GLU 124 HB2 GLU 124 238.359 -0.165 -15.227 894 HB3 GLU 124 HB3 GLU 124 236.948 0.679 -14.607 895 HG2 GLU 124 HG2 GLU 124 237.433 2.405 -16.456 896 HG3 GLU 124 HG3 GLU 124 238.452 1.135 -17.155 897 H ALA 125 H ALA 125 238.480 4.184 -14.762 898 HA ALA 125 HA ALA 125 237.193 4.830 -12.245 899 HB1 ALA 125 HB1 ALA 125 238.891 6.236 -13.774 900 HB2 ALA 125 HB2 ALA 125 237.753 6.982 -12.651 901 HB3 ALA 125 HB3 ALA 125 237.358 6.878 -14.366 902 H GLY 126 H GLY 126 235.095 5.497 -11.946 903 HA2 GLY 126 HA2 GLY 126 233.205 6.326 -13.706 904 HA3 GLY 126 HA3 GLY 126 233.200 4.577 -13.925 905 H GLN 127 H GLN 127 230.888 5.199 -13.210 906 HA GLN 127 HA GLN 127 230.725 5.192 -10.277 907 HB2 GLN 127 HB2 GLN 127 228.426 5.956 -10.514 908 HB3 GLN 127 HB3 GLN 127 229.518 7.027 -11.378 909 HG2 GLN 127 HG2 GLN 127 228.776 5.200 -13.304 910 HG3 GLN 127 HG3 GLN 127 227.299 5.424 -12.356 911 HE21 GLN 127 HE21 GLN 127 227.279 6.199 -14.933 912 HE22 GLN 127 HE22 GLN 127 227.285 7.922 -15.054 913 H TYR 128 H TYR 128 229.866 3.522 -9.198 914 HA TYR 128 HA TYR 128 228.850 1.266 -10.796 915 HB2 TYR 128 HB2 TYR 128 229.479 0.054 -8.478 916 HB3 TYR 128 HB3 TYR 128 230.620 0.234 -9.803 917 HD1 TYR 128 HD1 TYR 128 232.273 2.166 -9.717 918 HD2 TYR 128 HD2 TYR 128 229.916 1.004 -6.368 919 HE1 TYR 128 HE1 TYR 128 233.828 3.342 -8.220 920 HE2 TYR 128 HE2 TYR 128 231.466 2.183 -4.866 921 HH TYR 128 HH TYR 128 233.138 3.820 -4.847 922 H VAL 129 H VAL 129 227.231 -0.110 -9.702 923 HA VAL 129 HA VAL 129 225.400 1.569 -8.132 924 HB VAL 129 HB VAL 129 223.619 -0.034 -8.901 925 HG11 VAL 129 HG11 VAL 129 224.999 2.019 -10.417 926 HG12 VAL 129 HG12 VAL 129 223.271 1.752 -10.183 927 HG13 VAL 129 HG13 VAL 129 224.132 0.887 -11.454 928 HG21 VAL 129 HG21 VAL 129 225.692 -1.616 -9.709 929 HG22 VAL 129 HG22 VAL 129 225.191 -0.873 -11.228 930 HG23 VAL 129 HG23 VAL 129 224.024 -1.775 -10.262 931 H TRP 130 H TRP 130 224.995 1.058 -6.099 932 HA TRP 130 HA TRP 130 225.932 -1.513 -5.065 933 HB2 TRP 130 HB2 TRP 130 225.352 1.161 -3.865 934 HB3 TRP 130 HB3 TRP 130 225.217 -0.261 -2.837 935 HD1 TRP 130 HD1 TRP 130 227.868 1.290 -5.214 936 HE1 TRP 130 HE1 TRP 130 230.185 0.892 -4.170 937 HE3 TRP 130 HE3 TRP 130 226.461 -1.406 -1.104 938 HZ2 TRP 130 HZ2 TRP 130 231.274 -0.388 -1.905 939 HZ3 TRP 130 HZ3 TRP 130 228.205 -2.177 0.452 940 HH2 TRP 130 HH2 TRP 130 230.561 -1.679 0.057 941 H SER 131 H SER 131 224.480 -3.114 -5.051 942 HA SER 131 HA SER 131 221.667 -2.457 -4.449 943 HB2 SER 131 HB2 SER 131 222.024 -3.506 -6.669 944 HB3 SER 131 HB3 SER 131 222.776 -4.893 -5.876 945 HG SER 131 HG SER 131 220.406 -4.947 -6.445 946 H LEU 132 H LEU 132 220.901 -3.128 -2.524 947 HA LEU 132 HA LEU 132 222.011 -5.521 -1.295 948 HB2 LEU 132 HB2 LEU 132 222.218 -4.161 0.902 949 HB3 LEU 132 HB3 LEU 132 223.513 -4.108 -0.277 950 HG LEU 132 HG LEU 132 221.384 -1.979 -0.138 951 HD11 LEU 132 HD11 LEU 132 224.096 -1.579 1.023 952 HD12 LEU 132 HD12 LEU 132 222.867 -2.399 1.987 953 HD13 LEU 132 HD13 LEU 132 222.576 -0.764 1.391 954 HD21 LEU 132 HD21 LEU 132 223.905 -2.395 -1.640 955 HD22 LEU 132 HD22 LEU 132 223.564 -0.760 -1.072 956 HD23 LEU 132 HD23 LEU 132 222.414 -1.583 -2.123 957 H LYS 133 H LYS 133 220.672 -6.532 0.154 958 HA LYS 133 HA LYS 133 217.950 -5.422 0.326 959 HB2 LYS 133 HB2 LYS 133 218.341 -7.651 -0.854 960 HB3 LYS 133 HB3 LYS 133 218.720 -8.312 0.741 961 HG2 LYS 133 HG2 LYS 133 216.561 -8.295 1.408 962 HG3 LYS 133 HG3 LYS 133 216.173 -6.830 0.506 963 HD2 LYS 133 HD2 LYS 133 215.748 -7.982 -1.446 964 HD3 LYS 133 HD3 LYS 133 216.769 -9.347 -0.987 965 HE2 LYS 133 HE2 LYS 133 215.137 -10.152 0.548 966 HE3 LYS 133 HE3 LYS 133 214.183 -8.677 0.404 967 HZ1 LYS 133 HZ1 LYS 133 213.321 -10.640 -0.854 968 HZ2 LYS 133 HZ2 LYS 133 214.667 -10.517 -1.871 969 HZ3 LYS 133 HZ3 LYS 133 213.552 -9.247 -1.789 970 H PHE 134 H PHE 134 217.026 -5.063 2.264 971 HA PHE 134 HA PHE 134 218.618 -5.758 4.640 972 HB2 PHE 134 HB2 PHE 134 216.717 -3.449 4.208 973 HB3 PHE 134 HB3 PHE 134 217.494 -3.827 5.740 974 HD1 PHE 134 HD1 PHE 134 217.606 -1.376 3.651 975 HD2 PHE 134 HD2 PHE 134 220.222 -4.537 4.796 976 HE1 PHE 134 HE1 PHE 134 219.542 -0.005 3.003 977 HE2 PHE 134 HE2 PHE 134 222.159 -3.168 4.149 978 HZ PHE 134 HZ PHE 134 221.822 -0.899 3.253 979 H THR 135 H THR 135 217.641 -6.591 6.426 980 HA THR 135 HA THR 135 215.373 -8.235 5.998 981 HB THR 135 HB THR 135 217.104 -8.956 7.499 982 HG1 THR 135 HG1 THR 135 215.217 -9.777 8.190 983 HG21 THR 135 HG21 THR 135 217.805 -7.895 9.440 984 HG22 THR 135 HG22 THR 135 216.415 -6.813 9.466 985 HG23 THR 135 HG23 THR 135 217.684 -6.585 8.270 986 H ASP 136 H ASP 136 213.469 -8.281 7.451 987 HA ASP 136 HA ASP 136 212.315 -5.606 7.658 988 HB2 ASP 136 HB2 ASP 136 211.201 -7.680 6.530 989 HB3 ASP 136 HB3 ASP 136 210.805 -8.149 8.179 990 H SER 137 H SER 137 213.009 -8.455 9.648 991 HA SER 137 HA SER 137 211.887 -7.298 12.035 992 HB2 SER 137 HB2 SER 137 211.773 -9.666 11.914 993 HB3 SER 137 HB3 SER 137 213.480 -9.805 11.498 994 HG SER 137 HG SER 137 212.611 -8.727 13.967 995 H GLY 138 H GLY 138 215.023 -7.394 10.514 996 HA2 GLY 138 HA2 GLY 138 216.673 -5.744 11.032 997 HA3 GLY 138 HA3 GLY 138 216.044 -5.689 12.681 998 H ASP 139 H ASP 139 216.846 -8.657 10.909 999 HA ASP 139 HA ASP 139 219.001 -9.088 12.867 1000 HB2 ASP 139 HB2 ASP 139 216.877 -10.868 11.844 1001 HB3 ASP 139 HB3 ASP 139 218.471 -11.602 11.985 1002 HA PRO 140 HA PRO 140 221.051 -10.810 8.956 1003 HB2 PRO 140 HB2 PRO 140 219.646 -11.559 6.798 1004 HB3 PRO 140 HB3 PRO 140 219.757 -12.583 8.235 1005 HG2 PRO 140 HG2 PRO 140 217.540 -10.763 7.376 1006 HG3 PRO 140 HG3 PRO 140 217.446 -12.404 8.039 1007 HD2 PRO 140 HD2 PRO 140 217.054 -10.136 9.524 1008 HD3 PRO 140 HD3 PRO 140 217.625 -11.673 10.197 1009 H GLU 141 H GLU 141 222.158 -9.676 7.390 1010 HA GLU 141 HA GLU 141 220.847 -7.755 5.689 1011 HB2 GLU 141 HB2 GLU 141 222.282 -6.944 8.139 1012 HB3 GLU 141 HB3 GLU 141 222.737 -6.069 6.684 1013 HG2 GLU 141 HG2 GLU 141 220.866 -4.881 6.694 1014 HG3 GLU 141 HG3 GLU 141 219.862 -6.316 6.949 1015 H GLN 142 H GLN 142 221.819 -7.943 3.771 1016 HA GLN 142 HA GLN 142 224.728 -8.383 3.702 1017 HB2 GLN 142 HB2 GLN 142 222.570 -9.991 2.455 1018 HB3 GLN 142 HB3 GLN 142 223.992 -9.687 1.465 1019 HG2 GLN 142 HG2 GLN 142 225.203 -11.166 2.583 1020 HG3 GLN 142 HG3 GLN 142 224.710 -10.509 4.146 1021 HE21 GLN 142 HE21 GLN 142 223.934 -12.798 1.619 1022 HE22 GLN 142 HE22 GLN 142 222.862 -13.770 2.562 1023 H ILE 143 H ILE 143 225.852 -7.482 1.968 1024 HA ILE 143 HA ILE 143 224.320 -5.589 0.303 1025 HB ILE 143 HB ILE 143 227.128 -5.125 1.324 1026 HG12 ILE 143 HG12 ILE 143 224.618 -3.744 2.281 1027 HG13 ILE 143 HG13 ILE 143 225.345 -5.110 3.125 1028 HG21 ILE 143 HG21 ILE 143 227.077 -3.745 -0.454 1029 HG22 ILE 143 HG22 ILE 143 226.174 -2.702 0.645 1030 HG23 ILE 143 HG23 ILE 143 225.316 -3.711 -0.519 1031 HD11 ILE 143 HD11 ILE 143 225.943 -2.406 3.435 1032 HD12 ILE 143 HD12 ILE 143 227.323 -3.101 2.586 1033 HD13 ILE 143 HD13 ILE 143 226.802 -3.782 4.126 1034 H MET 144 H MET 144 225.015 -5.284 -1.830 1035 HA MET 144 HA MET 144 227.253 -6.901 -2.806 1036 HB2 MET 144 HB2 MET 144 224.907 -8.093 -2.924 1037 HB3 MET 144 HB3 MET 144 224.676 -7.051 -4.320 1038 HG2 MET 144 HG2 MET 144 227.242 -8.316 -4.465 1039 HG3 MET 144 HG3 MET 144 225.986 -9.524 -4.205 1040 HE1 MET 144 HE1 MET 144 227.182 -7.393 -7.886 1041 HE2 MET 144 HE2 MET 144 227.778 -8.979 -7.394 1042 HE3 MET 144 HE3 MET 144 227.964 -7.594 -6.319 1043 H VAL 145 H VAL 145 228.383 -5.884 -4.388 1044 HA VAL 145 HA VAL 145 227.052 -3.786 -5.932 1045 HB VAL 145 HB VAL 145 228.085 -2.623 -4.037 1046 HG11 VAL 145 HG11 VAL 145 230.320 -2.736 -3.466 1047 HG12 VAL 145 HG12 VAL 145 230.804 -3.353 -5.046 1048 HG13 VAL 145 HG13 VAL 145 229.970 -4.408 -3.904 1049 HG21 VAL 145 HG21 VAL 145 229.651 -1.138 -5.454 1050 HG22 VAL 145 HG22 VAL 145 227.955 -1.265 -5.920 1051 HG23 VAL 145 HG23 VAL 145 229.182 -2.184 -6.792 1052 H SER 146 H SER 146 227.769 -3.533 -7.981 1053 HA SER 146 HA SER 146 230.191 -4.945 -8.830 1054 HB2 SER 146 HB2 SER 146 227.701 -6.044 -9.236 1055 HB3 SER 146 HB3 SER 146 227.975 -5.174 -10.745 1056 HG SER 146 HG SER 146 229.050 -7.484 -9.915 1057 H LYS 147 H LYS 147 230.970 -4.260 -10.948 1058 HA LYS 147 HA LYS 147 230.307 -1.444 -11.457 1059 HB2 LYS 147 HB2 LYS 147 232.507 -1.483 -12.742 1060 HB3 LYS 147 HB3 LYS 147 232.614 -1.652 -10.986 1061 HG2 LYS 147 HG2 LYS 147 233.354 -3.794 -11.101 1062 HG3 LYS 147 HG3 LYS 147 232.456 -4.146 -12.578 1063 HD2 LYS 147 HD2 LYS 147 234.633 -2.164 -12.813 1064 HD3 LYS 147 HD3 LYS 147 235.124 -3.831 -12.503 1065 HE2 LYS 147 HE2 LYS 147 235.005 -4.022 -14.742 1066 HE3 LYS 147 HE3 LYS 147 233.280 -4.213 -14.438 1067 HZ1 LYS 147 HZ1 LYS 147 233.843 -2.567 -16.191 1068 HZ2 LYS 147 HZ2 LYS 147 234.567 -1.598 -15.008 1069 HZ3 LYS 147 HZ3 LYS 147 232.909 -1.930 -14.931 1070 H CYS 148 H CYS 148 229.526 -0.761 -13.388 1071 HA CYS 148 HA CYS 148 229.219 -2.792 -15.503 1072 HB2 CYS 148 HB2 CYS 148 227.099 -2.039 -14.334 1073 HB3 CYS 148 HB3 CYS 148 227.365 -0.455 -15.051 1074 HA PRO 149 HA PRO 149 231.775 0.133 -17.757 1075 HB2 PRO 149 HB2 PRO 149 231.994 -1.349 -20.017 1076 HB3 PRO 149 HB3 PRO 149 232.917 -1.703 -18.545 1077 HG2 PRO 149 HG2 PRO 149 230.402 -2.977 -19.560 1078 HG3 PRO 149 HG3 PRO 149 231.840 -3.744 -18.863 1079 HD2 PRO 149 HD2 PRO 149 229.574 -3.315 -17.443 1080 HD3 PRO 149 HD3 PRO 149 231.185 -3.290 -16.702 Start of MODEL 2 1 H1 THR 1 H1 THR 1 210.018 3.122 -37.757 2 H2 THR 1 H2 THR 1 209.656 2.736 -36.125 3 H3 THR 1 H3 THR 1 210.984 1.987 -36.912 4 HA THR 1 HA THR 1 210.693 4.823 -36.181 5 HB THR 1 HB THR 1 211.235 3.263 -34.346 6 HG1 THR 1 HG1 THR 1 213.070 4.345 -33.655 7 HG21 THR 1 HG21 THR 1 212.520 1.494 -34.649 8 HG22 THR 1 HG22 THR 1 213.896 2.564 -34.909 9 HG23 THR 1 HG23 THR 1 212.929 2.025 -36.280 10 HA PRO 2 HA PRO 2 213.452 5.681 -39.548 11 HB2 PRO 2 HB2 PRO 2 214.430 8.067 -38.743 12 HB3 PRO 2 HB3 PRO 2 212.766 7.866 -39.306 13 HG2 PRO 2 HG2 PRO 2 213.811 8.017 -36.505 14 HG3 PRO 2 HG3 PRO 2 212.375 8.785 -37.205 15 HD2 PRO 2 HD2 PRO 2 212.270 6.514 -35.713 16 HD3 PRO 2 HD3 PRO 2 211.106 6.883 -37.000 17 H SER 3 H SER 3 215.413 4.884 -39.986 18 HA SER 3 HA SER 3 217.676 5.433 -38.277 19 HB2 SER 3 HB2 SER 3 216.481 3.346 -37.354 20 HB3 SER 3 HB3 SER 3 217.062 2.530 -38.806 21 HG SER 3 HG SER 3 218.667 3.844 -36.862 22 H ALA 4 H ALA 4 219.655 5.175 -39.308 23 HA ALA 4 HA ALA 4 219.884 3.863 -41.848 24 HB1 ALA 4 HB1 ALA 4 220.723 6.207 -42.821 25 HB2 ALA 4 HB2 ALA 4 219.474 6.792 -41.722 26 HB3 ALA 4 HB3 ALA 4 219.063 5.640 -42.993 27 H SER 5 H SER 5 221.493 6.661 -40.299 28 HA SER 5 HA SER 5 223.755 5.107 -39.483 29 HB2 SER 5 HB2 SER 5 223.780 6.095 -42.140 30 HB3 SER 5 HB3 SER 5 224.901 7.095 -41.216 31 HG SER 5 HG SER 5 224.906 4.263 -41.411 32 H GLY 6 H GLY 6 225.676 6.902 -39.054 33 HA2 GLY 6 HA2 GLY 6 226.308 8.824 -37.927 34 HA3 GLY 6 HA3 GLY 6 224.677 9.443 -38.138 35 H LEU 7 H LEU 7 223.679 9.809 -36.278 36 HA LEU 7 HA LEU 7 223.034 9.696 -34.107 37 HB2 LEU 7 HB2 LEU 7 222.146 7.528 -34.974 38 HB3 LEU 7 HB3 LEU 7 223.601 6.746 -34.388 39 HG LEU 7 HG LEU 7 222.978 7.551 -32.074 40 HD11 LEU 7 HD11 LEU 7 221.047 8.632 -31.631 41 HD12 LEU 7 HD12 LEU 7 220.166 7.830 -32.931 42 HD13 LEU 7 HD13 LEU 7 221.234 9.185 -33.295 43 HD21 LEU 7 HD21 LEU 7 222.651 5.265 -32.614 44 HD22 LEU 7 HD22 LEU 7 221.220 5.626 -33.581 45 HD23 LEU 7 HD23 LEU 7 221.171 5.817 -31.829 46 H THR 8 H THR 8 224.992 10.901 -33.570 47 HA THR 8 HA THR 8 226.924 9.299 -32.024 48 HB THR 8 HB THR 8 227.549 12.084 -32.932 49 HG1 THR 8 HG1 THR 8 227.736 9.768 -34.555 50 HG21 THR 8 HG21 THR 8 229.151 10.977 -31.484 51 HG22 THR 8 HG22 THR 8 229.819 11.235 -33.097 52 HG23 THR 8 HG23 THR 8 229.261 9.631 -32.618 53 H LYS 9 H LYS 9 226.112 9.339 -29.988 54 HA LYS 9 HA LYS 9 224.944 11.732 -28.871 55 HB2 LYS 9 HB2 LYS 9 224.175 9.371 -28.362 56 HB3 LYS 9 HB3 LYS 9 225.638 9.182 -27.406 57 HG2 LYS 9 HG2 LYS 9 223.805 9.720 -25.957 58 HG3 LYS 9 HG3 LYS 9 224.923 11.085 -26.001 59 HD2 LYS 9 HD2 LYS 9 222.769 11.165 -28.005 60 HD3 LYS 9 HD3 LYS 9 222.234 11.287 -26.328 61 HE2 LYS 9 HE2 LYS 9 224.276 13.017 -26.252 62 HE3 LYS 9 HE3 LYS 9 223.852 13.163 -27.958 63 HZ1 LYS 9 HZ1 LYS 9 222.201 13.782 -25.590 64 HZ2 LYS 9 HZ2 LYS 9 221.480 13.477 -27.091 65 HZ3 LYS 9 HZ3 LYS 9 222.562 14.766 -26.918 66 H VAL 10 H VAL 10 226.078 13.326 -27.984 67 HA VAL 10 HA VAL 10 228.732 12.715 -26.849 68 HB VAL 10 HB VAL 10 227.832 15.379 -27.960 69 HG11 VAL 10 HG11 VAL 10 229.842 16.221 -27.384 70 HG12 VAL 10 HG12 VAL 10 230.691 14.711 -27.718 71 HG13 VAL 10 HG13 VAL 10 229.826 14.919 -26.196 72 HG21 VAL 10 HG21 VAL 10 228.288 13.171 -29.481 73 HG22 VAL 10 HG22 VAL 10 229.903 13.873 -29.404 74 HG23 VAL 10 HG23 VAL 10 228.553 14.827 -30.020 75 H ALA 11 H ALA 11 226.132 15.159 -26.565 76 HA ALA 11 HA ALA 11 226.866 15.899 -23.913 77 HB1 ALA 11 HB1 ALA 11 225.208 17.475 -24.038 78 HB2 ALA 11 HB2 ALA 11 224.120 16.422 -24.943 79 HB3 ALA 11 HB3 ALA 11 225.489 17.184 -25.754 80 H THR 12 H THR 12 226.434 14.903 -22.065 81 HA THR 12 HA THR 12 224.675 12.605 -22.018 82 HB THR 12 HB THR 12 225.450 12.775 -19.467 83 HG1 THR 12 HG1 THR 12 226.723 14.438 -19.270 84 HG21 THR 12 HG21 THR 12 227.155 11.266 -19.870 85 HG22 THR 12 HG22 THR 12 227.568 11.994 -21.422 86 HG23 THR 12 HG23 THR 12 226.090 11.047 -21.259 87 H VAL 13 H VAL 13 222.735 12.437 -21.009 88 HA VAL 13 HA VAL 13 221.510 14.940 -20.116 89 HB VAL 13 HB VAL 13 219.361 13.591 -20.194 90 HG11 VAL 13 HG11 VAL 13 219.412 14.980 -21.972 91 HG12 VAL 13 HG12 VAL 13 219.622 13.475 -22.864 92 HG13 VAL 13 HG13 VAL 13 221.024 14.467 -22.468 93 HG21 VAL 13 HG21 VAL 13 220.569 11.670 -22.067 94 HG22 VAL 13 HG22 VAL 13 219.292 11.444 -20.872 95 HG23 VAL 13 HG23 VAL 13 220.981 11.417 -20.372 96 H SER 14 H SER 14 222.047 15.255 -18.020 97 HA SER 14 HA SER 14 221.707 13.049 -16.119 98 HB2 SER 14 HB2 SER 14 223.788 14.643 -16.265 99 HB3 SER 14 HB3 SER 14 222.765 15.748 -15.349 100 HG SER 14 HG SER 14 224.064 14.382 -14.014 101 H ALA 15 H ALA 15 219.376 14.242 -17.278 102 HA ALA 15 HA ALA 15 218.055 15.120 -14.829 103 HB1 ALA 15 HB1 ALA 15 218.219 17.260 -15.561 104 HB2 ALA 15 HB2 ALA 15 216.815 16.794 -16.524 105 HB3 ALA 15 HB3 ALA 15 218.424 16.783 -17.246 106 H ALA 16 H ALA 16 216.176 14.083 -14.568 107 HA ALA 16 HA ALA 16 215.295 12.125 -16.380 108 HB1 ALA 16 HB1 ALA 16 214.862 11.979 -13.985 109 HB2 ALA 16 HB2 ALA 16 213.360 11.870 -14.905 110 HB3 ALA 16 HB3 ALA 16 213.784 13.374 -14.086 111 H SER 17 H SER 17 214.611 12.642 -18.360 112 HA SER 17 HA SER 17 213.053 15.018 -18.867 113 HB2 SER 17 HB2 SER 17 214.456 13.003 -20.481 114 HB3 SER 17 HB3 SER 17 212.953 13.576 -21.200 115 HG SER 17 HG SER 17 215.327 14.832 -21.000 116 H SER 18 H SER 18 210.959 15.104 -19.660 117 HA SER 18 HA SER 18 209.121 13.325 -18.452 118 HB2 SER 18 HB2 SER 18 208.962 15.862 -19.401 119 HB3 SER 18 HB3 SER 18 208.143 14.985 -20.693 120 HG SER 18 HG SER 18 206.795 14.058 -19.048 121 H LEU 19 H LEU 19 208.291 11.460 -19.142 122 HA LEU 19 HA LEU 19 208.004 9.583 -20.410 123 HB2 LEU 19 HB2 LEU 19 206.711 11.831 -21.670 124 HB3 LEU 19 HB3 LEU 19 207.191 10.656 -22.879 125 HG LEU 19 HG LEU 19 205.773 9.633 -20.473 126 HD11 LEU 19 HD11 LEU 19 204.180 11.217 -20.744 127 HD12 LEU 19 HD12 LEU 19 203.651 10.118 -22.020 128 HD13 LEU 19 HD13 LEU 19 204.622 11.535 -22.421 129 HD21 LEU 19 HD21 LEU 19 206.692 8.430 -22.667 130 HD22 LEU 19 HD22 LEU 19 205.096 8.891 -23.261 131 HD23 LEU 19 HD23 LEU 19 205.247 7.883 -21.821 132 H ILE 20 H ILE 20 210.629 10.123 -20.349 133 HA ILE 20 HA ILE 20 211.601 9.920 -23.112 134 HB ILE 20 HB ILE 20 212.592 11.686 -21.677 135 HG12 ILE 20 HG12 ILE 20 214.459 9.492 -22.569 136 HG13 ILE 20 HG13 ILE 20 213.815 10.810 -23.561 137 HG21 ILE 20 HG21 ILE 20 213.837 11.257 -19.766 138 HG22 ILE 20 HG22 ILE 20 214.054 9.556 -20.168 139 HG23 ILE 20 HG23 ILE 20 212.489 10.134 -19.601 140 HD11 ILE 20 HD11 ILE 20 216.152 11.159 -22.833 141 HD12 ILE 20 HD12 ILE 20 215.585 11.212 -21.163 142 HD13 ILE 20 HD13 ILE 20 215.049 12.434 -22.315 143 H GLY 21 H GLY 21 212.978 8.284 -23.754 144 HA2 GLY 21 HA2 GLY 21 212.740 5.832 -22.175 145 HA3 GLY 21 HA3 GLY 21 213.169 5.925 -23.887 146 H GLU 22 H GLU 22 214.431 4.657 -21.422 147 HA GLU 22 HA GLU 22 217.151 5.555 -22.009 148 HB2 GLU 22 HB2 GLU 22 215.783 6.109 -19.574 149 HB3 GLU 22 HB3 GLU 22 217.046 4.940 -19.232 150 HG2 GLU 22 HG2 GLU 22 218.678 6.405 -20.231 151 HG3 GLU 22 HG3 GLU 22 217.410 7.571 -20.595 152 H GLY 23 H GLY 23 218.649 3.948 -22.050 153 HA2 GLY 23 HA2 GLY 23 217.644 1.222 -21.870 154 HA3 GLY 23 HA3 GLY 23 219.204 1.728 -22.527 155 H PHE 24 H PHE 24 217.407 1.358 -19.485 156 HA PHE 24 HA PHE 24 219.585 1.634 -17.736 157 HB2 PHE 24 HB2 PHE 24 217.108 -0.063 -17.316 158 HB3 PHE 24 HB3 PHE 24 218.191 0.548 -16.057 159 HD1 PHE 24 HD1 PHE 24 218.343 3.040 -15.704 160 HD2 PHE 24 HD2 PHE 24 215.326 1.235 -18.105 161 HE1 PHE 24 HE1 PHE 24 216.980 5.081 -15.520 162 HE2 PHE 24 HE2 PHE 24 213.959 3.272 -17.923 163 HZ PHE 24 HZ PHE 24 214.787 5.199 -16.632 164 H MET 25 H MET 25 218.311 -1.181 -19.451 165 HA MET 25 HA MET 25 219.917 -3.122 -18.157 166 HB2 MET 25 HB2 MET 25 218.570 -3.124 -20.859 167 HB3 MET 25 HB3 MET 25 219.398 -4.522 -20.187 168 HG2 MET 25 HG2 MET 25 217.275 -5.002 -19.560 169 HG3 MET 25 HG3 MET 25 217.786 -4.070 -18.154 170 HE1 MET 25 HE1 MET 25 215.047 -2.982 -21.554 171 HE2 MET 25 HE2 MET 25 216.610 -3.790 -21.649 172 HE3 MET 25 HE3 MET 25 216.525 -2.030 -21.696 173 H ALA 26 H ALA 26 220.492 -0.934 -20.827 174 HA ALA 26 HA ALA 26 222.790 -2.229 -21.884 175 HB1 ALA 26 HB1 ALA 26 221.689 -0.705 -23.308 176 HB2 ALA 26 HB2 ALA 26 223.228 0.055 -22.903 177 HB3 ALA 26 HB3 ALA 26 221.746 0.583 -22.104 178 H GLN 27 H GLN 27 222.281 0.054 -19.267 179 HA GLN 27 HA GLN 27 225.180 0.275 -18.855 180 HB2 GLN 27 HB2 GLN 27 222.964 2.084 -18.505 181 HB3 GLN 27 HB3 GLN 27 223.833 1.896 -16.988 182 HG2 GLN 27 HG2 GLN 27 225.506 2.306 -19.371 183 HG3 GLN 27 HG3 GLN 27 224.489 3.666 -18.899 184 HE21 GLN 27 HE21 GLN 27 226.463 1.220 -17.222 185 HE22 GLN 27 HE22 GLN 27 227.299 2.356 -16.207 186 H CYS 28 H CYS 28 222.963 -1.871 -17.979 187 HA CYS 28 HA CYS 28 222.688 -3.346 -16.283 188 HB2 CYS 28 HB2 CYS 28 225.401 -2.328 -15.419 189 HB3 CYS 28 HB3 CYS 28 224.637 -3.809 -14.861 190 H ASP 29 H ASP 29 220.940 -1.925 -15.561 191 HA ASP 29 HA ASP 29 221.414 -1.030 -12.818 192 HB2 ASP 29 HB2 ASP 29 220.276 0.648 -15.046 193 HB3 ASP 29 HB3 ASP 29 219.812 0.939 -13.363 194 H ASN 30 H ASN 30 220.108 -2.275 -11.652 195 HA ASN 30 HA ASN 30 217.759 -3.497 -12.717 196 HB2 ASN 30 HB2 ASN 30 218.509 -3.284 -9.796 197 HB3 ASN 30 HB3 ASN 30 217.471 -4.488 -10.549 198 HD21 ASN 30 HD21 ASN 30 219.869 -4.825 -8.919 199 HD22 ASN 30 HD22 ASN 30 220.978 -5.745 -9.889 200 HA PRO 31 HA PRO 31 215.148 0.115 -12.070 201 HB2 PRO 31 HB2 PRO 31 212.812 -1.181 -12.735 202 HB3 PRO 31 HB3 PRO 31 213.917 -0.405 -13.880 203 HG2 PRO 31 HG2 PRO 31 213.638 -3.283 -13.176 204 HG3 PRO 31 HG3 PRO 31 213.963 -2.521 -14.744 205 HD2 PRO 31 HD2 PRO 31 215.904 -3.704 -13.277 206 HD3 PRO 31 HD3 PRO 31 216.216 -2.300 -14.319 207 H THR 32 H THR 32 214.599 0.712 -10.076 208 HA THR 32 HA THR 32 213.287 -1.261 -8.326 209 HB THR 32 HB THR 32 214.161 0.434 -6.506 210 HG1 THR 32 HG1 THR 32 215.135 1.957 -7.711 211 HG21 THR 32 HG21 THR 32 216.157 -0.852 -6.194 212 HG22 THR 32 HG22 THR 32 216.082 -1.441 -7.855 213 HG23 THR 32 HG23 THR 32 214.846 -1.923 -6.691 214 H ILE 33 H ILE 33 211.430 -0.772 -7.333 215 HA ILE 33 HA ILE 33 210.257 1.897 -7.806 216 HB ILE 33 HB ILE 33 208.124 0.161 -7.312 217 HG12 ILE 33 HG12 ILE 33 208.439 -1.446 -9.297 218 HG13 ILE 33 HG13 ILE 33 210.159 -1.106 -9.148 219 HG21 ILE 33 HG21 ILE 33 208.887 0.941 -10.087 220 HG22 ILE 33 HG22 ILE 33 208.525 2.186 -8.890 221 HG23 ILE 33 HG23 ILE 33 207.309 0.975 -9.299 222 HD11 ILE 33 HD11 ILE 33 210.030 -2.972 -7.863 223 HD12 ILE 33 HD12 ILE 33 208.365 -2.654 -7.371 224 HD13 ILE 33 HD13 ILE 33 209.691 -1.761 -6.627 225 H GLU 34 H GLU 34 208.950 2.754 -6.156 226 HA GLU 34 HA GLU 34 209.923 2.449 -3.581 227 HB2 GLU 34 HB2 GLU 34 207.781 3.623 -2.860 228 HB3 GLU 34 HB3 GLU 34 208.776 4.451 -4.049 229 HG2 GLU 34 HG2 GLU 34 207.280 4.023 -5.781 230 HG3 GLU 34 HG3 GLU 34 206.475 2.732 -4.896 231 H GLY 35 H GLY 35 209.938 0.620 -2.459 232 HA2 GLY 35 HA2 GLY 35 207.553 -1.102 -2.434 233 HA3 GLY 35 HA3 GLY 35 209.172 -1.576 -1.923 234 H ASP 36 H ASP 36 209.936 -0.966 0.094 235 HA ASP 36 HA ASP 36 207.922 0.104 1.958 236 HB2 ASP 36 HB2 ASP 36 209.842 -2.191 2.438 237 HB3 ASP 36 HB3 ASP 36 208.817 -1.455 3.680 238 H GLY 37 H GLY 37 210.141 1.469 0.555 239 HA2 GLY 37 HA2 GLY 37 212.258 1.868 2.454 240 HA3 GLY 37 HA3 GLY 37 211.990 2.786 0.983 241 HA PRO 38 HA PRO 38 210.072 4.715 5.131 242 HB2 PRO 38 HB2 PRO 38 212.859 5.444 5.875 243 HB3 PRO 38 HB3 PRO 38 211.504 4.957 6.910 244 HG2 PRO 38 HG2 PRO 38 213.509 3.276 6.414 245 HG3 PRO 38 HG3 PRO 38 211.834 2.697 6.497 246 HD2 PRO 38 HD2 PRO 38 213.551 3.202 4.100 247 HD3 PRO 38 HD3 PRO 38 212.386 1.897 4.399 248 H ILE 39 H ILE 39 209.241 6.451 4.132 249 HA ILE 39 HA ILE 39 210.811 8.205 2.491 250 HB ILE 39 HB ILE 39 207.972 8.612 3.438 251 HG12 ILE 39 HG12 ILE 39 208.382 7.581 0.716 252 HG13 ILE 39 HG13 ILE 39 208.853 6.450 1.980 253 HG21 ILE 39 HG21 ILE 39 209.673 9.880 1.341 254 HG22 ILE 39 HG22 ILE 39 208.562 10.621 2.494 255 HG23 ILE 39 HG23 ILE 39 207.932 9.761 1.090 256 HD11 ILE 39 HD11 ILE 39 206.427 6.460 1.041 257 HD12 ILE 39 HD12 ILE 39 206.210 7.808 2.157 258 HD13 ILE 39 HD13 ILE 39 206.712 6.231 2.765 259 H GLY 40 H GLY 40 210.943 10.529 2.803 260 HA2 GLY 40 HA2 GLY 40 211.204 12.468 4.036 261 HA3 GLY 40 HA3 GLY 40 210.446 11.663 5.398 262 H LYS 41 H LYS 41 213.093 9.948 4.041 263 HA LYS 41 HA LYS 41 214.934 11.090 6.027 264 HB2 LYS 41 HB2 LYS 41 214.067 9.051 6.987 265 HB3 LYS 41 HB3 LYS 41 214.396 8.164 5.506 266 HG2 LYS 41 HG2 LYS 41 216.539 7.825 6.041 267 HG3 LYS 41 HG3 LYS 41 216.747 9.465 6.661 268 HD2 LYS 41 HD2 LYS 41 217.041 8.012 8.509 269 HD3 LYS 41 HD3 LYS 41 215.440 8.731 8.693 270 HE2 LYS 41 HE2 LYS 41 215.633 6.161 7.220 271 HE3 LYS 41 HE3 LYS 41 215.881 6.118 8.965 272 HZ1 LYS 41 HZ1 LYS 41 213.714 7.387 9.117 273 HZ2 LYS 41 HZ2 LYS 41 213.599 5.769 8.634 274 HZ3 LYS 41 HZ3 LYS 41 213.473 7.003 7.485 275 H THR 42 H THR 42 216.920 11.520 5.279 276 HA THR 42 HA THR 42 217.671 10.459 2.634 277 HB THR 42 HB THR 42 218.487 13.095 3.872 278 HG1 THR 42 HG1 THR 42 216.652 12.548 1.781 279 HG21 THR 42 HG21 THR 42 220.072 12.028 2.188 280 HG22 THR 42 HG22 THR 42 219.528 13.675 1.870 281 HG23 THR 42 HG23 THR 42 218.806 12.324 0.996 282 H LEU 43 H LEU 43 219.676 9.581 2.358 283 HA LEU 43 HA LEU 43 221.345 9.377 4.773 284 HB2 LEU 43 HB2 LEU 43 222.221 7.289 3.897 285 HB3 LEU 43 HB3 LEU 43 220.477 7.217 4.032 286 HG LEU 43 HG LEU 43 220.521 7.850 1.496 287 HD11 LEU 43 HD11 LEU 43 222.695 6.427 0.705 288 HD12 LEU 43 HD12 LEU 43 223.340 7.302 2.094 289 HD13 LEU 43 HD13 LEU 43 222.611 8.185 0.754 290 HD21 LEU 43 HD21 LEU 43 219.675 5.751 2.411 291 HD22 LEU 43 HD22 LEU 43 221.317 5.112 2.481 292 HD23 LEU 43 HD23 LEU 43 220.578 5.477 0.921 293 H TYR 44 H TYR 44 223.592 9.610 4.591 294 HA TYR 44 HA TYR 44 224.425 11.189 2.263 295 HB2 TYR 44 HB2 TYR 44 224.748 11.578 5.027 296 HB3 TYR 44 HB3 TYR 44 226.345 11.161 4.421 297 HD1 TYR 44 HD1 TYR 44 223.482 13.456 3.786 298 HD2 TYR 44 HD2 TYR 44 227.666 12.787 3.413 299 HE1 TYR 44 HE1 TYR 44 223.774 15.763 2.988 300 HE2 TYR 44 HE2 TYR 44 227.971 15.091 2.615 301 HH TYR 44 HH TYR 44 226.564 16.856 1.492 302 H VAL 45 H VAL 45 226.064 10.589 0.969 303 HA VAL 45 HA VAL 45 227.394 8.027 1.563 304 HB VAL 45 HB VAL 45 227.744 7.885 -0.942 305 HG11 VAL 45 HG11 VAL 45 225.884 6.803 0.530 306 HG12 VAL 45 HG12 VAL 45 225.786 6.710 -1.228 307 HG13 VAL 45 HG13 VAL 45 224.819 7.896 -0.351 308 HG21 VAL 45 HG21 VAL 45 225.417 9.619 -1.427 309 HG22 VAL 45 HG22 VAL 45 226.870 9.370 -2.393 310 HG23 VAL 45 HG23 VAL 45 226.908 10.461 -1.011 311 H VAL 46 H VAL 46 229.445 8.251 2.126 312 HA VAL 46 HA VAL 46 231.035 10.379 0.852 313 HB VAL 46 HB VAL 46 232.399 10.500 2.909 314 HG11 VAL 46 HG11 VAL 46 230.521 11.514 4.366 315 HG12 VAL 46 HG12 VAL 46 229.476 11.135 2.995 316 HG13 VAL 46 HG13 VAL 46 230.852 12.219 2.783 317 HG21 VAL 46 HG21 VAL 46 232.019 8.312 3.840 318 HG22 VAL 46 HG22 VAL 46 230.300 8.647 4.030 319 HG23 VAL 46 HG23 VAL 46 231.480 9.526 5.000 320 H GLY 47 H GLY 47 233.306 9.934 0.602 321 HA2 GLY 47 HA2 GLY 47 234.595 7.543 1.166 322 HA3 GLY 47 HA3 GLY 47 233.796 7.319 -0.395 323 H ASP 48 H ASP 48 236.696 7.737 0.684 324 HA ASP 48 HA ASP 48 237.528 10.050 -0.845 325 HB2 ASP 48 HB2 ASP 48 238.641 9.557 1.284 326 HB3 ASP 48 HB3 ASP 48 239.167 7.993 0.657 327 H PHE 49 H PHE 49 236.908 9.474 -2.924 328 HA PHE 49 HA PHE 49 238.070 7.107 -4.154 329 HB2 PHE 49 HB2 PHE 49 236.410 9.214 -5.540 330 HB3 PHE 49 HB3 PHE 49 236.644 7.523 -6.003 331 HD1 PHE 49 HD1 PHE 49 235.696 5.739 -4.438 332 HD2 PHE 49 HD2 PHE 49 234.588 9.843 -4.254 333 HE1 PHE 49 HE1 PHE 49 233.637 5.125 -3.243 334 HE2 PHE 49 HE2 PHE 49 232.527 9.236 -3.058 335 HZ PHE 49 HZ PHE 49 232.049 6.874 -2.552 336 H ALA 50 H ALA 50 238.577 7.839 -6.716 337 HA ALA 50 HA ALA 50 241.072 9.286 -6.447 338 HB1 ALA 50 HB1 ALA 50 239.813 7.759 -8.708 339 HB2 ALA 50 HB2 ALA 50 241.242 7.341 -7.761 340 HB3 ALA 50 HB3 ALA 50 241.302 8.682 -8.903 341 H ASP 51 H ASP 51 238.094 9.641 -8.401 342 HA ASP 51 HA ASP 51 238.780 12.488 -8.731 343 HB2 ASP 51 HB2 ASP 51 237.877 10.476 -10.739 344 HB3 ASP 51 HB3 ASP 51 237.283 12.135 -10.910 345 H ALA 52 H ALA 52 237.338 11.832 -6.550 346 HA ALA 52 HA ALA 52 234.803 13.119 -7.103 347 HB1 ALA 52 HB1 ALA 52 235.008 10.257 -6.411 348 HB2 ALA 52 HB2 ALA 52 233.753 11.126 -7.295 349 HB3 ALA 52 HB3 ALA 52 233.797 11.188 -5.533 350 H SER 53 H SER 53 236.495 11.288 -4.555 351 HA SER 53 HA SER 53 236.846 11.707 -2.344 352 HB2 SER 53 HB2 SER 53 237.148 14.573 -3.263 353 HB3 SER 53 HB3 SER 53 237.886 13.825 -1.846 354 HG SER 53 HG SER 53 239.022 12.437 -3.323 355 H TRP 54 H TRP 54 234.760 11.199 -1.588 356 HA TRP 54 HA TRP 54 232.847 11.535 -0.415 357 HB2 TRP 54 HB2 TRP 54 233.738 14.397 -0.018 358 HB3 TRP 54 HB3 TRP 54 232.689 13.434 1.029 359 HD1 TRP 54 HD1 TRP 54 235.072 10.946 0.582 360 HE1 TRP 54 HE1 TRP 54 237.037 11.042 2.239 361 HE3 TRP 54 HE3 TRP 54 234.524 15.766 2.193 362 HZ2 TRP 54 HZ2 TRP 54 238.193 12.921 4.009 363 HZ3 TRP 54 HZ3 TRP 54 236.101 16.635 3.871 364 HH2 TRP 54 HH2 TRP 54 237.896 15.239 4.759 365 H LYS 55 H LYS 55 232.161 11.416 -2.851 366 HA LYS 55 HA LYS 55 230.801 13.859 -3.701 367 HB2 LYS 55 HB2 LYS 55 231.771 11.422 -5.038 368 HB3 LYS 55 HB3 LYS 55 230.213 11.997 -5.613 369 HG2 LYS 55 HG2 LYS 55 231.758 14.290 -5.491 370 HG3 LYS 55 HG3 LYS 55 232.868 13.052 -6.083 371 HD2 LYS 55 HD2 LYS 55 230.144 13.629 -7.247 372 HD3 LYS 55 HD3 LYS 55 231.667 14.237 -7.899 373 HE2 LYS 55 HE2 LYS 55 232.230 12.240 -8.798 374 HE3 LYS 55 HE3 LYS 55 231.539 11.324 -7.461 375 HZ1 LYS 55 HZ1 LYS 55 229.530 11.196 -8.464 376 HZ2 LYS 55 HZ2 LYS 55 230.468 11.347 -9.864 377 HZ3 LYS 55 HZ3 LYS 55 229.669 12.698 -9.232 378 H GLN 56 H GLN 56 228.749 14.199 -3.184 379 HA GLN 56 HA GLN 56 226.958 11.886 -2.859 380 HB2 GLN 56 HB2 GLN 56 227.660 12.959 -0.665 381 HB3 GLN 56 HB3 GLN 56 226.782 14.390 -1.182 382 HG2 GLN 56 HG2 GLN 56 225.374 11.766 -1.182 383 HG3 GLN 56 HG3 GLN 56 225.661 12.592 0.359 384 HE21 GLN 56 HE21 GLN 56 224.998 14.940 0.362 385 HE22 GLN 56 HE22 GLN 56 223.505 15.328 -0.412 386 H LYS 57 H LYS 57 225.819 12.031 -4.723 387 HA LYS 57 HA LYS 57 224.941 14.576 -5.768 388 HB2 LYS 57 HB2 LYS 57 225.050 11.808 -6.706 389 HB3 LYS 57 HB3 LYS 57 223.567 12.627 -7.171 390 HG2 LYS 57 HG2 LYS 57 224.657 14.146 -8.500 391 HG3 LYS 57 HG3 LYS 57 226.175 13.996 -7.613 392 HD2 LYS 57 HD2 LYS 57 226.885 12.609 -9.202 393 HD3 LYS 57 HD3 LYS 57 225.668 11.451 -8.662 394 HE2 LYS 57 HE2 LYS 57 224.717 13.608 -10.443 395 HE3 LYS 57 HE3 LYS 57 225.803 12.427 -11.172 396 HZ1 LYS 57 HZ1 LYS 57 223.833 11.383 -11.504 397 HZ2 LYS 57 HZ2 LYS 57 223.087 12.076 -10.152 398 HZ3 LYS 57 HZ3 LYS 57 224.155 10.778 -9.956 399 HA PRO 58 HA PRO 58 221.258 14.764 -3.210 400 HB2 PRO 58 HB2 PRO 58 220.373 16.544 -5.434 401 HB3 PRO 58 HB3 PRO 58 220.375 16.832 -3.683 402 HG2 PRO 58 HG2 PRO 58 222.192 17.987 -5.248 403 HG3 PRO 58 HG3 PRO 58 222.631 17.371 -3.643 404 HD2 PRO 58 HD2 PRO 58 223.166 16.196 -6.338 405 HD3 PRO 58 HD3 PRO 58 224.193 16.213 -4.890 406 H HIS 59 H HIS 59 221.084 14.399 -6.746 407 HA HIS 59 HA HIS 59 218.430 13.405 -6.828 408 HB2 HIS 59 HB2 HIS 59 220.028 14.329 -8.728 409 HB3 HIS 59 HB3 HIS 59 220.426 12.616 -8.908 410 HD1 HIS 59 HD1 HIS 59 217.708 15.094 -9.493 411 HD2 HIS 59 HD2 HIS 59 218.324 11.003 -9.885 412 HE1 HIS 59 HE1 HIS 59 215.813 14.262 -10.920 413 HE2 HIS 59 HE2 HIS 59 216.136 11.766 -11.033 414 H ARG 60 H ARG 60 221.345 11.955 -5.805 415 HA ARG 60 HA ARG 60 220.120 9.279 -5.961 416 HB2 ARG 60 HB2 ARG 60 223.087 9.858 -5.983 417 HB3 ARG 60 HB3 ARG 60 222.312 8.296 -6.198 418 HG2 ARG 60 HG2 ARG 60 221.762 10.535 -8.100 419 HG3 ARG 60 HG3 ARG 60 223.217 9.548 -8.259 420 HD2 ARG 60 HD2 ARG 60 221.758 8.404 -9.612 421 HD3 ARG 60 HD3 ARG 60 221.535 7.555 -8.073 422 HE ARG 60 HE ARG 60 219.621 9.410 -7.931 423 HH11 ARG 60 HH11 ARG 60 220.485 7.266 -10.564 424 HH12 ARG 60 HH12 ARG 60 218.871 7.173 -11.176 425 HH21 ARG 60 HH21 ARG 60 217.499 9.274 -8.737 426 HH22 ARG 60 HH22 ARG 60 217.175 8.314 -10.143 427 H ALA 61 H ALA 61 220.304 11.558 -3.873 428 HA ALA 61 HA ALA 61 221.870 10.882 -1.708 429 HB1 ALA 61 HB1 ALA 61 219.046 11.920 -1.541 430 HB2 ALA 61 HB2 ALA 61 220.459 12.915 -1.893 431 HB3 ALA 61 HB3 ALA 61 220.317 12.102 -0.334 432 H TYR 62 H TYR 62 218.888 9.381 -2.805 433 HA TYR 62 HA TYR 62 219.389 6.982 -1.400 434 HB2 TYR 62 HB2 TYR 62 217.518 7.001 0.183 435 HB3 TYR 62 HB3 TYR 62 218.661 8.287 0.549 436 HD1 TYR 62 HD1 TYR 62 215.254 7.491 -0.027 437 HD2 TYR 62 HD2 TYR 62 218.086 10.645 -0.387 438 HE1 TYR 62 HE1 TYR 62 213.420 9.126 -0.095 439 HE2 TYR 62 HE2 TYR 62 216.256 12.288 -0.455 440 HH TYR 62 HH TYR 62 213.159 11.634 0.468 441 H ARG 63 H ARG 63 218.597 5.467 -2.714 442 HA ARG 63 HA ARG 63 216.312 6.153 -4.424 443 HB2 ARG 63 HB2 ARG 63 218.667 5.184 -5.221 444 HB3 ARG 63 HB3 ARG 63 217.873 3.655 -4.864 445 HG2 ARG 63 HG2 ARG 63 217.147 3.788 -6.971 446 HG3 ARG 63 HG3 ARG 63 215.957 4.916 -6.319 447 HD2 ARG 63 HD2 ARG 63 216.994 6.735 -7.212 448 HD3 ARG 63 HD3 ARG 63 218.600 6.023 -7.070 449 HE ARG 63 HE ARG 63 216.839 5.878 -9.327 450 HH11 ARG 63 HH11 ARG 63 219.444 4.235 -7.657 451 HH12 ARG 63 HH12 ARG 63 220.007 3.422 -9.077 452 HH21 ARG 63 HH21 ARG 63 217.580 4.794 -11.194 453 HH22 ARG 63 HH22 ARG 63 218.952 3.741 -11.086 454 H TYR 64 H TYR 64 214.463 4.955 -4.464 455 HA TYR 64 HA TYR 64 213.986 3.285 -2.146 456 HB2 TYR 64 HB2 TYR 64 212.209 4.416 -4.300 457 HB3 TYR 64 HB3 TYR 64 211.611 3.238 -3.127 458 HD1 TYR 64 HD1 TYR 64 213.078 6.624 -3.482 459 HD2 TYR 64 HD2 TYR 64 211.013 3.908 -0.941 460 HE1 TYR 64 HE1 TYR 64 212.642 8.448 -1.898 461 HE2 TYR 64 HE2 TYR 64 210.570 5.728 0.651 462 HH TYR 64 HH TYR 64 210.431 8.163 0.669 463 H VAL 65 H VAL 65 214.263 1.174 -2.161 464 HA VAL 65 HA VAL 65 214.093 -0.287 -4.711 465 HB VAL 65 HB VAL 65 215.103 -1.465 -2.127 466 HG11 VAL 65 HG11 VAL 65 215.959 -2.168 -4.913 467 HG12 VAL 65 HG12 VAL 65 214.490 -2.837 -4.208 468 HG13 VAL 65 HG13 VAL 65 216.050 -3.136 -3.445 469 HG21 VAL 65 HG21 VAL 65 216.398 0.593 -2.612 470 HG22 VAL 65 HG22 VAL 65 216.829 -0.086 -4.182 471 HG23 VAL 65 HG23 VAL 65 217.363 -0.879 -2.701 472 H GLY 66 H GLY 66 212.302 -1.428 -5.085 473 HA2 GLY 66 HA2 GLY 66 210.176 -1.501 -3.225 474 HA3 GLY 66 HA3 GLY 66 210.230 -2.365 -4.757 475 H GLU 67 H GLU 67 211.239 -2.449 -1.397 476 HA GLU 67 HA GLU 67 210.421 -4.914 -0.666 477 HB2 GLU 67 HB2 GLU 67 212.650 -5.142 -2.511 478 HB3 GLU 67 HB3 GLU 67 213.027 -5.891 -0.963 479 HG2 GLU 67 HG2 GLU 67 210.374 -6.587 -1.879 480 HG3 GLU 67 HG3 GLU 67 211.611 -7.006 -3.062 481 H ASN 68 H ASN 68 211.276 -2.302 0.440 482 HA ASN 68 HA ASN 68 212.176 -1.445 2.339 483 HB2 ASN 68 HB2 ASN 68 211.041 -3.535 3.278 484 HB3 ASN 68 HB3 ASN 68 212.637 -4.279 3.277 485 HD21 ASN 68 HD21 ASN 68 212.626 -4.487 5.516 486 HD22 ASN 68 HD22 ASN 68 212.845 -3.120 6.565 487 H THR 69 H THR 69 213.862 -2.231 0.011 488 HA THR 69 HA THR 69 216.461 -2.595 1.334 489 HB THR 69 HB THR 69 216.952 -2.882 -1.353 490 HG1 THR 69 HG1 THR 69 214.507 -4.224 -0.880 491 HG21 THR 69 HG21 THR 69 217.766 -4.805 -0.663 492 HG22 THR 69 HG22 THR 69 216.148 -5.429 -0.344 493 HG23 THR 69 HG23 THR 69 217.010 -4.532 0.906 494 H TYR 70 H TYR 70 218.276 -1.355 0.562 495 HA TYR 70 HA TYR 70 217.498 1.260 -0.562 496 HB2 TYR 70 HB2 TYR 70 219.256 0.539 1.733 497 HB3 TYR 70 HB3 TYR 70 219.743 1.908 0.738 498 HD1 TYR 70 HD1 TYR 70 216.651 0.589 2.387 499 HD2 TYR 70 HD2 TYR 70 219.005 3.988 1.383 500 HE1 TYR 70 HE1 TYR 70 215.075 2.033 3.599 501 HE2 TYR 70 HE2 TYR 70 217.437 5.440 2.594 502 HH TYR 70 HH TYR 70 215.463 4.584 4.793 503 H GLN 71 H GLN 71 218.655 2.047 -2.257 504 HA GLN 71 HA GLN 71 221.174 0.769 -3.011 505 HB2 GLN 71 HB2 GLN 71 218.626 0.591 -4.538 506 HB3 GLN 71 HB3 GLN 71 220.101 0.854 -5.460 507 HG2 GLN 71 HG2 GLN 71 220.934 -1.205 -4.991 508 HG3 GLN 71 HG3 GLN 71 220.121 -1.304 -3.430 509 HE21 GLN 71 HE21 GLN 71 218.935 -3.089 -3.508 510 HE22 GLN 71 HE22 GLN 71 217.812 -3.497 -4.768 511 H ALA 72 H ALA 72 222.503 2.031 -4.353 512 HA ALA 72 HA ALA 72 221.567 4.648 -5.218 513 HB1 ALA 72 HB1 ALA 72 223.059 5.947 -3.953 514 HB2 ALA 72 HB2 ALA 72 223.968 4.535 -3.418 515 HB3 ALA 72 HB3 ALA 72 222.341 4.822 -2.799 516 H VAL 73 H VAL 73 222.509 5.223 -7.098 517 HA VAL 73 HA VAL 73 224.667 3.556 -8.125 518 HB VAL 73 HB VAL 73 222.726 4.014 -9.577 519 HG11 VAL 73 HG11 VAL 73 223.312 6.626 -10.489 520 HG12 VAL 73 HG12 VAL 73 223.139 6.694 -8.736 521 HG13 VAL 73 HG13 VAL 73 221.839 6.031 -9.723 522 HG21 VAL 73 HG21 VAL 73 224.011 4.697 -11.593 523 HG22 VAL 73 HG22 VAL 73 224.805 3.444 -10.641 524 HG23 VAL 73 HG23 VAL 73 225.364 5.112 -10.542 525 H VAL 74 H VAL 74 226.733 4.182 -8.349 526 HA VAL 74 HA VAL 74 227.387 7.028 -7.960 527 HB VAL 74 HB VAL 74 229.150 4.853 -6.865 528 HG11 VAL 74 HG11 VAL 74 230.393 6.743 -6.752 529 HG12 VAL 74 HG12 VAL 74 229.502 6.945 -5.246 530 HG13 VAL 74 HG13 VAL 74 228.988 7.804 -6.697 531 HG21 VAL 74 HG21 VAL 74 227.011 4.485 -5.802 532 HG22 VAL 74 HG22 VAL 74 226.868 6.202 -5.422 533 HG23 VAL 74 HG23 VAL 74 228.117 5.228 -4.648 534 H ASP 75 H ASP 75 229.152 7.815 -9.069 535 HA ASP 75 HA ASP 75 230.272 6.033 -11.138 536 HB2 ASP 75 HB2 ASP 75 228.786 7.939 -11.916 537 HB3 ASP 75 HB3 ASP 75 230.026 9.045 -11.310 538 H GLU 76 H GLU 76 232.378 5.609 -10.961 539 HA GLU 76 HA GLU 76 234.123 7.596 -9.667 540 HB2 GLU 76 HB2 GLU 76 233.497 4.968 -8.730 541 HB3 GLU 76 HB3 GLU 76 235.188 4.997 -9.211 542 HG2 GLU 76 HG2 GLU 76 234.871 5.529 -6.842 543 HG3 GLU 76 HG3 GLU 76 235.622 6.852 -7.734 544 H LYS 77 H LYS 77 236.448 7.263 -10.159 545 HA LYS 77 HA LYS 77 236.782 6.512 -12.979 546 HB2 LYS 77 HB2 LYS 77 237.451 8.820 -11.759 547 HB3 LYS 77 HB3 LYS 77 238.949 7.928 -11.534 548 HG2 LYS 77 HG2 LYS 77 239.360 7.791 -13.812 549 HG3 LYS 77 HG3 LYS 77 237.677 8.107 -14.234 550 HD2 LYS 77 HD2 LYS 77 237.873 10.397 -13.745 551 HD3 LYS 77 HD3 LYS 77 239.371 10.160 -12.844 552 HE2 LYS 77 HE2 LYS 77 240.570 9.651 -14.865 553 HE3 LYS 77 HE3 LYS 77 239.080 9.689 -15.807 554 HZ1 LYS 77 HZ1 LYS 77 239.838 12.084 -14.287 555 HZ2 LYS 77 HZ2 LYS 77 238.992 11.957 -15.748 556 HZ3 LYS 77 HZ3 LYS 77 240.670 11.745 -15.722 557 H ALA 78 H ALA 78 239.175 5.831 -13.445 558 HA ALA 78 HA ALA 78 239.560 3.276 -12.367 559 HB1 ALA 78 HB1 ALA 78 240.425 4.324 -14.588 560 HB2 ALA 78 HB2 ALA 78 241.372 3.070 -13.786 561 HB3 ALA 78 HB3 ALA 78 241.831 4.765 -13.619 562 H GLY 79 H GLY 79 240.814 2.449 -10.781 563 HA2 GLY 79 HA2 GLY 79 242.872 2.727 -9.423 564 HA3 GLY 79 HA3 GLY 79 242.329 4.382 -9.146 565 H ALA 80 H ALA 80 242.909 2.106 -7.295 566 HA ALA 80 HA ALA 80 240.510 1.133 -6.178 567 HB1 ALA 80 HB1 ALA 80 243.183 1.537 -4.834 568 HB2 ALA 80 HB2 ALA 80 242.683 0.102 -5.732 569 HB3 ALA 80 HB3 ALA 80 241.862 0.535 -4.232 570 H PHE 81 H PHE 81 239.144 1.908 -4.654 571 HA PHE 81 HA PHE 81 239.798 4.411 -3.284 572 HB2 PHE 81 HB2 PHE 81 237.369 5.145 -3.806 573 HB3 PHE 81 HB3 PHE 81 238.596 5.349 -5.050 574 HD1 PHE 81 HD1 PHE 81 238.130 4.635 -7.183 575 HD2 PHE 81 HD2 PHE 81 236.056 2.854 -3.919 576 HE1 PHE 81 HE1 PHE 81 236.758 3.344 -8.762 577 HE2 PHE 81 HE2 PHE 81 234.682 1.559 -5.497 578 HZ PHE 81 HZ PHE 81 235.033 1.802 -7.922 579 H ARG 82 H ARG 82 238.698 4.779 -1.372 580 HA ARG 82 HA ARG 82 237.190 2.473 -0.312 581 HB2 ARG 82 HB2 ARG 82 238.840 4.398 1.324 582 HB3 ARG 82 HB3 ARG 82 238.124 2.885 1.856 583 HG2 ARG 82 HG2 ARG 82 239.747 1.606 0.867 584 HG3 ARG 82 HG3 ARG 82 240.126 2.832 -0.350 585 HD2 ARG 82 HD2 ARG 82 241.952 2.690 1.211 586 HD3 ARG 82 HD3 ARG 82 241.123 4.228 1.439 587 HE ARG 82 HE ARG 82 241.094 1.935 3.262 588 HH11 ARG 82 HH11 ARG 82 240.108 5.239 2.581 589 HH12 ARG 82 HH12 ARG 82 239.638 5.561 4.216 590 HH21 ARG 82 HH21 ARG 82 240.473 2.383 5.415 591 HH22 ARG 82 HH22 ARG 82 239.849 3.945 5.821 592 H MET 83 H MET 83 235.284 2.887 0.794 593 HA MET 83 HA MET 83 234.563 5.650 1.361 594 HB2 MET 83 HB2 MET 83 232.400 5.433 0.143 595 HB3 MET 83 HB3 MET 83 233.807 5.452 -0.909 596 HG2 MET 83 HG2 MET 83 232.602 3.763 -1.848 597 HG3 MET 83 HG3 MET 83 233.603 2.850 -0.723 598 HE1 MET 83 HE1 MET 83 231.580 0.597 0.473 599 HE2 MET 83 HE2 MET 83 231.778 1.604 1.905 600 HE3 MET 83 HE3 MET 83 233.080 1.489 0.722 601 H GLN 84 H GLN 84 232.156 5.650 2.189 602 HA GLN 84 HA GLN 84 231.234 3.328 3.555 603 HB2 GLN 84 HB2 GLN 84 233.247 4.113 4.928 604 HB3 GLN 84 HB3 GLN 84 232.277 5.516 5.350 605 HG2 GLN 84 HG2 GLN 84 230.617 3.353 5.875 606 HG3 GLN 84 HG3 GLN 84 232.220 2.832 6.419 607 HE21 GLN 84 HE21 GLN 84 230.094 5.683 6.550 608 HE22 GLN 84 HE22 GLN 84 230.454 6.082 8.201 609 H TYR 85 H TYR 85 229.142 3.619 4.379 610 HA TYR 85 HA TYR 85 227.877 6.136 3.576 611 HB2 TYR 85 HB2 TYR 85 226.866 3.352 4.058 612 HB3 TYR 85 HB3 TYR 85 225.751 4.712 4.104 613 HD1 TYR 85 HD1 TYR 85 224.442 4.433 2.196 614 HD2 TYR 85 HD2 TYR 85 228.677 4.178 1.849 615 HE1 TYR 85 HE1 TYR 85 224.234 4.359 -0.252 616 HE2 TYR 85 HE2 TYR 85 228.478 4.104 -0.599 617 HH TYR 85 HH TYR 85 225.652 3.468 -2.198 618 H ALA 86 H ALA 86 226.689 7.411 4.944 619 HA ALA 86 HA ALA 86 226.126 6.682 7.659 620 HB1 ALA 86 HB1 ALA 86 228.493 7.193 7.921 621 HB2 ALA 86 HB2 ALA 86 227.503 8.404 8.736 622 HB3 ALA 86 HB3 ALA 86 228.246 8.775 7.179 623 H SER 87 H SER 87 224.239 7.633 8.115 624 HA SER 87 HA SER 87 223.186 9.705 6.454 625 HB2 SER 87 HB2 SER 87 222.180 7.908 8.493 626 HB3 SER 87 HB3 SER 87 221.557 9.551 8.726 627 HG SER 87 HG SER 87 220.398 8.038 7.224 628 H LYS 88 H LYS 88 222.622 11.826 7.006 629 HA LYS 88 HA LYS 88 224.527 13.264 8.475 630 HB2 LYS 88 HB2 LYS 88 222.466 13.887 6.715 631 HB3 LYS 88 HB3 LYS 88 221.998 14.680 8.214 632 HG2 LYS 88 HG2 LYS 88 224.740 15.203 7.846 633 HG3 LYS 88 HG3 LYS 88 223.956 15.466 6.288 634 HD2 LYS 88 HD2 LYS 88 223.108 16.688 8.916 635 HD3 LYS 88 HD3 LYS 88 224.010 17.512 7.644 636 HE2 LYS 88 HE2 LYS 88 222.130 18.011 6.570 637 HE3 LYS 88 HE3 LYS 88 221.660 16.313 6.526 638 HZ1 LYS 88 HZ1 LYS 88 221.277 17.734 9.051 639 HZ2 LYS 88 HZ2 LYS 88 220.319 16.542 8.325 640 HZ3 LYS 88 HZ3 LYS 88 220.239 18.142 7.777 641 H ASP 89 H ASP 89 221.348 12.040 9.404 642 HA ASP 89 HA ASP 89 221.586 13.308 12.031 643 HB2 ASP 89 HB2 ASP 89 219.314 11.833 10.681 644 HB3 ASP 89 HB3 ASP 89 219.247 12.406 12.355 645 H TRP 90 H TRP 90 223.365 11.103 11.275 646 HA TRP 90 HA TRP 90 224.186 9.130 12.057 647 HB2 TRP 90 HB2 TRP 90 223.530 10.759 14.237 648 HB3 TRP 90 HB3 TRP 90 222.933 9.162 14.671 649 HD1 TRP 90 HD1 TRP 90 225.182 7.327 13.519 650 HE1 TRP 90 HE1 TRP 90 227.548 7.361 14.530 651 HE3 TRP 90 HE3 TRP 90 225.051 11.931 15.740 652 HZ2 TRP 90 HZ2 TRP 90 229.147 9.107 16.064 653 HZ3 TRP 90 HZ3 TRP 90 227.041 12.707 16.961 654 HH2 TRP 90 HH2 TRP 90 229.045 11.323 17.118 655 H SER 91 H SER 91 221.847 8.822 10.573 656 HA SER 91 HA SER 91 220.112 6.958 11.963 657 HB2 SER 91 HB2 SER 91 219.978 8.547 9.539 658 HB3 SER 91 HB3 SER 91 219.523 6.875 9.215 659 HG SER 91 HG SER 91 218.081 8.771 10.378 660 HA PRO 92 HA PRO 92 221.630 2.963 10.856 661 HB2 PRO 92 HB2 PRO 92 219.886 2.262 8.712 662 HB3 PRO 92 HB3 PRO 92 219.760 1.775 10.411 663 HG2 PRO 92 HG2 PRO 92 218.369 3.954 8.954 664 HG3 PRO 92 HG3 PRO 92 217.833 3.012 10.355 665 HD2 PRO 92 HD2 PRO 92 218.604 5.564 10.604 666 HD3 PRO 92 HD3 PRO 92 218.983 4.359 11.859 667 H GLN 93 H GLN 93 223.596 3.288 9.976 668 HA GLN 93 HA GLN 93 223.780 3.940 7.117 669 HB2 GLN 93 HB2 GLN 93 226.027 4.694 7.560 670 HB3 GLN 93 HB3 GLN 93 224.937 5.452 8.708 671 HG2 GLN 93 HG2 GLN 93 225.627 3.928 10.440 672 HG3 GLN 93 HG3 GLN 93 226.630 3.034 9.298 673 HE21 GLN 93 HE21 GLN 93 226.163 6.397 10.363 674 HE22 GLN 93 HE22 GLN 93 227.855 6.765 10.485 675 H PHE 94 H PHE 94 226.170 3.009 6.373 676 HA PHE 94 HA PHE 94 226.086 0.122 6.946 677 HB2 PHE 94 HB2 PHE 94 225.514 -0.201 4.802 678 HB3 PHE 94 HB3 PHE 94 225.744 1.499 4.424 679 HD1 PHE 94 HD1 PHE 94 227.275 2.019 2.812 680 HD2 PHE 94 HD2 PHE 94 227.813 -1.560 5.048 681 HE1 PHE 94 HE1 PHE 94 229.232 1.463 1.435 682 HE2 PHE 94 HE2 PHE 94 229.775 -2.125 3.672 683 HZ PHE 94 HZ PHE 94 230.489 -0.609 1.864 684 H THR 95 H THR 95 227.871 -0.662 7.748 685 HA THR 95 HA THR 95 230.448 0.573 7.075 686 HB THR 95 HB THR 95 231.153 0.099 9.458 687 HG1 THR 95 HG1 THR 95 228.351 -0.101 9.855 688 HG21 THR 95 HG21 THR 95 230.712 2.376 8.857 689 HG22 THR 95 HG22 THR 95 230.037 2.056 10.455 690 HG23 THR 95 HG23 THR 95 228.978 2.133 9.046 691 H ALA 96 H ALA 96 231.969 -0.835 6.492 692 HA ALA 96 HA ALA 96 231.472 -3.698 7.006 693 HB1 ALA 96 HB1 ALA 96 231.924 -4.220 4.868 694 HB2 ALA 96 HB2 ALA 96 233.252 -3.064 4.767 695 HB3 ALA 96 HB3 ALA 96 231.590 -2.518 4.544 696 H ASP 97 H ASP 97 232.898 -4.601 8.328 697 HA ASP 97 HA ASP 97 235.219 -3.282 9.258 698 HB2 ASP 97 HB2 ASP 97 235.708 -5.442 10.399 699 HB3 ASP 97 HB3 ASP 97 234.055 -4.882 10.660 700 H GLY 98 H GLY 98 237.117 -5.499 9.268 701 HA2 GLY 98 HA2 GLY 98 238.560 -4.919 6.903 702 HA3 GLY 98 HA3 GLY 98 238.935 -6.213 8.048 703 H LEU 99 H LEU 99 236.752 -5.372 5.391 704 HA LEU 99 HA LEU 99 236.522 -8.218 4.677 705 HB2 LEU 99 HB2 LEU 99 234.381 -7.274 5.136 706 HB3 LEU 99 HB3 LEU 99 234.730 -5.839 4.198 707 HG LEU 99 HG LEU 99 233.087 -7.477 3.191 708 HD11 LEU 99 HD11 LEU 99 234.821 -5.766 2.029 709 HD12 LEU 99 HD12 LEU 99 233.568 -6.661 1.170 710 HD13 LEU 99 HD13 LEU 99 235.223 -7.269 1.199 711 HD21 LEU 99 HD21 LEU 99 235.587 -9.125 3.063 712 HD22 LEU 99 HD22 LEU 99 234.309 -9.321 1.863 713 HD23 LEU 99 HD23 LEU 99 233.966 -9.595 3.571 714 H GLU 100 H GLU 100 237.021 -4.971 3.295 715 HA GLU 100 HA GLU 100 238.035 -4.249 1.394 716 HB2 GLU 100 HB2 GLU 100 239.332 -6.961 1.167 717 HB3 GLU 100 HB3 GLU 100 239.938 -5.422 0.583 718 HG2 GLU 100 HG2 GLU 100 240.297 -4.692 2.846 719 HG3 GLU 100 HG3 GLU 100 239.641 -6.210 3.450 720 H LEU 101 H LEU 101 235.994 -4.188 0.422 721 HA LEU 101 HA LEU 101 234.959 -6.388 -1.070 722 HB2 LEU 101 HB2 LEU 101 233.505 -4.678 -0.106 723 HB3 LEU 101 HB3 LEU 101 234.231 -3.460 -1.153 724 HG LEU 101 HG LEU 101 233.033 -5.800 -2.521 725 HD11 LEU 101 HD11 LEU 101 231.340 -5.536 -0.882 726 HD12 LEU 101 HD12 LEU 101 230.765 -4.743 -2.347 727 HD13 LEU 101 HD13 LEU 101 231.394 -3.778 -1.013 728 HD21 LEU 101 HD21 LEU 101 232.643 -4.287 -4.213 729 HD22 LEU 101 HD22 LEU 101 234.091 -3.610 -3.471 730 HD23 LEU 101 HD23 LEU 101 232.510 -2.918 -3.108 731 H THR 102 H THR 102 234.847 -6.698 -3.257 732 HA THR 102 HA THR 102 236.678 -5.090 -4.912 733 HB THR 102 HB THR 102 236.361 -7.832 -5.841 734 HG1 THR 102 HG1 THR 102 237.505 -8.822 -4.177 735 HG21 THR 102 HG21 THR 102 238.461 -5.849 -5.571 736 HG22 THR 102 HG22 THR 102 238.263 -7.146 -6.751 737 HG23 THR 102 HG23 THR 102 239.003 -7.482 -5.185 738 HA PRO 103 HA PRO 103 233.517 -4.256 -7.887 739 HB2 PRO 103 HB2 PRO 103 235.276 -5.712 -9.827 740 HB3 PRO 103 HB3 PRO 103 234.464 -4.152 -10.006 741 HG2 PRO 103 HG2 PRO 103 237.063 -4.263 -9.461 742 HG3 PRO 103 HG3 PRO 103 236.024 -3.039 -8.696 743 HD2 PRO 103 HD2 PRO 103 237.230 -5.496 -7.534 744 HD3 PRO 103 HD3 PRO 103 236.831 -3.954 -6.754 745 H GLY 104 H GLY 104 231.714 -5.454 -7.551 746 HA2 GLY 104 HA2 GLY 104 230.148 -7.075 -8.124 747 HA3 GLY 104 HA3 GLY 104 231.407 -7.936 -9.013 748 H LYS 105 H LYS 105 231.643 -6.933 -5.637 749 HA LYS 105 HA LYS 105 231.492 -9.769 -4.839 750 HB2 LYS 105 HB2 LYS 105 233.811 -8.461 -4.893 751 HB3 LYS 105 HB3 LYS 105 233.242 -7.891 -3.320 752 HG2 LYS 105 HG2 LYS 105 232.844 -10.694 -3.420 753 HG3 LYS 105 HG3 LYS 105 234.478 -10.356 -3.994 754 HD2 LYS 105 HD2 LYS 105 234.246 -8.694 -1.818 755 HD3 LYS 105 HD3 LYS 105 233.344 -10.123 -1.310 756 HE2 LYS 105 HE2 LYS 105 236.206 -9.991 -2.244 757 HE3 LYS 105 HE3 LYS 105 235.623 -10.397 -0.632 758 HZ1 LYS 105 HZ1 LYS 105 234.506 -12.357 -1.686 759 HZ2 LYS 105 HZ2 LYS 105 236.196 -12.412 -1.699 760 HZ3 LYS 105 HZ3 LYS 105 235.353 -12.008 -3.109 761 H THR 106 H THR 106 230.716 -10.222 -2.778 762 HA THR 106 HA THR 106 228.656 -8.456 -1.871 763 HB THR 106 HB THR 106 229.402 -10.737 -0.143 764 HG1 THR 106 HG1 THR 106 228.860 -12.285 -1.605 765 HG21 THR 106 HG21 THR 106 227.290 -9.664 0.216 766 HG22 THR 106 HG22 THR 106 227.015 -11.292 -0.405 767 HG23 THR 106 HG23 THR 106 226.838 -9.901 -1.473 768 H ALA 107 H ALA 107 228.523 -7.262 -0.020 769 HA ALA 107 HA ALA 107 231.022 -6.927 1.512 770 HB1 ALA 107 HB1 ALA 107 229.439 -4.702 2.025 771 HB2 ALA 107 HB2 ALA 107 229.214 -5.014 0.302 772 HB3 ALA 107 HB3 ALA 107 230.836 -4.780 0.952 773 H SER 108 H SER 108 230.930 -6.689 3.743 774 HA SER 108 HA SER 108 228.640 -8.008 4.983 775 HB2 SER 108 HB2 SER 108 231.485 -7.528 5.791 776 HB3 SER 108 HB3 SER 108 230.281 -7.850 7.039 777 HG SER 108 HG SER 108 230.843 -9.499 4.793 778 H LEU 109 H LEU 109 227.340 -7.114 6.509 779 HA LEU 109 HA LEU 109 227.765 -4.267 7.152 780 HB2 LEU 109 HB2 LEU 109 225.916 -4.443 5.629 781 HB3 LEU 109 HB3 LEU 109 225.207 -5.752 6.553 782 HG LEU 109 HG LEU 109 224.817 -4.141 8.424 783 HD11 LEU 109 HD11 LEU 109 226.175 -2.337 8.263 784 HD12 LEU 109 HD12 LEU 109 224.784 -1.684 7.401 785 HD13 LEU 109 HD13 LEU 109 226.154 -2.333 6.500 786 HD21 LEU 109 HD21 LEU 109 223.299 -4.661 6.254 787 HD22 LEU 109 HD22 LEU 109 223.429 -2.906 6.139 788 HD23 LEU 109 HD23 LEU 109 222.779 -3.648 7.600 789 H LYS 110 H LYS 110 228.659 -4.476 9.159 790 HA LYS 110 HA LYS 110 227.523 -6.307 11.095 791 HB2 LYS 110 HB2 LYS 110 229.897 -4.475 11.075 792 HB3 LYS 110 HB3 LYS 110 229.316 -5.151 12.589 793 HG2 LYS 110 HG2 LYS 110 229.699 -7.076 10.393 794 HG3 LYS 110 HG3 LYS 110 231.163 -6.323 11.028 795 HD2 LYS 110 HD2 LYS 110 229.120 -7.489 12.884 796 HD3 LYS 110 HD3 LYS 110 230.308 -8.525 12.093 797 HE2 LYS 110 HE2 LYS 110 231.503 -8.040 13.958 798 HE3 LYS 110 HE3 LYS 110 231.954 -6.631 13.002 799 HZ1 LYS 110 HZ1 LYS 110 230.633 -5.253 14.243 800 HZ2 LYS 110 HZ2 LYS 110 231.096 -6.361 15.431 801 HZ3 LYS 110 HZ3 LYS 110 229.570 -6.482 14.715 802 H ARG 111 H ARG 111 228.417 -2.869 11.499 803 HA ARG 111 HA ARG 111 225.797 -2.036 12.205 804 HB2 ARG 111 HB2 ARG 111 226.279 -1.563 14.617 805 HB3 ARG 111 HB3 ARG 111 226.124 -3.270 14.227 806 HG2 ARG 111 HG2 ARG 111 228.675 -3.287 14.067 807 HG3 ARG 111 HG3 ARG 111 228.608 -1.718 14.870 808 HD2 ARG 111 HD2 ARG 111 228.903 -3.308 16.589 809 HD3 ARG 111 HD3 ARG 111 227.208 -2.832 16.654 810 HE ARG 111 HE ARG 111 227.598 -5.151 15.040 811 HH11 ARG 111 HH11 ARG 111 227.317 -4.069 18.361 812 HH12 ARG 111 HH12 ARG 111 226.756 -5.600 18.943 813 HH21 ARG 111 HH21 ARG 111 226.854 -7.173 15.821 814 HH22 ARG 111 HH22 ARG 111 226.496 -7.359 17.504 815 H GLY 112 H GLY 112 225.690 0.064 11.760 816 HA2 GLY 112 HA2 GLY 112 227.872 1.588 10.918 817 HA3 GLY 112 HA3 GLY 112 226.291 2.235 11.346 818 H GLY 113 H GLY 113 228.676 3.622 11.777 819 HA2 GLY 113 HA2 GLY 113 228.561 4.909 14.043 820 HA3 GLY 113 HA3 GLY 113 229.194 3.377 14.659 821 H TYR 114 H TYR 114 231.313 2.757 14.152 822 HA TYR 114 HA TYR 114 232.983 4.430 12.509 823 HB2 TYR 114 HB2 TYR 114 232.721 5.302 15.080 824 HB3 TYR 114 HB3 TYR 114 234.116 4.241 15.225 825 HD1 TYR 114 HD1 TYR 114 236.172 4.717 13.911 826 HD2 TYR 114 HD2 TYR 114 232.869 7.399 13.946 827 HE1 TYR 114 HE1 TYR 114 237.619 6.501 13.032 828 HE2 TYR 114 HE2 TYR 114 234.306 9.190 13.066 829 HH TYR 114 HH TYR 114 236.462 9.338 11.720 830 H GLY 115 H GLY 115 233.685 2.717 11.358 831 HA2 GLY 115 HA2 GLY 115 235.297 0.717 12.806 832 HA3 GLY 115 HA3 GLY 115 234.144 0.209 11.582 833 H GLN 116 H GLN 116 235.271 -0.471 9.882 834 HA GLN 116 HA GLN 116 237.574 1.133 8.983 835 HB2 GLN 116 HB2 GLN 116 237.650 -1.468 9.585 836 HB3 GLN 116 HB3 GLN 116 237.086 -1.613 7.925 837 HG2 GLN 116 HG2 GLN 116 239.199 0.191 7.790 838 HG3 GLN 116 HG3 GLN 116 239.728 -1.039 8.938 839 HE21 GLN 116 HE21 GLN 116 241.307 -1.760 7.465 840 HE22 GLN 116 HE22 GLN 116 240.887 -2.722 6.094 841 H ASP 117 H ASP 117 237.751 1.742 6.850 842 HA ASP 117 HA ASP 117 235.237 1.967 5.432 843 HB2 ASP 117 HB2 ASP 117 238.004 3.019 4.821 844 HB3 ASP 117 HB3 ASP 117 236.606 3.310 3.801 845 H THR 118 H THR 118 234.597 0.740 3.767 846 HA THR 118 HA THR 118 236.023 -1.596 3.064 847 HB THR 118 HB THR 118 233.947 -0.621 1.182 848 HG1 THR 118 HG1 THR 118 232.298 -0.905 2.649 849 HG21 THR 118 HG21 THR 118 233.010 -2.902 1.699 850 HG22 THR 118 HG22 THR 118 234.477 -3.192 2.635 851 HG23 THR 118 HG23 THR 118 234.583 -2.866 0.906 852 H ALA 119 H ALA 119 237.791 -1.677 1.890 853 HA ALA 119 HA ALA 119 238.404 0.425 -0.023 854 HB1 ALA 119 HB1 ALA 119 240.612 -0.687 -0.169 855 HB2 ALA 119 HB2 ALA 119 240.032 -1.924 0.948 856 HB3 ALA 119 HB3 ALA 119 240.171 -0.249 1.481 857 H VAL 120 H VAL 120 238.055 0.259 -2.134 858 HA VAL 120 HA VAL 120 237.613 -2.422 -3.280 859 HB VAL 120 HB VAL 120 236.437 0.160 -4.319 860 HG11 VAL 120 HG11 VAL 120 235.372 -1.058 -5.922 861 HG12 VAL 120 HG12 VAL 120 235.303 -2.515 -4.932 862 HG13 VAL 120 HG13 VAL 120 236.810 -2.061 -5.728 863 HG21 VAL 120 HG21 VAL 120 235.360 -0.103 -2.262 864 HG22 VAL 120 HG22 VAL 120 235.322 -1.861 -2.400 865 HG23 VAL 120 HG23 VAL 120 234.268 -0.874 -3.413 866 H THR 121 H THR 121 239.011 -3.051 -4.788 867 HA THR 121 HA THR 121 240.938 -1.140 -5.835 868 HB THR 121 HB THR 121 240.718 -4.134 -5.799 869 HG1 THR 121 HG1 THR 121 241.666 -3.142 -4.012 870 HG21 THR 121 HG21 THR 121 242.808 -2.587 -7.319 871 HG22 THR 121 HG22 THR 121 241.561 -3.611 -8.028 872 HG23 THR 121 HG23 THR 121 242.814 -4.323 -7.014 873 H LEU 122 H LEU 122 240.672 -0.168 -7.739 874 HA LEU 122 HA LEU 122 239.084 -1.529 -9.807 875 HB2 LEU 122 HB2 LEU 122 238.166 0.617 -8.486 876 HB3 LEU 122 HB3 LEU 122 239.089 1.438 -9.729 877 HG LEU 122 HG LEU 122 237.783 0.047 -11.419 878 HD11 LEU 122 HD11 LEU 122 236.966 -1.414 -9.352 879 HD12 LEU 122 HD12 LEU 122 236.002 -1.217 -10.814 880 HD13 LEU 122 HD13 LEU 122 235.650 -0.241 -9.388 881 HD21 LEU 122 HD21 LEU 122 237.392 2.502 -10.587 882 HD22 LEU 122 HD22 LEU 122 235.926 1.810 -9.892 883 HD23 LEU 122 HD23 LEU 122 236.211 1.707 -11.628 884 HA PRO 123 HA PRO 123 242.941 -0.585 -11.952 885 HB2 PRO 123 HB2 PRO 123 242.815 -2.555 -13.750 886 HB3 PRO 123 HB3 PRO 123 243.166 -2.892 -12.044 887 HG2 PRO 123 HG2 PRO 123 240.612 -3.225 -13.560 888 HG3 PRO 123 HG3 PRO 123 241.327 -4.276 -12.327 889 HD2 PRO 123 HD2 PRO 123 239.313 -2.408 -11.881 890 HD3 PRO 123 HD3 PRO 123 240.356 -3.110 -10.629 891 H GLU 124 H GLU 124 239.872 0.174 -12.768 892 HA GLU 124 HA GLU 124 240.620 1.676 -15.085 893 HB2 GLU 124 HB2 GLU 124 240.246 -0.664 -15.983 894 HB3 GLU 124 HB3 GLU 124 238.562 -0.493 -15.513 895 HG2 GLU 124 HG2 GLU 124 238.545 1.606 -16.968 896 HG3 GLU 124 HG3 GLU 124 240.084 1.018 -17.614 897 H ALA 125 H ALA 125 239.053 3.181 -15.705 898 HA ALA 125 HA ALA 125 237.360 4.070 -13.613 899 HB1 ALA 125 HB1 ALA 125 237.155 5.020 -16.450 900 HB2 ALA 125 HB2 ALA 125 238.520 5.457 -15.425 901 HB3 ALA 125 HB3 ALA 125 236.884 5.922 -14.959 902 H GLY 126 H GLY 126 235.167 4.016 -13.359 903 HA2 GLY 126 HA2 GLY 126 233.247 3.296 -15.236 904 HA3 GLY 126 HA3 GLY 126 233.777 1.803 -14.466 905 H GLN 127 H GLN 127 231.195 3.394 -14.415 906 HA GLN 127 HA GLN 127 230.979 4.183 -11.637 907 HB2 GLN 127 HB2 GLN 127 228.596 4.660 -12.210 908 HB3 GLN 127 HB3 GLN 127 229.757 5.531 -13.196 909 HG2 GLN 127 HG2 GLN 127 229.114 4.516 -15.098 910 HG3 GLN 127 HG3 GLN 127 228.836 2.959 -14.299 911 HE21 GLN 127 HE21 GLN 127 227.487 6.250 -14.456 912 HE22 GLN 127 HE22 GLN 127 225.833 5.755 -14.394 913 H TYR 128 H TYR 128 230.371 2.922 -10.021 914 HA TYR 128 HA TYR 128 229.327 0.248 -10.643 915 HB2 TYR 128 HB2 TYR 128 230.029 -0.322 -8.318 916 HB3 TYR 128 HB3 TYR 128 231.360 0.184 -9.350 917 HD1 TYR 128 HD1 TYR 128 229.046 1.390 -6.709 918 HD2 TYR 128 HD2 TYR 128 232.756 1.959 -8.710 919 HE1 TYR 128 HE1 TYR 128 229.680 3.081 -5.046 920 HE2 TYR 128 HE2 TYR 128 233.399 3.653 -7.046 921 HH TYR 128 HH TYR 128 232.034 3.991 -4.151 922 H VAL 129 H VAL 129 227.630 -0.649 -9.323 923 HA VAL 129 HA VAL 129 225.775 1.426 -8.367 924 HB VAL 129 HB VAL 129 223.975 -0.254 -8.718 925 HG11 VAL 129 HG11 VAL 129 225.567 0.209 -11.232 926 HG12 VAL 129 HG12 VAL 129 224.632 1.464 -10.420 927 HG13 VAL 129 HG13 VAL 129 223.820 0.041 -11.075 928 HG21 VAL 129 HG21 VAL 129 224.458 -2.401 -9.036 929 HG22 VAL 129 HG22 VAL 129 226.179 -2.028 -9.044 930 HG23 VAL 129 HG23 VAL 129 225.265 -1.997 -10.549 931 H TRP 130 H TRP 130 225.430 1.559 -6.257 932 HA TRP 130 HA TRP 130 226.358 -0.571 -4.510 933 HB2 TRP 130 HB2 TRP 130 225.765 2.299 -4.227 934 HB3 TRP 130 HB3 TRP 130 225.289 1.320 -2.845 935 HD1 TRP 130 HD1 TRP 130 228.028 3.353 -3.783 936 HE1 TRP 130 HE1 TRP 130 230.244 2.607 -2.712 937 HE3 TRP 130 HE3 TRP 130 226.688 -1.367 -2.337 938 HZ2 TRP 130 HZ2 TRP 130 231.288 0.326 -1.427 939 HZ3 TRP 130 HZ3 TRP 130 228.360 -2.764 -1.191 940 HH2 TRP 130 HH2 TRP 130 230.610 -1.932 -0.747 941 H SER 131 H SER 131 225.034 -2.192 -4.088 942 HA SER 131 HA SER 131 222.196 -1.595 -3.586 943 HB2 SER 131 HB2 SER 131 222.252 -2.748 -5.691 944 HB3 SER 131 HB3 SER 131 223.385 -3.949 -5.069 945 HG SER 131 HG SER 131 221.039 -4.506 -5.195 946 H LEU 132 H LEU 132 221.399 -2.304 -1.695 947 HA LEU 132 HA LEU 132 222.913 -4.337 -0.198 948 HB2 LEU 132 HB2 LEU 132 221.691 -2.051 1.285 949 HB3 LEU 132 HB3 LEU 132 223.029 -3.085 1.742 950 HG LEU 132 HG LEU 132 224.201 -1.837 -0.305 951 HD11 LEU 132 HD11 LEU 132 221.908 -0.107 0.478 952 HD12 LEU 132 HD12 LEU 132 222.639 -0.370 -1.106 953 HD13 LEU 132 HD13 LEU 132 223.452 0.648 0.081 954 HD21 LEU 132 HD21 LEU 132 224.121 -0.131 2.083 955 HD22 LEU 132 HD22 LEU 132 225.487 -0.912 1.288 956 HD23 LEU 132 HD23 LEU 132 224.467 -1.831 2.396 957 H LYS 133 H LYS 133 221.686 -5.836 0.821 958 HA LYS 133 HA LYS 133 218.776 -5.388 0.882 959 HB2 LYS 133 HB2 LYS 133 219.388 -6.992 -0.874 960 HB3 LYS 133 HB3 LYS 133 220.218 -7.988 0.328 961 HG2 LYS 133 HG2 LYS 133 218.320 -9.097 0.600 962 HG3 LYS 133 HG3 LYS 133 217.634 -7.643 1.327 963 HD2 LYS 133 HD2 LYS 133 217.258 -6.979 -1.202 964 HD3 LYS 133 HD3 LYS 133 217.317 -8.727 -1.429 965 HE2 LYS 133 HE2 LYS 133 215.470 -7.237 0.436 966 HE3 LYS 133 HE3 LYS 133 215.022 -7.951 -1.110 967 HZ1 LYS 133 HZ1 LYS 133 215.993 -9.438 1.273 968 HZ2 LYS 133 HZ2 LYS 133 215.593 -10.133 -0.216 969 HZ3 LYS 133 HZ3 LYS 133 214.396 -9.387 0.716 970 H PHE 134 H PHE 134 217.762 -5.687 2.736 971 HA PHE 134 HA PHE 134 218.970 -7.305 4.847 972 HB2 PHE 134 HB2 PHE 134 217.820 -4.924 6.025 973 HB3 PHE 134 HB3 PHE 134 219.423 -5.611 6.251 974 HD1 PHE 134 HD1 PHE 134 217.431 -3.381 4.056 975 HD2 PHE 134 HD2 PHE 134 221.314 -4.573 5.334 976 HE1 PHE 134 HE1 PHE 134 218.413 -1.479 2.840 977 HE2 PHE 134 HE2 PHE 134 222.299 -2.671 4.122 978 HZ PHE 134 HZ PHE 134 220.848 -1.124 2.872 979 H THR 135 H THR 135 217.503 -8.210 6.265 980 HA THR 135 HA THR 135 214.721 -8.130 5.360 981 HB THR 135 HB THR 135 215.846 -10.329 5.531 982 HG1 THR 135 HG1 THR 135 214.191 -11.327 6.786 983 HG21 THR 135 HG21 THR 135 217.333 -10.223 7.316 984 HG22 THR 135 HG22 THR 135 216.038 -11.268 7.896 985 HG23 THR 135 HG23 THR 135 216.113 -9.586 8.419 986 H ASP 136 H ASP 136 213.039 -8.424 7.137 987 HA ASP 136 HA ASP 136 213.302 -6.238 8.994 988 HB2 ASP 136 HB2 ASP 136 210.942 -6.870 9.622 989 HB3 ASP 136 HB3 ASP 136 211.176 -6.443 7.933 990 H SER 137 H SER 137 214.206 -9.452 9.153 991 HA SER 137 HA SER 137 213.394 -10.183 11.754 992 HB2 SER 137 HB2 SER 137 215.945 -11.132 10.457 993 HB3 SER 137 HB3 SER 137 214.887 -12.006 11.565 994 HG SER 137 HG SER 137 213.650 -12.560 9.945 995 H GLY 138 H GLY 138 215.988 -8.145 10.606 996 HA2 GLY 138 HA2 GLY 138 217.281 -6.655 11.830 997 HA3 GLY 138 HA3 GLY 138 216.566 -7.301 13.309 998 H ASP 139 H ASP 139 218.084 -9.376 10.938 999 HA ASP 139 HA ASP 139 220.530 -9.554 12.537 1000 HB2 ASP 139 HB2 ASP 139 218.453 -11.575 12.465 1001 HB3 ASP 139 HB3 ASP 139 219.974 -12.214 11.849 1002 HA PRO 140 HA PRO 140 221.428 -11.623 8.242 1003 HB2 PRO 140 HB2 PRO 140 218.902 -11.299 6.752 1004 HB3 PRO 140 HB3 PRO 140 219.937 -12.721 6.905 1005 HG2 PRO 140 HG2 PRO 140 217.551 -12.586 8.117 1006 HG3 PRO 140 HG3 PRO 140 218.932 -13.403 8.870 1007 HD2 PRO 140 HD2 PRO 140 217.806 -10.683 9.423 1008 HD3 PRO 140 HD3 PRO 140 218.393 -11.912 10.560 1009 H GLU 141 H GLU 141 222.672 -10.179 7.228 1010 HA GLU 141 HA GLU 141 221.490 -7.964 5.769 1011 HB2 GLU 141 HB2 GLU 141 223.099 -7.652 8.245 1012 HB3 GLU 141 HB3 GLU 141 223.458 -6.553 6.922 1013 HG2 GLU 141 HG2 GLU 141 221.684 -5.320 7.384 1014 HG3 GLU 141 HG3 GLU 141 220.621 -6.731 7.289 1015 H GLN 142 H GLN 142 222.379 -8.046 3.828 1016 HA GLN 142 HA GLN 142 225.270 -8.457 3.578 1017 HB2 GLN 142 HB2 GLN 142 223.732 -10.557 3.142 1018 HB3 GLN 142 HB3 GLN 142 223.480 -9.779 1.586 1019 HG2 GLN 142 HG2 GLN 142 225.385 -10.610 0.850 1020 HG3 GLN 142 HG3 GLN 142 226.264 -9.762 2.128 1021 HE21 GLN 142 HE21 GLN 142 227.210 -10.931 3.677 1022 HE22 GLN 142 HE22 GLN 142 226.996 -12.629 3.914 1023 H ILE 143 H ILE 143 226.226 -7.524 1.727 1024 HA ILE 143 HA ILE 143 224.492 -5.670 0.215 1025 HB ILE 143 HB ILE 143 227.356 -5.122 0.996 1026 HG12 ILE 143 HG12 ILE 143 225.699 -3.284 2.297 1027 HG13 ILE 143 HG13 ILE 143 224.919 -4.843 2.546 1028 HG21 ILE 143 HG21 ILE 143 226.714 -3.952 -0.995 1029 HG22 ILE 143 HG22 ILE 143 226.775 -2.801 0.339 1030 HG23 ILE 143 HG23 ILE 143 225.220 -3.397 -0.239 1031 HD11 ILE 143 HD11 ILE 143 227.785 -4.939 2.991 1032 HD12 ILE 143 HD12 ILE 143 226.457 -5.480 4.016 1033 HD13 ILE 143 HD13 ILE 143 226.961 -3.790 4.043 1034 H MET 144 H MET 144 225.057 -5.267 -1.971 1035 HA MET 144 HA MET 144 227.221 -6.877 -3.117 1036 HB2 MET 144 HB2 MET 144 224.364 -7.373 -3.482 1037 HB3 MET 144 HB3 MET 144 225.220 -7.161 -5.003 1038 HG2 MET 144 HG2 MET 144 226.890 -8.846 -3.673 1039 HG3 MET 144 HG3 MET 144 225.313 -9.356 -3.073 1040 HE1 MET 144 HE1 MET 144 227.072 -9.077 -7.095 1041 HE2 MET 144 HE2 MET 144 227.522 -10.641 -6.418 1042 HE3 MET 144 HE3 MET 144 227.846 -9.161 -5.513 1043 H VAL 145 H VAL 145 228.424 -5.636 -4.390 1044 HA VAL 145 HA VAL 145 227.133 -3.474 -5.919 1045 HB VAL 145 HB VAL 145 228.295 -2.513 -3.964 1046 HG11 VAL 145 HG11 VAL 145 230.119 -4.427 -4.193 1047 HG12 VAL 145 HG12 VAL 145 230.470 -2.880 -3.423 1048 HG13 VAL 145 HG13 VAL 145 230.957 -3.164 -5.095 1049 HG21 VAL 145 HG21 VAL 145 228.300 -0.862 -5.498 1050 HG22 VAL 145 HG22 VAL 145 228.991 -1.886 -6.757 1051 HG23 VAL 145 HG23 VAL 145 230.036 -1.168 -5.531 1052 H SER 146 H SER 146 227.753 -3.289 -8.011 1053 HA SER 146 HA SER 146 230.162 -4.680 -8.922 1054 HB2 SER 146 HB2 SER 146 229.086 -6.021 -10.501 1055 HB3 SER 146 HB3 SER 146 227.981 -6.100 -9.132 1056 HG SER 146 HG SER 146 227.467 -5.275 -11.594 1057 H LYS 147 H LYS 147 230.939 -3.991 -10.991 1058 HA LYS 147 HA LYS 147 229.882 -1.367 -11.821 1059 HB2 LYS 147 HB2 LYS 147 232.230 -0.878 -12.601 1060 HB3 LYS 147 HB3 LYS 147 232.018 -0.970 -10.849 1061 HG2 LYS 147 HG2 LYS 147 233.513 -2.601 -10.683 1062 HG3 LYS 147 HG3 LYS 147 232.727 -3.546 -11.947 1063 HD2 LYS 147 HD2 LYS 147 234.279 -1.179 -12.817 1064 HD3 LYS 147 HD3 LYS 147 235.201 -2.547 -12.191 1065 HE2 LYS 147 HE2 LYS 147 234.094 -4.025 -13.800 1066 HE3 LYS 147 HE3 LYS 147 233.176 -2.656 -14.426 1067 HZ1 LYS 147 HZ1 LYS 147 234.874 -2.639 -15.898 1068 HZ2 LYS 147 HZ2 LYS 147 235.976 -3.356 -14.834 1069 HZ3 LYS 147 HZ3 LYS 147 235.623 -1.707 -14.701 1070 H CYS 148 H CYS 148 229.086 -1.293 -13.801 1071 HA CYS 148 HA CYS 148 229.865 -3.383 -15.719 1072 HB2 CYS 148 HB2 CYS 148 227.334 -2.492 -14.889 1073 HB3 CYS 148 HB3 CYS 148 227.543 -1.870 -16.524 1074 HA PRO 149 HA PRO 149 232.146 -0.231 -17.917 1075 HB2 PRO 149 HB2 PRO 149 231.758 -2.158 -20.159 1076 HB3 PRO 149 HB3 PRO 149 233.246 -1.412 -19.557 1077 HG2 PRO 149 HG2 PRO 149 232.693 -3.961 -19.026 1078 HG3 PRO 149 HG3 PRO 149 233.447 -2.919 -17.806 1079 HD2 PRO 149 HD2 PRO 149 230.616 -3.853 -18.015 1080 HD3 PRO 149 HD3 PRO 149 231.625 -3.617 -16.573 Start of MODEL 3 1 H1 THR 1 H1 THR 1 208.818 -19.377 -6.840 2 H2 THR 1 H2 THR 1 209.993 -19.015 -8.036 3 H3 THR 1 H3 THR 1 208.727 -20.122 -8.380 4 HA THR 1 HA THR 1 208.481 -17.878 -9.345 5 HB THR 1 HB THR 1 206.055 -17.729 -8.484 6 HG1 THR 1 HG1 THR 1 205.819 -18.724 -6.648 7 HG21 THR 1 HG21 THR 1 206.030 -18.908 -10.410 8 HG22 THR 1 HG22 THR 1 205.626 -20.218 -9.301 9 HG23 THR 1 HG23 THR 1 207.282 -20.030 -9.875 10 HA PRO 2 HA PRO 2 209.218 -14.256 -6.932 11 HB2 PRO 2 HB2 PRO 2 206.719 -13.174 -8.140 12 HB3 PRO 2 HB3 PRO 2 208.345 -12.482 -8.106 13 HG2 PRO 2 HG2 PRO 2 207.388 -13.572 -10.334 14 HG3 PRO 2 HG3 PRO 2 209.085 -13.798 -9.870 15 HD2 PRO 2 HD2 PRO 2 206.790 -15.702 -9.667 16 HD3 PRO 2 HD3 PRO 2 208.489 -16.019 -10.075 17 H SER 3 H SER 3 205.947 -15.596 -6.989 18 HA SER 3 HA SER 3 204.967 -14.178 -4.737 19 HB2 SER 3 HB2 SER 3 203.951 -16.890 -5.561 20 HB3 SER 3 HB3 SER 3 203.050 -15.531 -4.888 21 HG SER 3 HG SER 3 203.078 -16.085 -7.335 22 H ALA 4 H ALA 4 206.298 -14.299 -2.981 23 HA ALA 4 HA ALA 4 206.757 -16.978 -1.839 24 HB1 ALA 4 HB1 ALA 4 208.796 -15.667 -2.523 25 HB2 ALA 4 HB2 ALA 4 208.763 -16.203 -0.842 26 HB3 ALA 4 HB3 ALA 4 208.395 -14.525 -1.240 27 H SER 5 H SER 5 206.090 -13.582 -1.011 28 HA SER 5 HA SER 5 204.458 -14.503 1.228 29 HB2 SER 5 HB2 SER 5 206.721 -12.511 1.471 30 HB3 SER 5 HB3 SER 5 205.465 -12.711 2.691 31 HG SER 5 HG SER 5 207.366 -13.953 3.122 32 H GLY 6 H GLY 6 202.775 -13.882 -0.286 33 HA2 GLY 6 HA2 GLY 6 201.079 -12.089 -0.057 34 HA3 GLY 6 HA3 GLY 6 202.383 -10.954 -0.367 35 H LEU 7 H LEU 7 201.651 -10.018 -2.197 36 HA LEU 7 HA LEU 7 201.144 -9.712 -4.381 37 HB2 LEU 7 HB2 LEU 7 202.882 -12.139 -4.441 38 HB3 LEU 7 HB3 LEU 7 202.090 -11.626 -5.919 39 HG LEU 7 HG LEU 7 203.635 -9.589 -4.388 40 HD11 LEU 7 HD11 LEU 7 205.022 -11.702 -4.511 41 HD12 LEU 7 HD12 LEU 7 205.726 -10.262 -5.246 42 HD13 LEU 7 HD13 LEU 7 204.998 -11.504 -6.264 43 HD21 LEU 7 HD21 LEU 7 204.092 -8.761 -6.635 44 HD22 LEU 7 HD22 LEU 7 202.361 -8.967 -6.379 45 HD23 LEU 7 HD23 LEU 7 203.259 -10.151 -7.328 46 H THR 8 H THR 8 199.053 -10.732 -2.923 47 HA THR 8 HA THR 8 197.869 -12.987 -4.256 48 HB THR 8 HB THR 8 197.341 -12.648 -1.929 49 HG1 THR 8 HG1 THR 8 195.143 -12.821 -2.059 50 HG21 THR 8 HG21 THR 8 195.918 -10.758 -1.190 51 HG22 THR 8 HG22 THR 8 196.229 -9.976 -2.738 52 HG23 THR 8 HG23 THR 8 197.560 -10.293 -1.627 53 H LYS 9 H LYS 9 197.423 -9.467 -4.348 54 HA LYS 9 HA LYS 9 195.657 -9.826 -6.681 55 HB2 LYS 9 HB2 LYS 9 194.763 -8.700 -4.523 56 HB3 LYS 9 HB3 LYS 9 195.736 -7.322 -5.017 57 HG2 LYS 9 HG2 LYS 9 194.363 -6.788 -6.732 58 HG3 LYS 9 HG3 LYS 9 193.936 -8.468 -7.061 59 HD2 LYS 9 HD2 LYS 9 192.820 -8.123 -4.611 60 HD3 LYS 9 HD3 LYS 9 192.658 -6.499 -5.282 61 HE2 LYS 9 HE2 LYS 9 190.681 -7.626 -5.881 62 HE3 LYS 9 HE3 LYS 9 191.669 -7.605 -7.341 63 HZ1 LYS 9 HZ1 LYS 9 190.495 -9.792 -6.411 64 HZ2 LYS 9 HZ2 LYS 9 191.979 -9.929 -5.612 65 HZ3 LYS 9 HZ3 LYS 9 191.934 -9.833 -7.301 66 H VAL 10 H VAL 10 196.576 -9.319 -8.554 67 HA VAL 10 HA VAL 10 198.904 -7.545 -8.584 68 HB VAL 10 HB VAL 10 197.819 -9.110 -10.925 69 HG11 VAL 10 HG11 VAL 10 199.529 -8.249 -12.047 70 HG12 VAL 10 HG12 VAL 10 200.667 -8.821 -10.826 71 HG13 VAL 10 HG13 VAL 10 199.903 -7.241 -10.649 72 HG21 VAL 10 HG21 VAL 10 198.209 -10.870 -9.499 73 HG22 VAL 10 HG22 VAL 10 199.474 -10.017 -8.616 74 HG23 VAL 10 HG23 VAL 10 199.809 -10.674 -10.218 75 H ALA 11 H ALA 11 195.943 -6.727 -8.391 76 HA ALA 11 HA ALA 11 195.508 -5.245 -10.841 77 HB1 ALA 11 HB1 ALA 11 193.828 -4.702 -8.471 78 HB2 ALA 11 HB2 ALA 11 193.792 -6.349 -9.099 79 HB3 ALA 11 HB3 ALA 11 193.367 -4.996 -10.147 80 H THR 12 H THR 12 195.620 -3.023 -11.086 81 HA THR 12 HA THR 12 197.445 -1.651 -9.346 82 HB THR 12 HB THR 12 197.572 -1.255 -11.736 83 HG1 THR 12 HG1 THR 12 197.762 0.914 -11.630 84 HG21 THR 12 HG21 THR 12 195.329 -1.539 -12.490 85 HG22 THR 12 HG22 THR 12 195.840 0.102 -12.883 86 HG23 THR 12 HG23 THR 12 194.773 -0.183 -11.510 87 H VAL 13 H VAL 13 197.012 -0.292 -7.725 88 HA VAL 13 HA VAL 13 194.290 0.791 -7.455 89 HB VAL 13 HB VAL 13 195.877 -0.282 -5.121 90 HG11 VAL 13 HG11 VAL 13 194.198 0.390 -3.774 91 HG12 VAL 13 HG12 VAL 13 192.952 0.061 -4.977 92 HG13 VAL 13 HG13 VAL 13 193.900 1.545 -5.072 93 HG21 VAL 13 HG21 VAL 13 193.713 -1.591 -6.750 94 HG22 VAL 13 HG22 VAL 13 194.126 -2.106 -5.114 95 HG23 VAL 13 HG23 VAL 13 195.331 -2.197 -6.398 96 H SER 14 H SER 14 197.596 0.950 -6.105 97 HA SER 14 HA SER 14 197.248 3.698 -5.296 98 HB2 SER 14 HB2 SER 14 199.975 2.517 -5.383 99 HB3 SER 14 HB3 SER 14 199.190 3.451 -4.110 100 HG SER 14 HG SER 14 197.983 1.575 -3.589 101 H ALA 15 H ALA 15 198.439 5.492 -6.083 102 HA ALA 15 HA ALA 15 198.694 5.552 -8.924 103 HB1 ALA 15 HB1 ALA 15 197.919 7.497 -7.673 104 HB2 ALA 15 HB2 ALA 15 199.352 7.886 -8.623 105 HB3 ALA 15 HB3 ALA 15 199.490 7.627 -6.883 106 H ALA 16 H ALA 16 200.479 5.547 -10.212 107 HA ALA 16 HA ALA 16 203.060 5.032 -8.883 108 HB1 ALA 16 HB1 ALA 16 202.203 4.100 -11.616 109 HB2 ALA 16 HB2 ALA 16 202.133 3.118 -10.153 110 HB3 ALA 16 HB3 ALA 16 203.689 3.675 -10.769 111 H SER 17 H SER 17 204.713 6.369 -9.281 112 HA SER 17 HA SER 17 204.326 8.751 -10.782 113 HB2 SER 17 HB2 SER 17 206.900 7.590 -9.683 114 HB3 SER 17 HB3 SER 17 206.658 9.254 -10.219 115 HG SER 17 HG SER 17 206.082 8.135 -7.836 116 H SER 18 H SER 18 205.282 9.440 -12.688 117 HA SER 18 HA SER 18 205.351 7.720 -14.832 118 HB2 SER 18 HB2 SER 18 207.177 10.083 -14.910 119 HB3 SER 18 HB3 SER 18 206.018 9.519 -16.113 120 HG SER 18 HG SER 18 205.662 11.459 -14.437 121 H LEU 19 H LEU 19 206.681 6.160 -15.473 122 HA LEU 19 HA LEU 19 209.342 5.987 -14.273 123 HB2 LEU 19 HB2 LEU 19 207.341 4.083 -15.038 124 HB3 LEU 19 HB3 LEU 19 208.821 3.733 -15.910 125 HG LEU 19 HG LEU 19 210.019 3.758 -13.688 126 HD11 LEU 19 HD11 LEU 19 207.840 4.946 -12.698 127 HD12 LEU 19 HD12 LEU 19 208.942 3.988 -11.713 128 HD13 LEU 19 HD13 LEU 19 207.448 3.271 -12.314 129 HD21 LEU 19 HD21 LEU 19 209.730 1.521 -13.496 130 HD22 LEU 19 HD22 LEU 19 208.850 1.742 -15.009 131 HD23 LEU 19 HD23 LEU 19 207.970 1.638 -13.483 132 H ILE 20 H ILE 20 210.381 7.587 -15.521 133 HA ILE 20 HA ILE 20 211.161 6.644 -18.178 134 HB ILE 20 HB ILE 20 211.039 8.867 -19.163 135 HG12 ILE 20 HG12 ILE 20 211.298 10.149 -17.027 136 HG13 ILE 20 HG13 ILE 20 210.008 10.751 -18.076 137 HG21 ILE 20 HG21 ILE 20 208.488 7.790 -18.008 138 HG22 ILE 20 HG22 ILE 20 209.157 7.542 -19.619 139 HG23 ILE 20 HG23 ILE 20 208.521 9.121 -19.163 140 HD11 ILE 20 HD11 ILE 20 208.729 10.709 -16.264 141 HD12 ILE 20 HD12 ILE 20 209.885 9.725 -15.367 142 HD13 ILE 20 HD13 ILE 20 208.714 8.954 -16.436 143 H GLY 21 H GLY 21 213.287 6.934 -18.658 144 HA2 GLY 21 HA2 GLY 21 214.896 8.759 -17.036 145 HA3 GLY 21 HA3 GLY 21 215.283 7.040 -16.926 146 H GLU 22 H GLU 22 216.792 9.405 -17.954 147 HA GLU 22 HA GLU 22 217.422 8.311 -20.613 148 HB2 GLU 22 HB2 GLU 22 216.673 11.019 -19.847 149 HB3 GLU 22 HB3 GLU 22 218.216 10.976 -20.686 150 HG2 GLU 22 HG2 GLU 22 215.551 10.033 -21.681 151 HG3 GLU 22 HG3 GLU 22 216.561 11.334 -22.308 152 H GLY 23 H GLY 23 219.551 8.006 -21.090 153 HA2 GLY 23 HA2 GLY 23 221.857 9.036 -20.494 154 HA3 GLY 23 HA3 GLY 23 221.444 8.457 -18.880 155 H PHE 24 H PHE 24 223.522 7.749 -21.069 156 HA PHE 24 HA PHE 24 223.075 5.110 -21.926 157 HB2 PHE 24 HB2 PHE 24 224.964 6.876 -22.520 158 HB3 PHE 24 HB3 PHE 24 225.852 5.992 -21.271 159 HD1 PHE 24 HD1 PHE 24 226.464 3.654 -21.602 160 HD2 PHE 24 HD2 PHE 24 224.431 5.857 -24.624 161 HE1 PHE 24 HE1 PHE 24 227.049 1.925 -23.252 162 HE2 PHE 24 HE2 PHE 24 225.011 4.132 -26.277 163 HZ PHE 24 HZ PHE 24 226.321 2.161 -25.593 164 H MET 25 H MET 25 224.335 6.401 -18.917 165 HA MET 25 HA MET 25 225.465 4.093 -17.831 166 HB2 MET 25 HB2 MET 25 225.059 5.175 -15.621 167 HB3 MET 25 HB3 MET 25 225.868 6.207 -16.790 168 HG2 MET 25 HG2 MET 25 224.364 7.715 -16.086 169 HG3 MET 25 HG3 MET 25 223.317 6.908 -17.251 170 HE1 MET 25 HE1 MET 25 220.639 6.009 -16.103 171 HE2 MET 25 HE2 MET 25 221.364 7.547 -16.573 172 HE3 MET 25 HE3 MET 25 220.571 7.389 -15.005 173 H ALA 26 H ALA 26 222.174 4.678 -18.516 174 HA ALA 26 HA ALA 26 221.040 3.113 -16.405 175 HB1 ALA 26 HB1 ALA 26 219.780 4.879 -17.572 176 HB2 ALA 26 HB2 ALA 26 218.956 3.322 -17.612 177 HB3 ALA 26 HB3 ALA 26 219.812 3.903 -19.042 178 H GLN 27 H GLN 27 223.097 2.006 -18.570 179 HA GLN 27 HA GLN 27 221.634 -0.187 -19.708 180 HB2 GLN 27 HB2 GLN 27 223.553 -0.673 -20.900 181 HB3 GLN 27 HB3 GLN 27 223.713 1.057 -20.654 182 HG2 GLN 27 HG2 GLN 27 224.981 -0.807 -18.702 183 HG3 GLN 27 HG3 GLN 27 225.734 -0.555 -20.274 184 HE21 GLN 27 HE21 GLN 27 225.368 0.620 -17.135 185 HE22 GLN 27 HE22 GLN 27 226.161 2.151 -17.355 186 H CYS 28 H CYS 28 223.288 0.365 -16.731 187 HA CYS 28 HA CYS 28 222.999 -2.487 -16.084 188 HB2 CYS 28 HB2 CYS 28 225.443 -1.423 -16.569 189 HB3 CYS 28 HB3 CYS 28 225.305 -1.114 -14.843 190 H ASP 29 H ASP 29 221.111 -2.001 -14.924 191 HA ASP 29 HA ASP 29 221.457 -1.425 -12.198 192 HB2 ASP 29 HB2 ASP 29 219.929 0.661 -12.214 193 HB3 ASP 29 HB3 ASP 29 221.635 0.877 -12.630 194 H ASN 30 H ASN 30 219.848 -2.359 -11.112 195 HA ASN 30 HA ASN 30 217.682 -3.575 -12.567 196 HB2 ASN 30 HB2 ASN 30 218.000 -3.536 -9.566 197 HB3 ASN 30 HB3 ASN 30 217.159 -4.726 -10.550 198 HD21 ASN 30 HD21 ASN 30 219.735 -4.397 -8.697 199 HD22 ASN 30 HD22 ASN 30 220.856 -5.460 -9.492 200 HA PRO 31 HA PRO 31 214.586 -0.454 -12.044 201 HB2 PRO 31 HB2 PRO 31 212.602 -2.567 -11.609 202 HB3 PRO 31 HB3 PRO 31 212.729 -1.371 -12.908 203 HG2 PRO 31 HG2 PRO 31 213.237 -3.994 -13.293 204 HG3 PRO 31 HG3 PRO 31 214.038 -2.700 -14.200 205 HD2 PRO 31 HD2 PRO 31 215.077 -4.366 -11.958 206 HD3 PRO 31 HD3 PRO 31 215.930 -3.715 -13.372 207 H THR 32 H THR 32 214.523 0.679 -10.206 208 HA THR 32 HA THR 32 213.927 -0.725 -7.705 209 HB THR 32 HB THR 32 214.625 1.817 -6.956 210 HG1 THR 32 HG1 THR 32 216.408 1.142 -9.044 211 HG21 THR 32 HG21 THR 32 216.265 0.798 -5.860 212 HG22 THR 32 HG22 THR 32 216.956 0.113 -7.331 213 HG23 THR 32 HG23 THR 32 215.601 -0.691 -6.533 214 H ILE 33 H ILE 33 211.781 -0.861 -7.613 215 HA ILE 33 HA ILE 33 210.103 1.510 -8.033 216 HB ILE 33 HB ILE 33 209.557 -0.774 -9.027 217 HG12 ILE 33 HG12 ILE 33 207.195 -0.082 -7.409 218 HG13 ILE 33 HG13 ILE 33 207.941 1.280 -8.240 219 HG21 ILE 33 HG21 ILE 33 208.487 -2.412 -7.619 220 HG22 ILE 33 HG22 ILE 33 208.699 -1.382 -6.203 221 HG23 ILE 33 HG23 ILE 33 210.106 -2.077 -7.008 222 HD11 ILE 33 HD11 ILE 33 206.309 -0.856 -9.286 223 HD12 ILE 33 HD12 ILE 33 207.833 -0.708 -10.159 224 HD13 ILE 33 HD13 ILE 33 206.761 0.683 -10.016 225 H GLU 34 H GLU 34 208.418 1.974 -6.454 226 HA GLU 34 HA GLU 34 209.509 2.320 -3.879 227 HB2 GLU 34 HB2 GLU 34 207.455 3.471 -5.192 228 HB3 GLU 34 HB3 GLU 34 206.555 2.395 -4.133 229 HG2 GLU 34 HG2 GLU 34 206.684 4.037 -2.639 230 HG3 GLU 34 HG3 GLU 34 208.357 3.527 -2.415 231 H GLY 35 H GLY 35 209.987 0.668 -2.589 232 HA2 GLY 35 HA2 GLY 35 208.050 -1.539 -2.286 233 HA3 GLY 35 HA3 GLY 35 209.779 -1.661 -1.971 234 H ASP 36 H ASP 36 210.013 -2.075 0.114 235 HA ASP 36 HA ASP 36 208.400 -0.550 2.051 236 HB2 ASP 36 HB2 ASP 36 209.741 -3.241 2.152 237 HB3 ASP 36 HB3 ASP 36 209.371 -2.375 3.649 238 H GLY 37 H GLY 37 210.514 0.813 0.832 239 HA2 GLY 37 HA2 GLY 37 212.823 0.690 2.588 240 HA3 GLY 37 HA3 GLY 37 212.612 1.765 1.215 241 HA PRO 38 HA PRO 38 211.791 3.891 5.413 242 HB2 PRO 38 HB2 PRO 38 214.113 5.261 5.693 243 HB3 PRO 38 HB3 PRO 38 213.882 3.618 6.323 244 HG2 PRO 38 HG2 PRO 38 215.216 4.500 3.784 245 HG3 PRO 38 HG3 PRO 38 215.756 3.298 4.971 246 HD2 PRO 38 HD2 PRO 38 214.541 2.602 2.661 247 HD3 PRO 38 HD3 PRO 38 214.338 1.671 4.159 248 H ILE 39 H ILE 39 210.439 5.492 4.924 249 HA ILE 39 HA ILE 39 210.717 7.201 2.667 250 HB ILE 39 HB ILE 39 208.546 6.536 3.811 251 HG12 ILE 39 HG12 ILE 39 208.936 9.509 3.389 252 HG13 ILE 39 HG13 ILE 39 208.772 8.345 2.078 253 HG21 ILE 39 HG21 ILE 39 208.311 8.744 5.546 254 HG22 ILE 39 HG22 ILE 39 209.822 7.930 5.952 255 HG23 ILE 39 HG23 ILE 39 208.304 7.030 5.962 256 HD11 ILE 39 HD11 ILE 39 206.571 7.769 3.522 257 HD12 ILE 39 HD12 ILE 39 206.614 8.926 2.193 258 HD13 ILE 39 HD13 ILE 39 206.742 9.492 3.857 259 H GLY 40 H GLY 40 210.996 9.479 2.635 260 HA2 GLY 40 HA2 GLY 40 212.179 11.388 3.092 261 HA3 GLY 40 HA3 GLY 40 211.531 11.193 4.708 262 H LYS 41 H LYS 41 213.567 8.614 3.731 263 HA LYS 41 HA LYS 41 215.678 9.673 5.476 264 HB2 LYS 41 HB2 LYS 41 214.442 7.271 5.563 265 HB3 LYS 41 HB3 LYS 41 215.810 6.870 4.534 266 HG2 LYS 41 HG2 LYS 41 217.228 8.001 6.373 267 HG3 LYS 41 HG3 LYS 41 215.793 7.786 7.378 268 HD2 LYS 41 HD2 LYS 41 216.696 5.772 7.828 269 HD3 LYS 41 HD3 LYS 41 216.021 5.321 6.262 270 HE2 LYS 41 HE2 LYS 41 218.595 6.601 5.965 271 HE3 LYS 41 HE3 LYS 41 218.697 5.207 7.040 272 HZ1 LYS 41 HZ1 LYS 41 218.005 3.772 5.382 273 HZ2 LYS 41 HZ2 LYS 41 218.992 4.850 4.533 274 HZ3 LYS 41 HZ3 LYS 41 217.310 4.997 4.445 275 H THR 42 H THR 42 217.658 10.165 4.739 276 HA THR 42 HA THR 42 218.294 9.513 1.935 277 HB THR 42 HB THR 42 219.149 11.915 3.566 278 HG1 THR 42 HG1 THR 42 217.383 11.671 1.359 279 HG21 THR 42 HG21 THR 42 220.287 10.816 1.175 280 HG22 THR 42 HG22 THR 42 220.793 12.214 2.120 281 HG23 THR 42 HG23 THR 42 219.581 12.398 0.852 282 H LEU 43 H LEU 43 220.310 8.730 1.431 283 HA LEU 43 HA LEU 43 222.027 8.013 3.721 284 HB2 LEU 43 HB2 LEU 43 221.108 6.520 1.366 285 HB3 LEU 43 HB3 LEU 43 222.831 6.383 1.663 286 HG LEU 43 HG LEU 43 220.639 5.683 3.619 287 HD11 LEU 43 HD11 LEU 43 220.584 3.820 2.368 288 HD12 LEU 43 HD12 LEU 43 222.084 3.426 3.207 289 HD13 LEU 43 HD13 LEU 43 222.136 4.160 1.605 290 HD21 LEU 43 HD21 LEU 43 223.633 5.705 3.860 291 HD22 LEU 43 HD22 LEU 43 222.622 4.670 4.869 292 HD23 LEU 43 HD23 LEU 43 222.434 6.422 4.935 293 H TYR 44 H TYR 44 223.949 9.002 3.810 294 HA TYR 44 HA TYR 44 224.991 10.207 1.333 295 HB2 TYR 44 HB2 TYR 44 224.546 11.321 3.892 296 HB3 TYR 44 HB3 TYR 44 226.292 11.220 3.687 297 HD1 TYR 44 HD1 TYR 44 227.427 12.786 2.361 298 HD2 TYR 44 HD2 TYR 44 223.193 12.484 2.073 299 HE1 TYR 44 HE1 TYR 44 227.383 14.807 0.961 300 HE2 TYR 44 HE2 TYR 44 223.137 14.502 0.673 301 HH TYR 44 HH TYR 44 225.506 15.682 -0.946 302 H VAL 45 H VAL 45 226.684 9.241 0.457 303 HA VAL 45 HA VAL 45 228.524 7.740 2.204 304 HB VAL 45 HB VAL 45 227.381 6.284 0.606 305 HG11 VAL 45 HG11 VAL 45 227.503 8.378 -1.137 306 HG12 VAL 45 HG12 VAL 45 227.091 6.720 -1.569 307 HG13 VAL 45 HG13 VAL 45 228.744 7.298 -1.773 308 HG21 VAL 45 HG21 VAL 45 230.321 6.723 0.142 309 HG22 VAL 45 HG22 VAL 45 229.435 5.356 -0.532 310 HG23 VAL 45 HG23 VAL 45 229.547 5.559 1.216 311 H VAL 46 H VAL 46 230.666 8.208 2.157 312 HA VAL 46 HA VAL 46 231.572 10.212 0.199 313 HB VAL 46 HB VAL 46 233.022 11.195 1.949 314 HG11 VAL 46 HG11 VAL 46 231.235 12.565 1.765 315 HG12 VAL 46 HG12 VAL 46 230.896 11.979 3.393 316 HG13 VAL 46 HG13 VAL 46 230.071 11.263 2.008 317 HG21 VAL 46 HG21 VAL 46 233.346 9.518 3.545 318 HG22 VAL 46 HG22 VAL 46 231.621 9.182 3.680 319 HG23 VAL 46 HG23 VAL 46 232.284 10.668 4.356 320 H GLY 47 H GLY 47 233.317 9.652 -0.934 321 HA2 GLY 47 HA2 GLY 47 234.881 7.326 -0.013 322 HA3 GLY 47 HA3 GLY 47 234.718 7.841 -1.697 323 H ASP 48 H ASP 48 236.955 7.539 0.539 324 HA ASP 48 HA ASP 48 238.313 10.061 -0.160 325 HB2 ASP 48 HB2 ASP 48 237.652 9.587 2.314 326 HB3 ASP 48 HB3 ASP 48 239.019 8.464 2.286 327 H PHE 49 H PHE 49 239.420 9.348 -1.944 328 HA PHE 49 HA PHE 49 241.930 8.455 -1.880 329 HB2 PHE 49 HB2 PHE 49 240.204 6.184 -1.312 330 HB3 PHE 49 HB3 PHE 49 241.171 5.913 -2.766 331 HD1 PHE 49 HD1 PHE 49 243.729 6.900 -2.357 332 HD2 PHE 49 HD2 PHE 49 241.108 5.254 0.565 333 HE1 PHE 49 HE1 PHE 49 245.664 6.302 -0.962 334 HE2 PHE 49 HE2 PHE 49 243.040 4.656 1.965 335 HZ PHE 49 HZ PHE 49 245.322 5.180 1.202 336 H ALA 50 H ALA 50 242.803 7.739 -3.973 337 HA ALA 50 HA ALA 50 242.985 8.048 -6.224 338 HB1 ALA 50 HB1 ALA 50 240.172 7.054 -6.476 339 HB2 ALA 50 HB2 ALA 50 241.473 5.987 -5.945 340 HB3 ALA 50 HB3 ALA 50 241.559 6.758 -7.527 341 H ASP 51 H ASP 51 242.108 10.343 -4.775 342 HA ASP 51 HA ASP 51 241.279 12.429 -5.073 343 HB2 ASP 51 HB2 ASP 51 242.634 11.927 -7.285 344 HB3 ASP 51 HB3 ASP 51 241.026 11.997 -8.020 345 H ALA 52 H ALA 52 239.343 11.265 -4.059 346 HA ALA 52 HA ALA 52 237.021 11.212 -5.839 347 HB1 ALA 52 HB1 ALA 52 236.793 9.331 -4.594 348 HB2 ALA 52 HB2 ALA 52 235.996 10.451 -3.488 349 HB3 ALA 52 HB3 ALA 52 237.678 9.997 -3.224 350 H SER 53 H SER 53 238.260 12.823 -2.940 351 HA SER 53 HA SER 53 237.645 14.709 -1.839 352 HB2 SER 53 HB2 SER 53 237.838 15.366 -4.478 353 HB3 SER 53 HB3 SER 53 236.188 15.883 -4.124 354 HG SER 53 HG SER 53 238.480 17.085 -3.477 355 H TRP 54 H TRP 54 235.781 12.464 -1.773 356 HA TRP 54 HA TRP 54 233.671 11.931 -1.102 357 HB2 TRP 54 HB2 TRP 54 233.705 14.788 -0.090 358 HB3 TRP 54 HB3 TRP 54 232.578 13.526 0.429 359 HD1 TRP 54 HD1 TRP 54 235.081 11.295 0.530 360 HE1 TRP 54 HE1 TRP 54 236.556 11.333 2.636 361 HE3 TRP 54 HE3 TRP 54 233.997 16.009 2.195 362 HZ2 TRP 54 HZ2 TRP 54 237.179 13.124 4.728 363 HZ3 TRP 54 HZ3 TRP 54 235.075 16.806 4.258 364 HH2 TRP 54 HH2 TRP 54 236.633 15.393 5.498 365 H LYS 55 H LYS 55 233.410 12.084 -3.603 366 HA LYS 55 HA LYS 55 231.519 14.162 -4.398 367 HB2 LYS 55 HB2 LYS 55 233.331 12.298 -5.810 368 HB3 LYS 55 HB3 LYS 55 231.810 12.643 -6.618 369 HG2 LYS 55 HG2 LYS 55 232.294 14.910 -6.836 370 HG3 LYS 55 HG3 LYS 55 233.551 14.856 -5.596 371 HD2 LYS 55 HD2 LYS 55 234.660 15.005 -7.694 372 HD3 LYS 55 HD3 LYS 55 234.848 13.341 -7.135 373 HE2 LYS 55 HE2 LYS 55 234.295 13.194 -9.426 374 HE3 LYS 55 HE3 LYS 55 232.825 12.778 -8.546 375 HZ1 LYS 55 HZ1 LYS 55 233.390 15.085 -10.227 376 HZ2 LYS 55 HZ2 LYS 55 232.470 15.390 -8.841 377 HZ3 LYS 55 HZ3 LYS 55 231.936 14.256 -9.976 378 H GLN 56 H GLN 56 229.402 13.841 -4.342 379 HA GLN 56 HA GLN 56 228.146 11.447 -5.197 380 HB2 GLN 56 HB2 GLN 56 228.805 11.648 -2.381 381 HB3 GLN 56 HB3 GLN 56 227.067 11.526 -2.616 382 HG2 GLN 56 HG2 GLN 56 228.863 9.643 -4.068 383 HG3 GLN 56 HG3 GLN 56 228.544 9.388 -2.345 384 HE21 GLN 56 HE21 GLN 56 227.551 8.607 -5.381 385 HE22 GLN 56 HE22 GLN 56 225.924 8.136 -5.042 386 H LYS 57 H LYS 57 226.542 12.346 -6.312 387 HA LYS 57 HA LYS 57 225.382 14.860 -5.612 388 HB2 LYS 57 HB2 LYS 57 225.409 13.146 -7.887 389 HB3 LYS 57 HB3 LYS 57 223.730 13.464 -7.477 390 HG2 LYS 57 HG2 LYS 57 224.633 15.063 -9.106 391 HG3 LYS 57 HG3 LYS 57 224.099 15.842 -7.615 392 HD2 LYS 57 HD2 LYS 57 226.163 16.571 -7.127 393 HD3 LYS 57 HD3 LYS 57 226.908 15.035 -7.569 394 HE2 LYS 57 HE2 LYS 57 225.863 16.718 -9.773 395 HE3 LYS 57 HE3 LYS 57 227.308 17.290 -8.944 396 HZ1 LYS 57 HZ1 LYS 57 227.991 14.767 -9.342 397 HZ2 LYS 57 HZ2 LYS 57 228.292 15.981 -10.481 398 HZ3 LYS 57 HZ3 LYS 57 226.952 14.965 -10.664 399 HA PRO 58 HA PRO 58 222.415 13.421 -2.605 400 HB2 PRO 58 HB2 PRO 58 220.944 15.844 -3.522 401 HB3 PRO 58 HB3 PRO 58 221.389 15.342 -1.880 402 HG2 PRO 58 HG2 PRO 58 222.708 17.305 -3.101 403 HG3 PRO 58 HG3 PRO 58 223.564 16.124 -2.092 404 HD2 PRO 58 HD2 PRO 58 223.410 16.316 -5.071 405 HD3 PRO 58 HD3 PRO 58 224.780 15.860 -4.039 406 H HIS 59 H HIS 59 221.479 14.472 -5.853 407 HA HIS 59 HA HIS 59 218.847 13.555 -5.905 408 HB2 HIS 59 HB2 HIS 59 220.897 14.246 -7.904 409 HB3 HIS 59 HB3 HIS 59 219.662 13.115 -8.473 410 HD1 HIS 59 HD1 HIS 59 220.282 16.662 -7.894 411 HD2 HIS 59 HD2 HIS 59 216.954 14.192 -8.208 412 HE1 HIS 59 HE1 HIS 59 218.342 18.199 -8.335 413 HE2 HIS 59 HE2 HIS 59 216.346 16.678 -8.565 414 H ARG 60 H ARG 60 221.814 11.743 -5.986 415 HA ARG 60 HA ARG 60 220.279 9.285 -6.524 416 HB2 ARG 60 HB2 ARG 60 223.231 9.699 -7.025 417 HB3 ARG 60 HB3 ARG 60 222.264 8.302 -7.476 418 HG2 ARG 60 HG2 ARG 60 221.052 9.593 -9.102 419 HG3 ARG 60 HG3 ARG 60 221.847 11.076 -8.571 420 HD2 ARG 60 HD2 ARG 60 224.034 10.014 -9.224 421 HD3 ARG 60 HD3 ARG 60 223.089 8.711 -9.965 422 HE ARG 60 HE ARG 60 222.319 11.322 -10.871 423 HH11 ARG 60 HH11 ARG 60 224.600 8.703 -11.374 424 HH12 ARG 60 HH12 ARG 60 224.909 9.132 -13.022 425 HH21 ARG 60 HH21 ARG 60 222.739 11.876 -13.037 426 HH22 ARG 60 HH22 ARG 60 223.856 10.932 -13.964 427 H ALA 61 H ALA 61 221.231 10.905 -4.001 428 HA ALA 61 HA ALA 61 222.808 8.897 -2.620 429 HB1 ALA 61 HB1 ALA 61 223.112 10.461 -0.926 430 HB2 ALA 61 HB2 ALA 61 221.627 11.326 -1.323 431 HB3 ALA 61 HB3 ALA 61 223.031 11.448 -2.383 432 H TYR 62 H TYR 62 219.685 8.847 -3.412 433 HA TYR 62 HA TYR 62 219.000 7.171 -1.181 434 HB2 TYR 62 HB2 TYR 62 216.970 8.378 -0.524 435 HB3 TYR 62 HB3 TYR 62 218.408 9.350 -0.247 436 HD1 TYR 62 HD1 TYR 62 215.164 9.292 -1.663 437 HD2 TYR 62 HD2 TYR 62 219.006 11.067 -2.129 438 HE1 TYR 62 HE1 TYR 62 214.155 11.129 -2.946 439 HE2 TYR 62 HE2 TYR 62 218.001 12.908 -3.416 440 HH TYR 62 HH TYR 62 214.962 12.795 -4.720 441 H ARG 63 H ARG 63 218.796 5.554 -2.705 442 HA ARG 63 HA ARG 63 216.601 5.871 -4.642 443 HB2 ARG 63 HB2 ARG 63 219.053 4.121 -4.690 444 HB3 ARG 63 HB3 ARG 63 217.690 3.861 -5.768 445 HG2 ARG 63 HG2 ARG 63 218.010 6.296 -6.469 446 HG3 ARG 63 HG3 ARG 63 219.575 6.192 -5.661 447 HD2 ARG 63 HD2 ARG 63 218.588 4.544 -7.981 448 HD3 ARG 63 HD3 ARG 63 219.901 5.720 -7.984 449 HE ARG 63 HE ARG 63 220.747 3.932 -6.164 450 HH11 ARG 63 HH11 ARG 63 219.510 3.547 -9.414 451 HH12 ARG 63 HH12 ARG 63 220.417 2.107 -9.724 452 HH21 ARG 63 HH21 ARG 63 221.950 2.026 -6.581 453 HH22 ARG 63 HH22 ARG 63 221.796 1.243 -8.119 454 H TYR 64 H TYR 64 214.774 4.969 -4.018 455 HA TYR 64 HA TYR 64 214.684 2.984 -1.949 456 HB2 TYR 64 HB2 TYR 64 212.553 4.261 -3.667 457 HB3 TYR 64 HB3 TYR 64 212.194 3.003 -2.480 458 HD1 TYR 64 HD1 TYR 64 214.129 6.217 -2.594 459 HD2 TYR 64 HD2 TYR 64 211.395 3.749 -0.460 460 HE1 TYR 64 HE1 TYR 64 213.965 7.925 -0.838 461 HE2 TYR 64 HE2 TYR 64 211.225 5.454 1.300 462 HH TYR 64 HH TYR 64 212.693 7.347 2.172 463 H VAL 65 H VAL 65 214.954 0.883 -2.245 464 HA VAL 65 HA VAL 65 214.523 -0.260 -4.908 465 HB VAL 65 HB VAL 65 215.642 -1.822 -2.601 466 HG11 VAL 65 HG11 VAL 65 215.733 -3.367 -4.193 467 HG12 VAL 65 HG12 VAL 65 216.987 -2.404 -4.972 468 HG13 VAL 65 HG13 VAL 65 215.301 -2.199 -5.441 469 HG21 VAL 65 HG21 VAL 65 217.327 -0.093 -4.408 470 HG22 VAL 65 HG22 VAL 65 217.871 -1.084 -3.056 471 HG23 VAL 65 HG23 VAL 65 216.885 0.345 -2.759 472 H GLY 66 H GLY 66 212.627 -1.181 -5.316 473 HA2 GLY 66 HA2 GLY 66 210.668 -1.604 -3.329 474 HA3 GLY 66 HA3 GLY 66 210.572 -2.155 -4.999 475 H GLU 67 H GLU 67 211.857 -2.902 -1.817 476 HA GLU 67 HA GLU 67 211.077 -5.547 -1.694 477 HB2 GLU 67 HB2 GLU 67 213.520 -5.133 -3.277 478 HB3 GLU 67 HB3 GLU 67 213.693 -6.330 -1.995 479 HG2 GLU 67 HG2 GLU 67 211.252 -6.654 -3.546 480 HG3 GLU 67 HG3 GLU 67 212.721 -6.781 -4.512 481 H ASN 68 H ASN 68 211.692 -3.148 -0.017 482 HA ASN 68 HA ASN 68 212.411 -2.666 2.077 483 HB2 ASN 68 HB2 ASN 68 211.335 -4.894 2.554 484 HB3 ASN 68 HB3 ASN 68 212.927 -5.631 2.384 485 HD21 ASN 68 HD21 ASN 68 213.217 -6.309 4.448 486 HD22 ASN 68 HD22 ASN 68 213.322 -5.237 5.810 487 H THR 69 H THR 69 214.301 -2.962 -0.262 488 HA THR 69 HA THR 69 216.814 -3.207 1.256 489 HB THR 69 HB THR 69 217.823 -3.710 -1.040 490 HG1 THR 69 HG1 THR 69 216.397 -4.434 -2.602 491 HG21 THR 69 HG21 THR 69 217.620 -5.952 -0.770 492 HG22 THR 69 HG22 THR 69 215.888 -5.874 -0.451 493 HG23 THR 69 HG23 THR 69 217.039 -5.425 0.808 494 H TYR 70 H TYR 70 218.556 -1.779 0.612 495 HA TYR 70 HA TYR 70 217.626 0.665 -0.749 496 HB2 TYR 70 HB2 TYR 70 218.148 0.542 1.922 497 HB3 TYR 70 HB3 TYR 70 219.723 1.016 1.295 498 HD1 TYR 70 HD1 TYR 70 219.977 3.147 0.065 499 HD2 TYR 70 HD2 TYR 70 216.298 2.054 1.900 500 HE1 TYR 70 HE1 TYR 70 219.211 5.475 -0.100 501 HE2 TYR 70 HE2 TYR 70 215.520 4.382 1.741 502 HH TYR 70 HH TYR 70 216.056 6.407 0.248 503 H GLN 71 H GLN 71 219.086 1.744 -2.053 504 HA GLN 71 HA GLN 71 221.813 0.772 -2.279 505 HB2 GLN 71 HB2 GLN 71 221.697 0.225 -4.616 506 HB3 GLN 71 HB3 GLN 71 220.487 -0.720 -3.760 507 HG2 GLN 71 HG2 GLN 71 218.792 0.985 -4.465 508 HG3 GLN 71 HG3 GLN 71 220.039 1.707 -5.479 509 HE21 GLN 71 HE21 GLN 71 219.094 -1.653 -4.788 510 HE22 GLN 71 HE22 GLN 71 218.870 -2.106 -6.451 511 H ALA 72 H ALA 72 223.150 2.125 -3.677 512 HA ALA 72 HA ALA 72 222.040 4.689 -4.492 513 HB1 ALA 72 HB1 ALA 72 222.508 5.477 -2.401 514 HB2 ALA 72 HB2 ALA 72 224.072 5.745 -3.172 515 HB3 ALA 72 HB3 ALA 72 223.826 4.333 -2.144 516 H VAL 73 H VAL 73 222.900 5.187 -6.413 517 HA VAL 73 HA VAL 73 225.179 3.773 -7.434 518 HB VAL 73 HB VAL 73 224.909 5.339 -9.425 519 HG11 VAL 73 HG11 VAL 73 223.393 3.104 -8.569 520 HG12 VAL 73 HG12 VAL 73 223.762 3.612 -10.217 521 HG13 VAL 73 HG13 VAL 73 222.304 4.199 -9.419 522 HG21 VAL 73 HG21 VAL 73 222.297 6.069 -8.117 523 HG22 VAL 73 HG22 VAL 73 222.992 6.711 -9.604 524 HG23 VAL 73 HG23 VAL 73 223.723 7.105 -8.048 525 H VAL 74 H VAL 74 227.253 4.360 -7.438 526 HA VAL 74 HA VAL 74 227.942 7.153 -6.793 527 HB VAL 74 HB VAL 74 229.547 4.820 -5.771 528 HG11 VAL 74 HG11 VAL 74 230.436 7.222 -5.958 529 HG12 VAL 74 HG12 VAL 74 230.650 6.369 -4.431 530 HG13 VAL 74 HG13 VAL 74 229.371 7.570 -4.597 531 HG21 VAL 74 HG21 VAL 74 228.451 5.165 -3.574 532 HG22 VAL 74 HG22 VAL 74 227.359 4.530 -4.806 533 HG23 VAL 74 HG23 VAL 74 227.289 6.234 -4.357 534 H ASP 75 H ASP 75 229.637 8.031 -7.896 535 HA ASP 75 HA ASP 75 230.601 6.588 -10.211 536 HB2 ASP 75 HB2 ASP 75 230.845 9.412 -9.215 537 HB3 ASP 75 HB3 ASP 75 231.917 8.833 -10.496 538 H GLU 76 H GLU 76 232.589 5.727 -10.503 539 HA GLU 76 HA GLU 76 234.459 5.864 -8.232 540 HB2 GLU 76 HB2 GLU 76 233.548 3.640 -8.610 541 HB3 GLU 76 HB3 GLU 76 234.052 3.690 -10.291 542 HG2 GLU 76 HG2 GLU 76 236.124 4.024 -8.183 543 HG3 GLU 76 HG3 GLU 76 235.452 2.422 -8.468 544 H LYS 77 H LYS 77 236.631 6.239 -8.570 545 HA LYS 77 HA LYS 77 237.561 6.684 -11.306 546 HB2 LYS 77 HB2 LYS 77 236.839 8.797 -9.595 547 HB3 LYS 77 HB3 LYS 77 238.597 8.761 -9.594 548 HG2 LYS 77 HG2 LYS 77 237.197 8.601 -12.210 549 HG3 LYS 77 HG3 LYS 77 237.237 10.152 -11.368 550 HD2 LYS 77 HD2 LYS 77 239.184 10.355 -12.525 551 HD3 LYS 77 HD3 LYS 77 239.810 9.491 -11.119 552 HE2 LYS 77 HE2 LYS 77 238.940 7.464 -12.778 553 HE3 LYS 77 HE3 LYS 77 239.610 8.646 -13.901 554 HZ1 LYS 77 HZ1 LYS 77 240.970 6.864 -12.172 555 HZ2 LYS 77 HZ2 LYS 77 241.424 8.453 -11.822 556 HZ3 LYS 77 HZ3 LYS 77 241.599 7.851 -13.390 557 H ALA 78 H ALA 78 239.125 5.193 -11.385 558 HA ALA 78 HA ALA 78 241.137 4.190 -11.069 559 HB1 ALA 78 HB1 ALA 78 241.499 6.778 -9.818 560 HB2 ALA 78 HB2 ALA 78 242.619 5.818 -10.785 561 HB3 ALA 78 HB3 ALA 78 242.479 5.524 -9.052 562 H GLY 79 H GLY 79 241.961 2.538 -9.852 563 HA2 GLY 79 HA2 GLY 79 240.269 1.460 -7.852 564 HA3 GLY 79 HA3 GLY 79 241.828 0.809 -8.359 565 H ALA 80 H ALA 80 240.853 0.712 -5.793 566 HA ALA 80 HA ALA 80 241.702 0.835 -3.686 567 HB1 ALA 80 HB1 ALA 80 243.738 2.891 -4.371 568 HB2 ALA 80 HB2 ALA 80 243.920 1.271 -5.042 569 HB3 ALA 80 HB3 ALA 80 243.852 1.497 -3.297 570 H PHE 81 H PHE 81 239.587 1.873 -3.435 571 HA PHE 81 HA PHE 81 239.927 4.564 -2.350 572 HB2 PHE 81 HB2 PHE 81 237.670 5.193 -3.294 573 HB3 PHE 81 HB3 PHE 81 238.966 5.053 -4.475 574 HD1 PHE 81 HD1 PHE 81 235.835 3.631 -3.257 575 HD2 PHE 81 HD2 PHE 81 238.988 3.236 -6.089 576 HE1 PHE 81 HE1 PHE 81 234.465 2.056 -4.556 577 HE2 PHE 81 HE2 PHE 81 237.623 1.658 -7.393 578 HZ PHE 81 HZ PHE 81 235.358 1.067 -6.627 579 H ARG 82 H ARG 82 238.880 4.928 -0.466 580 HA ARG 82 HA ARG 82 237.239 2.716 0.577 581 HB2 ARG 82 HB2 ARG 82 239.279 4.490 1.783 582 HB3 ARG 82 HB3 ARG 82 237.882 4.141 2.791 583 HG2 ARG 82 HG2 ARG 82 238.371 1.894 2.933 584 HG3 ARG 82 HG3 ARG 82 239.323 1.901 1.442 585 HD2 ARG 82 HD2 ARG 82 240.874 3.516 2.811 586 HD3 ARG 82 HD3 ARG 82 240.093 2.758 4.198 587 HE ARG 82 HE ARG 82 241.284 0.849 3.783 588 HH11 ARG 82 HH11 ARG 82 241.444 2.905 0.953 589 HH12 ARG 82 HH12 ARG 82 242.634 1.930 0.159 590 HH21 ARG 82 HH21 ARG 82 242.849 -0.438 2.725 591 HH22 ARG 82 HH22 ARG 82 243.430 0.032 1.163 592 H MET 83 H MET 83 235.189 3.094 1.300 593 HA MET 83 HA MET 83 234.295 5.860 1.621 594 HB2 MET 83 HB2 MET 83 232.310 5.473 0.205 595 HB3 MET 83 HB3 MET 83 233.811 5.382 -0.705 596 HG2 MET 83 HG2 MET 83 233.598 2.821 -0.251 597 HG3 MET 83 HG3 MET 83 231.902 3.213 0.029 598 HE1 MET 83 HE1 MET 83 230.422 3.177 -3.333 599 HE2 MET 83 HE2 MET 83 230.229 3.956 -1.763 600 HE3 MET 83 HE3 MET 83 230.557 2.225 -1.853 601 H GLN 84 H GLN 84 232.118 6.024 2.576 602 HA GLN 84 HA GLN 84 231.110 3.673 3.958 603 HB2 GLN 84 HB2 GLN 84 232.857 4.553 5.459 604 HB3 GLN 84 HB3 GLN 84 232.060 6.119 5.463 605 HG2 GLN 84 HG2 GLN 84 230.073 4.341 6.235 606 HG3 GLN 84 HG3 GLN 84 231.533 3.764 7.055 607 HE21 GLN 84 HE21 GLN 84 229.381 6.500 6.614 608 HE22 GLN 84 HE22 GLN 84 229.835 7.331 8.069 609 H TYR 85 H TYR 85 228.946 3.823 4.482 610 HA TYR 85 HA TYR 85 227.553 6.177 3.434 611 HB2 TYR 85 HB2 TYR 85 226.821 3.314 3.836 612 HB3 TYR 85 HB3 TYR 85 225.534 4.510 3.922 613 HD1 TYR 85 HD1 TYR 85 224.603 5.415 1.957 614 HD2 TYR 85 HD2 TYR 85 228.244 3.225 1.731 615 HE1 TYR 85 HE1 TYR 85 224.461 5.443 -0.497 616 HE2 TYR 85 HE2 TYR 85 228.111 3.247 -0.722 617 HH TYR 85 HH TYR 85 225.767 3.567 -2.440 618 H ALA 86 H ALA 86 226.170 7.417 4.629 619 HA ALA 86 HA ALA 86 225.439 6.714 7.327 620 HB1 ALA 86 HB1 ALA 86 227.432 8.904 6.807 621 HB2 ALA 86 HB2 ALA 86 227.587 7.517 7.887 622 HB3 ALA 86 HB3 ALA 86 226.464 8.821 8.279 623 H SER 87 H SER 87 223.442 7.450 7.656 624 HA SER 87 HA SER 87 222.161 9.198 5.813 625 HB2 SER 87 HB2 SER 87 220.865 7.471 6.883 626 HB3 SER 87 HB3 SER 87 221.279 8.089 8.488 627 HG SER 87 HG SER 87 219.731 9.502 8.315 628 H LYS 88 H LYS 88 220.875 11.139 6.603 629 HA LYS 88 HA LYS 88 222.717 13.025 7.743 630 HB2 LYS 88 HB2 LYS 88 219.823 13.507 7.042 631 HB3 LYS 88 HB3 LYS 88 221.105 14.701 7.179 632 HG2 LYS 88 HG2 LYS 88 222.214 13.337 5.257 633 HG3 LYS 88 HG3 LYS 88 220.575 12.736 4.998 634 HD2 LYS 88 HD2 LYS 88 220.072 14.595 3.890 635 HD3 LYS 88 HD3 LYS 88 220.423 15.550 5.331 636 HE2 LYS 88 HE2 LYS 88 222.795 14.648 3.855 637 HE3 LYS 88 HE3 LYS 88 221.750 15.747 2.956 638 HZ1 LYS 88 HZ1 LYS 88 222.370 16.495 5.705 639 HZ2 LYS 88 HZ2 LYS 88 222.224 17.463 4.325 640 HZ3 LYS 88 HZ3 LYS 88 223.644 16.586 4.595 641 H ASP 89 H ASP 89 219.667 11.534 8.787 642 HA ASP 89 HA ASP 89 219.824 12.943 11.347 643 HB2 ASP 89 HB2 ASP 89 217.687 11.965 9.722 644 HB3 ASP 89 HB3 ASP 89 217.620 11.130 11.281 645 H TRP 90 H TRP 90 221.831 10.959 10.786 646 HA TRP 90 HA TRP 90 222.853 9.125 11.654 647 HB2 TRP 90 HB2 TRP 90 221.232 9.990 14.054 648 HB3 TRP 90 HB3 TRP 90 222.500 8.772 14.113 649 HD1 TRP 90 HD1 TRP 90 225.027 9.729 13.310 650 HE1 TRP 90 HE1 TRP 90 226.101 11.999 13.875 651 HE3 TRP 90 HE3 TRP 90 220.812 12.339 14.549 652 HZ2 TRP 90 HZ2 TRP 90 225.273 14.558 14.730 653 HZ3 TRP 90 HZ3 TRP 90 221.038 14.691 15.230 654 HH2 TRP 90 HH2 TRP 90 223.223 15.777 15.318 655 H SER 91 H SER 91 220.571 8.530 10.124 656 HA SER 91 HA SER 91 219.078 6.454 11.497 657 HB2 SER 91 HB2 SER 91 218.622 8.106 9.252 658 HB3 SER 91 HB3 SER 91 218.702 6.457 8.635 659 HG SER 91 HG SER 91 216.595 7.345 9.481 660 HA PRO 92 HA PRO 92 220.985 2.634 10.275 661 HB2 PRO 92 HB2 PRO 92 219.252 2.483 7.830 662 HB3 PRO 92 HB3 PRO 92 219.653 1.216 9.008 663 HG2 PRO 92 HG2 PRO 92 217.307 2.460 9.114 664 HG3 PRO 92 HG3 PRO 92 218.183 2.049 10.598 665 HD2 PRO 92 HD2 PRO 92 217.788 4.692 9.305 666 HD3 PRO 92 HD3 PRO 92 218.018 4.294 11.023 667 H GLN 93 H GLN 93 223.012 2.729 9.575 668 HA GLN 93 HA GLN 93 223.551 3.765 6.867 669 HB2 GLN 93 HB2 GLN 93 225.701 3.741 8.932 670 HB3 GLN 93 HB3 GLN 93 225.429 4.866 7.610 671 HG2 GLN 93 HG2 GLN 93 223.704 5.984 8.820 672 HG3 GLN 93 HG3 GLN 93 223.717 4.754 10.080 673 HE21 GLN 93 HE21 GLN 93 225.635 4.579 11.399 674 HE22 GLN 93 HE22 GLN 93 226.592 5.995 11.700 675 H PHE 94 H PHE 94 226.049 2.978 6.377 676 HA PHE 94 HA PHE 94 226.061 0.060 6.786 677 HB2 PHE 94 HB2 PHE 94 225.648 -0.039 4.558 678 HB3 PHE 94 HB3 PHE 94 226.138 1.625 4.291 679 HD1 PHE 94 HD1 PHE 94 228.332 2.160 3.534 680 HD2 PHE 94 HD2 PHE 94 227.334 -1.852 4.547 681 HE1 PHE 94 HE1 PHE 94 230.410 1.381 2.475 682 HE2 PHE 94 HE2 PHE 94 229.413 -2.637 3.490 683 HZ PHE 94 HZ PHE 94 230.956 -1.018 2.453 684 H THR 95 H THR 95 227.790 -0.600 7.871 685 HA THR 95 HA THR 95 230.369 0.701 7.411 686 HB THR 95 HB THR 95 230.787 0.671 9.901 687 HG1 THR 95 HG1 THR 95 229.178 -0.603 10.679 688 HG21 THR 95 HG21 THR 95 230.023 2.790 10.234 689 HG22 THR 95 HG22 THR 95 228.472 2.475 9.456 690 HG23 THR 95 HG23 THR 95 229.922 2.691 8.476 691 H ALA 96 H ALA 96 231.864 -0.774 7.015 692 HA ALA 96 HA ALA 96 231.417 -3.537 7.934 693 HB1 ALA 96 HB1 ALA 96 231.694 -3.006 5.453 694 HB2 ALA 96 HB2 ALA 96 232.704 -4.291 6.119 695 HB3 ALA 96 HB3 ALA 96 233.389 -2.692 5.829 696 H ASP 97 H ASP 97 233.168 -4.748 8.751 697 HA ASP 97 HA ASP 97 235.048 -3.100 10.281 698 HB2 ASP 97 HB2 ASP 97 233.485 -5.203 11.052 699 HB3 ASP 97 HB3 ASP 97 235.030 -6.005 10.738 700 H GLY 98 H GLY 98 235.405 -3.734 7.387 701 HA2 GLY 98 HA2 GLY 98 237.533 -3.776 6.309 702 HA3 GLY 98 HA3 GLY 98 238.133 -4.806 7.615 703 H LEU 99 H LEU 99 237.861 -4.974 4.531 704 HA LEU 99 HA LEU 99 237.643 -7.777 4.384 705 HB2 LEU 99 HB2 LEU 99 235.591 -7.986 3.044 706 HB3 LEU 99 HB3 LEU 99 235.277 -7.456 4.685 707 HG LEU 99 HG LEU 99 235.561 -5.257 2.764 708 HD11 LEU 99 HD11 LEU 99 233.053 -5.819 2.108 709 HD12 LEU 99 HD12 LEU 99 233.653 -7.468 2.280 710 HD13 LEU 99 HD13 LEU 99 234.427 -6.362 1.145 711 HD21 LEU 99 HD21 LEU 99 234.816 -4.987 5.090 712 HD22 LEU 99 HD22 LEU 99 233.407 -5.988 4.742 713 HD23 LEU 99 HD23 LEU 99 233.608 -4.434 3.933 714 H GLU 100 H GLU 100 237.421 -4.705 2.642 715 HA GLU 100 HA GLU 100 238.299 -3.998 0.674 716 HB2 GLU 100 HB2 GLU 100 240.040 -6.461 0.661 717 HB3 GLU 100 HB3 GLU 100 240.366 -4.899 -0.071 718 HG2 GLU 100 HG2 GLU 100 240.583 -3.917 2.122 719 HG3 GLU 100 HG3 GLU 100 240.253 -5.482 2.856 720 H LEU 101 H LEU 101 236.228 -4.435 -0.155 721 HA LEU 101 HA LEU 101 235.555 -6.872 -1.447 722 HB2 LEU 101 HB2 LEU 101 233.934 -5.209 -0.550 723 HB3 LEU 101 HB3 LEU 101 234.361 -4.134 -1.878 724 HG LEU 101 HG LEU 101 233.464 -6.854 -2.636 725 HD11 LEU 101 HD11 LEU 101 231.242 -5.014 -2.117 726 HD12 LEU 101 HD12 LEU 101 232.016 -5.665 -0.675 727 HD13 LEU 101 HD13 LEU 101 231.354 -6.758 -1.888 728 HD21 LEU 101 HD21 LEU 101 232.780 -4.090 -3.633 729 HD22 LEU 101 HD22 LEU 101 232.354 -5.614 -4.408 730 HD23 LEU 101 HD23 LEU 101 234.044 -5.130 -4.288 731 H THR 102 H THR 102 235.401 -7.370 -3.608 732 HA THR 102 HA THR 102 237.091 -5.766 -5.414 733 HB THR 102 HB THR 102 236.544 -8.745 -5.414 734 HG1 THR 102 HG1 THR 102 238.795 -7.200 -4.678 735 HG21 THR 102 HG21 THR 102 236.913 -7.776 -7.696 736 HG22 THR 102 HG22 THR 102 238.067 -9.008 -7.190 737 HG23 THR 102 HG23 THR 102 238.524 -7.305 -7.150 738 HA PRO 103 HA PRO 103 233.713 -4.706 -8.070 739 HB2 PRO 103 HB2 PRO 103 235.457 -5.959 -10.162 740 HB3 PRO 103 HB3 PRO 103 234.558 -4.438 -10.219 741 HG2 PRO 103 HG2 PRO 103 237.178 -4.442 -9.744 742 HG3 PRO 103 HG3 PRO 103 236.095 -3.320 -8.887 743 HD2 PRO 103 HD2 PRO 103 237.489 -5.739 -7.885 744 HD3 PRO 103 HD3 PRO 103 236.955 -4.295 -7.007 745 H GLY 104 H GLY 104 231.905 -5.886 -7.928 746 HA2 GLY 104 HA2 GLY 104 230.373 -7.483 -8.686 747 HA3 GLY 104 HA3 GLY 104 231.705 -8.366 -9.438 748 H LYS 105 H LYS 105 231.624 -7.324 -6.067 749 HA LYS 105 HA LYS 105 231.247 -10.122 -5.227 750 HB2 LYS 105 HB2 LYS 105 233.664 -9.497 -5.201 751 HB3 LYS 105 HB3 LYS 105 233.279 -8.211 -4.054 752 HG2 LYS 105 HG2 LYS 105 232.327 -10.069 -2.577 753 HG3 LYS 105 HG3 LYS 105 233.180 -11.181 -3.648 754 HD2 LYS 105 HD2 LYS 105 235.239 -10.520 -2.919 755 HD3 LYS 105 HD3 LYS 105 234.704 -8.876 -2.569 756 HE2 LYS 105 HE2 LYS 105 233.275 -10.153 -0.725 757 HE3 LYS 105 HE3 LYS 105 234.590 -11.316 -0.883 758 HZ1 LYS 105 HZ1 LYS 105 235.369 -9.921 0.748 759 HZ2 LYS 105 HZ2 LYS 105 234.678 -8.534 0.070 760 HZ3 LYS 105 HZ3 LYS 105 236.062 -9.212 -0.625 761 H THR 106 H THR 106 230.400 -10.423 -3.146 762 HA THR 106 HA THR 106 228.566 -8.344 -2.343 763 HB THR 106 HB THR 106 228.031 -10.151 -0.523 764 HG1 THR 106 HG1 THR 106 228.891 -12.066 -0.806 765 HG21 THR 106 HG21 THR 106 227.476 -10.638 -3.438 766 HG22 THR 106 HG22 THR 106 226.482 -9.725 -2.302 767 HG23 THR 106 HG23 THR 106 226.675 -11.467 -2.103 768 H ALA 107 H ALA 107 228.587 -7.164 -0.481 769 HA ALA 107 HA ALA 107 231.086 -7.222 1.067 770 HB1 ALA 107 HB1 ALA 107 231.017 -4.980 1.185 771 HB2 ALA 107 HB2 ALA 107 229.275 -4.943 1.452 772 HB3 ALA 107 HB3 ALA 107 229.913 -5.116 -0.183 773 H SER 108 H SER 108 231.066 -7.131 3.313 774 HA SER 108 HA SER 108 228.768 -8.421 4.529 775 HB2 SER 108 HB2 SER 108 231.236 -7.589 6.035 776 HB3 SER 108 HB3 SER 108 230.172 -8.967 6.321 777 HG SER 108 HG SER 108 231.926 -9.825 5.354 778 H LEU 109 H LEU 109 227.325 -7.497 5.875 779 HA LEU 109 HA LEU 109 227.685 -4.640 6.486 780 HB2 LEU 109 HB2 LEU 109 225.772 -5.104 5.067 781 HB3 LEU 109 HB3 LEU 109 225.172 -6.288 6.211 782 HG LEU 109 HG LEU 109 224.825 -4.475 7.866 783 HD11 LEU 109 HD11 LEU 109 226.463 -2.878 7.153 784 HD12 LEU 109 HD12 LEU 109 224.868 -2.136 7.022 785 HD13 LEU 109 HD13 LEU 109 225.692 -2.721 5.576 786 HD21 LEU 109 HD21 LEU 109 222.756 -4.096 7.080 787 HD22 LEU 109 HD22 LEU 109 223.236 -5.198 5.791 788 HD23 LEU 109 HD23 LEU 109 223.343 -3.455 5.546 789 H LYS 110 H LYS 110 227.566 -3.912 8.557 790 HA LYS 110 HA LYS 110 227.457 -5.945 10.663 791 HB2 LYS 110 HB2 LYS 110 228.541 -3.139 10.557 792 HB3 LYS 110 HB3 LYS 110 228.307 -3.978 12.084 793 HG2 LYS 110 HG2 LYS 110 229.743 -5.838 11.046 794 HG3 LYS 110 HG3 LYS 110 230.202 -4.618 9.857 795 HD2 LYS 110 HD2 LYS 110 231.837 -4.176 11.353 796 HD3 LYS 110 HD3 LYS 110 230.575 -3.215 12.124 797 HE2 LYS 110 HE2 LYS 110 229.997 -5.322 13.433 798 HE3 LYS 110 HE3 LYS 110 231.525 -5.974 12.844 799 HZ1 LYS 110 HZ1 LYS 110 232.734 -4.566 14.127 800 HZ2 LYS 110 HZ2 LYS 110 231.361 -4.682 15.112 801 HZ3 LYS 110 HZ3 LYS 110 231.571 -3.337 14.108 802 H ARG 111 H ARG 111 226.443 -2.529 10.455 803 HA ARG 111 HA ARG 111 223.712 -2.951 10.900 804 HB2 ARG 111 HB2 ARG 111 224.749 -3.711 13.145 805 HB3 ARG 111 HB3 ARG 111 225.041 -2.001 13.426 806 HG2 ARG 111 HG2 ARG 111 222.409 -2.008 12.697 807 HG3 ARG 111 HG3 ARG 111 222.559 -3.533 13.572 808 HD2 ARG 111 HD2 ARG 111 223.663 -0.987 14.705 809 HD3 ARG 111 HD3 ARG 111 221.958 -1.393 14.885 810 HE ARG 111 HE ARG 111 223.621 -3.552 15.691 811 HH11 ARG 111 HH11 ARG 111 222.417 -0.438 16.746 812 HH12 ARG 111 HH12 ARG 111 222.550 -0.819 18.430 813 HH21 ARG 111 HH21 ARG 111 223.798 -4.046 17.914 814 HH22 ARG 111 HH22 ARG 111 223.334 -2.863 19.091 815 H GLY 112 H GLY 112 226.420 -0.802 11.725 816 HA2 GLY 112 HA2 GLY 112 226.335 1.275 10.235 817 HA3 GLY 112 HA3 GLY 112 224.750 1.508 10.969 818 H GLY 113 H GLY 113 227.360 3.060 11.021 819 HA2 GLY 113 HA2 GLY 113 227.262 4.457 13.272 820 HA3 GLY 113 HA3 GLY 113 228.041 2.984 13.860 821 H TYR 114 H TYR 114 230.189 2.839 13.711 822 HA TYR 114 HA TYR 114 231.621 4.378 11.688 823 HB2 TYR 114 HB2 TYR 114 231.929 4.757 14.660 824 HB3 TYR 114 HB3 TYR 114 233.260 5.092 13.560 825 HD1 TYR 114 HD1 TYR 114 232.297 6.504 11.364 826 HD2 TYR 114 HD2 TYR 114 230.819 6.651 15.352 827 HE1 TYR 114 HE1 TYR 114 231.385 8.746 10.937 828 HE2 TYR 114 HE2 TYR 114 229.902 8.894 14.935 829 HH TYR 114 HH TYR 114 229.220 10.129 12.241 830 H GLY 115 H GLY 115 232.447 2.616 10.686 831 HA2 GLY 115 HA2 GLY 115 234.118 0.809 12.327 832 HA3 GLY 115 HA3 GLY 115 233.172 0.246 10.960 833 H GLN 116 H GLN 116 234.691 -0.456 9.581 834 HA GLN 116 HA GLN 116 236.891 1.374 8.873 835 HB2 GLN 116 HB2 GLN 116 236.653 -1.599 8.973 836 HB3 GLN 116 HB3 GLN 116 237.726 -0.894 7.774 837 HG2 GLN 116 HG2 GLN 116 238.152 0.297 10.365 838 HG3 GLN 116 HG3 GLN 116 238.300 -1.458 10.436 839 HE21 GLN 116 HE21 GLN 116 239.612 -2.381 8.538 840 HE22 GLN 116 HE22 GLN 116 241.083 -1.552 8.175 841 H ASP 117 H ASP 117 236.955 2.221 6.875 842 HA ASP 117 HA ASP 117 234.800 1.907 5.078 843 HB2 ASP 117 HB2 ASP 117 237.516 3.034 4.388 844 HB3 ASP 117 HB3 ASP 117 235.980 3.390 3.609 845 H THR 118 H THR 118 234.587 0.803 3.172 846 HA THR 118 HA THR 118 236.311 -1.509 2.838 847 HB THR 118 HB THR 118 233.824 -0.685 1.318 848 HG1 THR 118 HG1 THR 118 233.379 -1.128 3.493 849 HG21 THR 118 HG21 THR 118 234.694 -3.507 1.509 850 HG22 THR 118 HG22 THR 118 235.536 -2.460 0.367 851 HG23 THR 118 HG23 THR 118 233.790 -2.675 0.244 852 H ALA 119 H ALA 119 237.863 -1.728 1.368 853 HA ALA 119 HA ALA 119 238.243 0.426 -0.588 854 HB1 ALA 119 HB1 ALA 119 240.049 -1.265 0.983 855 HB2 ALA 119 HB2 ALA 119 240.276 0.367 0.358 856 HB3 ALA 119 HB3 ALA 119 240.542 -1.024 -0.692 857 H VAL 120 H VAL 120 238.140 0.079 -2.729 858 HA VAL 120 HA VAL 120 237.872 -2.706 -3.670 859 HB VAL 120 HB VAL 120 236.581 -0.311 -4.975 860 HG11 VAL 120 HG11 VAL 120 236.332 -3.284 -5.351 861 HG12 VAL 120 HG12 VAL 120 236.830 -2.070 -6.531 862 HG13 VAL 120 HG13 VAL 120 235.155 -2.136 -5.984 863 HG21 VAL 120 HG21 VAL 120 235.538 -2.148 -2.849 864 HG22 VAL 120 HG22 VAL 120 234.448 -1.378 -4.002 865 HG23 VAL 120 HG23 VAL 120 235.451 -0.388 -2.942 866 H THR 121 H THR 121 239.256 -3.352 -5.220 867 HA THR 121 HA THR 121 241.119 -1.381 -6.298 868 HB THR 121 HB THR 121 241.120 -4.370 -6.032 869 HG1 THR 121 HG1 THR 121 242.227 -3.794 -4.367 870 HG21 THR 121 HG21 THR 121 243.479 -4.224 -7.014 871 HG22 THR 121 HG22 THR 121 242.925 -2.730 -7.772 872 HG23 THR 121 HG23 THR 121 242.117 -4.254 -8.134 873 H LEU 122 H LEU 122 239.970 -0.395 -7.945 874 HA LEU 122 HA LEU 122 239.460 -2.084 -10.296 875 HB2 LEU 122 HB2 LEU 122 237.286 -1.601 -9.402 876 HB3 LEU 122 HB3 LEU 122 237.686 0.092 -9.190 877 HG LEU 122 HG LEU 122 237.748 0.400 -11.618 878 HD11 LEU 122 HD11 LEU 122 238.448 -1.676 -12.467 879 HD12 LEU 122 HD12 LEU 122 236.783 -1.489 -13.018 880 HD13 LEU 122 HD13 LEU 122 237.149 -2.542 -11.650 881 HD21 LEU 122 HD21 LEU 122 235.247 -0.871 -10.521 882 HD22 LEU 122 HD22 LEU 122 235.323 0.009 -12.048 883 HD23 LEU 122 HD23 LEU 122 235.666 0.841 -10.532 884 HA PRO 123 HA PRO 123 242.341 1.205 -11.594 885 HB2 PRO 123 HB2 PRO 123 243.369 -0.123 -13.709 886 HB3 PRO 123 HB3 PRO 123 243.884 -0.432 -12.039 887 HG2 PRO 123 HG2 PRO 123 241.942 -1.961 -13.737 888 HG3 PRO 123 HG3 PRO 123 243.224 -2.573 -12.676 889 HD2 PRO 123 HD2 PRO 123 240.615 -2.497 -11.929 890 HD3 PRO 123 HD3 PRO 123 241.952 -2.315 -10.778 891 H GLU 124 H GLU 124 239.495 0.095 -12.977 892 HA GLU 124 HA GLU 124 239.773 1.856 -15.315 893 HB2 GLU 124 HB2 GLU 124 239.107 -0.687 -15.461 894 HB3 GLU 124 HB3 GLU 124 237.517 -0.082 -15.010 895 HG2 GLU 124 HG2 GLU 124 237.155 0.869 -17.013 896 HG3 GLU 124 HG3 GLU 124 238.847 1.354 -17.210 897 H ALA 125 H ALA 125 238.751 3.741 -15.242 898 HA ALA 125 HA ALA 125 237.014 4.436 -13.082 899 HB1 ALA 125 HB1 ALA 125 237.312 6.098 -15.553 900 HB2 ALA 125 HB2 ALA 125 238.647 5.940 -14.411 901 HB3 ALA 125 HB3 ALA 125 237.105 6.613 -13.879 902 H GLY 126 H GLY 126 234.897 4.058 -12.947 903 HA2 GLY 126 HA2 GLY 126 233.139 4.453 -15.188 904 HA3 GLY 126 HA3 GLY 126 233.323 2.752 -14.766 905 H GLN 127 H GLN 127 230.839 3.861 -14.644 906 HA GLN 127 HA GLN 127 230.166 4.944 -12.113 907 HB2 GLN 127 HB2 GLN 127 228.836 4.706 -14.462 908 HB3 GLN 127 HB3 GLN 127 228.088 3.405 -13.547 909 HG2 GLN 127 HG2 GLN 127 227.658 5.068 -11.718 910 HG3 GLN 127 HG3 GLN 127 228.192 6.324 -12.848 911 HE21 GLN 127 HE21 GLN 127 226.079 3.460 -13.046 912 HE22 GLN 127 HE22 GLN 127 224.742 4.292 -13.757 913 H TYR 128 H TYR 128 229.723 4.027 -10.232 914 HA TYR 128 HA TYR 128 229.696 1.084 -10.080 915 HB2 TYR 128 HB2 TYR 128 231.343 2.939 -8.783 916 HB3 TYR 128 HB3 TYR 128 230.187 2.435 -7.557 917 HD1 TYR 128 HD1 TYR 128 229.794 -0.228 -7.534 918 HD2 TYR 128 HD2 TYR 128 233.297 1.738 -8.931 919 HE1 TYR 128 HE1 TYR 128 231.090 -2.278 -7.148 920 HE2 TYR 128 HE2 TYR 128 234.606 -0.307 -8.546 921 HH TYR 128 HH TYR 128 233.507 -2.876 -6.711 922 H VAL 129 H VAL 129 228.158 0.073 -8.753 923 HA VAL 129 HA VAL 129 226.028 1.840 -7.741 924 HB VAL 129 HB VAL 129 224.368 0.106 -8.311 925 HG11 VAL 129 HG11 VAL 129 224.024 0.954 -10.379 926 HG12 VAL 129 HG12 VAL 129 225.670 0.613 -10.915 927 HG13 VAL 129 HG13 VAL 129 225.346 2.023 -9.907 928 HG21 VAL 129 HG21 VAL 129 224.987 -1.958 -8.841 929 HG22 VAL 129 HG22 VAL 129 226.682 -1.476 -8.797 930 HG23 VAL 129 HG23 VAL 129 225.771 -1.351 -10.301 931 H TRP 130 H TRP 130 225.769 1.681 -5.636 932 HA TRP 130 HA TRP 130 226.733 -0.713 -4.246 933 HB2 TRP 130 HB2 TRP 130 227.257 1.875 -3.696 934 HB3 TRP 130 HB3 TRP 130 225.817 1.655 -2.709 935 HD1 TRP 130 HD1 TRP 130 226.068 0.322 -0.481 936 HE1 TRP 130 HE1 TRP 130 228.068 -0.721 0.760 937 HE3 TRP 130 HE3 TRP 130 229.577 0.648 -4.182 938 HZ2 TRP 130 HZ2 TRP 130 230.779 -1.322 0.236 939 HZ3 TRP 130 HZ3 TRP 130 231.849 -0.181 -3.732 940 HH2 TRP 130 HH2 TRP 130 232.436 -1.146 -1.568 941 H SER 131 H SER 131 225.233 -2.208 -3.891 942 HA SER 131 HA SER 131 222.535 -1.318 -3.111 943 HB2 SER 131 HB2 SER 131 222.596 -2.388 -5.368 944 HB3 SER 131 HB3 SER 131 223.215 -3.858 -4.614 945 HG SER 131 HG SER 131 220.878 -3.756 -4.953 946 H LEU 132 H LEU 132 221.464 -2.517 -1.510 947 HA LEU 132 HA LEU 132 223.102 -4.467 -0.037 948 HB2 LEU 132 HB2 LEU 132 221.471 -2.305 1.297 949 HB3 LEU 132 HB3 LEU 132 222.553 -3.447 2.067 950 HG LEU 132 HG LEU 132 224.338 -2.237 0.491 951 HD11 LEU 132 HD11 LEU 132 222.126 -0.239 0.860 952 HD12 LEU 132 HD12 LEU 132 222.946 -0.707 -0.630 953 HD13 LEU 132 HD13 LEU 132 223.801 0.237 0.591 954 HD21 LEU 132 HD21 LEU 132 224.401 -0.494 2.534 955 HD22 LEU 132 HD22 LEU 132 224.966 -2.160 2.657 956 HD23 LEU 132 HD23 LEU 132 223.351 -1.732 3.224 957 H LYS 133 H LYS 133 222.000 -6.220 0.697 958 HA LYS 133 HA LYS 133 219.062 -6.166 0.467 959 HB2 LYS 133 HB2 LYS 133 220.670 -7.588 -1.190 960 HB3 LYS 133 HB3 LYS 133 220.415 -8.772 0.095 961 HG2 LYS 133 HG2 LYS 133 218.583 -9.323 -1.056 962 HG3 LYS 133 HG3 LYS 133 217.878 -7.875 -0.336 963 HD2 LYS 133 HD2 LYS 133 218.657 -6.584 -2.317 964 HD3 LYS 133 HD3 LYS 133 219.195 -8.101 -3.042 965 HE2 LYS 133 HE2 LYS 133 216.360 -7.475 -2.214 966 HE3 LYS 133 HE3 LYS 133 216.978 -7.370 -3.860 967 HZ1 LYS 133 HZ1 LYS 133 216.281 -9.714 -2.286 968 HZ2 LYS 133 HZ2 LYS 133 217.659 -9.865 -3.257 969 HZ3 LYS 133 HZ3 LYS 133 216.173 -9.457 -3.956 970 H PHE 134 H PHE 134 218.074 -6.491 2.328 971 HA PHE 134 HA PHE 134 219.166 -8.411 4.244 972 HB2 PHE 134 HB2 PHE 134 218.200 -6.388 5.895 973 HB3 PHE 134 HB3 PHE 134 219.888 -6.796 5.623 974 HD1 PHE 134 HD1 PHE 134 217.139 -4.677 4.286 975 HD2 PHE 134 HD2 PHE 134 221.336 -5.221 4.740 976 HE1 PHE 134 HE1 PHE 134 217.526 -2.436 3.349 977 HE2 PHE 134 HE2 PHE 134 221.730 -2.979 3.804 978 HZ PHE 134 HZ PHE 134 219.825 -1.585 3.106 979 H THR 135 H THR 135 217.645 -9.417 5.533 980 HA THR 135 HA THR 135 214.911 -9.201 4.553 981 HB THR 135 HB THR 135 214.513 -11.325 5.448 982 HG1 THR 135 HG1 THR 135 215.507 -12.141 7.182 983 HG21 THR 135 HG21 THR 135 217.388 -11.881 5.177 984 HG22 THR 135 HG22 THR 135 216.607 -11.119 3.791 985 HG23 THR 135 HG23 THR 135 215.999 -12.653 4.415 986 H ASP 136 H ASP 136 213.146 -9.553 6.293 987 HA ASP 136 HA ASP 136 213.437 -7.393 8.215 988 HB2 ASP 136 HB2 ASP 136 211.021 -7.625 8.544 989 HB3 ASP 136 HB3 ASP 136 211.413 -7.491 6.833 990 H SER 137 H SER 137 214.402 -10.453 8.385 991 HA SER 137 HA SER 137 213.170 -11.437 10.749 992 HB2 SER 137 HB2 SER 137 214.339 -12.881 9.092 993 HB3 SER 137 HB3 SER 137 215.873 -12.173 9.598 994 HG SER 137 HG SER 137 215.780 -13.246 11.450 995 H GLY 138 H GLY 138 215.813 -9.248 10.142 996 HA2 GLY 138 HA2 GLY 138 216.811 -7.798 11.660 997 HA3 GLY 138 HA3 GLY 138 215.953 -8.627 12.964 998 H ASP 139 H ASP 139 218.145 -9.984 10.521 999 HA ASP 139 HA ASP 139 220.300 -10.267 12.399 1000 HB2 ASP 139 HB2 ASP 139 218.353 -12.372 12.195 1001 HB3 ASP 139 HB3 ASP 139 219.895 -12.950 11.574 1002 HA PRO 140 HA PRO 140 221.734 -12.181 8.202 1003 HB2 PRO 140 HB2 PRO 140 219.865 -12.480 6.239 1004 HB3 PRO 140 HB3 PRO 140 220.264 -13.747 7.403 1005 HG2 PRO 140 HG2 PRO 140 217.980 -11.814 7.422 1006 HG3 PRO 140 HG3 PRO 140 217.979 -13.549 7.787 1007 HD2 PRO 140 HD2 PRO 140 217.958 -11.681 9.723 1008 HD3 PRO 140 HD3 PRO 140 218.803 -13.229 9.918 1009 H GLU 141 H GLU 141 222.859 -10.594 7.265 1010 HA GLU 141 HA GLU 141 221.462 -8.533 5.734 1011 HB2 GLU 141 HB2 GLU 141 222.859 -8.097 8.245 1012 HB3 GLU 141 HB3 GLU 141 223.557 -7.143 6.944 1013 HG2 GLU 141 HG2 GLU 141 221.561 -5.984 6.564 1014 HG3 GLU 141 HG3 GLU 141 220.602 -7.172 7.458 1015 H GLN 142 H GLN 142 222.257 -8.787 3.744 1016 HA GLN 142 HA GLN 142 225.173 -9.125 3.445 1017 HB2 GLN 142 HB2 GLN 142 223.588 -11.109 2.832 1018 HB3 GLN 142 HB3 GLN 142 223.233 -10.154 1.398 1019 HG2 GLN 142 HG2 GLN 142 224.959 -11.208 0.486 1020 HG3 GLN 142 HG3 GLN 142 225.963 -10.114 1.444 1021 HE21 GLN 142 HE21 GLN 142 227.154 -10.916 3.105 1022 HE22 GLN 142 HE22 GLN 142 227.237 -12.593 3.510 1023 H ILE 143 H ILE 143 226.164 -8.084 1.676 1024 HA ILE 143 HA ILE 143 224.534 -5.987 0.389 1025 HB ILE 143 HB ILE 143 227.457 -5.645 1.043 1026 HG12 ILE 143 HG12 ILE 143 226.373 -5.970 3.178 1027 HG13 ILE 143 HG13 ILE 143 226.732 -4.258 2.981 1028 HG21 ILE 143 HG21 ILE 143 226.744 -4.129 -0.618 1029 HG22 ILE 143 HG22 ILE 143 226.778 -3.215 0.889 1030 HG23 ILE 143 HG23 ILE 143 225.242 -3.781 0.237 1031 HD11 ILE 143 HD11 ILE 143 224.215 -5.562 3.437 1032 HD12 ILE 143 HD12 ILE 143 224.155 -4.581 1.974 1033 HD13 ILE 143 HD13 ILE 143 224.622 -3.848 3.508 1034 H MET 144 H MET 144 225.045 -5.467 -1.774 1035 HA MET 144 HA MET 144 227.067 -7.132 -3.092 1036 HB2 MET 144 HB2 MET 144 224.374 -7.746 -3.222 1037 HB3 MET 144 HB3 MET 144 224.651 -6.840 -4.702 1038 HG2 MET 144 HG2 MET 144 226.734 -8.789 -4.239 1039 HG3 MET 144 HG3 MET 144 225.135 -9.531 -4.275 1040 HE1 MET 144 HE1 MET 144 227.778 -9.756 -6.608 1041 HE2 MET 144 HE2 MET 144 228.027 -8.103 -6.044 1042 HE3 MET 144 HE3 MET 144 227.662 -8.411 -7.743 1043 H VAL 145 H VAL 145 228.331 -5.957 -4.366 1044 HA VAL 145 HA VAL 145 227.227 -3.539 -5.622 1045 HB VAL 145 HB VAL 145 228.513 -2.878 -3.626 1046 HG11 VAL 145 HG11 VAL 145 230.821 -3.292 -3.373 1047 HG12 VAL 145 HG12 VAL 145 230.965 -3.928 -5.012 1048 HG13 VAL 145 HG13 VAL 145 230.095 -4.846 -3.783 1049 HG21 VAL 145 HG21 VAL 145 230.332 -1.556 -5.116 1050 HG22 VAL 145 HG22 VAL 145 228.631 -1.104 -5.008 1051 HG23 VAL 145 HG23 VAL 145 229.203 -2.064 -6.371 1052 H SER 146 H SER 146 227.847 -3.156 -7.679 1053 HA SER 146 HA SER 146 230.046 -4.708 -8.833 1054 HB2 SER 146 HB2 SER 146 228.741 -5.524 -10.658 1055 HB3 SER 146 HB3 SER 146 227.827 -5.895 -9.196 1056 HG SER 146 HG SER 146 226.849 -4.719 -11.209 1057 H LYS 147 H LYS 147 230.848 -3.848 -10.845 1058 HA LYS 147 HA LYS 147 230.156 -1.009 -11.239 1059 HB2 LYS 147 HB2 LYS 147 232.549 -0.798 -12.095 1060 HB3 LYS 147 HB3 LYS 147 232.338 -1.010 -10.354 1061 HG2 LYS 147 HG2 LYS 147 233.627 -2.809 -10.378 1062 HG3 LYS 147 HG3 LYS 147 232.606 -3.574 -11.597 1063 HD2 LYS 147 HD2 LYS 147 234.214 -1.521 -12.803 1064 HD3 LYS 147 HD3 LYS 147 235.234 -2.637 -11.896 1065 HE2 LYS 147 HE2 LYS 147 233.135 -3.848 -13.587 1066 HE3 LYS 147 HE3 LYS 147 234.466 -3.061 -14.434 1067 HZ1 LYS 147 HZ1 LYS 147 235.215 -4.842 -12.258 1068 HZ2 LYS 147 HZ2 LYS 147 235.925 -4.630 -13.779 1069 HZ3 LYS 147 HZ3 LYS 147 234.539 -5.586 -13.618 1070 H CYS 148 H CYS 148 229.395 -0.474 -13.183 1071 HA CYS 148 HA CYS 148 229.981 -2.260 -15.453 1072 HB2 CYS 148 HB2 CYS 148 227.382 -0.885 -14.761 1073 HB3 CYS 148 HB3 CYS 148 227.701 -1.630 -16.323 1074 HA PRO 149 HA PRO 149 231.605 1.610 -17.045 1075 HB2 PRO 149 HB2 PRO 149 232.664 0.578 -19.312 1076 HB3 PRO 149 HB3 PRO 149 233.430 0.382 -17.725 1077 HG2 PRO 149 HG2 PRO 149 231.707 -1.538 -19.250 1078 HG3 PRO 149 HG3 PRO 149 233.211 -1.849 -18.364 1079 HD2 PRO 149 HD2 PRO 149 230.763 -2.394 -17.338 1080 HD3 PRO 149 HD3 PRO 149 232.142 -1.918 -16.326 Start of MODEL 4 1 H1 THR 1 H1 THR 1 224.764 -32.029 17.865 2 H2 THR 1 H2 THR 1 225.450 -30.532 18.350 3 H3 THR 1 H3 THR 1 224.201 -31.250 19.284 4 HA THR 1 HA THR 1 225.695 -33.167 19.631 5 HB THR 1 HB THR 1 227.950 -31.319 18.956 6 HG1 THR 1 HG1 THR 1 227.740 -31.556 16.884 7 HG21 THR 1 HG21 THR 1 228.613 -33.330 20.012 8 HG22 THR 1 HG22 THR 1 229.031 -33.476 18.306 9 HG23 THR 1 HG23 THR 1 227.608 -34.303 18.939 10 HA PRO 2 HA PRO 2 225.241 -30.375 23.268 11 HB2 PRO 2 HB2 PRO 2 225.295 -33.068 24.542 12 HB3 PRO 2 HB3 PRO 2 224.187 -31.718 24.810 13 HG2 PRO 2 HG2 PRO 2 223.405 -33.851 23.432 14 HG3 PRO 2 HG3 PRO 2 222.913 -32.220 22.934 15 HD2 PRO 2 HD2 PRO 2 225.014 -34.005 21.775 16 HD3 PRO 2 HD3 PRO 2 223.873 -32.924 20.950 17 H SER 3 H SER 3 227.377 -29.577 23.056 18 HA SER 3 HA SER 3 229.279 -30.852 24.852 19 HB2 SER 3 HB2 SER 3 229.580 -31.432 22.245 20 HB3 SER 3 HB3 SER 3 230.453 -29.902 22.289 21 HG SER 3 HG SER 3 231.797 -30.757 23.875 22 H ALA 4 H ALA 4 230.861 -29.434 25.690 23 HA ALA 4 HA ALA 4 230.010 -26.698 25.854 24 HB1 ALA 4 HB1 ALA 4 231.019 -28.084 27.731 25 HB2 ALA 4 HB2 ALA 4 231.624 -26.438 27.547 26 HB3 ALA 4 HB3 ALA 4 232.578 -27.799 26.958 27 H SER 5 H SER 5 232.460 -28.439 24.069 28 HA SER 5 HA SER 5 234.226 -26.362 23.472 29 HB2 SER 5 HB2 SER 5 234.392 -28.912 22.967 30 HB3 SER 5 HB3 SER 5 233.586 -28.496 21.454 31 HG SER 5 HG SER 5 236.017 -27.378 22.416 32 H GLY 6 H GLY 6 231.462 -27.531 21.529 33 HA2 GLY 6 HA2 GLY 6 229.946 -25.921 20.530 34 HA3 GLY 6 HA3 GLY 6 231.318 -24.842 20.321 35 H LEU 7 H LEU 7 230.720 -28.265 19.500 36 HA LEU 7 HA LEU 7 231.773 -27.725 16.814 37 HB2 LEU 7 HB2 LEU 7 231.811 -30.263 16.659 38 HB3 LEU 7 HB3 LEU 7 232.956 -29.514 17.751 39 HG LEU 7 HG LEU 7 230.402 -30.336 18.982 40 HD11 LEU 7 HD11 LEU 7 230.544 -32.244 17.642 41 HD12 LEU 7 HD12 LEU 7 231.322 -32.712 19.155 42 HD13 LEU 7 HD13 LEU 7 232.302 -32.300 17.748 43 HD21 LEU 7 HD21 LEU 7 232.342 -31.372 20.502 44 HD22 LEU 7 HD22 LEU 7 231.846 -29.684 20.602 45 HD23 LEU 7 HD23 LEU 7 233.274 -30.128 19.668 46 H THR 8 H THR 8 230.639 -28.189 14.968 47 HA THR 8 HA THR 8 228.144 -29.543 14.916 48 HB THR 8 HB THR 8 227.258 -27.589 15.987 49 HG1 THR 8 HG1 THR 8 225.713 -27.115 14.545 50 HG21 THR 8 HG21 THR 8 227.939 -25.674 13.864 51 HG22 THR 8 HG22 THR 8 229.266 -26.141 14.929 52 HG23 THR 8 HG23 THR 8 227.794 -25.445 15.606 53 H LYS 9 H LYS 9 227.125 -29.480 12.755 54 HA LYS 9 HA LYS 9 229.160 -29.150 10.670 55 HB2 LYS 9 HB2 LYS 9 226.757 -30.874 11.008 56 HB3 LYS 9 HB3 LYS 9 227.186 -30.405 9.371 57 HG2 LYS 9 HG2 LYS 9 229.412 -31.414 11.004 58 HG3 LYS 9 HG3 LYS 9 228.145 -32.587 10.637 59 HD2 LYS 9 HD2 LYS 9 229.456 -30.869 8.540 60 HD3 LYS 9 HD3 LYS 9 230.054 -32.468 8.985 61 HE2 LYS 9 HE2 LYS 9 227.495 -33.092 8.557 62 HE3 LYS 9 HE3 LYS 9 227.610 -31.690 7.494 63 HZ1 LYS 9 HZ1 LYS 9 229.795 -32.977 6.762 64 HZ2 LYS 9 HZ2 LYS 9 228.288 -33.280 6.056 65 HZ3 LYS 9 HZ3 LYS 9 228.875 -34.309 7.263 66 H VAL 10 H VAL 10 229.118 -27.291 9.584 67 HA VAL 10 HA VAL 10 226.498 -26.097 8.950 68 HB VAL 10 HB VAL 10 227.762 -23.879 8.883 69 HG11 VAL 10 HG11 VAL 10 227.612 -25.087 11.629 70 HG12 VAL 10 HG12 VAL 10 226.167 -24.735 10.678 71 HG13 VAL 10 HG13 VAL 10 227.265 -23.431 11.132 72 HG21 VAL 10 HG21 VAL 10 230.030 -24.658 8.902 73 HG22 VAL 10 HG22 VAL 10 229.766 -25.539 10.409 74 HG23 VAL 10 HG23 VAL 10 229.738 -23.776 10.401 75 H ALA 11 H ALA 11 226.536 -27.322 6.987 76 HA ALA 11 HA ALA 11 228.611 -26.881 5.038 77 HB1 ALA 11 HB1 ALA 11 227.532 -29.016 5.053 78 HB2 ALA 11 HB2 ALA 11 227.118 -28.204 3.543 79 HB3 ALA 11 HB3 ALA 11 225.944 -28.273 4.859 80 H THR 12 H THR 12 228.596 -25.557 3.278 81 HA THR 12 HA THR 12 226.481 -23.534 3.184 82 HB THR 12 HB THR 12 228.241 -22.517 1.492 83 HG1 THR 12 HG1 THR 12 229.898 -23.806 1.354 84 HG21 THR 12 HG21 THR 12 227.719 -22.098 4.179 85 HG22 THR 12 HG22 THR 12 228.653 -21.058 3.104 86 HG23 THR 12 HG23 THR 12 229.471 -22.271 4.088 87 H VAL 13 H VAL 13 225.070 -23.377 1.571 88 HA VAL 13 HA VAL 13 223.761 -24.135 -0.143 89 HB VAL 13 HB VAL 13 224.948 -23.941 -2.397 90 HG11 VAL 13 HG11 VAL 13 225.200 -21.530 -0.615 91 HG12 VAL 13 HG12 VAL 13 223.650 -22.155 -1.177 92 HG13 VAL 13 HG13 VAL 13 224.843 -21.578 -2.342 93 HG21 VAL 13 HG21 VAL 13 227.186 -22.916 -0.652 94 HG22 VAL 13 HG22 VAL 13 227.121 -22.864 -2.413 95 HG23 VAL 13 HG23 VAL 13 227.221 -24.416 -1.583 96 H SER 14 H SER 14 223.439 -26.288 0.602 97 HA SER 14 HA SER 14 224.773 -28.299 -1.084 98 HB2 SER 14 HB2 SER 14 224.226 -29.847 0.991 99 HB3 SER 14 HB3 SER 14 225.701 -28.881 0.954 100 HG SER 14 HG SER 14 224.814 -27.457 2.362 101 H ALA 15 H ALA 15 223.501 -29.768 -2.063 102 HA ALA 15 HA ALA 15 221.674 -30.831 -2.866 103 HB1 ALA 15 HB1 ALA 15 220.635 -30.205 -0.120 104 HB2 ALA 15 HB2 ALA 15 221.255 -31.736 -0.736 105 HB3 ALA 15 HB3 ALA 15 219.705 -31.116 -1.309 106 H ALA 16 H ALA 16 220.755 -29.898 -4.541 107 HA ALA 16 HA ALA 16 219.342 -28.667 -5.817 108 HB1 ALA 16 HB1 ALA 16 217.653 -27.176 -4.357 109 HB2 ALA 16 HB2 ALA 16 218.099 -28.386 -3.156 110 HB3 ALA 16 HB3 ALA 16 217.401 -28.889 -4.693 111 H SER 17 H SER 17 219.713 -26.845 -6.909 112 HA SER 17 HA SER 17 220.340 -24.357 -5.624 113 HB2 SER 17 HB2 SER 17 222.506 -26.055 -6.790 114 HB3 SER 17 HB3 SER 17 222.603 -24.306 -7.003 115 HG SER 17 HG SER 17 222.460 -25.749 -4.563 116 H SER 18 H SER 18 219.280 -22.926 -6.826 117 HA SER 18 HA SER 18 219.266 -23.269 -9.757 118 HB2 SER 18 HB2 SER 18 217.049 -23.359 -8.200 119 HB3 SER 18 HB3 SER 18 217.121 -21.630 -8.534 120 HG SER 18 HG SER 18 215.998 -23.198 -10.078 121 H LEU 19 H LEU 19 219.883 -21.579 -10.998 122 HA LEU 19 HA LEU 19 220.282 -18.964 -9.722 123 HB2 LEU 19 HB2 LEU 19 222.403 -20.448 -9.916 124 HB3 LEU 19 HB3 LEU 19 222.319 -20.073 -11.626 125 HG LEU 19 HG LEU 19 222.216 -17.582 -10.731 126 HD11 LEU 19 HD11 LEU 19 222.283 -17.642 -8.467 127 HD12 LEU 19 HD12 LEU 19 224.018 -17.689 -8.769 128 HD13 LEU 19 HD13 LEU 19 223.143 -19.180 -8.418 129 HD21 LEU 19 HD21 LEU 19 223.961 -17.928 -12.136 130 HD22 LEU 19 HD22 LEU 19 224.469 -19.408 -11.324 131 HD23 LEU 19 HD23 LEU 19 224.871 -17.837 -10.629 132 H ILE 20 H ILE 20 218.378 -18.326 -10.850 133 HA ILE 20 HA ILE 20 218.420 -18.370 -13.755 134 HB ILE 20 HB ILE 20 216.305 -18.820 -12.584 135 HG12 ILE 20 HG12 ILE 20 216.440 -16.370 -14.331 136 HG13 ILE 20 HG13 ILE 20 216.086 -18.038 -14.801 137 HG21 ILE 20 HG21 ILE 20 216.597 -17.394 -10.640 138 HG22 ILE 20 HG22 ILE 20 215.091 -16.999 -11.466 139 HG23 ILE 20 HG23 ILE 20 216.499 -15.957 -11.657 140 HD11 ILE 20 HD11 ILE 20 214.079 -17.561 -13.051 141 HD12 ILE 20 HD12 ILE 20 213.966 -17.324 -14.795 142 HD13 ILE 20 HD13 ILE 20 214.318 -15.955 -13.740 143 H GLY 21 H GLY 21 218.826 -16.657 -15.066 144 HA2 GLY 21 HA2 GLY 21 218.676 -13.943 -14.298 145 HA3 GLY 21 HA3 GLY 21 220.347 -14.496 -14.146 146 H GLU 22 H GLU 22 218.908 -12.574 -15.999 147 HA GLU 22 HA GLU 22 220.261 -13.438 -18.416 148 HB2 GLU 22 HB2 GLU 22 217.380 -13.592 -18.084 149 HB3 GLU 22 HB3 GLU 22 217.815 -12.524 -19.410 150 HG2 GLU 22 HG2 GLU 22 218.459 -15.429 -19.082 151 HG3 GLU 22 HG3 GLU 22 217.516 -14.645 -20.345 152 H GLY 23 H GLY 23 221.010 -11.757 -19.626 153 HA2 GLY 23 HA2 GLY 23 220.911 -9.517 -20.467 154 HA3 GLY 23 HA3 GLY 23 220.012 -9.053 -19.020 155 H PHE 24 H PHE 24 223.145 -9.540 -20.428 156 HA PHE 24 HA PHE 24 224.715 -9.360 -18.088 157 HB2 PHE 24 HB2 PHE 24 225.173 -9.259 -20.981 158 HB3 PHE 24 HB3 PHE 24 226.293 -8.247 -20.057 159 HD1 PHE 24 HD1 PHE 24 228.285 -9.251 -19.566 160 HD2 PHE 24 HD2 PHE 24 224.769 -11.644 -19.690 161 HE1 PHE 24 HE1 PHE 24 229.621 -11.237 -19.002 162 HE2 PHE 24 HE2 PHE 24 226.098 -13.634 -19.126 163 HZ PHE 24 HZ PHE 24 228.528 -13.434 -18.780 164 H MET 25 H MET 25 223.282 -6.910 -20.183 165 HA MET 25 HA MET 25 224.690 -4.707 -19.049 166 HB2 MET 25 HB2 MET 25 223.047 -3.297 -20.192 167 HB3 MET 25 HB3 MET 25 223.683 -4.534 -21.266 168 HG2 MET 25 HG2 MET 25 221.594 -5.876 -20.683 169 HG3 MET 25 HG3 MET 25 220.972 -4.379 -19.989 170 HE1 MET 25 HE1 MET 25 220.181 -6.445 -22.520 171 HE2 MET 25 HE2 MET 25 221.737 -6.337 -23.343 172 HE3 MET 25 HE3 MET 25 220.290 -5.667 -24.098 173 H ALA 26 H ALA 26 221.859 -6.499 -18.117 174 HA ALA 26 HA ALA 26 221.144 -4.475 -16.120 175 HB1 ALA 26 HB1 ALA 26 219.661 -6.881 -17.155 176 HB2 ALA 26 HB2 ALA 26 219.269 -5.179 -17.399 177 HB3 ALA 26 HB3 ALA 26 219.105 -5.901 -15.798 178 H GLN 27 H GLN 27 223.375 -6.751 -16.115 179 HA GLN 27 HA GLN 27 222.613 -8.268 -13.782 180 HB2 GLN 27 HB2 GLN 27 224.741 -9.345 -13.950 181 HB3 GLN 27 HB3 GLN 27 224.092 -9.191 -15.573 182 HG2 GLN 27 HG2 GLN 27 226.190 -8.511 -16.015 183 HG3 GLN 27 HG3 GLN 27 225.546 -6.956 -15.497 184 HE21 GLN 27 HE21 GLN 27 227.418 -6.101 -14.721 185 HE22 GLN 27 HE22 GLN 27 228.269 -6.734 -13.347 186 H CYS 28 H CYS 28 224.401 -5.354 -14.455 187 HA CYS 28 HA CYS 28 225.491 -5.218 -11.770 188 HB2 CYS 28 HB2 CYS 28 226.563 -3.164 -12.491 189 HB3 CYS 28 HB3 CYS 28 226.831 -4.430 -13.684 190 H ASP 29 H ASP 29 222.478 -4.715 -12.912 191 HA ASP 29 HA ASP 29 221.622 -3.274 -10.658 192 HB2 ASP 29 HB2 ASP 29 220.685 -1.280 -12.079 193 HB3 ASP 29 HB3 ASP 29 222.334 -1.218 -11.449 194 H ASN 30 H ASN 30 219.618 -3.907 -10.278 195 HA ASN 30 HA ASN 30 218.059 -5.058 -12.468 196 HB2 ASN 30 HB2 ASN 30 217.403 -5.159 -9.517 197 HB3 ASN 30 HB3 ASN 30 216.757 -6.178 -10.797 198 HD21 ASN 30 HD21 ASN 30 219.404 -5.597 -8.656 199 HD22 ASN 30 HD22 ASN 30 220.275 -7.058 -9.002 200 HA PRO 31 HA PRO 31 215.148 -1.779 -12.922 201 HB2 PRO 31 HB2 PRO 31 212.762 -3.212 -12.690 202 HB3 PRO 31 HB3 PRO 31 213.687 -2.936 -14.175 203 HG2 PRO 31 HG2 PRO 31 213.625 -5.321 -12.403 204 HG3 PRO 31 HG3 PRO 31 213.793 -5.215 -14.164 205 HD2 PRO 31 HD2 PRO 31 215.891 -5.749 -12.574 206 HD3 PRO 31 HD3 PRO 31 216.061 -4.780 -14.053 207 H THR 32 H THR 32 214.561 -0.281 -11.458 208 HA THR 32 HA THR 32 213.801 -1.189 -8.781 209 HB THR 32 HB THR 32 214.115 1.486 -8.489 210 HG1 THR 32 HG1 THR 32 214.859 2.036 -10.442 211 HG21 THR 32 HG21 THR 32 215.809 0.915 -7.167 212 HG22 THR 32 HG22 THR 32 216.695 0.141 -8.480 213 HG23 THR 32 HG23 THR 32 215.431 -0.747 -7.626 214 H ILE 33 H ILE 33 211.851 -1.026 -8.038 215 HA ILE 33 HA ILE 33 209.923 0.904 -9.147 216 HB ILE 33 HB ILE 33 209.572 -1.321 -10.213 217 HG12 ILE 33 HG12 ILE 33 207.260 -0.857 -8.353 218 HG13 ILE 33 HG13 ILE 33 207.700 0.371 -9.537 219 HG21 ILE 33 HG21 ILE 33 210.277 -2.886 -8.637 220 HG22 ILE 33 HG22 ILE 33 208.524 -3.083 -8.676 221 HG23 ILE 33 HG23 ILE 33 209.283 -2.189 -7.359 222 HD11 ILE 33 HD11 ILE 33 206.311 -2.156 -9.889 223 HD12 ILE 33 HD12 ILE 33 207.628 -1.921 -11.039 224 HD13 ILE 33 HD13 ILE 33 206.340 -0.721 -10.914 225 H GLU 34 H GLU 34 208.058 1.200 -7.719 226 HA GLU 34 HA GLU 34 208.822 1.781 -5.101 227 HB2 GLU 34 HB2 GLU 34 206.871 2.782 -6.297 228 HB3 GLU 34 HB3 GLU 34 205.994 1.278 -6.050 229 HG2 GLU 34 HG2 GLU 34 205.204 2.502 -4.302 230 HG3 GLU 34 HG3 GLU 34 206.582 1.718 -3.531 231 H GLY 35 H GLY 35 209.524 0.312 -3.680 232 HA2 GLY 35 HA2 GLY 35 207.939 -2.158 -3.292 233 HA3 GLY 35 HA3 GLY 35 209.687 -2.089 -3.107 234 H ASP 36 H ASP 36 210.125 -2.415 -1.035 235 HA ASP 36 HA ASP 36 208.599 -0.864 0.964 236 HB2 ASP 36 HB2 ASP 36 209.494 -3.698 0.916 237 HB3 ASP 36 HB3 ASP 36 209.622 -2.853 2.466 238 H GLY 37 H GLY 37 210.987 0.071 -0.435 239 HA2 GLY 37 HA2 GLY 37 213.302 -0.256 1.161 240 HA3 GLY 37 HA3 GLY 37 213.023 1.036 0.007 241 HA PRO 38 HA PRO 38 212.844 2.737 4.374 242 HB2 PRO 38 HB2 PRO 38 215.160 4.089 4.468 243 HB3 PRO 38 HB3 PRO 38 215.076 2.350 4.818 244 HG2 PRO 38 HG2 PRO 38 215.967 3.746 2.326 245 HG3 PRO 38 HG3 PRO 38 216.656 2.319 3.119 246 HD2 PRO 38 HD2 PRO 38 214.975 2.240 0.933 247 HD3 PRO 38 HD3 PRO 38 215.209 0.900 2.070 248 H ILE 39 H ILE 39 211.583 4.482 4.516 249 HA ILE 39 HA ILE 39 211.900 6.640 2.542 250 HB ILE 39 HB ILE 39 209.540 6.135 4.357 251 HG12 ILE 39 HG12 ILE 39 209.932 4.338 2.641 252 HG13 ILE 39 HG13 ILE 39 208.398 5.186 2.471 253 HG21 ILE 39 HG21 ILE 39 208.472 7.662 2.555 254 HG22 ILE 39 HG22 ILE 39 210.139 8.131 2.211 255 HG23 ILE 39 HG23 ILE 39 209.466 8.386 3.821 256 HD11 ILE 39 HD11 ILE 39 210.877 5.547 0.812 257 HD12 ILE 39 HD12 ILE 39 209.459 6.589 0.708 258 HD13 ILE 39 HD13 ILE 39 209.326 4.880 0.305 259 H GLY 40 H GLY 40 211.773 8.841 3.228 260 HA2 GLY 40 HA2 GLY 40 212.306 10.625 4.567 261 HA3 GLY 40 HA3 GLY 40 211.668 9.687 5.907 262 H LYS 41 H LYS 41 214.267 8.358 4.051 263 HA LYS 41 HA LYS 41 216.192 9.143 6.136 264 HB2 LYS 41 HB2 LYS 41 215.590 6.400 5.063 265 HB3 LYS 41 HB3 LYS 41 217.172 6.777 5.729 266 HG2 LYS 41 HG2 LYS 41 215.648 7.684 7.726 267 HG3 LYS 41 HG3 LYS 41 214.571 6.444 7.083 268 HD2 LYS 41 HD2 LYS 41 216.908 5.089 7.122 269 HD3 LYS 41 HD3 LYS 41 217.150 6.180 8.488 270 HE2 LYS 41 HE2 LYS 41 215.592 5.153 9.750 271 HE3 LYS 41 HE3 LYS 41 214.516 4.878 8.382 272 HZ1 LYS 41 HZ1 LYS 41 216.913 3.277 9.099 273 HZ2 LYS 41 HZ2 LYS 41 216.005 3.055 7.690 274 HZ3 LYS 41 HZ3 LYS 41 215.297 2.785 9.202 275 H THR 42 H THR 42 218.110 9.840 5.415 276 HA THR 42 HA THR 42 218.702 9.518 2.546 277 HB THR 42 HB THR 42 219.502 11.777 4.395 278 HG1 THR 42 HG1 THR 42 217.563 11.629 2.329 279 HG21 THR 42 HG21 THR 42 220.767 11.022 2.068 280 HG22 THR 42 HG22 THR 42 220.837 12.606 2.835 281 HG23 THR 42 HG23 THR 42 219.667 12.298 1.553 282 H LEU 43 H LEU 43 220.532 8.498 2.010 283 HA LEU 43 HA LEU 43 222.410 7.811 4.159 284 HB2 LEU 43 HB2 LEU 43 221.813 6.581 1.482 285 HB3 LEU 43 HB3 LEU 43 223.274 6.184 2.358 286 HG LEU 43 HG LEU 43 221.546 4.495 2.706 287 HD11 LEU 43 HD11 LEU 43 221.889 4.219 4.968 288 HD12 LEU 43 HD12 LEU 43 221.747 5.942 5.311 289 HD13 LEU 43 HD13 LEU 43 223.199 5.314 4.532 290 HD21 LEU 43 HD21 LEU 43 219.618 6.061 2.429 291 HD22 LEU 43 HD22 LEU 43 219.925 6.642 4.065 292 HD23 LEU 43 HD23 LEU 43 219.474 4.958 3.796 293 H TYR 44 H TYR 44 224.301 8.828 4.275 294 HA TYR 44 HA TYR 44 225.230 10.334 1.931 295 HB2 TYR 44 HB2 TYR 44 225.159 10.894 4.768 296 HB3 TYR 44 HB3 TYR 44 226.797 11.050 4.144 297 HD1 TYR 44 HD1 TYR 44 227.348 12.762 2.505 298 HD2 TYR 44 HD2 TYR 44 223.394 12.385 4.032 299 HE1 TYR 44 HE1 TYR 44 226.798 14.984 1.612 300 HE2 TYR 44 HE2 TYR 44 222.833 14.606 3.141 301 HH TYR 44 HH TYR 44 224.649 16.199 0.881 302 H VAL 45 H VAL 45 226.833 9.505 0.789 303 HA VAL 45 HA VAL 45 228.552 7.479 2.011 304 HB VAL 45 HB VAL 45 227.461 6.864 -0.099 305 HG11 VAL 45 HG11 VAL 45 227.463 9.189 -1.051 306 HG12 VAL 45 HG12 VAL 45 227.920 7.911 -2.175 307 HG13 VAL 45 HG13 VAL 45 229.161 8.941 -1.460 308 HG21 VAL 45 HG21 VAL 45 229.454 5.696 0.324 309 HG22 VAL 45 HG22 VAL 45 230.457 7.087 -0.089 310 HG23 VAL 45 HG23 VAL 45 229.580 6.225 -1.353 311 H VAL 46 H VAL 46 230.459 8.022 2.753 312 HA VAL 46 HA VAL 46 231.884 10.295 1.538 313 HB VAL 46 HB VAL 46 232.804 10.888 3.689 314 HG11 VAL 46 HG11 VAL 46 229.958 10.590 4.442 315 HG12 VAL 46 HG12 VAL 46 230.300 11.413 2.920 316 HG13 VAL 46 HG13 VAL 46 230.987 12.023 4.426 317 HG21 VAL 46 HG21 VAL 46 232.949 8.646 4.660 318 HG22 VAL 46 HG22 VAL 46 231.195 8.603 4.830 319 HG23 VAL 46 HG23 VAL 46 232.143 9.769 5.754 320 H GLY 47 H GLY 47 234.322 10.149 2.507 321 HA2 GLY 47 HA2 GLY 47 235.939 8.263 3.103 322 HA3 GLY 47 HA3 GLY 47 235.276 7.492 1.658 323 H ASP 48 H ASP 48 235.811 8.296 -0.384 324 HA ASP 48 HA ASP 48 236.993 10.549 -1.229 325 HB2 ASP 48 HB2 ASP 48 238.871 10.674 0.086 326 HB3 ASP 48 HB3 ASP 48 238.980 8.922 0.285 327 H PHE 49 H PHE 49 237.071 10.408 -3.402 328 HA PHE 49 HA PHE 49 237.740 7.815 -4.603 329 HB2 PHE 49 HB2 PHE 49 235.207 9.382 -4.965 330 HB3 PHE 49 HB3 PHE 49 235.823 8.377 -6.282 331 HD1 PHE 49 HD1 PHE 49 236.899 6.070 -4.756 332 HD2 PHE 49 HD2 PHE 49 233.294 8.283 -4.274 333 HE1 PHE 49 HE1 PHE 49 235.832 4.103 -3.733 334 HE2 PHE 49 HE2 PHE 49 232.224 6.319 -3.252 335 HZ PHE 49 HZ PHE 49 233.492 4.227 -2.979 336 H ALA 50 H ALA 50 239.178 10.434 -4.425 337 HA ALA 50 HA ALA 50 240.380 11.864 -5.736 338 HB1 ALA 50 HB1 ALA 50 240.299 10.099 -8.091 339 HB2 ALA 50 HB2 ALA 50 240.875 9.361 -6.597 340 HB3 ALA 50 HB3 ALA 50 241.677 10.794 -7.238 341 H ASP 51 H ASP 51 238.961 13.533 -5.985 342 HA ASP 51 HA ASP 51 238.001 15.157 -7.314 343 HB2 ASP 51 HB2 ASP 51 238.949 13.846 -9.332 344 HB3 ASP 51 HB3 ASP 51 237.341 13.118 -9.440 345 H ALA 52 H ALA 52 236.826 13.110 -5.466 346 HA ALA 52 HA ALA 52 234.109 13.958 -5.634 347 HB1 ALA 52 HB1 ALA 52 234.229 11.002 -5.637 348 HB2 ALA 52 HB2 ALA 52 234.536 11.793 -7.182 349 HB3 ALA 52 HB3 ALA 52 233.022 12.087 -6.325 350 H SER 53 H SER 53 236.078 14.326 -3.762 351 HA SER 53 HA SER 53 236.098 12.444 -1.663 352 HB2 SER 53 HB2 SER 53 236.621 15.400 -1.335 353 HB3 SER 53 HB3 SER 53 237.296 14.065 -0.400 354 HG SER 53 HG SER 53 238.876 14.559 -1.805 355 H TRP 54 H TRP 54 233.991 11.887 -1.271 356 HA TRP 54 HA TRP 54 232.102 11.862 -0.004 357 HB2 TRP 54 HB2 TRP 54 232.659 14.620 1.070 358 HB3 TRP 54 HB3 TRP 54 231.872 13.249 1.866 359 HD1 TRP 54 HD1 TRP 54 234.622 11.448 0.754 360 HE1 TRP 54 HE1 TRP 54 236.636 11.485 2.342 361 HE3 TRP 54 HE3 TRP 54 233.355 15.541 3.546 362 HZ2 TRP 54 HZ2 TRP 54 237.574 13.061 4.501 363 HZ3 TRP 54 HZ3 TRP 54 234.869 16.248 5.352 364 HH2 TRP 54 HH2 TRP 54 236.934 15.034 5.819 365 H LYS 55 H LYS 55 231.527 12.218 -2.421 366 HA LYS 55 HA LYS 55 229.919 14.665 -2.720 367 HB2 LYS 55 HB2 LYS 55 231.642 13.231 -4.513 368 HB3 LYS 55 HB3 LYS 55 230.005 13.200 -5.153 369 HG2 LYS 55 HG2 LYS 55 230.127 15.784 -4.569 370 HG3 LYS 55 HG3 LYS 55 231.854 15.485 -4.774 371 HD2 LYS 55 HD2 LYS 55 229.730 14.775 -6.798 372 HD3 LYS 55 HD3 LYS 55 230.731 16.227 -6.858 373 HE2 LYS 55 HE2 LYS 55 232.741 14.732 -6.891 374 HE3 LYS 55 HE3 LYS 55 231.646 13.360 -7.054 375 HZ1 LYS 55 HZ1 LYS 55 232.126 15.556 -8.977 376 HZ2 LYS 55 HZ2 LYS 55 230.757 14.569 -9.080 377 HZ3 LYS 55 HZ3 LYS 55 232.299 13.890 -9.218 378 H GLN 56 H GLN 56 227.828 14.423 -2.291 379 HA GLN 56 HA GLN 56 226.356 12.180 -3.381 380 HB2 GLN 56 HB2 GLN 56 227.128 11.345 -1.175 381 HB3 GLN 56 HB3 GLN 56 226.327 12.704 -0.401 382 HG2 GLN 56 HG2 GLN 56 224.747 11.087 -0.119 383 HG3 GLN 56 HG3 GLN 56 224.218 11.774 -1.664 384 HE21 GLN 56 HE21 GLN 56 224.415 8.973 -0.170 385 HE22 GLN 56 HE22 GLN 56 224.817 7.917 -1.477 386 H LYS 57 H LYS 57 225.172 13.607 -4.600 387 HA LYS 57 HA LYS 57 223.984 15.958 -3.491 388 HB2 LYS 57 HB2 LYS 57 222.811 16.129 -5.667 389 HB3 LYS 57 HB3 LYS 57 224.547 15.926 -5.842 390 HG2 LYS 57 HG2 LYS 57 223.606 13.337 -5.917 391 HG3 LYS 57 HG3 LYS 57 222.366 14.248 -6.781 392 HD2 LYS 57 HD2 LYS 57 225.292 14.586 -7.378 393 HD3 LYS 57 HD3 LYS 57 224.323 13.326 -8.147 394 HE2 LYS 57 HE2 LYS 57 222.808 15.011 -9.037 395 HE3 LYS 57 HE3 LYS 57 223.724 16.282 -8.229 396 HZ1 LYS 57 HZ1 LYS 57 224.373 14.762 -10.636 397 HZ2 LYS 57 HZ2 LYS 57 225.665 15.171 -9.623 398 HZ3 LYS 57 HZ3 LYS 57 224.679 16.385 -10.265 399 HA PRO 58 HA PRO 58 220.431 14.215 -1.500 400 HB2 PRO 58 HB2 PRO 58 219.089 16.713 -2.418 401 HB3 PRO 58 HB3 PRO 58 219.207 16.022 -0.789 402 HG2 PRO 58 HG2 PRO 58 220.676 18.133 -1.470 403 HG3 PRO 58 HG3 PRO 58 221.353 16.845 -0.455 404 HD2 PRO 58 HD2 PRO 58 221.789 17.395 -3.362 405 HD3 PRO 58 HD3 PRO 58 222.946 16.846 -2.133 406 H HIS 59 H HIS 59 220.274 15.456 -4.793 407 HA HIS 59 HA HIS 59 217.691 14.578 -5.467 408 HB2 HIS 59 HB2 HIS 59 219.773 15.887 -6.771 409 HB3 HIS 59 HB3 HIS 59 219.584 14.378 -7.674 410 HD1 HIS 59 HD1 HIS 59 216.822 16.499 -6.140 411 HD2 HIS 59 HD2 HIS 59 218.206 15.245 -9.853 412 HE1 HIS 59 HE1 HIS 59 215.117 17.309 -7.802 413 HE2 HIS 59 HE2 HIS 59 216.010 16.598 -10.048 414 H ARG 60 H ARG 60 220.712 12.839 -5.181 415 HA ARG 60 HA ARG 60 219.284 10.364 -5.873 416 HB2 ARG 60 HB2 ARG 60 221.228 9.469 -6.995 417 HB3 ARG 60 HB3 ARG 60 220.782 10.993 -7.744 418 HG2 ARG 60 HG2 ARG 60 222.721 11.972 -7.197 419 HG3 ARG 60 HG3 ARG 60 222.765 11.230 -5.597 420 HD2 ARG 60 HD2 ARG 60 223.871 9.365 -6.337 421 HD3 ARG 60 HD3 ARG 60 223.210 9.496 -7.975 422 HE ARG 60 HE ARG 60 225.067 11.583 -7.208 423 HH11 ARG 60 HH11 ARG 60 224.697 8.451 -8.736 424 HH12 ARG 60 HH12 ARG 60 226.154 8.596 -9.659 425 HH21 ARG 60 HH21 ARG 60 226.981 11.761 -8.428 426 HH22 ARG 60 HH22 ARG 60 227.451 10.470 -9.480 427 H ALA 61 H ALA 61 220.053 11.792 -3.333 428 HA ALA 61 HA ALA 61 222.122 10.409 -2.027 429 HB1 ALA 61 HB1 ALA 61 219.875 12.145 -1.195 430 HB2 ALA 61 HB2 ALA 61 221.601 12.284 -0.862 431 HB3 ALA 61 HB3 ALA 61 220.617 11.137 0.046 432 H TYR 62 H TYR 62 218.968 9.361 -2.891 433 HA TYR 62 HA TYR 62 219.417 6.783 -1.736 434 HB2 TYR 62 HB2 TYR 62 217.461 6.709 -0.282 435 HB3 TYR 62 HB3 TYR 62 218.556 7.984 0.240 436 HD1 TYR 62 HD1 TYR 62 217.996 10.363 -0.921 437 HD2 TYR 62 HD2 TYR 62 215.213 7.207 -0.283 438 HE1 TYR 62 HE1 TYR 62 216.150 11.982 -1.007 439 HE2 TYR 62 HE2 TYR 62 213.360 8.820 -0.369 440 HH TYR 62 HH TYR 62 213.226 11.405 -1.624 441 H ARG 63 H ARG 63 218.549 5.289 -3.041 442 HA ARG 63 HA ARG 63 216.356 6.122 -4.826 443 HB2 ARG 63 HB2 ARG 63 218.370 3.967 -5.454 444 HB3 ARG 63 HB3 ARG 63 217.211 4.708 -6.545 445 HG2 ARG 63 HG2 ARG 63 218.714 6.848 -5.655 446 HG3 ARG 63 HG3 ARG 63 219.894 5.549 -5.831 447 HD2 ARG 63 HD2 ARG 63 217.997 6.588 -7.933 448 HD3 ARG 63 HD3 ARG 63 219.748 6.766 -7.901 449 HE ARG 63 HE ARG 63 219.971 4.485 -8.461 450 HH11 ARG 63 HH11 ARG 63 216.613 5.505 -8.383 451 HH12 ARG 63 HH12 ARG 63 216.057 4.152 -9.303 452 HH21 ARG 63 HH21 ARG 63 219.214 2.701 -9.672 453 HH22 ARG 63 HH22 ARG 63 217.526 2.563 -10.030 454 H TYR 64 H TYR 64 214.530 4.971 -4.790 455 HA TYR 64 HA TYR 64 214.208 2.893 -2.841 456 HB2 TYR 64 HB2 TYR 64 212.521 4.738 -3.969 457 HB3 TYR 64 HB3 TYR 64 212.025 3.247 -4.780 458 HD1 TYR 64 HD1 TYR 64 210.181 2.284 -3.818 459 HD2 TYR 64 HD2 TYR 64 213.014 4.197 -1.282 460 HE1 TYR 64 HE1 TYR 64 208.822 1.691 -1.857 461 HE2 TYR 64 HE2 TYR 64 211.660 3.606 0.680 462 HH TYR 64 HH TYR 64 209.854 2.548 1.435 463 H VAL 65 H VAL 65 214.641 0.823 -3.145 464 HA VAL 65 HA VAL 65 214.531 -0.275 -5.877 465 HB VAL 65 HB VAL 65 215.823 -1.788 -3.647 466 HG11 VAL 65 HG11 VAL 65 215.447 -2.544 -6.104 467 HG12 VAL 65 HG12 VAL 65 216.989 -2.875 -5.314 468 HG13 VAL 65 HG13 VAL 65 216.847 -1.526 -6.441 469 HG21 VAL 65 HG21 VAL 65 217.166 0.478 -5.112 470 HG22 VAL 65 HG22 VAL 65 217.973 -0.697 -4.072 471 HG23 VAL 65 HG23 VAL 65 216.790 0.418 -3.390 472 H GLY 66 H GLY 66 212.551 -1.094 -6.169 473 HA2 GLY 66 HA2 GLY 66 210.775 -1.943 -4.222 474 HA3 GLY 66 HA3 GLY 66 210.710 -2.436 -5.912 475 H GLU 67 H GLU 67 211.822 -3.225 -2.715 476 HA GLU 67 HA GLU 67 211.431 -5.892 -2.669 477 HB2 GLU 67 HB2 GLU 67 213.690 -5.261 -4.414 478 HB3 GLU 67 HB3 GLU 67 214.120 -6.401 -3.145 479 HG2 GLU 67 HG2 GLU 67 211.601 -7.004 -4.506 480 HG3 GLU 67 HG3 GLU 67 213.021 -7.040 -5.549 481 H ASN 68 H ASN 68 212.023 -3.467 -0.949 482 HA ASN 68 HA ASN 68 212.868 -3.007 1.102 483 HB2 ASN 68 HB2 ASN 68 212.126 -5.632 1.247 484 HB3 ASN 68 HB3 ASN 68 213.831 -5.743 1.673 485 HD21 ASN 68 HD21 ASN 68 212.672 -6.506 3.696 486 HD22 ASN 68 HD22 ASN 68 212.319 -5.293 4.885 487 H THR 69 H THR 69 214.584 -3.199 -1.381 488 HA THR 69 HA THR 69 217.222 -3.485 -0.119 489 HB THR 69 HB THR 69 217.662 -3.330 -2.846 490 HG1 THR 69 HG1 THR 69 215.552 -3.622 -3.420 491 HG21 THR 69 HG21 THR 69 217.220 -6.064 -1.943 492 HG22 THR 69 HG22 THR 69 218.261 -5.115 -0.883 493 HG23 THR 69 HG23 THR 69 218.670 -5.294 -2.588 494 H TYR 70 H TYR 70 218.876 -1.960 -0.705 495 HA TYR 70 HA TYR 70 217.788 0.678 -1.442 496 HB2 TYR 70 HB2 TYR 70 218.543 0.634 0.877 497 HB3 TYR 70 HB3 TYR 70 220.113 0.012 0.379 498 HD1 TYR 70 HD1 TYR 70 217.891 2.873 -0.564 499 HD2 TYR 70 HD2 TYR 70 221.817 1.554 0.416 500 HE1 TYR 70 HE1 TYR 70 218.720 5.169 -0.820 501 HE2 TYR 70 HE2 TYR 70 222.655 3.851 0.163 502 HH TYR 70 HH TYR 70 221.931 5.947 -1.109 503 H GLN 71 H GLN 71 218.721 1.784 -3.076 504 HA GLN 71 HA GLN 71 221.190 0.700 -4.262 505 HB2 GLN 71 HB2 GLN 71 219.060 0.156 -5.545 506 HB3 GLN 71 HB3 GLN 71 218.922 1.878 -5.868 507 HG2 GLN 71 HG2 GLN 71 219.996 1.222 -7.756 508 HG3 GLN 71 HG3 GLN 71 221.392 1.562 -6.735 509 HE21 GLN 71 HE21 GLN 71 219.138 -1.163 -7.136 510 HE22 GLN 71 HE22 GLN 71 220.372 -2.373 -7.301 511 H ALA 72 H ALA 72 222.728 2.163 -4.827 512 HA ALA 72 HA ALA 72 222.058 4.983 -5.050 513 HB1 ALA 72 HB1 ALA 72 224.194 4.226 -3.088 514 HB2 ALA 72 HB2 ALA 72 222.511 4.421 -2.598 515 HB3 ALA 72 HB3 ALA 72 223.387 5.780 -3.304 516 H VAL 73 H VAL 73 222.956 5.465 -6.953 517 HA VAL 73 HA VAL 73 225.320 4.142 -7.919 518 HB VAL 73 HB VAL 73 223.935 6.566 -9.085 519 HG11 VAL 73 HG11 VAL 73 225.834 6.533 -10.312 520 HG12 VAL 73 HG12 VAL 73 224.976 5.269 -11.191 521 HG13 VAL 73 HG13 VAL 73 226.165 4.836 -9.962 522 HG21 VAL 73 HG21 VAL 73 223.494 3.930 -10.315 523 HG22 VAL 73 HG22 VAL 73 222.372 5.266 -10.051 524 HG23 VAL 73 HG23 VAL 73 222.746 4.154 -8.734 525 H VAL 74 H VAL 74 227.394 4.825 -7.812 526 HA VAL 74 HA VAL 74 227.914 7.556 -6.828 527 HB VAL 74 HB VAL 74 229.507 5.148 -5.962 528 HG11 VAL 74 HG11 VAL 74 229.973 6.934 -4.069 529 HG12 VAL 74 HG12 VAL 74 229.563 8.057 -5.363 530 HG13 VAL 74 HG13 VAL 74 230.893 6.919 -5.573 531 HG21 VAL 74 HG21 VAL 74 227.286 4.844 -5.086 532 HG22 VAL 74 HG22 VAL 74 227.233 6.517 -4.530 533 HG23 VAL 74 HG23 VAL 74 228.343 5.373 -3.776 534 H ASP 75 H ASP 75 229.554 8.648 -7.791 535 HA ASP 75 HA ASP 75 230.919 7.314 -10.014 536 HB2 ASP 75 HB2 ASP 75 231.469 9.587 -10.799 537 HB3 ASP 75 HB3 ASP 75 229.727 9.376 -10.569 538 H GLU 76 H GLU 76 233.044 6.895 -10.012 539 HA GLU 76 HA GLU 76 234.763 8.177 -8.009 540 HB2 GLU 76 HB2 GLU 76 235.811 5.841 -7.690 541 HB3 GLU 76 HB3 GLU 76 234.287 6.188 -6.884 542 HG2 GLU 76 HG2 GLU 76 233.104 5.060 -8.758 543 HG3 GLU 76 HG3 GLU 76 234.673 4.613 -9.419 544 H LYS 77 H LYS 77 237.087 7.868 -8.422 545 HA LYS 77 HA LYS 77 237.678 8.094 -11.257 546 HB2 LYS 77 HB2 LYS 77 238.698 9.307 -9.000 547 HB3 LYS 77 HB3 LYS 77 239.946 8.139 -9.398 548 HG2 LYS 77 HG2 LYS 77 240.495 10.206 -10.443 549 HG3 LYS 77 HG3 LYS 77 240.003 9.072 -11.702 550 HD2 LYS 77 HD2 LYS 77 237.629 10.238 -11.117 551 HD3 LYS 77 HD3 LYS 77 238.736 11.573 -10.794 552 HE2 LYS 77 HE2 LYS 77 239.227 11.854 -12.969 553 HE3 LYS 77 HE3 LYS 77 239.291 10.120 -13.278 554 HZ1 LYS 77 HZ1 LYS 77 236.674 11.376 -12.822 555 HZ2 LYS 77 HZ2 LYS 77 237.073 10.032 -13.770 556 HZ3 LYS 77 HZ3 LYS 77 237.427 11.591 -14.323 557 H ALA 78 H ALA 78 239.854 7.043 -11.959 558 HA ALA 78 HA ALA 78 239.535 4.187 -11.627 559 HB1 ALA 78 HB1 ALA 78 240.543 4.011 -13.618 560 HB2 ALA 78 HB2 ALA 78 241.871 5.069 -13.142 561 HB3 ALA 78 HB3 ALA 78 240.355 5.762 -13.716 562 H GLY 79 H GLY 79 240.694 2.875 -10.365 563 HA2 GLY 79 HA2 GLY 79 242.412 2.067 -9.061 564 HA3 GLY 79 HA3 GLY 79 243.405 3.415 -9.624 565 H ALA 80 H ALA 80 242.824 2.126 -6.916 566 HA ALA 80 HA ALA 80 242.768 2.781 -4.744 567 HB1 ALA 80 HB1 ALA 80 242.979 5.434 -4.490 568 HB2 ALA 80 HB2 ALA 80 243.544 5.263 -6.151 569 HB3 ALA 80 HB3 ALA 80 244.353 4.390 -4.851 570 H PHE 81 H PHE 81 240.800 2.307 -3.957 571 HA PHE 81 HA PHE 81 238.732 4.393 -4.129 572 HB2 PHE 81 HB2 PHE 81 238.247 1.418 -4.350 573 HB3 PHE 81 HB3 PHE 81 237.010 2.666 -4.363 574 HD1 PHE 81 HD1 PHE 81 240.038 1.546 -6.219 575 HD2 PHE 81 HD2 PHE 81 236.290 3.544 -6.374 576 HE1 PHE 81 HE1 PHE 81 240.224 1.695 -8.661 577 HE2 PHE 81 HE2 PHE 81 236.470 3.695 -8.821 578 HZ PHE 81 HZ PHE 81 238.438 2.770 -9.968 579 H ARG 82 H ARG 82 237.608 4.811 -2.301 580 HA ARG 82 HA ARG 82 237.523 3.003 -0.072 581 HB2 ARG 82 HB2 ARG 82 239.513 5.154 -0.157 582 HB3 ARG 82 HB3 ARG 82 238.490 5.209 1.271 583 HG2 ARG 82 HG2 ARG 82 239.063 2.688 1.479 584 HG3 ARG 82 HG3 ARG 82 240.404 3.084 0.396 585 HD2 ARG 82 HD2 ARG 82 239.889 3.969 3.203 586 HD3 ARG 82 HD3 ARG 82 241.376 3.372 2.470 587 HE ARG 82 HE ARG 82 240.545 6.081 2.668 588 HH11 ARG 82 HH11 ARG 82 242.268 3.864 0.581 589 HH12 ARG 82 HH12 ARG 82 243.216 5.104 -0.164 590 HH21 ARG 82 HH21 ARG 82 241.806 7.717 1.686 591 HH22 ARG 82 HH22 ARG 82 242.960 7.291 0.467 592 H MET 83 H MET 83 235.607 3.288 0.936 593 HA MET 83 HA MET 83 234.452 5.947 1.141 594 HB2 MET 83 HB2 MET 83 232.361 5.378 0.049 595 HB3 MET 83 HB3 MET 83 233.697 5.156 -1.069 596 HG2 MET 83 HG2 MET 83 232.557 2.868 0.497 597 HG3 MET 83 HG3 MET 83 231.860 3.390 -1.033 598 HE1 MET 83 HE1 MET 83 233.059 0.645 0.006 599 HE2 MET 83 HE2 MET 83 234.209 0.011 -1.171 600 HE3 MET 83 HE3 MET 83 232.590 0.484 -1.685 601 H GLN 84 H GLN 84 232.195 5.778 2.198 602 HA GLN 84 HA GLN 84 231.597 3.552 3.864 603 HB2 GLN 84 HB2 GLN 84 233.636 4.558 4.987 604 HB3 GLN 84 HB3 GLN 84 232.666 5.987 5.300 605 HG2 GLN 84 HG2 GLN 84 231.127 3.868 6.243 606 HG3 GLN 84 HG3 GLN 84 232.788 3.488 6.728 607 HE21 GLN 84 HE21 GLN 84 230.022 5.046 7.630 608 HE22 GLN 84 HE22 GLN 84 230.690 6.162 8.780 609 H TYR 85 H TYR 85 229.532 3.749 4.759 610 HA TYR 85 HA TYR 85 228.057 6.142 3.925 611 HB2 TYR 85 HB2 TYR 85 227.362 3.292 4.285 612 HB3 TYR 85 HB3 TYR 85 226.123 4.441 4.778 613 HD1 TYR 85 HD1 TYR 85 227.511 2.661 2.053 614 HD2 TYR 85 HD2 TYR 85 225.523 6.292 3.041 615 HE1 TYR 85 HE1 TYR 85 226.821 2.918 -0.292 616 HE2 TYR 85 HE2 TYR 85 224.828 6.556 0.698 617 HH TYR 85 HH TYR 85 225.937 5.572 -1.671 618 H ALA 86 H ALA 86 226.836 7.371 5.299 619 HA ALA 86 HA ALA 86 226.473 6.695 8.070 620 HB1 ALA 86 HB1 ALA 86 228.845 7.502 7.995 621 HB2 ALA 86 HB2 ALA 86 227.788 8.430 9.059 622 HB3 ALA 86 HB3 ALA 86 228.230 9.073 7.477 623 H SER 87 H SER 87 224.564 7.522 8.662 624 HA SER 87 HA SER 87 223.146 9.321 6.964 625 HB2 SER 87 HB2 SER 87 222.498 7.541 9.064 626 HB3 SER 87 HB3 SER 87 221.935 9.144 9.568 627 HG SER 87 HG SER 87 221.040 7.506 7.538 628 H LYS 88 H LYS 88 221.993 11.289 7.937 629 HA LYS 88 HA LYS 88 224.024 13.109 8.857 630 HB2 LYS 88 HB2 LYS 88 221.378 13.306 7.651 631 HB3 LYS 88 HB3 LYS 88 221.619 14.490 8.932 632 HG2 LYS 88 HG2 LYS 88 223.769 15.126 7.782 633 HG3 LYS 88 HG3 LYS 88 223.245 14.118 6.431 634 HD2 LYS 88 HD2 LYS 88 221.035 15.586 6.726 635 HD3 LYS 88 HD3 LYS 88 222.209 16.734 7.373 636 HE2 LYS 88 HE2 LYS 88 223.473 15.867 5.119 637 HE3 LYS 88 HE3 LYS 88 221.784 15.808 4.619 638 HZ1 LYS 88 HZ1 LYS 88 221.542 18.067 4.859 639 HZ2 LYS 88 HZ2 LYS 88 223.144 17.976 4.323 640 HZ3 LYS 88 HZ3 LYS 88 222.815 18.216 5.965 641 H ASP 89 H ASP 89 221.200 11.529 10.251 642 HA ASP 89 HA ASP 89 221.585 12.973 12.770 643 HB2 ASP 89 HB2 ASP 89 219.307 12.013 11.408 644 HB3 ASP 89 HB3 ASP 89 219.461 11.021 12.864 645 H TRP 90 H TRP 90 223.531 10.975 11.861 646 HA TRP 90 HA TRP 90 224.719 9.188 12.609 647 HB2 TRP 90 HB2 TRP 90 223.607 10.453 15.060 648 HB3 TRP 90 HB3 TRP 90 224.338 8.863 15.244 649 HD1 TRP 90 HD1 TRP 90 226.907 8.789 15.453 650 HE1 TRP 90 HE1 TRP 90 228.804 10.511 15.210 651 HE3 TRP 90 HE3 TRP 90 224.213 12.711 13.580 652 HZ2 TRP 90 HZ2 TRP 90 229.119 13.177 14.337 653 HZ3 TRP 90 HZ3 TRP 90 225.388 14.809 13.067 654 HH2 TRP 90 HH2 TRP 90 227.791 15.036 13.438 655 H SER 91 H SER 91 222.290 8.490 11.421 656 HA SER 91 HA SER 91 221.039 6.445 13.058 657 HB2 SER 91 HB2 SER 91 219.303 6.541 11.589 658 HB3 SER 91 HB3 SER 91 220.052 8.062 11.107 659 HG SER 91 HG SER 91 219.662 6.810 9.283 660 HA PRO 92 HA PRO 92 222.802 2.615 11.678 661 HB2 PRO 92 HB2 PRO 92 220.750 2.365 9.505 662 HB3 PRO 92 HB3 PRO 92 221.325 1.144 10.660 663 HG2 PRO 92 HG2 PRO 92 218.995 2.372 11.040 664 HG3 PRO 92 HG3 PRO 92 220.069 2.016 12.406 665 HD2 PRO 92 HD2 PRO 92 219.474 4.613 11.090 666 HD3 PRO 92 HD3 PRO 92 219.932 4.273 12.777 667 H GLN 93 H GLN 93 224.690 2.635 10.665 668 HA GLN 93 HA GLN 93 224.828 3.678 7.912 669 HB2 GLN 93 HB2 GLN 93 227.264 4.152 8.500 670 HB3 GLN 93 HB3 GLN 93 226.054 5.187 9.237 671 HG2 GLN 93 HG2 GLN 93 226.202 3.786 11.286 672 HG3 GLN 93 HG3 GLN 93 227.534 2.910 10.532 673 HE21 GLN 93 HE21 GLN 93 229.491 4.017 10.123 674 HE22 GLN 93 HE22 GLN 93 229.899 5.458 11.001 675 H PHE 94 H PHE 94 227.205 2.878 7.035 676 HA PHE 94 HA PHE 94 227.229 -0.047 7.369 677 HB2 PHE 94 HB2 PHE 94 226.519 -0.113 5.227 678 HB3 PHE 94 HB3 PHE 94 226.911 1.577 4.949 679 HD1 PHE 94 HD1 PHE 94 228.819 2.187 3.729 680 HD2 PHE 94 HD2 PHE 94 228.358 -1.833 5.043 681 HE1 PHE 94 HE1 PHE 94 230.731 1.518 2.335 682 HE2 PHE 94 HE2 PHE 94 230.269 -2.510 3.651 683 HZ PHE 94 HZ PHE 94 231.459 -0.833 2.293 684 H THR 95 H THR 95 229.072 -0.793 8.113 685 HA THR 95 HA THR 95 231.610 0.285 7.241 686 HB THR 95 HB THR 95 232.064 0.150 9.971 687 HG1 THR 95 HG1 THR 95 229.751 0.194 10.266 688 HG21 THR 95 HG21 THR 95 232.415 2.014 7.986 689 HG22 THR 95 HG22 THR 95 232.911 2.175 9.670 690 HG23 THR 95 HG23 THR 95 231.365 2.837 9.139 691 H ALA 96 H ALA 96 232.646 -1.492 6.630 692 HA ALA 96 HA ALA 96 232.270 -3.951 8.204 693 HB1 ALA 96 HB1 ALA 96 231.637 -3.954 5.769 694 HB2 ALA 96 HB2 ALA 96 232.777 -5.206 6.259 695 HB3 ALA 96 HB3 ALA 96 233.352 -3.776 5.403 696 H ASP 97 H ASP 97 233.924 -4.826 9.276 697 HA ASP 97 HA ASP 97 236.485 -3.477 9.259 698 HB2 ASP 97 HB2 ASP 97 235.060 -4.651 11.246 699 HB3 ASP 97 HB3 ASP 97 236.174 -5.964 10.835 700 H GLY 98 H GLY 98 238.094 -4.020 7.946 701 HA2 GLY 98 HA2 GLY 98 239.442 -5.219 6.519 702 HA3 GLY 98 HA3 GLY 98 239.147 -6.576 7.612 703 H LEU 99 H LEU 99 236.842 -4.829 5.559 704 HA LEU 99 HA LEU 99 235.867 -7.336 4.502 705 HB2 LEU 99 HB2 LEU 99 234.108 -5.929 4.964 706 HB3 LEU 99 HB3 LEU 99 234.980 -4.495 4.461 707 HG LEU 99 HG LEU 99 234.632 -5.063 2.118 708 HD11 LEU 99 HD11 LEU 99 232.896 -7.353 2.974 709 HD12 LEU 99 HD12 LEU 99 234.600 -7.572 2.590 710 HD13 LEU 99 HD13 LEU 99 233.493 -6.956 1.364 711 HD21 LEU 99 HD21 LEU 99 232.149 -5.109 3.820 712 HD22 LEU 99 HD22 LEU 99 232.152 -4.850 2.077 713 HD23 LEU 99 HD23 LEU 99 232.956 -3.695 3.141 714 H GLU 100 H GLU 100 237.058 -4.292 3.030 715 HA GLU 100 HA GLU 100 238.071 -3.857 1.044 716 HB2 GLU 100 HB2 GLU 100 238.940 -6.738 1.330 717 HB3 GLU 100 HB3 GLU 100 239.531 -5.652 0.085 718 HG2 GLU 100 HG2 GLU 100 240.446 -4.202 1.772 719 HG3 GLU 100 HG3 GLU 100 239.836 -5.272 3.030 720 H LEU 101 H LEU 101 236.096 -3.495 0.061 721 HA LEU 101 HA LEU 101 234.542 -5.528 -1.164 722 HB2 LEU 101 HB2 LEU 101 233.563 -3.421 -0.472 723 HB3 LEU 101 HB3 LEU 101 234.594 -2.541 -1.598 724 HG LEU 101 HG LEU 101 232.849 -4.614 -2.791 725 HD11 LEU 101 HD11 LEU 101 231.083 -2.595 -2.760 726 HD12 LEU 101 HD12 LEU 101 231.811 -2.383 -1.169 727 HD13 LEU 101 HD13 LEU 101 231.067 -3.922 -1.599 728 HD21 LEU 101 HD21 LEU 101 232.512 -2.710 -4.417 729 HD22 LEU 101 HD22 LEU 101 234.161 -3.312 -4.271 730 HD23 LEU 101 HD23 LEU 101 233.699 -1.810 -3.476 731 H THR 102 H THR 102 234.350 -6.137 -3.281 732 HA THR 102 HA THR 102 236.324 -5.122 -5.201 733 HB THR 102 HB THR 102 235.748 -8.048 -4.662 734 HG1 THR 102 HG1 THR 102 237.182 -7.519 -3.159 735 HG21 THR 102 HG21 THR 102 236.249 -7.481 -7.061 736 HG22 THR 102 HG22 THR 102 237.347 -8.625 -6.291 737 HG23 THR 102 HG23 THR 102 237.837 -6.945 -6.514 738 HA PRO 103 HA PRO 103 232.949 -4.661 -8.033 739 HB2 PRO 103 HB2 PRO 103 234.791 -6.044 -9.943 740 HB3 PRO 103 HB3 PRO 103 233.853 -4.562 -10.162 741 HG2 PRO 103 HG2 PRO 103 236.464 -4.445 -9.676 742 HG3 PRO 103 HG3 PRO 103 235.345 -3.274 -8.939 743 HD2 PRO 103 HD2 PRO 103 236.756 -5.584 -7.705 744 HD3 PRO 103 HD3 PRO 103 236.277 -4.037 -6.986 745 H GLY 104 H GLY 104 231.274 -5.992 -7.609 746 HA2 GLY 104 HA2 GLY 104 229.858 -7.776 -8.100 747 HA3 GLY 104 HA3 GLY 104 231.203 -8.587 -8.908 748 H LYS 105 H LYS 105 231.298 -7.320 -5.618 749 HA LYS 105 HA LYS 105 231.297 -10.077 -4.578 750 HB2 LYS 105 HB2 LYS 105 233.562 -8.587 -4.765 751 HB3 LYS 105 HB3 LYS 105 232.991 -8.108 -3.162 752 HG2 LYS 105 HG2 LYS 105 232.768 -10.906 -3.267 753 HG3 LYS 105 HG3 LYS 105 234.331 -10.506 -3.982 754 HD2 LYS 105 HD2 LYS 105 234.219 -8.853 -1.784 755 HD3 LYS 105 HD3 LYS 105 233.438 -10.328 -1.210 756 HE2 LYS 105 HE2 LYS 105 235.357 -11.644 -1.818 757 HE3 LYS 105 HE3 LYS 105 236.120 -10.253 -2.586 758 HZ1 LYS 105 HZ1 LYS 105 235.750 -9.302 -0.133 759 HZ2 LYS 105 HZ2 LYS 105 237.152 -10.124 -0.601 760 HZ3 LYS 105 HZ3 LYS 105 235.932 -10.945 0.232 761 H THR 106 H THR 106 230.555 -10.350 -2.462 762 HA THR 106 HA THR 106 228.524 -8.453 -1.696 763 HB THR 106 HB THR 106 227.822 -10.082 -0.077 764 HG1 THR 106 HG1 THR 106 229.601 -10.867 0.863 765 HG21 THR 106 HG21 THR 106 227.092 -11.702 -1.454 766 HG22 THR 106 HG22 THR 106 228.692 -12.007 -2.131 767 HG23 THR 106 HG23 THR 106 227.744 -10.629 -2.691 768 H ALA 107 H ALA 107 228.433 -7.208 0.135 769 HA ALA 107 HA ALA 107 230.996 -6.801 1.513 770 HB1 ALA 107 HB1 ALA 107 230.580 -4.697 0.865 771 HB2 ALA 107 HB2 ALA 107 229.467 -4.663 2.232 772 HB3 ALA 107 HB3 ALA 107 228.861 -5.008 0.612 773 H SER 108 H SER 108 231.178 -6.883 3.704 774 HA SER 108 HA SER 108 229.197 -8.375 5.138 775 HB2 SER 108 HB2 SER 108 231.536 -7.048 6.479 776 HB3 SER 108 HB3 SER 108 230.792 -8.609 6.826 777 HG SER 108 HG SER 108 232.936 -8.367 5.549 778 H LEU 109 H LEU 109 227.587 -7.631 6.371 779 HA LEU 109 HA LEU 109 227.641 -4.793 7.167 780 HB2 LEU 109 HB2 LEU 109 225.794 -6.004 5.544 781 HB3 LEU 109 HB3 LEU 109 225.017 -6.109 7.113 782 HG LEU 109 HG LEU 109 226.066 -3.526 5.965 783 HD11 LEU 109 HD11 LEU 109 224.195 -3.199 4.795 784 HD12 LEU 109 HD12 LEU 109 223.173 -3.882 6.057 785 HD13 LEU 109 HD13 LEU 109 223.979 -4.945 4.904 786 HD21 LEU 109 HD21 LEU 109 225.854 -3.401 8.325 787 HD22 LEU 109 HD22 LEU 109 224.290 -4.215 8.293 788 HD23 LEU 109 HD23 LEU 109 224.448 -2.585 7.639 789 H LYS 110 H LYS 110 228.466 -4.972 9.203 790 HA LYS 110 HA LYS 110 226.748 -6.272 11.181 791 HB2 LYS 110 HB2 LYS 110 229.069 -7.499 10.379 792 HB3 LYS 110 HB3 LYS 110 229.604 -6.586 11.784 793 HG2 LYS 110 HG2 LYS 110 227.348 -7.691 12.764 794 HG3 LYS 110 HG3 LYS 110 227.833 -8.930 11.607 795 HD2 LYS 110 HD2 LYS 110 229.989 -7.865 13.313 796 HD3 LYS 110 HD3 LYS 110 228.742 -8.789 14.151 797 HE2 LYS 110 HE2 LYS 110 229.623 -10.053 11.677 798 HE3 LYS 110 HE3 LYS 110 230.934 -9.825 12.832 799 HZ1 LYS 110 HZ1 LYS 110 229.086 -10.812 14.445 800 HZ2 LYS 110 HZ2 LYS 110 230.156 -11.795 13.579 801 HZ3 LYS 110 HZ3 LYS 110 228.585 -11.544 13.004 802 H ARG 111 H ARG 111 229.640 -4.221 10.710 803 HA ARG 111 HA ARG 111 229.169 -2.883 13.244 804 HB2 ARG 111 HB2 ARG 111 231.376 -3.088 11.332 805 HB3 ARG 111 HB3 ARG 111 231.147 -1.455 11.937 806 HG2 ARG 111 HG2 ARG 111 232.323 -2.033 13.718 807 HG3 ARG 111 HG3 ARG 111 230.989 -3.088 14.190 808 HD2 ARG 111 HD2 ARG 111 232.108 -4.767 12.529 809 HD3 ARG 111 HD3 ARG 111 233.536 -3.765 12.778 810 HE ARG 111 HE ARG 111 233.766 -4.689 14.850 811 HH11 ARG 111 HH11 ARG 111 230.481 -5.239 13.765 812 HH12 ARG 111 HH12 ARG 111 230.077 -6.258 15.104 813 HH21 ARG 111 HH21 ARG 111 233.227 -6.031 16.616 814 HH22 ARG 111 HH22 ARG 111 231.638 -6.710 16.723 815 H GLY 112 H GLY 112 228.162 -0.973 13.512 816 HA2 GLY 112 HA2 GLY 112 227.626 0.664 11.115 817 HA3 GLY 112 HA3 GLY 112 226.319 0.246 12.220 818 H GLY 113 H GLY 113 229.636 1.586 12.427 819 HA2 GLY 113 HA2 GLY 113 229.140 4.124 13.220 820 HA3 GLY 113 HA3 GLY 113 228.885 3.207 14.708 821 H TYR 114 H TYR 114 231.216 4.284 12.345 822 HA TYR 114 HA TYR 114 233.464 4.560 12.411 823 HB2 TYR 114 HB2 TYR 114 232.634 4.746 15.170 824 HB3 TYR 114 HB3 TYR 114 234.233 4.019 15.062 825 HD1 TYR 114 HD1 TYR 114 232.862 6.955 15.806 826 HD2 TYR 114 HD2 TYR 114 235.520 5.383 12.877 827 HE1 TYR 114 HE1 TYR 114 233.848 9.190 15.507 828 HE2 TYR 114 HE2 TYR 114 236.510 7.611 12.573 829 HH TYR 114 HH TYR 114 236.749 9.728 13.927 830 H GLY 115 H GLY 115 234.202 2.905 11.201 831 HA2 GLY 115 HA2 GLY 115 235.292 0.606 12.655 832 HA3 GLY 115 HA3 GLY 115 234.200 0.284 11.316 833 H GLN 116 H GLN 116 235.479 -0.552 9.764 834 HA GLN 116 HA GLN 116 237.961 0.887 9.094 835 HB2 GLN 116 HB2 GLN 116 237.653 -1.775 9.623 836 HB3 GLN 116 HB3 GLN 116 237.506 -1.756 7.872 837 HG2 GLN 116 HG2 GLN 116 239.682 -0.243 8.106 838 HG3 GLN 116 HG3 GLN 116 239.843 -1.181 9.590 839 HE21 GLN 116 HE21 GLN 116 240.692 -3.166 9.460 840 HE22 GLN 116 HE22 GLN 116 240.985 -4.029 7.992 841 H ASP 117 H ASP 117 238.152 1.869 7.162 842 HA ASP 117 HA ASP 117 235.894 2.205 5.491 843 HB2 ASP 117 HB2 ASP 117 238.696 3.140 5.504 844 HB3 ASP 117 HB3 ASP 117 237.942 3.058 3.915 845 H THR 118 H THR 118 235.230 1.154 3.709 846 HA THR 118 HA THR 118 236.542 -1.317 3.004 847 HB THR 118 HB THR 118 234.163 -0.109 1.601 848 HG1 THR 118 HG1 THR 118 233.400 -0.108 3.602 849 HG21 THR 118 HG21 THR 118 235.209 -2.883 1.945 850 HG22 THR 118 HG22 THR 118 234.734 -2.038 0.473 851 HG23 THR 118 HG23 THR 118 233.504 -2.584 1.610 852 H ALA 119 H ALA 119 238.195 -1.370 1.647 853 HA ALA 119 HA ALA 119 238.497 0.726 -0.369 854 HB1 ALA 119 HB1 ALA 119 240.748 0.351 -0.324 855 HB2 ALA 119 HB2 ALA 119 240.570 -1.367 0.034 856 HB3 ALA 119 HB3 ALA 119 240.329 -0.171 1.308 857 H VAL 120 H VAL 120 238.715 0.335 -2.544 858 HA VAL 120 HA VAL 120 238.093 -2.393 -3.476 859 HB VAL 120 HB VAL 120 237.103 0.021 -4.962 860 HG11 VAL 120 HG11 VAL 120 235.502 -1.524 -5.883 861 HG12 VAL 120 HG12 VAL 120 236.040 -2.796 -4.787 862 HG13 VAL 120 HG13 VAL 120 237.120 -2.202 -6.048 863 HG21 VAL 120 HG21 VAL 120 236.181 0.341 -2.772 864 HG22 VAL 120 HG22 VAL 120 235.705 -1.354 -2.671 865 HG23 VAL 120 HG23 VAL 120 234.908 -0.279 -3.823 866 H THR 121 H THR 121 239.228 -3.126 -5.226 867 HA THR 121 HA THR 121 241.312 -1.336 -6.270 868 HB THR 121 HB THR 121 241.128 -4.288 -5.813 869 HG1 THR 121 HG1 THR 121 242.791 -3.914 -4.533 870 HG21 THR 121 HG21 THR 121 243.543 -4.155 -6.959 871 HG22 THR 121 HG22 THR 121 242.683 -2.985 -7.961 872 HG23 THR 121 HG23 THR 121 242.086 -4.640 -7.828 873 H LEU 122 H LEU 122 240.434 -0.375 -8.043 874 HA LEU 122 HA LEU 122 239.504 -2.151 -10.199 875 HB2 LEU 122 HB2 LEU 122 238.203 0.283 -9.072 876 HB3 LEU 122 HB3 LEU 122 238.058 -0.012 -10.792 877 HG LEU 122 HG LEU 122 237.405 -2.317 -9.077 878 HD11 LEU 122 HD11 LEU 122 235.612 -1.509 -7.975 879 HD12 LEU 122 HD12 LEU 122 235.219 -0.346 -9.241 880 HD13 LEU 122 HD13 LEU 122 236.496 0.013 -8.082 881 HD21 LEU 122 HD21 LEU 122 236.886 -2.730 -11.261 882 HD22 LEU 122 HD22 LEU 122 236.480 -1.049 -11.602 883 HD23 LEU 122 HD23 LEU 122 235.346 -2.065 -10.715 884 HA PRO 123 HA PRO 123 242.711 0.250 -12.248 885 HB2 PRO 123 HB2 PRO 123 243.028 -1.345 -14.373 886 HB3 PRO 123 HB3 PRO 123 243.592 -1.827 -12.760 887 HG2 PRO 123 HG2 PRO 123 241.116 -2.649 -14.231 888 HG3 PRO 123 HG3 PRO 123 242.221 -3.636 -13.258 889 HD2 PRO 123 HD2 PRO 123 239.818 -2.626 -12.353 890 HD3 PRO 123 HD3 PRO 123 241.175 -3.084 -11.305 891 H GLU 124 H GLU 124 239.509 0.195 -12.912 892 HA GLU 124 HA GLU 124 239.830 1.816 -15.345 893 HB2 GLU 124 HB2 GLU 124 238.789 -0.586 -15.568 894 HB3 GLU 124 HB3 GLU 124 237.358 0.183 -14.898 895 HG2 GLU 124 HG2 GLU 124 237.314 1.768 -16.737 896 HG3 GLU 124 HG3 GLU 124 238.796 1.055 -17.400 897 H ALA 125 H ALA 125 238.572 3.639 -15.495 898 HA ALA 125 HA ALA 125 237.420 4.588 -13.003 899 HB1 ALA 125 HB1 ALA 125 238.466 6.408 -13.792 900 HB2 ALA 125 HB2 ALA 125 237.031 6.610 -14.796 901 HB3 ALA 125 HB3 ALA 125 238.460 5.811 -15.451 902 H GLY 126 H GLY 126 235.293 5.063 -12.635 903 HA2 GLY 126 HA2 GLY 126 233.245 5.442 -14.424 904 HA3 GLY 126 HA3 GLY 126 233.356 3.693 -14.244 905 H GLN 127 H GLN 127 231.022 4.608 -13.549 906 HA GLN 127 HA GLN 127 231.053 5.119 -10.660 907 HB2 GLN 127 HB2 GLN 127 228.740 5.819 -10.883 908 HB3 GLN 127 HB3 GLN 127 229.741 6.682 -12.040 909 HG2 GLN 127 HG2 GLN 127 229.007 4.975 -13.756 910 HG3 GLN 127 HG3 GLN 127 227.813 4.435 -12.563 911 HE21 GLN 127 HE21 GLN 127 225.885 5.199 -13.062 912 HE22 GLN 127 HE22 GLN 127 225.537 6.793 -13.632 913 H TYR 128 H TYR 128 230.255 3.715 -9.209 914 HA TYR 128 HA TYR 128 229.287 1.130 -10.232 915 HB2 TYR 128 HB2 TYR 128 230.201 0.081 -8.298 916 HB3 TYR 128 HB3 TYR 128 231.440 1.172 -8.904 917 HD1 TYR 128 HD1 TYR 128 231.555 3.517 -7.780 918 HD2 TYR 128 HD2 TYR 128 229.592 0.161 -6.050 919 HE1 TYR 128 HE1 TYR 128 231.725 4.566 -5.569 920 HE2 TYR 128 HE2 TYR 128 229.758 1.205 -3.830 921 HH TYR 128 HH TYR 128 230.474 4.424 -3.358 922 H VAL 129 H VAL 129 227.735 -0.023 -8.804 923 HA VAL 129 HA VAL 129 225.821 1.891 -7.645 924 HB VAL 129 HB VAL 129 224.100 0.101 -8.063 925 HG11 VAL 129 HG11 VAL 129 224.921 2.122 -9.633 926 HG12 VAL 129 HG12 VAL 129 223.571 1.059 -10.035 927 HG13 VAL 129 HG13 VAL 129 225.164 0.764 -10.732 928 HG21 VAL 129 HG21 VAL 129 224.554 -1.837 -9.120 929 HG22 VAL 129 HG22 VAL 129 226.183 -1.558 -8.505 930 HG23 VAL 129 HG23 VAL 129 225.777 -1.110 -10.161 931 H TRP 130 H TRP 130 225.251 1.710 -5.575 932 HA TRP 130 HA TRP 130 226.426 -0.440 -3.992 933 HB2 TRP 130 HB2 TRP 130 225.620 2.326 -3.511 934 HB3 TRP 130 HB3 TRP 130 225.061 1.234 -2.250 935 HD1 TRP 130 HD1 TRP 130 227.772 3.443 -2.770 936 HE1 TRP 130 HE1 TRP 130 229.904 2.722 -1.526 937 HE3 TRP 130 HE3 TRP 130 226.549 -1.429 -1.799 938 HZ2 TRP 130 HZ2 TRP 130 230.934 0.405 -0.297 939 HZ3 TRP 130 HZ3 TRP 130 228.171 -2.829 -0.586 940 HH2 TRP 130 HH2 TRP 130 230.315 -1.928 0.149 941 H SER 131 H SER 131 225.243 -2.241 -3.750 942 HA SER 131 HA SER 131 222.318 -1.971 -3.561 943 HB2 SER 131 HB2 SER 131 223.582 -3.472 -5.357 944 HB3 SER 131 HB3 SER 131 223.593 -4.630 -4.027 945 HG SER 131 HG SER 131 221.676 -4.395 -5.627 946 H LEU 132 H LEU 132 221.372 -2.370 -1.682 947 HA LEU 132 HA LEU 132 222.731 -4.080 0.292 948 HB2 LEU 132 HB2 LEU 132 221.793 -1.262 0.598 949 HB3 LEU 132 HB3 LEU 132 221.640 -2.341 1.969 950 HG LEU 132 HG LEU 132 224.153 -2.812 1.629 951 HD11 LEU 132 HD11 LEU 132 225.211 -0.601 0.716 952 HD12 LEU 132 HD12 LEU 132 223.703 -0.493 -0.191 953 HD13 LEU 132 HD13 LEU 132 224.754 -1.894 -0.389 954 HD21 LEU 132 HD21 LEU 132 222.839 -0.424 2.795 955 HD22 LEU 132 HD22 LEU 132 224.599 -0.422 2.702 956 HD23 LEU 132 HD23 LEU 132 223.765 -1.706 3.575 957 H LYS 133 H LYS 133 221.390 -5.476 1.364 958 HA LYS 133 HA LYS 133 218.492 -5.083 1.016 959 HB2 LYS 133 HB2 LYS 133 219.534 -6.862 -0.497 960 HB3 LYS 133 HB3 LYS 133 219.789 -7.801 0.980 961 HG2 LYS 133 HG2 LYS 133 217.408 -7.822 1.413 962 HG3 LYS 133 HG3 LYS 133 217.118 -6.798 0.006 963 HD2 LYS 133 HD2 LYS 133 217.416 -8.501 -1.466 964 HD3 LYS 133 HD3 LYS 133 218.617 -9.311 -0.456 965 HE2 LYS 133 HE2 LYS 133 215.791 -9.190 0.484 966 HE3 LYS 133 HE3 LYS 133 216.206 -10.323 -0.801 967 HZ1 LYS 133 HZ1 LYS 133 217.593 -10.198 1.825 968 HZ2 LYS 133 HZ2 LYS 133 217.817 -11.358 0.615 969 HZ3 LYS 133 HZ3 LYS 133 216.351 -11.286 1.454 970 H PHE 134 H PHE 134 217.274 -5.295 2.771 971 HA PHE 134 HA PHE 134 218.428 -6.574 5.156 972 HB2 PHE 134 HB2 PHE 134 216.617 -4.212 5.472 973 HB3 PHE 134 HB3 PHE 134 217.849 -4.826 6.566 974 HD1 PHE 134 HD1 PHE 134 217.051 -2.147 4.618 975 HD2 PHE 134 HD2 PHE 134 220.307 -4.794 5.324 976 HE1 PHE 134 HE1 PHE 134 218.619 -0.437 3.789 977 HE2 PHE 134 HE2 PHE 134 221.878 -3.093 4.497 978 HZ PHE 134 HZ PHE 134 221.034 -0.910 3.728 979 H THR 135 H THR 135 217.016 -7.669 6.475 980 HA THR 135 HA THR 135 214.619 -8.635 5.208 981 HB THR 135 HB THR 135 216.112 -10.129 6.473 982 HG1 THR 135 HG1 THR 135 214.491 -11.208 7.573 983 HG21 THR 135 HG21 THR 135 216.968 -9.454 8.398 984 HG22 THR 135 HG22 THR 135 215.387 -9.766 9.116 985 HG23 THR 135 HG23 THR 135 215.793 -8.148 8.543 986 H ASP 136 H ASP 136 212.683 -9.005 6.879 987 HA ASP 136 HA ASP 136 211.787 -6.329 7.589 988 HB2 ASP 136 HB2 ASP 136 210.513 -8.839 6.834 989 HB3 ASP 136 HB3 ASP 136 209.736 -8.088 8.227 990 H SER 137 H SER 137 212.552 -9.395 9.151 991 HA SER 137 HA SER 137 211.525 -8.719 11.711 992 HB2 SER 137 HB2 SER 137 212.232 -11.042 10.707 993 HB3 SER 137 HB3 SER 137 213.805 -10.633 11.389 994 HG SER 137 HG SER 137 212.123 -11.816 12.728 995 H GLY 138 H GLY 138 214.521 -8.006 10.080 996 HA2 GLY 138 HA2 GLY 138 216.024 -6.317 10.689 997 HA3 GLY 138 HA3 GLY 138 215.303 -6.292 12.301 998 H ASP 139 H ASP 139 216.339 -9.316 10.865 999 HA ASP 139 HA ASP 139 218.504 -9.406 12.848 1000 HB2 ASP 139 HB2 ASP 139 216.579 -11.424 11.864 1001 HB3 ASP 139 HB3 ASP 139 218.224 -12.006 12.104 1002 HA PRO 140 HA PRO 140 220.808 -11.317 9.106 1003 HB2 PRO 140 HB2 PRO 140 219.420 -11.792 6.801 1004 HB3 PRO 140 HB3 PRO 140 219.628 -12.991 8.081 1005 HG2 PRO 140 HG2 PRO 140 217.295 -11.206 7.519 1006 HG3 PRO 140 HG3 PRO 140 217.309 -12.918 7.976 1007 HD2 PRO 140 HD2 PRO 140 216.780 -10.967 9.759 1008 HD3 PRO 140 HD3 PRO 140 217.643 -12.449 10.212 1009 H GLU 141 H GLU 141 222.069 -9.974 7.937 1010 HA GLU 141 HA GLU 141 220.904 -7.918 6.253 1011 HB2 GLU 141 HB2 GLU 141 221.410 -7.198 8.801 1012 HB3 GLU 141 HB3 GLU 141 222.992 -6.903 8.095 1013 HG2 GLU 141 HG2 GLU 141 222.054 -5.384 6.487 1014 HG3 GLU 141 HG3 GLU 141 220.414 -5.767 7.033 1015 H GLN 142 H GLN 142 221.958 -8.061 4.394 1016 HA GLN 142 HA GLN 142 224.874 -8.424 4.425 1017 HB2 GLN 142 HB2 GLN 142 223.260 -10.491 3.803 1018 HB3 GLN 142 HB3 GLN 142 223.399 -9.742 2.219 1019 HG2 GLN 142 HG2 GLN 142 225.432 -10.559 1.925 1020 HG3 GLN 142 HG3 GLN 142 225.979 -9.944 3.489 1021 HE21 GLN 142 HE21 GLN 142 223.735 -12.463 2.343 1022 HE22 GLN 142 HE22 GLN 142 224.356 -13.711 3.362 1023 H ILE 143 H ILE 143 225.952 -7.732 2.457 1024 HA ILE 143 HA ILE 143 224.410 -5.740 0.918 1025 HB ILE 143 HB ILE 143 227.316 -5.435 1.672 1026 HG12 ILE 143 HG12 ILE 143 224.924 -4.105 2.960 1027 HG13 ILE 143 HG13 ILE 143 225.877 -5.391 3.692 1028 HG21 ILE 143 HG21 ILE 143 226.854 -4.173 -0.256 1029 HG22 ILE 143 HG22 ILE 143 226.782 -3.024 1.079 1030 HG23 ILE 143 HG23 ILE 143 225.292 -3.641 0.367 1031 HD11 ILE 143 HD11 ILE 143 227.542 -3.192 2.834 1032 HD12 ILE 143 HD12 ILE 143 227.399 -3.957 4.417 1033 HD13 ILE 143 HD13 ILE 143 226.283 -2.672 3.955 1034 H MET 144 H MET 144 225.163 -5.320 -1.242 1035 HA MET 144 HA MET 144 227.078 -7.215 -2.374 1036 HB2 MET 144 HB2 MET 144 224.244 -7.468 -2.670 1037 HB3 MET 144 HB3 MET 144 224.933 -7.038 -4.228 1038 HG2 MET 144 HG2 MET 144 226.451 -9.108 -2.871 1039 HG3 MET 144 HG3 MET 144 224.772 -9.563 -3.154 1040 HE1 MET 144 HE1 MET 144 228.062 -8.673 -4.245 1041 HE2 MET 144 HE2 MET 144 227.860 -8.006 -5.865 1042 HE3 MET 144 HE3 MET 144 228.262 -9.710 -5.658 1043 H VAL 145 H VAL 145 228.314 -6.335 -3.956 1044 HA VAL 145 HA VAL 145 227.470 -3.726 -5.042 1045 HB VAL 145 HB VAL 145 229.312 -3.447 -3.428 1046 HG11 VAL 145 HG11 VAL 145 230.427 -5.685 -4.906 1047 HG12 VAL 145 HG12 VAL 145 230.828 -5.075 -3.304 1048 HG13 VAL 145 HG13 VAL 145 231.568 -4.355 -4.733 1049 HG21 VAL 145 HG21 VAL 145 229.032 -2.021 -5.504 1050 HG22 VAL 145 HG22 VAL 145 230.352 -2.953 -6.207 1051 HG23 VAL 145 HG23 VAL 145 230.626 -1.998 -4.751 1052 H SER 146 H SER 146 227.758 -3.366 -7.200 1053 HA SER 146 HA SER 146 229.120 -5.416 -8.787 1054 HB2 SER 146 HB2 SER 146 227.293 -5.713 -10.283 1055 HB3 SER 146 HB3 SER 146 226.614 -5.853 -8.662 1056 HG SER 146 HG SER 146 225.724 -3.856 -8.854 1057 H LYS 147 H LYS 147 229.728 -4.718 -10.919 1058 HA LYS 147 HA LYS 147 229.908 -1.786 -11.151 1059 HB2 LYS 147 HB2 LYS 147 232.020 -2.169 -12.409 1060 HB3 LYS 147 HB3 LYS 147 232.094 -2.701 -10.726 1061 HG2 LYS 147 HG2 LYS 147 232.313 -4.884 -11.286 1062 HG3 LYS 147 HG3 LYS 147 231.305 -4.734 -12.726 1063 HD2 LYS 147 HD2 LYS 147 233.706 -3.182 -13.027 1064 HD3 LYS 147 HD3 LYS 147 234.107 -4.846 -12.594 1065 HE2 LYS 147 HE2 LYS 147 232.340 -5.437 -14.428 1066 HE3 LYS 147 HE3 LYS 147 232.664 -3.799 -14.993 1067 HZ1 LYS 147 HZ1 LYS 147 234.087 -5.340 -16.128 1068 HZ2 LYS 147 HZ2 LYS 147 234.653 -5.981 -14.669 1069 HZ3 LYS 147 HZ3 LYS 147 235.037 -4.391 -15.098 1070 H CYS 148 H CYS 148 229.321 -0.827 -13.026 1071 HA CYS 148 HA CYS 148 228.043 -2.525 -15.028 1072 HB2 CYS 148 HB2 CYS 148 227.929 0.434 -14.461 1073 HB3 CYS 148 HB3 CYS 148 227.205 -0.278 -15.899 1074 HA PRO 149 HA PRO 149 231.258 -2.024 -18.013 1075 HB2 PRO 149 HB2 PRO 149 229.853 -2.247 -20.319 1076 HB3 PRO 149 HB3 PRO 149 230.155 -3.624 -19.243 1077 HG2 PRO 149 HG2 PRO 149 227.709 -1.910 -19.487 1078 HG3 PRO 149 HG3 PRO 149 227.828 -3.675 -19.348 1079 HD2 PRO 149 HD2 PRO 149 227.227 -2.082 -17.242 1080 HD3 PRO 149 HD3 PRO 149 228.131 -3.600 -17.065 Start of MODEL 5 1 H1 THR 1 H1 THR 1 206.701 -12.158 -7.880 2 H2 THR 1 H2 THR 1 206.952 -13.145 -6.500 3 H3 THR 1 H3 THR 1 206.532 -11.493 -6.310 4 HA THR 1 HA THR 1 204.910 -13.794 -6.831 5 HB THR 1 HB THR 1 203.740 -11.233 -5.960 6 HG1 THR 1 HG1 THR 1 205.637 -12.486 -4.268 7 HG21 THR 1 HG21 THR 1 202.395 -12.549 -4.797 8 HG22 THR 1 HG22 THR 1 203.747 -13.386 -4.036 9 HG23 THR 1 HG23 THR 1 203.157 -13.914 -5.613 10 HA PRO 2 HA PRO 2 202.650 -10.826 -9.812 11 HB2 PRO 2 HB2 PRO 2 203.672 -8.410 -10.418 12 HB3 PRO 2 HB3 PRO 2 202.674 -8.683 -8.985 13 HG2 PRO 2 HG2 PRO 2 205.640 -8.428 -9.212 14 HG3 PRO 2 HG3 PRO 2 204.555 -7.813 -7.955 15 HD2 PRO 2 HD2 PRO 2 206.083 -10.095 -7.726 16 HD3 PRO 2 HD3 PRO 2 204.612 -9.774 -6.790 17 H SER 3 H SER 3 206.160 -10.221 -10.171 18 HA SER 3 HA SER 3 207.580 -10.451 -11.931 19 HB2 SER 3 HB2 SER 3 206.246 -12.858 -11.640 20 HB3 SER 3 HB3 SER 3 206.073 -12.515 -13.360 21 HG SER 3 HG SER 3 208.151 -13.543 -12.217 22 H ALA 4 H ALA 4 205.356 -8.568 -12.233 23 HA ALA 4 HA ALA 4 205.113 -8.569 -15.172 24 HB1 ALA 4 HB1 ALA 4 203.210 -6.937 -13.607 25 HB2 ALA 4 HB2 ALA 4 203.029 -8.687 -13.480 26 HB3 ALA 4 HB3 ALA 4 202.956 -7.906 -15.058 27 H SER 5 H SER 5 207.362 -7.524 -13.752 28 HA SER 5 HA SER 5 207.166 -4.724 -13.381 29 HB2 SER 5 HB2 SER 5 209.635 -6.362 -14.012 30 HB3 SER 5 HB3 SER 5 209.606 -4.743 -13.314 31 HG SER 5 HG SER 5 208.518 -5.637 -11.503 32 H GLY 6 H GLY 6 208.181 -6.730 -16.122 33 HA2 GLY 6 HA2 GLY 6 207.323 -5.514 -18.261 34 HA3 GLY 6 HA3 GLY 6 208.513 -4.321 -17.765 35 H LEU 7 H LEU 7 208.188 -7.791 -18.499 36 HA LEU 7 HA LEU 7 210.933 -8.303 -18.857 37 HB2 LEU 7 HB2 LEU 7 208.421 -9.662 -19.745 38 HB3 LEU 7 HB3 LEU 7 209.963 -10.201 -20.380 39 HG LEU 7 HG LEU 7 209.381 -10.041 -17.426 40 HD11 LEU 7 HD11 LEU 7 209.426 -12.665 -18.777 41 HD12 LEU 7 HD12 LEU 7 207.994 -11.673 -19.044 42 HD13 LEU 7 HD13 LEU 7 208.471 -12.107 -17.404 43 HD21 LEU 7 HD21 LEU 7 211.394 -11.049 -17.095 44 HD22 LEU 7 HD22 LEU 7 211.768 -10.179 -18.584 45 HD23 LEU 7 HD23 LEU 7 211.353 -11.892 -18.643 46 H THR 8 H THR 8 212.276 -7.575 -20.352 47 HA THR 8 HA THR 8 211.173 -6.729 -22.950 48 HB THR 8 HB THR 8 213.881 -5.799 -22.197 49 HG1 THR 8 HG1 THR 8 213.261 -5.090 -20.332 50 HG21 THR 8 HG21 THR 8 211.887 -5.018 -24.003 51 HG22 THR 8 HG22 THR 8 213.440 -4.243 -23.699 52 HG23 THR 8 HG23 THR 8 212.009 -3.728 -22.808 53 H LYS 9 H LYS 9 211.301 -8.773 -23.896 54 HA LYS 9 HA LYS 9 213.917 -10.058 -24.108 55 HB2 LYS 9 HB2 LYS 9 211.278 -11.008 -24.042 56 HB3 LYS 9 HB3 LYS 9 211.820 -11.287 -25.692 57 HG2 LYS 9 HG2 LYS 9 213.629 -12.637 -24.961 58 HG3 LYS 9 HG3 LYS 9 213.387 -12.163 -23.279 59 HD2 LYS 9 HD2 LYS 9 211.075 -13.217 -23.481 60 HD3 LYS 9 HD3 LYS 9 211.651 -13.927 -24.992 61 HE2 LYS 9 HE2 LYS 9 213.624 -14.793 -23.580 62 HE3 LYS 9 HE3 LYS 9 212.609 -14.418 -22.189 63 HZ1 LYS 9 HZ1 LYS 9 212.582 -16.768 -23.397 64 HZ2 LYS 9 HZ2 LYS 9 211.384 -16.001 -24.312 65 HZ3 LYS 9 HZ3 LYS 9 211.216 -16.123 -22.632 66 H VAL 10 H VAL 10 215.256 -9.627 -25.716 67 HA VAL 10 HA VAL 10 216.159 -8.882 -27.642 68 HB VAL 10 HB VAL 10 214.882 -10.855 -28.511 69 HG11 VAL 10 HG11 VAL 10 212.841 -8.747 -29.038 70 HG12 VAL 10 HG12 VAL 10 212.635 -10.397 -28.454 71 HG13 VAL 10 HG13 VAL 10 212.999 -10.105 -30.153 72 HG21 VAL 10 HG21 VAL 10 215.231 -10.300 -30.850 73 HG22 VAL 10 HG22 VAL 10 216.539 -9.659 -29.858 74 HG23 VAL 10 HG23 VAL 10 215.277 -8.582 -30.454 75 H ALA 11 H ALA 11 216.219 -7.194 -29.213 76 HA ALA 11 HA ALA 11 214.782 -4.856 -28.360 77 HB1 ALA 11 HB1 ALA 11 216.338 -3.658 -29.498 78 HB2 ALA 11 HB2 ALA 11 216.374 -4.783 -30.856 79 HB3 ALA 11 HB3 ALA 11 217.233 -5.172 -29.367 80 H THR 12 H THR 12 212.764 -4.460 -28.980 81 HA THR 12 HA THR 12 211.927 -5.299 -31.672 82 HB THR 12 HB THR 12 210.595 -6.339 -29.966 83 HG1 THR 12 HG1 THR 12 209.039 -4.196 -30.963 84 HG21 THR 12 HG21 THR 12 209.234 -5.086 -28.376 85 HG22 THR 12 HG22 THR 12 210.020 -3.592 -28.885 86 HG23 THR 12 HG23 THR 12 210.959 -4.857 -28.093 87 H VAL 13 H VAL 13 211.817 -3.763 -33.142 88 HA VAL 13 HA VAL 13 211.483 -1.781 -34.196 89 HB VAL 13 HB VAL 13 209.976 -0.903 -31.728 90 HG11 VAL 13 HG11 VAL 13 209.183 0.018 -34.413 91 HG12 VAL 13 HG12 VAL 13 210.727 0.629 -33.819 92 HG13 VAL 13 HG13 VAL 13 209.257 0.894 -32.884 93 HG21 VAL 13 HG21 VAL 13 209.344 -3.102 -33.209 94 HG22 VAL 13 HG22 VAL 13 208.439 -1.842 -34.046 95 HG23 VAL 13 HG23 VAL 13 208.181 -2.117 -32.324 96 H SER 14 H SER 14 212.839 -0.118 -34.530 97 HA SER 14 HA SER 14 214.377 0.876 -32.219 98 HB2 SER 14 HB2 SER 14 215.594 -0.365 -34.104 99 HB3 SER 14 HB3 SER 14 215.272 1.059 -35.095 100 HG SER 14 HG SER 14 216.516 2.281 -33.741 101 H ALA 15 H ALA 15 214.694 3.057 -31.929 102 HA ALA 15 HA ALA 15 213.558 4.944 -33.834 103 HB1 ALA 15 HB1 ALA 15 211.613 4.543 -32.552 104 HB2 ALA 15 HB2 ALA 15 212.272 6.072 -31.970 105 HB3 ALA 15 HB3 ALA 15 212.511 4.595 -31.034 106 H ALA 16 H ALA 16 214.594 6.887 -33.836 107 HA ALA 16 HA ALA 16 217.082 7.141 -32.540 108 HB1 ALA 16 HB1 ALA 16 217.072 8.390 -34.442 109 HB2 ALA 16 HB2 ALA 16 216.674 9.660 -33.286 110 HB3 ALA 16 HB3 ALA 16 215.396 8.901 -34.234 111 H SER 17 H SER 17 217.526 7.652 -30.508 112 HA SER 17 HA SER 17 215.482 8.730 -28.771 113 HB2 SER 17 HB2 SER 17 218.198 7.547 -28.397 114 HB3 SER 17 HB3 SER 17 217.570 8.599 -27.129 115 HG SER 17 HG SER 17 216.324 6.268 -28.165 116 H SER 18 H SER 18 215.355 10.743 -27.950 117 HA SER 18 HA SER 18 217.411 12.680 -28.793 118 HB2 SER 18 HB2 SER 18 214.866 12.773 -29.599 119 HB3 SER 18 HB3 SER 18 214.674 13.613 -28.060 120 HG SER 18 HG SER 18 216.408 14.310 -30.195 121 H LEU 19 H LEU 19 218.713 12.918 -27.076 122 HA LEU 19 HA LEU 19 219.463 13.418 -24.991 123 HB2 LEU 19 HB2 LEU 19 216.818 14.864 -24.936 124 HB3 LEU 19 HB3 LEU 19 217.979 14.964 -23.629 125 HG LEU 19 HG LEU 19 219.628 15.746 -25.504 126 HD11 LEU 19 HD11 LEU 19 217.026 16.612 -26.740 127 HD12 LEU 19 HD12 LEU 19 217.947 15.219 -27.306 128 HD13 LEU 19 HD13 LEU 19 218.660 16.830 -27.369 129 HD21 LEU 19 HD21 LEU 19 217.619 17.846 -24.975 130 HD22 LEU 19 HD22 LEU 19 219.360 17.841 -24.695 131 HD23 LEU 19 HD23 LEU 19 218.282 17.027 -23.561 132 H ILE 20 H ILE 20 217.841 10.945 -25.409 133 HA ILE 20 HA ILE 20 217.270 10.409 -22.585 134 HB ILE 20 HB ILE 20 215.114 10.744 -23.664 135 HG12 ILE 20 HG12 ILE 20 215.785 7.893 -22.972 136 HG13 ILE 20 HG13 ILE 20 215.132 9.147 -21.914 137 HG21 ILE 20 HG21 ILE 20 214.489 9.919 -25.662 138 HG22 ILE 20 HG22 ILE 20 215.291 8.372 -25.392 139 HG23 ILE 20 HG23 ILE 20 216.226 9.768 -25.927 140 HD11 ILE 20 HD11 ILE 20 213.735 7.675 -24.125 141 HD12 ILE 20 HD12 ILE 20 213.086 9.143 -23.391 142 HD13 ILE 20 HD13 ILE 20 213.343 7.703 -22.405 143 H GLY 21 H GLY 21 217.948 8.447 -21.852 144 HA2 GLY 21 HA2 GLY 21 219.435 6.787 -23.788 145 HA3 GLY 21 HA3 GLY 21 219.750 6.865 -22.050 146 H GLU 22 H GLU 22 219.135 4.617 -23.961 147 HA GLU 22 HA GLU 22 216.960 3.428 -22.372 148 HB2 GLU 22 HB2 GLU 22 216.969 3.933 -25.172 149 HB3 GLU 22 HB3 GLU 22 217.037 2.193 -24.936 150 HG2 GLU 22 HG2 GLU 22 215.081 2.306 -23.530 151 HG3 GLU 22 HG3 GLU 22 215.016 4.051 -23.758 152 H GLY 23 H GLY 23 217.289 1.370 -21.652 153 HA2 GLY 23 HA2 GLY 23 218.316 -0.808 -21.829 154 HA3 GLY 23 HA3 GLY 23 219.708 -0.036 -22.599 155 H PHE 24 H PHE 24 219.379 2.144 -20.408 156 HA PHE 24 HA PHE 24 221.443 1.359 -18.745 157 HB2 PHE 24 HB2 PHE 24 220.764 3.206 -17.262 158 HB3 PHE 24 HB3 PHE 24 220.743 3.688 -18.963 159 HD1 PHE 24 HD1 PHE 24 218.636 4.128 -20.100 160 HD2 PHE 24 HD2 PHE 24 218.738 3.054 -15.982 161 HE1 PHE 24 HE1 PHE 24 216.317 4.907 -19.842 162 HE2 PHE 24 HE2 PHE 24 216.419 3.831 -15.719 163 HZ PHE 24 HZ PHE 24 215.205 4.760 -17.651 164 H MET 25 H MET 25 217.966 0.904 -18.323 165 HA MET 25 HA MET 25 217.972 0.045 -15.656 166 HB2 MET 25 HB2 MET 25 215.807 -1.043 -16.212 167 HB3 MET 25 HB3 MET 25 215.904 0.630 -16.744 168 HG2 MET 25 HG2 MET 25 216.242 -0.038 -19.010 169 HG3 MET 25 HG3 MET 25 216.411 -1.728 -18.542 170 HE1 MET 25 HE1 MET 25 212.916 0.459 -19.920 171 HE2 MET 25 HE2 MET 25 213.778 -0.761 -20.858 172 HE3 MET 25 HE3 MET 25 214.655 0.607 -20.170 173 H ALA 26 H ALA 26 218.779 -1.647 -18.615 174 HA ALA 26 HA ALA 26 219.051 -4.169 -17.126 175 HB1 ALA 26 HB1 ALA 26 218.560 -5.304 -19.016 176 HB2 ALA 26 HB2 ALA 26 219.417 -4.165 -20.057 177 HB3 ALA 26 HB3 ALA 26 217.799 -3.779 -19.470 178 H GLN 27 H GLN 27 220.927 -1.650 -17.528 179 HA GLN 27 HA GLN 27 223.307 -2.955 -18.583 180 HB2 GLN 27 HB2 GLN 27 222.859 -0.684 -19.300 181 HB3 GLN 27 HB3 GLN 27 222.776 -0.135 -17.634 182 HG2 GLN 27 HG2 GLN 27 224.878 0.443 -18.837 183 HG3 GLN 27 HG3 GLN 27 225.103 -0.434 -17.326 184 HE21 GLN 27 HE21 GLN 27 227.055 -1.282 -17.785 185 HE22 GLN 27 HE22 GLN 27 227.339 -2.450 -19.030 186 H CYS 28 H CYS 28 221.948 -1.913 -15.526 187 HA CYS 28 HA CYS 28 223.531 -3.584 -13.967 188 HB2 CYS 28 HB2 CYS 28 224.880 -1.754 -12.777 189 HB3 CYS 28 HB3 CYS 28 225.468 -2.319 -14.334 190 H ASP 29 H ASP 29 221.718 -0.571 -14.125 191 HA ASP 29 HA ASP 29 221.044 -0.408 -11.387 192 HB2 ASP 29 HB2 ASP 29 219.786 0.754 -13.876 193 HB3 ASP 29 HB3 ASP 29 219.159 1.064 -12.250 194 H ASN 30 H ASN 30 220.437 -2.512 -10.829 195 HA ASN 30 HA ASN 30 218.235 -3.852 -12.080 196 HB2 ASN 30 HB2 ASN 30 219.208 -4.499 -9.309 197 HB3 ASN 30 HB3 ASN 30 218.555 -5.584 -10.533 198 HD21 ASN 30 HD21 ASN 30 221.343 -4.182 -9.189 199 HD22 ASN 30 HD22 ASN 30 222.505 -4.876 -10.276 200 HA PRO 31 HA PRO 31 215.258 -1.548 -9.622 201 HB2 PRO 31 HB2 PRO 31 213.164 -2.498 -11.280 202 HB3 PRO 31 HB3 PRO 31 213.943 -0.911 -11.292 203 HG2 PRO 31 HG2 PRO 31 214.112 -2.798 -13.327 204 HG3 PRO 31 HG3 PRO 31 215.201 -1.423 -13.097 205 HD2 PRO 31 HD2 PRO 31 215.587 -4.293 -12.361 206 HD3 PRO 31 HD3 PRO 31 216.774 -3.104 -12.943 207 H THR 32 H THR 32 215.203 -2.694 -7.786 208 HA THR 32 HA THR 32 213.478 -5.081 -7.705 209 HB THR 32 HB THR 32 214.833 -5.353 -5.420 210 HG1 THR 32 HG1 THR 32 216.792 -4.211 -7.115 211 HG21 THR 32 HG21 THR 32 216.274 -6.933 -6.439 212 HG22 THR 32 HG22 THR 32 216.131 -6.145 -8.010 213 HG23 THR 32 HG23 THR 32 214.742 -6.980 -7.312 214 H ILE 33 H ILE 33 211.522 -4.138 -7.222 215 HA ILE 33 HA ILE 33 211.453 -2.740 -4.638 216 HB ILE 33 HB ILE 33 209.474 -1.419 -5.574 217 HG12 ILE 33 HG12 ILE 33 209.394 -2.877 -7.683 218 HG13 ILE 33 HG13 ILE 33 209.240 -1.139 -7.902 219 HG21 ILE 33 HG21 ILE 33 211.147 0.024 -5.183 220 HG22 ILE 33 HG22 ILE 33 211.303 0.038 -6.939 221 HG23 ILE 33 HG23 ILE 33 212.353 -0.994 -5.969 222 HD11 ILE 33 HD11 ILE 33 211.995 -1.848 -8.072 223 HD12 ILE 33 HD12 ILE 33 210.945 -1.149 -9.306 224 HD13 ILE 33 HD13 ILE 33 211.054 -2.901 -9.130 225 H GLU 34 H GLU 34 210.616 -4.221 -3.353 226 HA GLU 34 HA GLU 34 207.868 -5.061 -3.816 227 HB2 GLU 34 HB2 GLU 34 210.203 -6.899 -3.737 228 HB3 GLU 34 HB3 GLU 34 208.795 -7.387 -2.803 229 HG2 GLU 34 HG2 GLU 34 208.767 -6.708 -5.737 230 HG3 GLU 34 HG3 GLU 34 208.841 -8.339 -5.072 231 H GLY 35 H GLY 35 206.971 -4.103 -2.064 232 HA2 GLY 35 HA2 GLY 35 206.654 -4.687 0.383 233 HA3 GLY 35 HA3 GLY 35 208.385 -4.397 0.517 234 H ASP 36 H ASP 36 208.652 -2.578 1.652 235 HA ASP 36 HA ASP 36 207.619 -0.096 0.598 236 HB2 ASP 36 HB2 ASP 36 206.545 -1.287 3.128 237 HB3 ASP 36 HB3 ASP 36 206.759 0.466 3.038 238 H GLY 37 H GLY 37 209.749 0.548 0.375 239 HA2 GLY 37 HA2 GLY 37 211.756 0.314 2.342 240 HA3 GLY 37 HA3 GLY 37 211.767 1.458 1.008 241 HA PRO 38 HA PRO 38 210.928 3.513 5.270 242 HB2 PRO 38 HB2 PRO 38 213.407 4.412 5.899 243 HB3 PRO 38 HB3 PRO 38 212.799 2.825 6.408 244 HG2 PRO 38 HG2 PRO 38 214.593 3.523 4.111 245 HG3 PRO 38 HG3 PRO 38 214.730 2.192 5.274 246 HD2 PRO 38 HD2 PRO 38 213.731 1.850 2.782 247 HD3 PRO 38 HD3 PRO 38 213.171 0.899 4.172 248 H ILE 39 H ILE 39 209.838 5.167 4.318 249 HA ILE 39 HA ILE 39 211.051 7.015 2.494 250 HB ILE 39 HB ILE 39 208.408 7.333 3.911 251 HG12 ILE 39 HG12 ILE 39 208.398 6.343 1.141 252 HG13 ILE 39 HG13 ILE 39 209.065 5.204 2.305 253 HG21 ILE 39 HG21 ILE 39 209.753 8.676 1.624 254 HG22 ILE 39 HG22 ILE 39 208.764 9.360 2.914 255 HG23 ILE 39 HG23 ILE 39 207.998 8.495 1.581 256 HD11 ILE 39 HD11 ILE 39 207.045 4.676 3.034 257 HD12 ILE 39 HD12 ILE 39 206.386 5.636 1.711 258 HD13 ILE 39 HD13 ILE 39 206.627 6.369 3.296 259 H GLY 40 H GLY 40 211.289 9.292 2.802 260 HA2 GLY 40 HA2 GLY 40 211.772 11.219 3.966 261 HA3 GLY 40 HA3 GLY 40 211.070 10.481 5.396 262 H LYS 41 H LYS 41 213.633 8.862 3.667 263 HA LYS 41 HA LYS 41 215.550 9.727 5.729 264 HB2 LYS 41 HB2 LYS 41 214.903 6.922 4.848 265 HB3 LYS 41 HB3 LYS 41 216.432 7.319 5.620 266 HG2 LYS 41 HG2 LYS 41 213.754 7.912 6.856 267 HG3 LYS 41 HG3 LYS 41 214.653 6.420 7.139 268 HD2 LYS 41 HD2 LYS 41 215.893 9.119 7.605 269 HD3 LYS 41 HD3 LYS 41 214.914 8.324 8.840 270 HE2 LYS 41 HE2 LYS 41 216.792 7.307 9.477 271 HE3 LYS 41 HE3 LYS 41 216.630 6.331 8.019 272 HZ1 LYS 41 HZ1 LYS 41 218.357 8.668 8.498 273 HZ2 LYS 41 HZ2 LYS 41 217.888 8.281 6.921 274 HZ3 LYS 41 HZ3 LYS 41 218.759 7.162 7.841 275 H THR 42 H THR 42 217.499 10.287 5.015 276 HA THR 42 HA THR 42 218.192 9.670 2.215 277 HB THR 42 HB THR 42 218.984 12.091 3.854 278 HG1 THR 42 HG1 THR 42 217.110 11.776 1.750 279 HG21 THR 42 HG21 THR 42 220.445 12.664 2.300 280 HG22 THR 42 HG22 THR 42 219.265 12.402 1.017 281 HG23 THR 42 HG23 THR 42 220.251 11.059 1.595 282 H LEU 43 H LEU 43 220.238 8.936 1.755 283 HA LEU 43 HA LEU 43 221.915 8.280 4.088 284 HB2 LEU 43 HB2 LEU 43 221.208 6.779 1.626 285 HB3 LEU 43 HB3 LEU 43 222.847 6.594 2.220 286 HG LEU 43 HG LEU 43 220.298 5.920 3.684 287 HD11 LEU 43 HD11 LEU 43 221.596 4.429 1.868 288 HD12 LEU 43 HD12 LEU 43 220.732 3.752 3.249 289 HD13 LEU 43 HD13 LEU 43 222.480 3.973 3.324 290 HD21 LEU 43 HD21 LEU 43 221.509 6.579 5.487 291 HD22 LEU 43 HD22 LEU 43 223.056 6.365 4.670 292 HD23 LEU 43 HD23 LEU 43 222.191 4.964 5.299 293 H TYR 44 H TYR 44 223.832 9.256 4.213 294 HA TYR 44 HA TYR 44 224.863 10.595 1.812 295 HB2 TYR 44 HB2 TYR 44 224.621 11.430 4.506 296 HB3 TYR 44 HB3 TYR 44 226.344 11.257 4.190 297 HD1 TYR 44 HD1 TYR 44 223.265 12.773 2.733 298 HD2 TYR 44 HD2 TYR 44 227.491 12.998 3.164 299 HE1 TYR 44 HE1 TYR 44 223.261 14.944 1.580 300 HE2 TYR 44 HE2 TYR 44 227.498 15.172 2.015 301 HH TYR 44 HH TYR 44 225.825 16.320 0.237 302 H VAL 45 H VAL 45 226.439 9.628 0.740 303 HA VAL 45 HA VAL 45 228.204 7.772 2.195 304 HB VAL 45 HB VAL 45 226.848 6.694 0.442 305 HG11 VAL 45 HG11 VAL 45 227.192 8.951 -1.023 306 HG12 VAL 45 HG12 VAL 45 226.657 7.403 -1.679 307 HG13 VAL 45 HG13 VAL 45 228.354 7.867 -1.787 308 HG21 VAL 45 HG21 VAL 45 229.820 6.818 -0.017 309 HG22 VAL 45 HG22 VAL 45 228.763 5.652 -0.816 310 HG23 VAL 45 HG23 VAL 45 228.917 5.646 0.942 311 H VAL 46 H VAL 46 230.363 8.037 2.144 312 HA VAL 46 HA VAL 46 231.429 10.220 0.470 313 HB VAL 46 HB VAL 46 233.161 10.545 2.291 314 HG11 VAL 46 HG11 VAL 46 230.332 11.338 2.352 315 HG12 VAL 46 HG12 VAL 46 231.792 12.325 2.371 316 HG13 VAL 46 HG13 VAL 46 231.214 11.577 3.861 317 HG21 VAL 46 HG21 VAL 46 232.109 8.265 3.375 318 HG22 VAL 46 HG22 VAL 46 231.362 9.522 4.361 319 HG23 VAL 46 HG23 VAL 46 233.118 9.429 4.233 320 H GLY 47 H GLY 47 232.847 9.530 -0.970 321 HA2 GLY 47 HA2 GLY 47 234.436 7.121 -0.333 322 HA3 GLY 47 HA3 GLY 47 233.759 7.418 -1.936 323 H ASP 48 H ASP 48 236.450 7.744 0.026 324 HA ASP 48 HA ASP 48 237.605 10.096 -1.067 325 HB2 ASP 48 HB2 ASP 48 238.310 9.133 1.099 326 HB3 ASP 48 HB3 ASP 48 238.969 7.730 0.249 327 H PHE 49 H PHE 49 237.234 9.827 -3.305 328 HA PHE 49 HA PHE 49 238.530 7.678 -4.743 329 HB2 PHE 49 HB2 PHE 49 237.212 10.149 -5.889 330 HB3 PHE 49 HB3 PHE 49 237.544 8.627 -6.724 331 HD1 PHE 49 HD1 PHE 49 236.544 6.607 -4.915 332 HD2 PHE 49 HD2 PHE 49 234.935 10.439 -5.825 333 HE1 PHE 49 HE1 PHE 49 234.295 5.798 -4.332 334 HE2 PHE 49 HE2 PHE 49 232.685 9.637 -5.243 335 HZ PHE 49 HZ PHE 49 232.362 7.313 -4.496 336 H ALA 50 H ALA 50 239.552 8.795 -6.993 337 HA ALA 50 HA ALA 50 242.034 9.906 -6.021 338 HB1 ALA 50 HB1 ALA 50 242.096 8.177 -7.726 339 HB2 ALA 50 HB2 ALA 50 242.810 9.669 -8.335 340 HB3 ALA 50 HB3 ALA 50 241.182 9.205 -8.830 341 H ASP 51 H ASP 51 239.778 10.933 -8.614 342 HA ASP 51 HA ASP 51 240.668 13.698 -8.128 343 HB2 ASP 51 HB2 ASP 51 239.268 12.711 -10.618 344 HB3 ASP 51 HB3 ASP 51 240.157 14.223 -10.394 345 H ALA 52 H ALA 52 238.811 12.725 -6.354 346 HA ALA 52 HA ALA 52 236.592 14.519 -6.837 347 HB1 ALA 52 HB1 ALA 52 235.350 12.858 -7.736 348 HB2 ALA 52 HB2 ALA 52 235.074 12.461 -6.042 349 HB3 ALA 52 HB3 ALA 52 236.293 11.583 -6.965 350 H SER 53 H SER 53 237.601 11.838 -4.722 351 HA SER 53 HA SER 53 237.690 11.592 -2.470 352 HB2 SER 53 HB2 SER 53 238.376 14.536 -2.553 353 HB3 SER 53 HB3 SER 53 238.718 13.428 -1.226 354 HG SER 53 HG SER 53 240.183 12.367 -2.484 355 H TRP 54 H TRP 54 235.683 11.083 -1.782 356 HA TRP 54 HA TRP 54 233.734 11.259 -0.639 357 HB2 TRP 54 HB2 TRP 54 234.793 14.020 0.020 358 HB3 TRP 54 HB3 TRP 54 233.311 13.344 0.705 359 HD1 TRP 54 HD1 TRP 54 236.320 11.033 0.316 360 HE1 TRP 54 HE1 TRP 54 237.248 10.467 2.648 361 HE3 TRP 54 HE3 TRP 54 233.541 14.297 3.112 362 HZ2 TRP 54 HZ2 TRP 54 236.856 11.296 5.318 363 HZ3 TRP 54 HZ3 TRP 54 233.881 14.345 5.548 364 HH2 TRP 54 HH2 TRP 54 235.503 12.875 6.627 365 H LYS 55 H LYS 55 233.154 11.232 -3.072 366 HA LYS 55 HA LYS 55 231.795 13.675 -3.918 367 HB2 LYS 55 HB2 LYS 55 233.228 11.762 -5.303 368 HB3 LYS 55 HB3 LYS 55 231.560 11.349 -5.678 369 HG2 LYS 55 HG2 LYS 55 231.508 14.027 -6.037 370 HG3 LYS 55 HG3 LYS 55 233.171 13.658 -6.502 371 HD2 LYS 55 HD2 LYS 55 232.375 12.002 -8.096 372 HD3 LYS 55 HD3 LYS 55 230.707 12.305 -7.602 373 HE2 LYS 55 HE2 LYS 55 232.350 14.610 -8.513 374 HE3 LYS 55 HE3 LYS 55 231.771 13.471 -9.729 375 HZ1 LYS 55 HZ1 LYS 55 229.503 13.822 -8.780 376 HZ2 LYS 55 HZ2 LYS 55 230.168 15.182 -9.534 377 HZ3 LYS 55 HZ3 LYS 55 230.139 15.082 -7.846 378 H GLN 56 H GLN 56 229.697 13.978 -3.674 379 HA GLN 56 HA GLN 56 227.855 11.717 -3.631 380 HB2 GLN 56 HB2 GLN 56 226.729 12.756 -1.574 381 HB3 GLN 56 HB3 GLN 56 228.217 11.857 -1.310 382 HG2 GLN 56 HG2 GLN 56 228.911 14.568 -1.787 383 HG3 GLN 56 HG3 GLN 56 227.602 14.533 -0.597 384 HE21 GLN 56 HE21 GLN 56 230.264 12.250 -1.171 385 HE22 GLN 56 HE22 GLN 56 230.945 12.389 0.411 386 H LYS 57 H LYS 57 225.784 12.225 -4.324 387 HA LYS 57 HA LYS 57 225.322 15.031 -5.112 388 HB2 LYS 57 HB2 LYS 57 224.997 12.502 -6.674 389 HB3 LYS 57 HB3 LYS 57 223.890 13.833 -6.983 390 HG2 LYS 57 HG2 LYS 57 225.541 15.194 -7.830 391 HG3 LYS 57 HG3 LYS 57 226.830 14.342 -6.975 392 HD2 LYS 57 HD2 LYS 57 227.074 12.811 -8.611 393 HD3 LYS 57 HD3 LYS 57 225.340 12.710 -8.914 394 HE2 LYS 57 HE2 LYS 57 225.403 14.255 -10.550 395 HE3 LYS 57 HE3 LYS 57 226.576 15.257 -9.697 396 HZ1 LYS 57 HZ1 LYS 57 227.923 14.547 -11.335 397 HZ2 LYS 57 HZ2 LYS 57 227.006 13.167 -11.665 398 HZ3 LYS 57 HZ3 LYS 57 228.093 13.168 -10.370 399 HA PRO 58 HA PRO 58 221.520 14.792 -2.866 400 HB2 PRO 58 HB2 PRO 58 219.983 16.537 -4.296 401 HB3 PRO 58 HB3 PRO 58 221.260 17.049 -3.174 402 HG2 PRO 58 HG2 PRO 58 221.347 16.787 -6.158 403 HG3 PRO 58 HG3 PRO 58 221.995 18.075 -5.127 404 HD2 PRO 58 HD2 PRO 58 223.561 16.134 -6.154 405 HD3 PRO 58 HD3 PRO 58 223.871 16.848 -4.557 406 H HIS 59 H HIS 59 221.456 14.361 -6.368 407 HA HIS 59 HA HIS 59 218.842 13.123 -6.341 408 HB2 HIS 59 HB2 HIS 59 220.735 14.073 -8.366 409 HB3 HIS 59 HB3 HIS 59 219.955 12.548 -8.806 410 HD1 HIS 59 HD1 HIS 59 219.089 14.462 -10.678 411 HD2 HIS 59 HD2 HIS 59 217.367 14.444 -6.896 412 HE1 HIS 59 HE1 HIS 59 216.906 15.682 -10.928 413 HE2 HIS 59 HE2 HIS 59 215.910 15.717 -8.615 414 H ARG 60 H ARG 60 221.732 12.027 -5.281 415 HA ARG 60 HA ARG 60 221.091 9.256 -6.020 416 HB2 ARG 60 HB2 ARG 60 223.883 10.370 -5.698 417 HB3 ARG 60 HB3 ARG 60 223.462 8.713 -6.102 418 HG2 ARG 60 HG2 ARG 60 222.377 10.762 -7.912 419 HG3 ARG 60 HG3 ARG 60 224.132 10.594 -7.911 420 HD2 ARG 60 HD2 ARG 60 223.962 8.788 -9.194 421 HD3 ARG 60 HD3 ARG 60 223.021 7.984 -7.927 422 HE ARG 60 HE ARG 60 221.126 8.347 -9.153 423 HH11 ARG 60 HH11 ARG 60 223.648 10.430 -10.390 424 HH12 ARG 60 HH12 ARG 60 222.726 10.942 -11.763 425 HH21 ARG 60 HH21 ARG 60 219.911 9.024 -10.967 426 HH22 ARG 60 HH22 ARG 60 220.606 10.144 -12.091 427 H ALA 61 H ALA 61 220.604 11.086 -3.614 428 HA ALA 61 HA ALA 61 222.097 10.461 -1.403 429 HB1 ALA 61 HB1 ALA 61 219.655 10.459 -0.281 430 HB2 ALA 61 HB2 ALA 61 219.262 11.171 -1.847 431 HB3 ALA 61 HB3 ALA 61 220.475 11.925 -0.815 432 H TYR 62 H TYR 62 219.346 8.581 -2.672 433 HA TYR 62 HA TYR 62 220.432 6.076 -2.285 434 HB2 TYR 62 HB2 TYR 62 220.372 5.718 -0.080 435 HB3 TYR 62 HB3 TYR 62 219.580 7.260 0.195 436 HD1 TYR 62 HD1 TYR 62 217.504 7.260 1.190 437 HD2 TYR 62 HD2 TYR 62 218.763 3.774 -0.898 438 HE1 TYR 62 HE1 TYR 62 215.483 6.087 1.943 439 HE2 TYR 62 HE2 TYR 62 216.739 2.591 -0.155 440 HH TYR 62 HH TYR 62 214.518 4.009 2.163 441 H ARG 63 H ARG 63 219.306 4.809 -3.592 442 HA ARG 63 HA ARG 63 216.674 5.626 -4.484 443 HB2 ARG 63 HB2 ARG 63 218.638 4.644 -5.905 444 HB3 ARG 63 HB3 ARG 63 218.020 3.091 -5.357 445 HG2 ARG 63 HG2 ARG 63 215.854 3.583 -6.333 446 HG3 ARG 63 HG3 ARG 63 216.425 5.175 -6.835 447 HD2 ARG 63 HD2 ARG 63 216.602 3.853 -8.759 448 HD3 ARG 63 HD3 ARG 63 218.244 3.928 -8.121 449 HE ARG 63 HE ARG 63 216.728 1.640 -7.239 450 HH11 ARG 63 HH11 ARG 63 218.849 2.898 -9.725 451 HH12 ARG 63 HH12 ARG 63 219.397 1.334 -10.223 452 HH21 ARG 63 HH21 ARG 63 217.445 -0.418 -7.906 453 HH22 ARG 63 HH22 ARG 63 218.597 -0.551 -9.191 454 H TYR 64 H TYR 64 214.771 4.681 -4.026 455 HA TYR 64 HA TYR 64 214.674 2.854 -1.802 456 HB2 TYR 64 HB2 TYR 64 212.594 4.330 -3.392 457 HB3 TYR 64 HB3 TYR 64 212.131 3.054 -2.263 458 HD1 TYR 64 HD1 TYR 64 214.508 5.958 -2.199 459 HD2 TYR 64 HD2 TYR 64 211.369 3.841 -0.257 460 HE1 TYR 64 HE1 TYR 64 214.586 7.561 -0.336 461 HE2 TYR 64 HE2 TYR 64 211.438 5.436 1.605 462 HH TYR 64 HH TYR 64 213.007 7.005 2.631 463 H VAL 65 H VAL 65 214.718 0.754 -1.955 464 HA VAL 65 HA VAL 65 213.405 -0.556 -4.230 465 HB VAL 65 HB VAL 65 215.228 -2.430 -3.750 466 HG11 VAL 65 HG11 VAL 65 216.136 -0.142 -5.445 467 HG12 VAL 65 HG12 VAL 65 214.676 -1.040 -5.861 468 HG13 VAL 65 HG13 VAL 65 216.225 -1.876 -5.757 469 HG21 VAL 65 HG21 VAL 65 216.260 -0.374 -2.189 470 HG22 VAL 65 HG22 VAL 65 217.251 -0.374 -3.650 471 HG23 VAL 65 HG23 VAL 65 217.085 -1.848 -2.696 472 H GLY 66 H GLY 66 211.636 -1.306 -3.287 473 HA2 GLY 66 HA2 GLY 66 211.025 -1.785 -0.711 474 HA3 GLY 66 HA3 GLY 66 210.330 -2.730 -2.027 475 H GLU 67 H GLU 67 210.584 -3.745 0.502 476 HA GLU 67 HA GLU 67 211.049 -5.807 1.370 477 HB2 GLU 67 HB2 GLU 67 212.018 -6.126 -1.220 478 HB3 GLU 67 HB3 GLU 67 213.389 -6.547 -0.197 479 HG2 GLU 67 HG2 GLU 67 210.678 -7.718 0.299 480 HG3 GLU 67 HG3 GLU 67 211.758 -8.393 -0.920 481 H ASN 68 H ASN 68 212.309 -3.251 2.079 482 HA ASN 68 HA ASN 68 213.835 -2.455 3.552 483 HB2 ASN 68 HB2 ASN 68 213.072 -4.595 4.762 484 HB3 ASN 68 HB3 ASN 68 214.600 -5.289 4.229 485 HD21 ASN 68 HD21 ASN 68 214.487 -5.359 6.759 486 HD22 ASN 68 HD22 ASN 68 215.337 -4.061 7.540 487 H THR 69 H THR 69 214.619 -3.375 0.744 488 HA THR 69 HA THR 69 217.498 -3.749 1.114 489 HB THR 69 HB THR 69 217.605 -4.518 -1.099 490 HG1 THR 69 HG1 THR 69 215.086 -3.296 -1.580 491 HG21 THR 69 HG21 THR 69 214.793 -5.363 -0.838 492 HG22 THR 69 HG22 THR 69 215.884 -5.818 0.469 493 HG23 THR 69 HG23 THR 69 216.241 -6.305 -1.186 494 H TYR 70 H TYR 70 219.005 -2.340 0.045 495 HA TYR 70 HA TYR 70 217.890 0.288 -0.686 496 HB2 TYR 70 HB2 TYR 70 220.374 -0.198 0.974 497 HB3 TYR 70 HB3 TYR 70 219.783 1.374 0.448 498 HD1 TYR 70 HD1 TYR 70 218.572 -1.627 2.338 499 HD2 TYR 70 HD2 TYR 70 218.550 2.611 1.954 500 HE1 TYR 70 HE1 TYR 70 217.244 -1.453 4.400 501 HE2 TYR 70 HE2 TYR 70 217.221 2.795 4.013 502 HH TYR 70 HH TYR 70 215.632 0.229 5.420 503 H GLN 71 H GLN 71 218.891 1.379 -2.350 504 HA GLN 71 HA GLN 71 221.287 0.220 -3.560 505 HB2 GLN 71 HB2 GLN 71 219.059 -0.704 -4.568 506 HB3 GLN 71 HB3 GLN 71 218.961 0.872 -5.342 507 HG2 GLN 71 HG2 GLN 71 220.528 0.363 -6.845 508 HG3 GLN 71 HG3 GLN 71 221.564 -0.409 -5.646 509 HE21 GLN 71 HE21 GLN 71 220.134 -2.461 -4.719 510 HE22 GLN 71 HE22 GLN 71 219.726 -3.568 -5.994 511 H ALA 72 H ALA 72 222.617 1.730 -4.471 512 HA ALA 72 HA ALA 72 221.577 4.353 -5.161 513 HB1 ALA 72 HB1 ALA 72 222.042 4.609 -2.792 514 HB2 ALA 72 HB2 ALA 72 223.187 5.553 -3.746 515 HB3 ALA 72 HB3 ALA 72 223.689 4.020 -3.033 516 H VAL 73 H VAL 73 222.600 5.177 -6.891 517 HA VAL 73 HA VAL 73 224.816 3.705 -8.024 518 HB VAL 73 HB VAL 73 223.544 6.232 -9.095 519 HG11 VAL 73 HG11 VAL 73 224.743 5.941 -10.992 520 HG12 VAL 73 HG12 VAL 73 224.722 4.183 -10.869 521 HG13 VAL 73 HG13 VAL 73 225.852 5.122 -9.893 522 HG21 VAL 73 HG21 VAL 73 222.814 3.677 -10.337 523 HG22 VAL 73 HG22 VAL 73 221.815 5.075 -9.945 524 HG23 VAL 73 HG23 VAL 73 222.202 3.890 -8.698 525 H VAL 74 H VAL 74 226.900 4.257 -8.005 526 HA VAL 74 HA VAL 74 227.654 6.914 -6.964 527 HB VAL 74 HB VAL 74 229.208 4.375 -6.451 528 HG11 VAL 74 HG11 VAL 74 230.100 5.871 -4.559 529 HG12 VAL 74 HG12 VAL 74 229.411 7.207 -5.482 530 HG13 VAL 74 HG13 VAL 74 230.655 6.187 -6.204 531 HG21 VAL 74 HG21 VAL 74 227.038 4.162 -5.376 532 HG22 VAL 74 HG22 VAL 74 227.231 5.748 -4.628 533 HG23 VAL 74 HG23 VAL 74 228.298 4.419 -4.171 534 H ASP 75 H ASP 75 229.452 7.883 -7.864 535 HA ASP 75 HA ASP 75 230.525 6.585 -10.286 536 HB2 ASP 75 HB2 ASP 75 229.060 8.775 -10.422 537 HB3 ASP 75 HB3 ASP 75 230.575 9.562 -9.958 538 H GLU 76 H GLU 76 232.585 6.024 -10.116 539 HA GLU 76 HA GLU 76 234.372 7.682 -8.463 540 HB2 GLU 76 HB2 GLU 76 235.595 5.372 -8.123 541 HB3 GLU 76 HB3 GLU 76 234.253 5.846 -7.092 542 HG2 GLU 76 HG2 GLU 76 233.513 4.350 -9.515 543 HG3 GLU 76 HG3 GLU 76 234.459 3.460 -8.324 544 H LYS 77 H LYS 77 236.705 7.386 -8.992 545 HA LYS 77 HA LYS 77 237.019 7.201 -11.905 546 HB2 LYS 77 HB2 LYS 77 237.874 9.112 -10.040 547 HB3 LYS 77 HB3 LYS 77 239.331 8.260 -10.530 548 HG2 LYS 77 HG2 LYS 77 239.314 9.150 -12.584 549 HG3 LYS 77 HG3 LYS 77 237.563 8.998 -12.746 550 HD2 LYS 77 HD2 LYS 77 238.285 10.975 -10.757 551 HD3 LYS 77 HD3 LYS 77 239.005 11.339 -12.326 552 HE2 LYS 77 HE2 LYS 77 236.856 11.292 -13.390 553 HE3 LYS 77 HE3 LYS 77 236.087 10.706 -11.915 554 HZ1 LYS 77 HZ1 LYS 77 237.530 13.271 -11.874 555 HZ2 LYS 77 HZ2 LYS 77 236.233 12.756 -10.918 556 HZ3 LYS 77 HZ3 LYS 77 235.970 13.206 -12.527 557 H ALA 78 H ALA 78 239.371 6.600 -12.538 558 HA ALA 78 HA ALA 78 239.757 3.879 -11.846 559 HB1 ALA 78 HB1 ALA 78 240.507 4.171 -13.956 560 HB2 ALA 78 HB2 ALA 78 242.038 4.480 -13.139 561 HB3 ALA 78 HB3 ALA 78 241.027 5.830 -13.657 562 H GLY 79 H GLY 79 240.821 3.017 -10.194 563 HA2 GLY 79 HA2 GLY 79 243.099 3.003 -9.109 564 HA3 GLY 79 HA3 GLY 79 242.781 4.705 -8.769 565 H ALA 80 H ALA 80 243.310 2.441 -6.953 566 HA ALA 80 HA ALA 80 241.049 1.516 -5.633 567 HB1 ALA 80 HB1 ALA 80 242.447 0.752 -3.997 568 HB2 ALA 80 HB2 ALA 80 243.433 2.213 -3.999 569 HB3 ALA 80 HB3 ALA 80 243.616 1.024 -5.289 570 H PHE 81 H PHE 81 239.601 2.357 -4.272 571 HA PHE 81 HA PHE 81 240.161 4.904 -2.942 572 HB2 PHE 81 HB2 PHE 81 237.976 5.825 -3.626 573 HB3 PHE 81 HB3 PHE 81 239.027 5.542 -5.009 574 HD1 PHE 81 HD1 PHE 81 238.407 4.051 -6.734 575 HD2 PHE 81 HD2 PHE 81 236.096 4.262 -3.166 576 HE1 PHE 81 HE1 PHE 81 236.647 2.708 -7.800 577 HE2 PHE 81 HE2 PHE 81 234.330 2.918 -4.229 578 HZ PHE 81 HZ PHE 81 234.606 2.138 -6.547 579 H ARG 82 H ARG 82 238.996 5.263 -1.073 580 HA ARG 82 HA ARG 82 237.630 2.890 0.011 581 HB2 ARG 82 HB2 ARG 82 239.343 5.010 1.188 582 HB3 ARG 82 HB3 ARG 82 238.020 4.430 2.188 583 HG2 ARG 82 HG2 ARG 82 238.916 2.338 2.411 584 HG3 ARG 82 HG3 ARG 82 239.795 2.436 0.879 585 HD2 ARG 82 HD2 ARG 82 241.395 2.520 2.645 586 HD3 ARG 82 HD3 ARG 82 241.292 4.130 1.937 587 HE ARG 82 HE ARG 82 240.295 3.306 4.569 588 HH11 ARG 82 HH11 ARG 82 240.811 5.860 2.230 589 HH12 ARG 82 HH12 ARG 82 240.560 7.128 3.379 590 HH21 ARG 82 HH21 ARG 82 239.965 4.980 6.077 591 HH22 ARG 82 HH22 ARG 82 240.085 6.631 5.564 592 H MET 83 H MET 83 235.681 3.212 1.284 593 HA MET 83 HA MET 83 234.394 5.799 1.129 594 HB2 MET 83 HB2 MET 83 232.335 4.777 0.038 595 HB3 MET 83 HB3 MET 83 233.717 5.076 -1.004 596 HG2 MET 83 HG2 MET 83 232.934 2.981 -1.643 597 HG3 MET 83 HG3 MET 83 234.332 2.639 -0.625 598 HE1 MET 83 HE1 MET 83 229.958 2.221 0.791 599 HE2 MET 83 HE2 MET 83 230.397 2.606 -0.873 600 HE3 MET 83 HE3 MET 83 230.720 3.766 0.415 601 H GLN 84 H GLN 84 232.272 5.843 2.199 602 HA GLN 84 HA GLN 84 231.568 3.663 3.951 603 HB2 GLN 84 HB2 GLN 84 233.514 5.109 4.995 604 HB3 GLN 84 HB3 GLN 84 232.203 6.220 5.366 605 HG2 GLN 84 HG2 GLN 84 231.180 3.841 6.229 606 HG3 GLN 84 HG3 GLN 84 232.906 3.655 6.580 607 HE21 GLN 84 HE21 GLN 84 230.620 6.386 6.716 608 HE22 GLN 84 HE22 GLN 84 230.980 6.814 8.359 609 H TYR 85 H TYR 85 229.571 4.067 5.116 610 HA TYR 85 HA TYR 85 227.958 6.200 3.867 611 HB2 TYR 85 HB2 TYR 85 227.448 3.350 4.375 612 HB3 TYR 85 HB3 TYR 85 226.125 4.410 4.846 613 HD1 TYR 85 HD1 TYR 85 224.848 5.609 3.189 614 HD2 TYR 85 HD2 TYR 85 228.136 3.171 2.033 615 HE1 TYR 85 HE1 TYR 85 224.096 5.717 0.851 616 HE2 TYR 85 HE2 TYR 85 227.396 3.273 -0.310 617 HH TYR 85 HH TYR 85 225.732 5.278 -1.631 618 H ALA 86 H ALA 86 226.545 7.394 5.112 619 HA ALA 86 HA ALA 86 226.124 6.916 7.896 620 HB1 ALA 86 HB1 ALA 86 227.289 8.862 8.783 621 HB2 ALA 86 HB2 ALA 86 227.930 9.225 7.181 622 HB3 ALA 86 HB3 ALA 86 228.423 7.752 8.014 623 H SER 87 H SER 87 224.153 7.673 8.313 624 HA SER 87 HA SER 87 222.802 9.396 6.474 625 HB2 SER 87 HB2 SER 87 222.087 7.832 8.865 626 HB3 SER 87 HB3 SER 87 221.166 9.334 8.675 627 HG SER 87 HG SER 87 220.661 8.620 6.534 628 H LYS 88 H LYS 88 222.031 11.490 6.794 629 HA LYS 88 HA LYS 88 223.760 13.276 8.093 630 HB2 LYS 88 HB2 LYS 88 221.118 13.492 6.741 631 HB3 LYS 88 HB3 LYS 88 221.598 14.823 7.784 632 HG2 LYS 88 HG2 LYS 88 223.822 14.722 6.427 633 HG3 LYS 88 HG3 LYS 88 222.832 13.870 5.240 634 HD2 LYS 88 HD2 LYS 88 221.214 15.802 5.377 635 HD3 LYS 88 HD3 LYS 88 222.435 16.656 6.322 636 HE2 LYS 88 HE2 LYS 88 223.937 15.901 4.232 637 HE3 LYS 88 HE3 LYS 88 222.367 16.009 3.436 638 HZ1 LYS 88 HZ1 LYS 88 222.184 18.289 4.408 639 HZ2 LYS 88 HZ2 LYS 88 223.406 18.114 3.251 640 HZ3 LYS 88 HZ3 LYS 88 223.800 18.159 4.894 641 H ASP 89 H ASP 89 220.861 11.660 9.214 642 HA ASP 89 HA ASP 89 220.821 13.265 11.666 643 HB2 ASP 89 HB2 ASP 89 218.874 11.211 10.581 644 HB3 ASP 89 HB3 ASP 89 218.676 12.064 12.118 645 H TRP 90 H TRP 90 222.943 11.248 11.099 646 HA TRP 90 HA TRP 90 224.082 9.569 12.121 647 HB2 TRP 90 HB2 TRP 90 222.805 11.121 14.248 648 HB3 TRP 90 HB3 TRP 90 223.189 9.476 14.736 649 HD1 TRP 90 HD1 TRP 90 225.005 12.498 13.115 650 HE1 TRP 90 HE1 TRP 90 227.444 12.487 13.933 651 HE3 TRP 90 HE3 TRP 90 224.920 8.201 15.885 652 HZ2 TRP 90 HZ2 TRP 90 229.113 10.877 15.537 653 HZ3 TRP 90 HZ3 TRP 90 226.980 7.497 17.031 654 HH2 TRP 90 HH2 TRP 90 229.034 8.809 16.859 655 H SER 91 H SER 91 221.782 8.758 10.732 656 HA SER 91 HA SER 91 220.410 6.775 12.347 657 HB2 SER 91 HB2 SER 91 219.827 8.204 9.970 658 HB3 SER 91 HB3 SER 91 219.872 6.495 9.538 659 HG SER 91 HG SER 91 218.355 7.641 11.649 660 HA PRO 92 HA PRO 92 222.315 2.891 11.336 661 HB2 PRO 92 HB2 PRO 92 220.485 2.531 8.987 662 HB3 PRO 92 HB3 PRO 92 220.953 1.366 10.243 663 HG2 PRO 92 HG2 PRO 92 218.591 2.590 10.347 664 HG3 PRO 92 HG3 PRO 92 219.531 2.303 11.823 665 HD2 PRO 92 HD2 PRO 92 219.054 4.834 10.341 666 HD3 PRO 92 HD3 PRO 92 219.348 4.574 12.076 667 H GLN 93 H GLN 93 224.305 2.989 10.544 668 HA GLN 93 HA GLN 93 224.748 4.045 7.837 669 HB2 GLN 93 HB2 GLN 93 226.829 3.573 9.967 670 HB3 GLN 93 HB3 GLN 93 226.986 4.540 8.512 671 HG2 GLN 93 HG2 GLN 93 225.216 6.057 9.456 672 HG3 GLN 93 HG3 GLN 93 225.370 5.159 10.967 673 HE21 GLN 93 HE21 GLN 93 225.846 7.603 11.413 674 HE22 GLN 93 HE22 GLN 93 227.534 8.008 11.451 675 H PHE 94 H PHE 94 227.080 3.024 7.075 676 HA PHE 94 HA PHE 94 226.783 0.099 7.216 677 HB2 PHE 94 HB2 PHE 94 226.155 0.153 5.059 678 HB3 PHE 94 HB3 PHE 94 226.601 1.842 4.888 679 HD1 PHE 94 HD1 PHE 94 229.005 2.407 4.359 680 HD2 PHE 94 HD2 PHE 94 227.474 -1.556 4.144 681 HE1 PHE 94 HE1 PHE 94 230.901 1.760 2.936 682 HE2 PHE 94 HE2 PHE 94 229.371 -2.211 2.721 683 HZ PHE 94 HZ PHE 94 231.086 -0.554 2.114 684 H THR 95 H THR 95 228.591 -1.026 7.579 685 HA THR 95 HA THR 95 231.205 -0.031 6.932 686 HB THR 95 HB THR 95 231.672 -0.529 9.603 687 HG1 THR 95 HG1 THR 95 229.435 -0.441 10.062 688 HG21 THR 95 HG21 THR 95 231.538 1.880 7.933 689 HG22 THR 95 HG22 THR 95 232.818 1.295 8.997 690 HG23 THR 95 HG23 THR 95 231.431 2.148 9.673 691 H ALA 96 H ALA 96 232.053 -1.803 6.077 692 HA ALA 96 HA ALA 96 231.352 -4.425 7.145 693 HB1 ALA 96 HB1 ALA 96 233.190 -4.098 4.825 694 HB2 ALA 96 HB2 ALA 96 231.483 -3.699 4.621 695 HB3 ALA 96 HB3 ALA 96 231.955 -5.320 5.128 696 H ASP 97 H ASP 97 232.480 -4.813 8.959 697 HA ASP 97 HA ASP 97 235.068 -3.969 9.563 698 HB2 ASP 97 HB2 ASP 97 233.053 -5.337 10.882 699 HB3 ASP 97 HB3 ASP 97 234.362 -6.524 10.787 700 H GLY 98 H GLY 98 236.797 -4.395 8.367 701 HA2 GLY 98 HA2 GLY 98 238.426 -5.530 7.210 702 HA3 GLY 98 HA3 GLY 98 238.046 -6.874 8.293 703 H LEU 99 H LEU 99 237.067 -5.320 5.243 704 HA LEU 99 HA LEU 99 236.395 -7.989 4.223 705 HB2 LEU 99 HB2 LEU 99 234.301 -7.038 4.906 706 HB3 LEU 99 HB3 LEU 99 234.649 -5.543 4.061 707 HG LEU 99 HG LEU 99 234.746 -7.190 1.968 708 HD11 LEU 99 HD11 LEU 99 232.940 -8.562 3.946 709 HD12 LEU 99 HD12 LEU 99 234.354 -9.232 3.134 710 HD13 LEU 99 HD13 LEU 99 232.904 -8.851 2.207 711 HD21 LEU 99 HD21 LEU 99 232.824 -6.186 1.325 712 HD22 LEU 99 HD22 LEU 99 233.135 -5.210 2.759 713 HD23 LEU 99 HD23 LEU 99 231.994 -6.552 2.838 714 H GLU 100 H GLU 100 237.256 -4.644 3.451 715 HA GLU 100 HA GLU 100 237.999 -3.643 1.557 716 HB2 GLU 100 HB2 GLU 100 239.808 -4.928 0.347 717 HB3 GLU 100 HB3 GLU 100 240.059 -4.699 2.065 718 HG2 GLU 100 HG2 GLU 100 239.398 -6.957 2.489 719 HG3 GLU 100 HG3 GLU 100 239.027 -7.190 0.784 720 H LEU 101 H LEU 101 235.930 -3.579 0.659 721 HA LEU 101 HA LEU 101 234.625 -5.417 -0.888 722 HB2 LEU 101 HB2 LEU 101 233.669 -3.264 -0.281 723 HB3 LEU 101 HB3 LEU 101 234.793 -2.440 -1.360 724 HG LEU 101 HG LEU 101 233.505 -4.237 -3.029 725 HD11 LEU 101 HD11 LEU 101 231.815 -3.721 -0.743 726 HD12 LEU 101 HD12 LEU 101 231.570 -4.820 -2.102 727 HD13 LEU 101 HD13 LEU 101 231.084 -3.129 -2.234 728 HD21 LEU 101 HD21 LEU 101 232.141 -1.976 -3.491 729 HD22 LEU 101 HD22 LEU 101 233.814 -2.217 -3.994 730 HD23 LEU 101 HD23 LEU 101 233.457 -1.332 -2.511 731 H THR 102 H THR 102 234.637 -6.137 -2.932 732 HA THR 102 HA THR 102 236.773 -5.196 -4.728 733 HB THR 102 HB THR 102 235.938 -8.086 -4.408 734 HG1 THR 102 HG1 THR 102 237.126 -7.976 -2.680 735 HG21 THR 102 HG21 THR 102 236.905 -7.622 -6.584 736 HG22 THR 102 HG22 THR 102 238.001 -8.592 -5.600 737 HG23 THR 102 HG23 THR 102 238.301 -6.868 -5.815 738 HA PRO 103 HA PRO 103 233.651 -4.527 -7.792 739 HB2 PRO 103 HB2 PRO 103 235.658 -5.749 -9.638 740 HB3 PRO 103 HB3 PRO 103 234.771 -4.228 -9.788 741 HG2 PRO 103 HG2 PRO 103 237.324 -4.216 -9.064 742 HG3 PRO 103 HG3 PRO 103 236.160 -3.115 -8.288 743 HD2 PRO 103 HD2 PRO 103 237.375 -5.641 -7.251 744 HD3 PRO 103 HD3 PRO 103 236.975 -4.141 -6.387 745 H GLY 104 H GLY 104 231.906 -5.720 -8.214 746 HA2 GLY 104 HA2 GLY 104 230.548 -7.507 -8.681 747 HA3 GLY 104 HA3 GLY 104 231.898 -8.151 -9.619 748 H LYS 105 H LYS 105 231.965 -7.495 -6.152 749 HA LYS 105 HA LYS 105 232.008 -10.396 -5.641 750 HB2 LYS 105 HB2 LYS 105 234.285 -9.194 -5.629 751 HB3 LYS 105 HB3 LYS 105 233.732 -8.442 -4.129 752 HG2 LYS 105 HG2 LYS 105 233.413 -11.345 -4.165 753 HG3 LYS 105 HG3 LYS 105 235.086 -10.814 -4.336 754 HD2 LYS 105 HD2 LYS 105 233.710 -9.291 -2.301 755 HD3 LYS 105 HD3 LYS 105 233.619 -11.021 -1.971 756 HE2 LYS 105 HE2 LYS 105 236.248 -9.917 -2.792 757 HE3 LYS 105 HE3 LYS 105 235.667 -9.514 -1.177 758 HZ1 LYS 105 HZ1 LYS 105 235.493 -11.832 -0.653 759 HZ2 LYS 105 HZ2 LYS 105 237.050 -11.535 -1.244 760 HZ3 LYS 105 HZ3 LYS 105 235.897 -12.280 -2.233 761 H THR 106 H THR 106 231.136 -11.101 -3.719 762 HA THR 106 HA THR 106 229.070 -9.491 -2.594 763 HB THR 106 HB THR 106 230.142 -12.138 -1.589 764 HG1 THR 106 HG1 THR 106 229.105 -13.043 -3.165 765 HG21 THR 106 HG21 THR 106 227.476 -10.803 -1.187 766 HG22 THR 106 HG22 THR 106 228.690 -11.147 0.046 767 HG23 THR 106 HG23 THR 106 227.849 -12.472 -0.756 768 H ALA 107 H ALA 107 228.889 -8.589 -0.575 769 HA ALA 107 HA ALA 107 231.344 -8.471 1.058 770 HB1 ALA 107 HB1 ALA 107 231.382 -6.385 0.057 771 HB2 ALA 107 HB2 ALA 107 230.523 -6.063 1.564 772 HB3 ALA 107 HB3 ALA 107 229.625 -6.238 0.056 773 H SER 108 H SER 108 231.073 -8.197 3.276 774 HA SER 108 HA SER 108 228.493 -9.131 4.285 775 HB2 SER 108 HB2 SER 108 231.285 -9.430 5.128 776 HB3 SER 108 HB3 SER 108 230.198 -9.039 6.460 777 HG SER 108 HG SER 108 229.155 -10.898 6.183 778 H LEU 109 H LEU 109 227.243 -8.005 5.706 779 HA LEU 109 HA LEU 109 228.127 -5.267 6.352 780 HB2 LEU 109 HB2 LEU 109 226.146 -5.590 4.762 781 HB3 LEU 109 HB3 LEU 109 225.257 -6.156 6.165 782 HG LEU 109 HG LEU 109 226.426 -3.697 6.910 783 HD11 LEU 109 HD11 LEU 109 225.764 -2.145 5.267 784 HD12 LEU 109 HD12 LEU 109 224.912 -3.376 4.336 785 HD13 LEU 109 HD13 LEU 109 226.673 -3.391 4.413 786 HD21 LEU 109 HD21 LEU 109 223.647 -4.639 6.289 787 HD22 LEU 109 HD22 LEU 109 223.968 -2.985 6.811 788 HD23 LEU 109 HD23 LEU 109 224.390 -4.339 7.860 789 H LYS 110 H LYS 110 228.978 -5.576 8.361 790 HA LYS 110 HA LYS 110 227.707 -7.209 10.346 791 HB2 LYS 110 HB2 LYS 110 230.079 -5.358 10.353 792 HB3 LYS 110 HB3 LYS 110 229.462 -6.035 11.855 793 HG2 LYS 110 HG2 LYS 110 229.884 -8.015 9.740 794 HG3 LYS 110 HG3 LYS 110 231.350 -7.184 10.266 795 HD2 LYS 110 HD2 LYS 110 231.180 -9.065 11.666 796 HD3 LYS 110 HD3 LYS 110 230.605 -7.713 12.645 797 HE2 LYS 110 HE2 LYS 110 228.515 -9.069 11.092 798 HE3 LYS 110 HE3 LYS 110 229.290 -10.082 12.310 799 HZ1 LYS 110 HZ1 LYS 110 227.734 -9.139 13.617 800 HZ2 LYS 110 HZ2 LYS 110 227.567 -7.762 12.649 801 HZ3 LYS 110 HZ3 LYS 110 228.862 -7.882 13.729 802 H ARG 111 H ARG 111 228.615 -3.772 10.649 803 HA ARG 111 HA ARG 111 225.922 -3.106 11.552 804 HB2 ARG 111 HB2 ARG 111 228.364 -3.095 13.276 805 HB3 ARG 111 HB3 ARG 111 227.175 -1.822 13.506 806 HG2 ARG 111 HG2 ARG 111 225.623 -3.231 14.376 807 HG3 ARG 111 HG3 ARG 111 226.174 -4.608 13.422 808 HD2 ARG 111 HD2 ARG 111 227.150 -5.347 15.284 809 HD3 ARG 111 HD3 ARG 111 228.327 -4.053 15.063 810 HE ARG 111 HE ARG 111 226.206 -4.171 17.018 811 HH11 ARG 111 HH11 ARG 111 228.468 -2.106 15.330 812 HH12 ARG 111 HH12 ARG 111 228.413 -0.857 16.528 813 HH21 ARG 111 HH21 ARG 111 226.139 -2.522 18.599 814 HH22 ARG 111 HH22 ARG 111 227.096 -1.093 18.384 815 H GLY 112 H GLY 112 226.098 -0.594 12.312 816 HA2 GLY 112 HA2 GLY 112 227.706 0.822 10.278 817 HA3 GLY 112 HA3 GLY 112 225.990 1.166 10.478 818 H GLY 113 H GLY 113 228.560 2.765 10.860 819 HA2 GLY 113 HA2 GLY 113 228.040 4.750 12.421 820 HA3 GLY 113 HA3 GLY 113 228.201 3.529 13.687 821 H TYR 114 H TYR 114 230.249 2.670 14.155 822 HA TYR 114 HA TYR 114 232.519 4.083 12.919 823 HB2 TYR 114 HB2 TYR 114 231.811 4.815 15.312 824 HB3 TYR 114 HB3 TYR 114 232.534 3.294 15.822 825 HD1 TYR 114 HD1 TYR 114 233.174 6.658 14.563 826 HD2 TYR 114 HD2 TYR 114 234.956 2.933 15.597 827 HE1 TYR 114 HE1 TYR 114 235.389 7.730 14.592 828 HE2 TYR 114 HE2 TYR 114 237.173 3.994 15.626 829 HH TYR 114 HH TYR 114 237.820 6.954 14.287 830 H GLY 115 H GLY 115 233.030 2.349 11.584 831 HA2 GLY 115 HA2 GLY 115 234.223 0.048 12.987 832 HA3 GLY 115 HA3 GLY 115 233.138 -0.221 11.628 833 H GLN 116 H GLN 116 234.522 -1.083 10.155 834 HA GLN 116 HA GLN 116 236.908 0.496 9.456 835 HB2 GLN 116 HB2 GLN 116 236.315 -2.448 9.178 836 HB3 GLN 116 HB3 GLN 116 237.655 -1.674 8.341 837 HG2 GLN 116 HG2 GLN 116 238.423 -0.878 10.630 838 HG3 GLN 116 HG3 GLN 116 237.253 -2.017 11.296 839 HE21 GLN 116 HE21 GLN 116 237.485 -4.293 10.579 840 HE22 GLN 116 HE22 GLN 116 239.082 -4.904 10.324 841 H ASP 117 H ASP 117 236.886 1.546 7.579 842 HA ASP 117 HA ASP 117 234.676 1.426 5.805 843 HB2 ASP 117 HB2 ASP 117 236.204 2.835 4.290 844 HB3 ASP 117 HB3 ASP 117 235.781 3.508 5.863 845 H THR 118 H THR 118 234.592 0.735 3.624 846 HA THR 118 HA THR 118 236.250 -1.619 3.124 847 HB THR 118 HB THR 118 234.604 -2.061 1.281 848 HG1 THR 118 HG1 THR 118 233.104 0.037 2.453 849 HG21 THR 118 HG21 THR 118 232.598 -2.387 2.852 850 HG22 THR 118 HG22 THR 118 233.696 -1.833 4.115 851 HG23 THR 118 HG23 THR 118 234.089 -3.272 3.175 852 H ALA 119 H ALA 119 238.026 -1.382 1.996 853 HA ALA 119 HA ALA 119 238.280 0.811 0.080 854 HB1 ALA 119 HB1 ALA 119 240.017 0.256 1.883 855 HB2 ALA 119 HB2 ALA 119 240.600 0.552 0.247 856 HB3 ALA 119 HB3 ALA 119 240.464 -1.100 0.849 857 H VAL 120 H VAL 120 238.123 0.499 -2.054 858 HA VAL 120 HA VAL 120 238.321 -2.266 -3.061 859 HB VAL 120 HB VAL 120 236.037 -1.401 -3.223 860 HG11 VAL 120 HG11 VAL 120 235.442 0.492 -4.548 861 HG12 VAL 120 HG12 VAL 120 237.107 0.707 -5.087 862 HG13 VAL 120 HG13 VAL 120 236.680 1.004 -3.401 863 HG21 VAL 120 HG21 VAL 120 237.430 -2.695 -5.164 864 HG22 VAL 120 HG22 VAL 120 236.765 -1.330 -6.063 865 HG23 VAL 120 HG23 VAL 120 235.689 -2.420 -5.189 866 H THR 121 H THR 121 239.897 -2.664 -4.449 867 HA THR 121 HA THR 121 241.427 -0.440 -5.552 868 HB THR 121 HB THR 121 241.920 -3.381 -5.188 869 HG1 THR 121 HG1 THR 121 243.404 -1.110 -4.369 870 HG21 THR 121 HG21 THR 121 243.197 -1.657 -7.171 871 HG22 THR 121 HG22 THR 121 243.190 -3.414 -7.023 872 HG23 THR 121 HG23 THR 121 244.323 -2.454 -6.071 873 H LEU 122 H LEU 122 240.232 0.293 -7.295 874 HA LEU 122 HA LEU 122 240.023 -1.590 -9.546 875 HB2 LEU 122 HB2 LEU 122 237.795 -1.140 -8.484 876 HB3 LEU 122 HB3 LEU 122 237.992 0.550 -8.908 877 HG LEU 122 HG LEU 122 238.249 -0.327 -11.338 878 HD11 LEU 122 HD11 LEU 122 236.514 -2.563 -10.433 879 HD12 LEU 122 HD12 LEU 122 238.263 -2.748 -10.302 880 HD13 LEU 122 HD13 LEU 122 237.525 -2.424 -11.870 881 HD21 LEU 122 HD21 LEU 122 235.469 -0.761 -10.500 882 HD22 LEU 122 HD22 LEU 122 236.143 0.378 -11.666 883 HD23 LEU 122 HD23 LEU 122 236.192 0.749 -9.944 884 HA PRO 123 HA PRO 123 242.555 1.890 -11.033 885 HB2 PRO 123 HB2 PRO 123 243.357 -0.008 -13.113 886 HB3 PRO 123 HB3 PRO 123 244.345 0.799 -11.881 887 HG2 PRO 123 HG2 PRO 123 243.818 -1.854 -11.809 888 HG3 PRO 123 HG3 PRO 123 244.029 -0.883 -10.341 889 HD2 PRO 123 HD2 PRO 123 241.499 -1.822 -11.644 890 HD3 PRO 123 HD3 PRO 123 241.935 -1.790 -9.922 891 H GLU 124 H GLU 124 239.743 0.686 -12.147 892 HA GLU 124 HA GLU 124 239.888 2.094 -14.731 893 HB2 GLU 124 HB2 GLU 124 239.377 -0.345 -14.855 894 HB3 GLU 124 HB3 GLU 124 237.939 -0.060 -13.887 895 HG2 GLU 124 HG2 GLU 124 237.163 1.510 -15.691 896 HG3 GLU 124 HG3 GLU 124 238.512 0.913 -16.673 897 H ALA 125 H ALA 125 238.375 3.639 -15.220 898 HA ALA 125 HA ALA 125 236.726 4.589 -12.979 899 HB1 ALA 125 HB1 ALA 125 238.450 6.049 -14.268 900 HB2 ALA 125 HB2 ALA 125 236.880 6.728 -13.841 901 HB3 ALA 125 HB3 ALA 125 237.178 6.161 -15.483 902 H GLY 126 H GLY 126 234.530 4.847 -13.127 903 HA2 GLY 126 HA2 GLY 126 232.964 4.976 -15.407 904 HA3 GLY 126 HA3 GLY 126 233.153 3.260 -15.063 905 H GLN 127 H GLN 127 230.696 3.748 -14.993 906 HA GLN 127 HA GLN 127 229.704 4.925 -12.566 907 HB2 GLN 127 HB2 GLN 127 228.604 4.378 -15.034 908 HB3 GLN 127 HB3 GLN 127 227.858 3.164 -14.003 909 HG2 GLN 127 HG2 GLN 127 227.090 4.915 -12.485 910 HG3 GLN 127 HG3 GLN 127 227.841 6.137 -13.522 911 HE21 GLN 127 HE21 GLN 127 225.040 4.413 -12.867 912 HE22 GLN 127 HE22 GLN 127 224.156 4.806 -14.298 913 H TYR 128 H TYR 128 228.966 3.936 -10.747 914 HA TYR 128 HA TYR 128 229.281 1.012 -10.574 915 HB2 TYR 128 HB2 TYR 128 230.797 2.971 -9.225 916 HB3 TYR 128 HB3 TYR 128 229.706 2.288 -8.024 917 HD1 TYR 128 HD1 TYR 128 229.537 -0.413 -8.253 918 HD2 TYR 128 HD2 TYR 128 232.862 1.985 -9.376 919 HE1 TYR 128 HE1 TYR 128 231.010 -2.364 -8.027 920 HE2 TYR 128 HE2 TYR 128 234.348 0.041 -9.148 921 HH TYR 128 HH TYR 128 233.355 -3.025 -9.114 922 H VAL 129 H VAL 129 227.828 -0.093 -9.242 923 HA VAL 129 HA VAL 129 225.565 1.506 -8.241 924 HB VAL 129 HB VAL 129 224.082 -0.436 -8.776 925 HG11 VAL 129 HG11 VAL 129 225.413 1.278 -10.795 926 HG12 VAL 129 HG12 VAL 129 223.720 1.200 -10.308 927 HG13 VAL 129 HG13 VAL 129 224.383 -0.023 -11.391 928 HG21 VAL 129 HG21 VAL 129 225.646 -2.234 -8.946 929 HG22 VAL 129 HG22 VAL 129 226.536 -1.416 -10.227 930 HG23 VAL 129 HG23 VAL 129 224.909 -2.018 -10.534 931 H TRP 130 H TRP 130 225.242 1.317 -6.135 932 HA TRP 130 HA TRP 130 226.571 -0.822 -4.672 933 HB2 TRP 130 HB2 TRP 130 225.857 1.897 -4.109 934 HB3 TRP 130 HB3 TRP 130 225.116 0.853 -2.899 935 HD1 TRP 130 HD1 TRP 130 226.616 0.761 -0.839 936 HE1 TRP 130 HE1 TRP 130 229.147 0.608 -0.394 937 HE3 TRP 130 HE3 TRP 130 228.294 0.930 -5.661 938 HZ2 TRP 130 HZ2 TRP 130 231.543 0.573 -1.897 939 HZ3 TRP 130 HZ3 TRP 130 230.717 0.839 -6.074 940 HH2 TRP 130 HH2 TRP 130 232.307 0.664 -4.230 941 H SER 131 H SER 131 225.550 -2.655 -4.300 942 HA SER 131 HA SER 131 222.614 -2.636 -4.063 943 HB2 SER 131 HB2 SER 131 223.798 -4.024 -5.891 944 HB3 SER 131 HB3 SER 131 224.290 -5.090 -4.577 945 HG SER 131 HG SER 131 222.265 -5.627 -5.687 946 H LEU 132 H LEU 132 221.740 -3.066 -2.148 947 HA LEU 132 HA LEU 132 223.224 -4.675 -0.196 948 HB2 LEU 132 HB2 LEU 132 221.918 -2.045 0.510 949 HB3 LEU 132 HB3 LEU 132 222.821 -3.094 1.584 950 HG LEU 132 HG LEU 132 224.798 -2.634 -0.075 951 HD11 LEU 132 HD11 LEU 132 224.238 -1.295 -1.769 952 HD12 LEU 132 HD12 LEU 132 224.239 0.011 -0.586 953 HD13 LEU 132 HD13 LEU 132 222.730 -0.804 -0.996 954 HD21 LEU 132 HD21 LEU 132 224.688 -1.973 2.298 955 HD22 LEU 132 HD22 LEU 132 223.827 -0.507 1.831 956 HD23 LEU 132 HD23 LEU 132 225.488 -0.762 1.294 957 H LYS 133 H LYS 133 221.958 -6.014 1.003 958 HA LYS 133 HA LYS 133 219.045 -5.597 0.938 959 HB2 LYS 133 HB2 LYS 133 220.307 -7.521 -0.579 960 HB3 LYS 133 HB3 LYS 133 219.851 -8.419 0.873 961 HG2 LYS 133 HG2 LYS 133 217.658 -6.792 0.007 962 HG3 LYS 133 HG3 LYS 133 218.246 -7.767 -1.337 963 HD2 LYS 133 HD2 LYS 133 216.543 -9.001 -0.177 964 HD3 LYS 133 HD3 LYS 133 218.100 -9.771 0.129 965 HE2 LYS 133 HE2 LYS 133 216.922 -9.710 2.194 966 HE3 LYS 133 HE3 LYS 133 218.200 -8.497 2.286 967 HZ1 LYS 133 HZ1 LYS 133 215.413 -7.831 1.518 968 HZ2 LYS 133 HZ2 LYS 133 216.649 -6.770 1.978 969 HZ3 LYS 133 HZ3 LYS 133 215.951 -7.798 3.124 970 H PHE 134 H PHE 134 218.265 -5.511 2.929 971 HA PHE 134 HA PHE 134 219.527 -7.142 5.039 972 HB2 PHE 134 HB2 PHE 134 218.281 -4.463 5.626 973 HB3 PHE 134 HB3 PHE 134 219.406 -5.390 6.607 974 HD1 PHE 134 HD1 PHE 134 219.285 -2.423 5.229 975 HD2 PHE 134 HD2 PHE 134 221.564 -5.983 4.730 976 HE1 PHE 134 HE1 PHE 134 221.151 -1.099 4.321 977 HE2 PHE 134 HE2 PHE 134 223.430 -4.665 3.823 978 HZ PHE 134 HZ PHE 134 223.226 -2.222 3.619 979 H THR 135 H THR 135 218.161 -8.065 6.547 980 HA THR 135 HA THR 135 215.292 -7.948 5.873 981 HB THR 135 HB THR 135 215.122 -10.236 6.767 982 HG1 THR 135 HG1 THR 135 217.949 -10.170 6.953 983 HG21 THR 135 HG21 THR 135 216.318 -11.449 5.043 984 HG22 THR 135 HG22 THR 135 217.289 -10.017 4.693 985 HG23 THR 135 HG23 THR 135 215.552 -10.005 4.381 986 H ASP 136 H ASP 136 213.944 -8.841 7.830 987 HA ASP 136 HA ASP 136 214.459 -7.015 10.024 988 HB2 ASP 136 HB2 ASP 136 212.198 -7.551 10.754 989 HB3 ASP 136 HB3 ASP 136 212.197 -7.172 9.037 990 H SER 137 H SER 137 214.900 -10.362 9.359 991 HA SER 137 HA SER 137 214.647 -11.414 11.970 992 HB2 SER 137 HB2 SER 137 216.129 -12.349 9.516 993 HB3 SER 137 HB3 SER 137 216.170 -13.252 11.030 994 HG SER 137 HG SER 137 213.811 -12.533 9.617 995 H GLY 138 H GLY 138 217.217 -9.647 10.398 996 HA2 GLY 138 HA2 GLY 138 218.955 -8.553 11.531 997 HA3 GLY 138 HA3 GLY 138 218.672 -9.593 12.928 998 H ASP 139 H ASP 139 218.722 -11.921 10.844 999 HA ASP 139 HA ASP 139 221.600 -12.319 11.053 1000 HB2 ASP 139 HB2 ASP 139 219.449 -14.022 11.429 1001 HB3 ASP 139 HB3 ASP 139 220.084 -14.509 9.859 1002 HA PRO 140 HA PRO 140 220.902 -13.001 6.309 1003 HB2 PRO 140 HB2 PRO 140 218.266 -11.845 5.739 1004 HB3 PRO 140 HB3 PRO 140 218.916 -13.422 5.290 1005 HG2 PRO 140 HG2 PRO 140 216.968 -13.134 7.138 1006 HG3 PRO 140 HG3 PRO 140 218.181 -14.425 7.224 1007 HD2 PRO 140 HD2 PRO 140 218.048 -11.843 8.734 1008 HD3 PRO 140 HD3 PRO 140 218.505 -13.461 9.303 1009 H GLU 141 H GLU 141 222.376 -11.171 6.933 1010 HA GLU 141 HA GLU 141 221.494 -8.696 5.604 1011 HB2 GLU 141 HB2 GLU 141 221.736 -8.712 8.240 1012 HB3 GLU 141 HB3 GLU 141 223.446 -8.549 7.865 1013 HG2 GLU 141 HG2 GLU 141 223.200 -6.453 6.971 1014 HG3 GLU 141 HG3 GLU 141 221.499 -6.714 6.559 1015 H GLN 142 H GLN 142 222.580 -8.824 3.733 1016 HA GLN 142 HA GLN 142 225.496 -8.845 3.860 1017 HB2 GLN 142 HB2 GLN 142 223.949 -11.065 2.923 1018 HB3 GLN 142 HB3 GLN 142 224.801 -10.356 1.558 1019 HG2 GLN 142 HG2 GLN 142 226.706 -11.277 2.189 1020 HG3 GLN 142 HG3 GLN 142 226.574 -10.559 3.799 1021 HE21 GLN 142 HE21 GLN 142 227.662 -13.120 3.188 1022 HE22 GLN 142 HE22 GLN 142 226.677 -14.303 3.971 1023 H ILE 143 H ILE 143 226.515 -7.901 2.028 1024 HA ILE 143 HA ILE 143 224.699 -6.352 0.299 1025 HB ILE 143 HB ILE 143 226.447 -4.556 0.283 1026 HG12 ILE 143 HG12 ILE 143 227.521 -5.644 2.848 1027 HG13 ILE 143 HG13 ILE 143 228.146 -6.302 1.340 1028 HG21 ILE 143 HG21 ILE 143 225.218 -5.167 2.966 1029 HG22 ILE 143 HG22 ILE 143 224.402 -4.384 1.613 1030 HG23 ILE 143 HG23 ILE 143 225.760 -3.587 2.403 1031 HD11 ILE 143 HD11 ILE 143 229.118 -4.312 0.720 1032 HD12 ILE 143 HD12 ILE 143 229.340 -4.305 2.470 1033 HD13 ILE 143 HD13 ILE 143 228.048 -3.350 1.740 1034 H MET 144 H MET 144 225.704 -5.618 -1.750 1035 HA MET 144 HA MET 144 227.949 -7.255 -2.663 1036 HB2 MET 144 HB2 MET 144 225.455 -8.147 -3.168 1037 HB3 MET 144 HB3 MET 144 225.672 -7.085 -4.552 1038 HG2 MET 144 HG2 MET 144 227.909 -8.324 -4.869 1039 HG3 MET 144 HG3 MET 144 227.204 -9.538 -3.801 1040 HE1 MET 144 HE1 MET 144 227.160 -10.189 -7.911 1041 HE2 MET 144 HE2 MET 144 228.330 -9.612 -6.723 1042 HE3 MET 144 HE3 MET 144 227.370 -8.459 -7.646 1043 H VAL 145 H VAL 145 228.898 -6.503 -4.664 1044 HA VAL 145 HA VAL 145 228.135 -3.777 -5.433 1045 HB VAL 145 HB VAL 145 229.966 -3.603 -3.802 1046 HG11 VAL 145 HG11 VAL 145 232.233 -4.397 -4.465 1047 HG12 VAL 145 HG12 VAL 145 231.481 -5.303 -5.775 1048 HG13 VAL 145 HG13 VAL 145 231.092 -5.691 -4.100 1049 HG21 VAL 145 HG21 VAL 145 229.764 -2.343 -6.236 1050 HG22 VAL 145 HG22 VAL 145 231.455 -2.845 -6.185 1051 HG23 VAL 145 HG23 VAL 145 230.792 -1.844 -4.893 1052 H SER 146 H SER 146 228.215 -3.378 -7.572 1053 HA SER 146 HA SER 146 229.769 -5.118 -9.328 1054 HB2 SER 146 HB2 SER 146 226.894 -4.620 -10.045 1055 HB3 SER 146 HB3 SER 146 227.981 -5.883 -10.619 1056 HG SER 146 HG SER 146 227.874 -6.767 -8.466 1057 H LYS 147 H LYS 147 230.113 -4.257 -11.435 1058 HA LYS 147 HA LYS 147 229.678 -1.347 -11.578 1059 HB2 LYS 147 HB2 LYS 147 231.692 -1.267 -13.006 1060 HB3 LYS 147 HB3 LYS 147 232.029 -1.911 -11.395 1061 HG2 LYS 147 HG2 LYS 147 231.452 -4.156 -12.929 1062 HG3 LYS 147 HG3 LYS 147 232.404 -3.123 -13.997 1063 HD2 LYS 147 HD2 LYS 147 233.396 -3.373 -11.229 1064 HD3 LYS 147 HD3 LYS 147 233.479 -4.838 -12.210 1065 HE2 LYS 147 HE2 LYS 147 234.492 -2.202 -13.229 1066 HE3 LYS 147 HE3 LYS 147 235.496 -3.248 -12.229 1067 HZ1 LYS 147 HZ1 LYS 147 235.612 -4.845 -13.856 1068 HZ2 LYS 147 HZ2 LYS 147 235.583 -3.440 -14.797 1069 HZ3 LYS 147 HZ3 LYS 147 234.176 -4.360 -14.611 1070 H CYS 148 H CYS 148 229.321 -0.403 -13.671 1071 HA CYS 148 HA CYS 148 227.622 -2.062 -15.330 1072 HB2 CYS 148 HB2 CYS 148 228.246 0.870 -15.712 1073 HB3 CYS 148 HB3 CYS 148 226.861 -0.025 -16.324 1074 HA PRO 149 HA PRO 149 231.222 -2.701 -18.002 1075 HB2 PRO 149 HB2 PRO 149 230.102 -4.642 -19.529 1076 HB3 PRO 149 HB3 PRO 149 230.725 -4.944 -17.899 1077 HG2 PRO 149 HG2 PRO 149 227.900 -4.483 -18.792 1078 HG3 PRO 149 HG3 PRO 149 228.536 -5.692 -17.658 1079 HD2 PRO 149 HD2 PRO 149 227.356 -3.395 -16.830 1080 HD3 PRO 149 HD3 PRO 149 228.655 -4.189 -15.919 Start of MODEL 6 1 H1 THR 1 H1 THR 1 224.709 -23.456 4.727 2 H2 THR 1 H2 THR 1 223.166 -24.209 4.730 3 H3 THR 1 H3 THR 1 224.552 -25.090 4.229 4 HA THR 1 HA THR 1 225.432 -25.139 6.356 5 HB THR 1 HB THR 1 223.137 -23.572 7.478 6 HG1 THR 1 HG1 THR 1 225.488 -22.288 6.574 7 HG21 THR 1 HG21 THR 1 225.199 -24.754 8.712 8 HG22 THR 1 HG22 THR 1 224.393 -23.309 9.320 9 HG23 THR 1 HG23 THR 1 225.899 -23.164 8.413 10 HA PRO 2 HA PRO 2 222.447 -28.598 6.093 11 HB2 PRO 2 HB2 PRO 2 224.560 -29.679 7.903 12 HB3 PRO 2 HB3 PRO 2 223.771 -30.438 6.517 13 HG2 PRO 2 HG2 PRO 2 226.243 -29.495 6.301 14 HG3 PRO 2 HG3 PRO 2 225.081 -29.292 4.977 15 HD2 PRO 2 HD2 PRO 2 226.048 -27.296 6.976 16 HD3 PRO 2 HD3 PRO 2 225.641 -27.074 5.262 17 H SER 3 H SER 3 220.793 -27.687 7.300 18 HA SER 3 HA SER 3 220.479 -28.665 9.947 19 HB2 SER 3 HB2 SER 3 221.363 -25.854 9.587 20 HB3 SER 3 HB3 SER 3 220.035 -26.112 10.717 21 HG SER 3 HG SER 3 221.344 -27.541 11.865 22 H ALA 4 H ALA 4 219.381 -26.070 7.752 23 HA ALA 4 HA ALA 4 216.621 -27.002 8.204 24 HB1 ALA 4 HB1 ALA 4 216.417 -24.942 9.124 25 HB2 ALA 4 HB2 ALA 4 216.179 -24.481 7.438 26 HB3 ALA 4 HB3 ALA 4 217.758 -24.272 8.195 27 H SER 5 H SER 5 216.753 -28.414 6.430 28 HA SER 5 HA SER 5 216.382 -29.059 4.289 29 HB2 SER 5 HB2 SER 5 214.821 -26.891 4.558 30 HB3 SER 5 HB3 SER 5 215.897 -26.303 3.290 31 HG SER 5 HG SER 5 214.217 -28.578 3.250 32 H GLY 6 H GLY 6 218.257 -29.759 3.461 33 HA2 GLY 6 HA2 GLY 6 220.294 -27.833 2.630 34 HA3 GLY 6 HA3 GLY 6 220.493 -29.574 2.736 35 H LEU 7 H LEU 7 217.999 -27.684 1.047 36 HA LEU 7 HA LEU 7 218.997 -28.774 -1.502 37 HB2 LEU 7 HB2 LEU 7 216.291 -28.892 -0.310 38 HB3 LEU 7 HB3 LEU 7 216.360 -28.490 -2.014 39 HG LEU 7 HG LEU 7 217.996 -30.814 -1.272 40 HD11 LEU 7 HD11 LEU 7 215.952 -30.950 0.235 41 HD12 LEU 7 HD12 LEU 7 216.263 -32.329 -0.819 42 HD13 LEU 7 HD13 LEU 7 215.013 -31.160 -1.242 43 HD21 LEU 7 HD21 LEU 7 217.828 -30.671 -3.528 44 HD22 LEU 7 HD22 LEU 7 216.246 -29.894 -3.476 45 HD23 LEU 7 HD23 LEU 7 216.381 -31.636 -3.238 46 H THR 8 H THR 8 218.711 -27.468 -3.346 47 HA THR 8 HA THR 8 218.220 -24.630 -2.734 48 HB THR 8 HB THR 8 219.733 -25.570 -5.151 49 HG1 THR 8 HG1 THR 8 221.420 -26.058 -4.008 50 HG21 THR 8 HG21 THR 8 221.031 -23.437 -4.550 51 HG22 THR 8 HG22 THR 8 219.634 -23.054 -3.544 52 HG23 THR 8 HG23 THR 8 219.434 -23.282 -5.282 53 H LYS 9 H LYS 9 215.973 -24.747 -3.074 54 HA LYS 9 HA LYS 9 214.965 -25.614 -5.651 55 HB2 LYS 9 HB2 LYS 9 213.845 -25.054 -3.023 56 HB3 LYS 9 HB3 LYS 9 212.885 -24.336 -4.308 57 HG2 LYS 9 HG2 LYS 9 211.888 -26.341 -4.354 58 HG3 LYS 9 HG3 LYS 9 213.292 -26.815 -5.313 59 HD2 LYS 9 HD2 LYS 9 214.254 -27.171 -2.806 60 HD3 LYS 9 HD3 LYS 9 212.545 -27.534 -2.553 61 HE2 LYS 9 HE2 LYS 9 214.137 -28.767 -4.786 62 HE3 LYS 9 HE3 LYS 9 214.070 -29.480 -3.175 63 HZ1 LYS 9 HZ1 LYS 9 212.322 -30.552 -4.084 64 HZ2 LYS 9 HZ2 LYS 9 212.016 -29.350 -5.233 65 HZ3 LYS 9 HZ3 LYS 9 211.484 -29.150 -3.639 66 H VAL 10 H VAL 10 214.874 -24.336 -7.370 67 HA VAL 10 HA VAL 10 214.344 -21.476 -7.021 68 HB VAL 10 HB VAL 10 216.054 -20.945 -8.778 69 HG11 VAL 10 HG11 VAL 10 217.620 -22.111 -6.562 70 HG12 VAL 10 HG12 VAL 10 216.315 -21.014 -6.109 71 HG13 VAL 10 HG13 VAL 10 217.594 -20.465 -7.194 72 HG21 VAL 10 HG21 VAL 10 216.735 -22.786 -9.907 73 HG22 VAL 10 HG22 VAL 10 216.522 -23.852 -8.520 74 HG23 VAL 10 HG23 VAL 10 217.957 -22.834 -8.638 75 H ALA 11 H ALA 11 213.438 -20.438 -8.860 76 HA ALA 11 HA ALA 11 211.796 -22.177 -10.461 77 HB1 ALA 11 HB1 ALA 11 210.967 -19.997 -11.429 78 HB2 ALA 11 HB2 ALA 11 212.059 -19.183 -10.309 79 HB3 ALA 11 HB3 ALA 11 210.755 -20.195 -9.689 80 H THR 12 H THR 12 212.406 -23.068 -12.313 81 HA THR 12 HA THR 12 214.677 -21.976 -13.773 82 HB THR 12 HB THR 12 214.572 -24.400 -13.245 83 HG1 THR 12 HG1 THR 12 214.503 -23.801 -16.017 84 HG21 THR 12 HG21 THR 12 212.387 -24.568 -15.302 85 HG22 THR 12 HG22 THR 12 212.133 -24.716 -13.563 86 HG23 THR 12 HG23 THR 12 213.133 -25.896 -14.412 87 H VAL 13 H VAL 13 214.479 -20.747 -15.503 88 HA VAL 13 HA VAL 13 213.678 -19.723 -17.364 89 HB VAL 13 HB VAL 13 211.556 -21.868 -17.497 90 HG11 VAL 13 HG11 VAL 13 212.119 -21.252 -20.045 91 HG12 VAL 13 HG12 VAL 13 212.457 -19.697 -19.286 92 HG13 VAL 13 HG13 VAL 13 210.866 -20.438 -19.109 93 HG21 VAL 13 HG21 VAL 13 213.306 -23.273 -17.688 94 HG22 VAL 13 HG22 VAL 13 214.444 -21.972 -18.037 95 HG23 VAL 13 HG23 VAL 13 213.417 -22.614 -19.319 96 H SER 14 H SER 14 212.491 -17.931 -17.559 97 HA SER 14 HA SER 14 210.499 -17.341 -15.563 98 HB2 SER 14 HB2 SER 14 210.448 -15.095 -16.617 99 HB3 SER 14 HB3 SER 14 212.087 -15.605 -16.213 100 HG SER 14 HG SER 14 212.574 -15.738 -18.284 101 H ALA 15 H ALA 15 210.525 -18.266 -18.929 102 HA ALA 15 HA ALA 15 208.876 -18.858 -20.371 103 HB1 ALA 15 HB1 ALA 15 206.491 -19.006 -19.122 104 HB2 ALA 15 HB2 ALA 15 207.574 -19.128 -17.737 105 HB3 ALA 15 HB3 ALA 15 207.707 -20.281 -19.064 106 H ALA 16 H ALA 16 208.986 -17.009 -21.598 107 HA ALA 16 HA ALA 16 206.620 -15.439 -21.727 108 HB1 ALA 16 HB1 ALA 16 208.967 -14.297 -20.335 109 HB2 ALA 16 HB2 ALA 16 207.249 -13.946 -20.143 110 HB3 ALA 16 HB3 ALA 16 208.146 -13.249 -21.492 111 H SER 17 H SER 17 206.340 -14.653 -23.757 112 HA SER 17 HA SER 17 208.582 -14.988 -25.626 113 HB2 SER 17 HB2 SER 17 206.745 -14.866 -27.384 114 HB3 SER 17 HB3 SER 17 206.706 -16.279 -26.330 115 HG SER 17 HG SER 17 204.919 -15.561 -25.401 116 H SER 18 H SER 18 209.695 -13.091 -25.543 117 HA SER 18 HA SER 18 208.183 -10.651 -26.216 118 HB2 SER 18 HB2 SER 18 210.699 -10.826 -24.538 119 HB3 SER 18 HB3 SER 18 209.811 -9.353 -24.930 120 HG SER 18 HG SER 18 209.280 -10.181 -22.853 121 H LEU 19 H LEU 19 208.757 -9.625 -28.020 122 HA LEU 19 HA LEU 19 211.069 -10.605 -29.505 123 HB2 LEU 19 HB2 LEU 19 208.740 -8.852 -30.272 124 HB3 LEU 19 HB3 LEU 19 210.102 -9.131 -31.337 125 HG LEU 19 HG LEU 19 208.244 -10.570 -31.945 126 HD11 LEU 19 HD11 LEU 19 210.474 -12.140 -30.660 127 HD12 LEU 19 HD12 LEU 19 210.513 -11.417 -32.269 128 HD13 LEU 19 HD13 LEU 19 209.379 -12.721 -31.913 129 HD21 LEU 19 HD21 LEU 19 207.288 -10.645 -29.610 130 HD22 LEU 19 HD22 LEU 19 208.483 -11.891 -29.253 131 HD23 LEU 19 HD23 LEU 19 207.267 -12.167 -30.500 132 H ILE 20 H ILE 20 209.955 -7.728 -27.844 133 HA ILE 20 HA ILE 20 211.921 -5.963 -28.933 134 HB ILE 20 HB ILE 20 209.813 -5.123 -27.992 135 HG12 ILE 20 HG12 ILE 20 212.376 -4.162 -26.730 136 HG13 ILE 20 HG13 ILE 20 211.539 -3.519 -28.149 137 HG21 ILE 20 HG21 ILE 20 210.704 -5.361 -25.197 138 HG22 ILE 20 HG22 ILE 20 210.174 -6.858 -25.960 139 HG23 ILE 20 HG23 ILE 20 209.086 -5.472 -25.889 140 HD11 ILE 20 HD11 ILE 20 210.629 -2.012 -26.811 141 HD12 ILE 20 HD12 ILE 20 211.245 -2.828 -25.375 142 HD13 ILE 20 HD13 ILE 20 209.699 -3.315 -26.070 143 H GLY 21 H GLY 21 213.920 -5.419 -28.189 144 HA2 GLY 21 HA2 GLY 21 214.851 -6.747 -25.718 145 HA3 GLY 21 HA3 GLY 21 215.820 -6.764 -27.195 146 H GLU 22 H GLU 22 216.240 -5.631 -24.421 147 HA GLU 22 HA GLU 22 217.241 -3.037 -25.317 148 HB2 GLU 22 HB2 GLU 22 215.021 -3.399 -23.507 149 HB3 GLU 22 HB3 GLU 22 216.343 -2.564 -22.707 150 HG2 GLU 22 HG2 GLU 22 216.368 -0.918 -24.473 151 HG3 GLU 22 HG3 GLU 22 215.046 -1.760 -25.273 152 H GLY 23 H GLY 23 219.167 -2.459 -24.423 153 HA2 GLY 23 HA2 GLY 23 220.429 -4.453 -22.681 154 HA3 GLY 23 HA3 GLY 23 221.266 -3.221 -23.632 155 H PHE 24 H PHE 24 218.503 -2.575 -21.531 156 HA PHE 24 HA PHE 24 219.796 -0.452 -20.202 157 HB2 PHE 24 HB2 PHE 24 217.263 -0.930 -20.493 158 HB3 PHE 24 HB3 PHE 24 217.442 -1.919 -19.036 159 HD1 PHE 24 HD1 PHE 24 217.047 -0.920 -17.006 160 HD2 PHE 24 HD2 PHE 24 218.296 1.501 -20.278 161 HE1 PHE 24 HE1 PHE 24 216.798 1.091 -15.610 162 HE2 PHE 24 HE2 PHE 24 218.049 3.515 -18.885 163 HZ PHE 24 HZ PHE 24 217.300 3.311 -16.549 164 H MET 25 H MET 25 219.401 -3.857 -19.409 165 HA MET 25 HA MET 25 220.211 -3.760 -16.713 166 HB2 MET 25 HB2 MET 25 220.605 -6.034 -18.669 167 HB3 MET 25 HB3 MET 25 220.614 -6.153 -16.917 168 HG2 MET 25 HG2 MET 25 218.340 -5.969 -16.751 169 HG3 MET 25 HG3 MET 25 218.192 -5.061 -18.254 170 HE1 MET 25 HE1 MET 25 217.002 -7.242 -20.664 171 HE2 MET 25 HE2 MET 25 218.723 -6.963 -20.934 172 HE3 MET 25 HE3 MET 25 217.726 -5.698 -20.214 173 H ALA 26 H ALA 26 222.021 -3.618 -19.681 174 HA ALA 26 HA ALA 26 224.548 -4.411 -18.674 175 HB1 ALA 26 HB1 ALA 26 225.318 -4.021 -20.762 176 HB2 ALA 26 HB2 ALA 26 224.479 -2.476 -20.903 177 HB3 ALA 26 HB3 ALA 26 223.596 -3.983 -21.146 178 H GLN 27 H GLN 27 222.731 -1.534 -18.233 179 HA GLN 27 HA GLN 27 225.025 0.158 -17.745 180 HB2 GLN 27 HB2 GLN 27 222.886 0.971 -18.773 181 HB3 GLN 27 HB3 GLN 27 222.098 0.714 -17.224 182 HG2 GLN 27 HG2 GLN 27 222.758 3.062 -17.694 183 HG3 GLN 27 HG3 GLN 27 223.389 2.405 -16.189 184 HE21 GLN 27 HE21 GLN 27 225.603 1.899 -16.045 185 HE22 GLN 27 HE22 GLN 27 226.760 2.598 -17.136 186 H CYS 28 H CYS 28 224.051 -2.328 -16.015 187 HA CYS 28 HA CYS 28 224.239 -2.970 -13.854 188 HB2 CYS 28 HB2 CYS 28 225.437 -0.244 -13.336 189 HB3 CYS 28 HB3 CYS 28 225.635 -1.695 -12.363 190 H ASP 29 H ASP 29 221.901 -1.334 -14.866 191 HA ASP 29 HA ASP 29 220.932 -0.134 -12.384 192 HB2 ASP 29 HB2 ASP 29 220.135 0.051 -15.262 193 HB3 ASP 29 HB3 ASP 29 218.910 0.356 -14.022 194 H ASN 30 H ASN 30 220.508 -1.932 -11.142 195 HA ASN 30 HA ASN 30 218.780 -4.033 -12.171 196 HB2 ASN 30 HB2 ASN 30 219.559 -3.905 -9.288 197 HB3 ASN 30 HB3 ASN 30 219.401 -5.304 -10.343 198 HD21 ASN 30 HD21 ASN 30 221.501 -2.956 -9.033 199 HD22 ASN 30 HD22 ASN 30 222.956 -3.490 -9.819 200 HA PRO 31 HA PRO 31 215.314 -1.795 -10.387 201 HB2 PRO 31 HB2 PRO 31 213.494 -3.382 -11.849 202 HB3 PRO 31 HB3 PRO 31 214.058 -1.746 -12.215 203 HG2 PRO 31 HG2 PRO 31 214.603 -4.035 -13.721 204 HG3 PRO 31 HG3 PRO 31 215.443 -2.480 -13.835 205 HD2 PRO 31 HD2 PRO 31 216.258 -4.977 -12.421 206 HD3 PRO 31 HD3 PRO 31 217.263 -3.759 -13.237 207 H THR 32 H THR 32 215.369 -2.533 -8.359 208 HA THR 32 HA THR 32 214.056 -5.110 -7.812 209 HB THR 32 HB THR 32 215.505 -4.185 -5.522 210 HG1 THR 32 HG1 THR 32 216.945 -3.113 -6.771 211 HG21 THR 32 HG21 THR 32 214.948 -6.590 -6.618 212 HG22 THR 32 HG22 THR 32 216.142 -6.317 -5.350 213 HG23 THR 32 HG23 THR 32 216.651 -6.412 -7.036 214 H ILE 33 H ILE 33 211.957 -4.441 -7.556 215 HA ILE 33 HA ILE 33 211.511 -2.686 -5.248 216 HB ILE 33 HB ILE 33 209.478 -1.770 -6.525 217 HG12 ILE 33 HG12 ILE 33 210.811 -1.833 -9.074 218 HG13 ILE 33 HG13 ILE 33 210.536 -3.481 -8.522 219 HG21 ILE 33 HG21 ILE 33 210.887 -0.006 -7.589 220 HG22 ILE 33 HG22 ILE 33 212.303 -0.987 -7.215 221 HG23 ILE 33 HG23 ILE 33 211.299 -0.354 -5.910 222 HD11 ILE 33 HD11 ILE 33 208.129 -2.641 -8.054 223 HD12 ILE 33 HD12 ILE 33 208.622 -3.034 -9.702 224 HD13 ILE 33 HD13 ILE 33 208.561 -1.352 -9.176 225 H GLU 34 H GLU 34 210.756 -4.118 -3.857 226 HA GLU 34 HA GLU 34 208.151 -5.302 -4.380 227 HB2 GLU 34 HB2 GLU 34 210.543 -6.911 -3.449 228 HB3 GLU 34 HB3 GLU 34 208.881 -7.477 -3.372 229 HG2 GLU 34 HG2 GLU 34 208.882 -6.974 -5.925 230 HG3 GLU 34 HG3 GLU 34 210.634 -7.057 -5.749 231 H GLY 35 H GLY 35 207.056 -4.231 -2.789 232 HA2 GLY 35 HA2 GLY 35 206.453 -4.238 -0.455 233 HA3 GLY 35 HA3 GLY 35 208.152 -4.476 -0.057 234 H ASP 36 H ASP 36 208.346 -2.742 1.290 235 HA ASP 36 HA ASP 36 208.323 -0.127 -0.033 236 HB2 ASP 36 HB2 ASP 36 206.878 -0.894 2.482 237 HB3 ASP 36 HB3 ASP 36 207.498 0.753 2.295 238 H GLY 37 H GLY 37 210.426 0.391 -0.044 239 HA2 GLY 37 HA2 GLY 37 212.248 -0.472 1.991 240 HA3 GLY 37 HA3 GLY 37 212.604 0.652 0.691 241 HA PRO 38 HA PRO 38 212.486 3.054 4.669 242 HB2 PRO 38 HB2 PRO 38 214.861 4.312 4.376 243 HB3 PRO 38 HB3 PRO 38 214.723 2.686 5.073 244 HG2 PRO 38 HG2 PRO 38 215.508 3.506 2.303 245 HG3 PRO 38 HG3 PRO 38 216.199 2.244 3.339 246 HD2 PRO 38 HD2 PRO 38 214.431 1.742 1.316 247 HD3 PRO 38 HD3 PRO 38 214.598 0.714 2.751 248 H ILE 39 H ILE 39 210.936 4.540 4.185 249 HA ILE 39 HA ILE 39 211.345 6.426 2.003 250 HB ILE 39 HB ILE 39 209.007 6.360 3.907 251 HG12 ILE 39 HG12 ILE 39 209.034 5.105 1.167 252 HG13 ILE 39 HG13 ILE 39 209.449 4.179 2.606 253 HG21 ILE 39 HG21 ILE 39 209.102 8.409 2.746 254 HG22 ILE 39 HG22 ILE 39 207.892 7.438 1.908 255 HG23 ILE 39 HG23 ILE 39 209.509 7.619 1.223 256 HD11 ILE 39 HD11 ILE 39 207.115 3.884 1.929 257 HD12 ILE 39 HD12 ILE 39 206.840 5.610 2.160 258 HD13 ILE 39 HD13 ILE 39 207.258 4.592 3.537 259 H GLY 40 H GLY 40 211.209 8.702 2.269 260 HA2 GLY 40 HA2 GLY 40 211.777 10.700 3.227 261 HA3 GLY 40 HA3 GLY 40 211.083 10.061 4.707 262 H LYS 41 H LYS 41 213.698 8.278 3.335 263 HA LYS 41 HA LYS 41 215.576 9.559 5.209 264 HB2 LYS 41 HB2 LYS 41 214.813 6.682 4.989 265 HB3 LYS 41 HB3 LYS 41 216.470 7.082 5.420 266 HG2 LYS 41 HG2 LYS 41 215.655 8.396 7.318 267 HG3 LYS 41 HG3 LYS 41 213.997 7.967 6.892 268 HD2 LYS 41 HD2 LYS 41 216.020 5.812 7.331 269 HD3 LYS 41 HD3 LYS 41 215.278 6.611 8.719 270 HE2 LYS 41 HE2 LYS 41 213.123 5.892 8.117 271 HE3 LYS 41 HE3 LYS 41 213.631 5.465 6.484 272 HZ1 LYS 41 HZ1 LYS 41 213.327 3.681 8.416 273 HZ2 LYS 41 HZ2 LYS 41 214.957 4.058 8.662 274 HZ3 LYS 41 HZ3 LYS 41 214.441 3.484 7.158 275 H THR 42 H THR 42 217.525 10.005 4.412 276 HA THR 42 HA THR 42 218.264 8.844 1.806 277 HB THR 42 HB THR 42 217.813 11.182 1.519 278 HG1 THR 42 HG1 THR 42 220.629 10.946 1.722 279 HG21 THR 42 HG21 THR 42 219.051 12.932 2.708 280 HG22 THR 42 HG22 THR 42 219.718 11.706 3.787 281 HG23 THR 42 HG23 THR 42 217.981 12.014 3.769 282 H LEU 43 H LEU 43 220.318 8.067 1.516 283 HA LEU 43 HA LEU 43 221.917 7.764 3.958 284 HB2 LEU 43 HB2 LEU 43 221.978 6.248 1.347 285 HB3 LEU 43 HB3 LEU 43 223.096 5.977 2.666 286 HG LEU 43 HG LEU 43 220.121 5.485 2.703 287 HD11 LEU 43 HD11 LEU 43 220.593 3.229 2.640 288 HD12 LEU 43 HD12 LEU 43 222.249 3.451 3.207 289 HD13 LEU 43 HD13 LEU 43 221.818 3.884 1.552 290 HD21 LEU 43 HD21 LEU 43 222.151 5.150 4.907 291 HD22 LEU 43 HD22 LEU 43 220.472 4.618 4.967 292 HD23 LEU 43 HD23 LEU 43 220.849 6.336 4.863 293 H TYR 44 H TYR 44 224.120 8.250 4.007 294 HA TYR 44 HA TYR 44 225.132 9.827 1.734 295 HB2 TYR 44 HB2 TYR 44 224.786 10.594 4.525 296 HB3 TYR 44 HB3 TYR 44 226.440 10.828 3.968 297 HD1 TYR 44 HD1 TYR 44 222.905 11.634 3.132 298 HD2 TYR 44 HD2 TYR 44 227.000 12.701 2.683 299 HE1 TYR 44 HE1 TYR 44 222.232 13.732 2.042 300 HE2 TYR 44 HE2 TYR 44 226.337 14.802 1.593 301 HH TYR 44 HH TYR 44 224.211 16.314 1.643 302 H VAL 45 H VAL 45 226.874 8.930 0.855 303 HA VAL 45 HA VAL 45 228.595 7.246 2.551 304 HB VAL 45 HB VAL 45 227.534 6.028 0.703 305 HG11 VAL 45 HG11 VAL 45 227.473 6.702 -1.429 306 HG12 VAL 45 HG12 VAL 45 229.152 7.246 -1.411 307 HG13 VAL 45 HG13 VAL 45 227.878 8.289 -0.778 308 HG21 VAL 45 HG21 VAL 45 230.516 6.385 0.598 309 HG22 VAL 45 HG22 VAL 45 229.672 5.160 -0.347 310 HG23 VAL 45 HG23 VAL 45 229.587 5.126 1.413 311 H VAL 46 H VAL 46 230.669 7.766 2.836 312 HA VAL 46 HA VAL 46 231.981 9.604 0.985 313 HB VAL 46 HB VAL 46 232.756 11.113 2.676 314 HG11 VAL 46 HG11 VAL 46 229.837 10.782 3.291 315 HG12 VAL 46 HG12 VAL 46 230.403 11.349 1.719 316 HG13 VAL 46 HG13 VAL 46 230.780 12.268 3.178 317 HG21 VAL 46 HG21 VAL 46 232.049 10.924 5.032 318 HG22 VAL 46 HG22 VAL 46 233.060 9.574 4.516 319 HG23 VAL 46 HG23 VAL 46 231.316 9.363 4.665 320 H GLY 47 H GLY 47 234.359 9.990 1.973 321 HA2 GLY 47 HA2 GLY 47 235.840 8.405 3.497 322 HA3 GLY 47 HA3 GLY 47 235.492 7.307 2.155 323 H ASP 48 H ASP 48 236.641 7.483 0.295 324 HA ASP 48 HA ASP 48 237.931 9.833 -0.571 325 HB2 ASP 48 HB2 ASP 48 240.258 9.289 -0.202 326 HB3 ASP 48 HB3 ASP 48 239.417 9.338 1.352 327 H PHE 49 H PHE 49 237.811 9.644 -2.672 328 HA PHE 49 HA PHE 49 238.424 7.046 -3.920 329 HB2 PHE 49 HB2 PHE 49 236.315 9.023 -4.827 330 HB3 PHE 49 HB3 PHE 49 236.710 7.488 -5.610 331 HD1 PHE 49 HD1 PHE 49 235.828 8.632 -2.145 332 HD2 PHE 49 HD2 PHE 49 235.160 5.841 -5.294 333 HE1 PHE 49 HE1 PHE 49 234.102 7.529 -0.795 334 HE2 PHE 49 HE2 PHE 49 233.430 4.732 -3.939 335 HZ PHE 49 HZ PHE 49 232.898 5.578 -1.694 336 H ALA 50 H ALA 50 240.371 8.949 -3.515 337 HA ALA 50 HA ALA 50 242.096 9.918 -4.636 338 HB1 ALA 50 HB1 ALA 50 241.392 8.184 -6.439 339 HB2 ALA 50 HB2 ALA 50 242.462 9.516 -6.876 340 HB3 ALA 50 HB3 ALA 50 240.747 9.594 -7.281 341 H ASP 51 H ASP 51 239.271 10.798 -6.621 342 HA ASP 51 HA ASP 51 238.867 13.340 -5.541 343 HB2 ASP 51 HB2 ASP 51 241.222 13.378 -6.932 344 HB3 ASP 51 HB3 ASP 51 240.070 13.857 -8.188 345 H ALA 52 H ALA 52 237.138 11.432 -6.200 346 HA ALA 52 HA ALA 52 235.552 12.686 -8.285 347 HB1 ALA 52 HB1 ALA 52 236.960 10.153 -8.643 348 HB2 ALA 52 HB2 ALA 52 236.244 11.233 -9.840 349 HB3 ALA 52 HB3 ALA 52 235.234 10.058 -8.997 350 H SER 53 H SER 53 235.319 12.326 -5.357 351 HA SER 53 HA SER 53 232.668 11.114 -5.360 352 HB2 SER 53 HB2 SER 53 233.104 9.792 -3.383 353 HB3 SER 53 HB3 SER 53 234.317 9.387 -4.597 354 HG SER 53 HG SER 53 234.696 10.310 -2.127 355 H TRP 54 H TRP 54 232.871 11.344 -2.295 356 HA TRP 54 HA TRP 54 232.131 12.814 -0.737 357 HB2 TRP 54 HB2 TRP 54 233.922 14.810 -2.137 358 HB3 TRP 54 HB3 TRP 54 233.438 14.809 -0.436 359 HD1 TRP 54 HD1 TRP 54 234.114 11.638 0.040 360 HE1 TRP 54 HE1 TRP 54 236.590 10.954 0.262 361 HE3 TRP 54 HE3 TRP 54 236.276 15.678 -2.231 362 HZ2 TRP 54 HZ2 TRP 54 239.121 11.998 -0.432 363 HZ3 TRP 54 HZ3 TRP 54 238.727 15.759 -2.410 364 HH2 TRP 54 HH2 TRP 54 240.119 13.956 -1.528 365 H LYS 55 H LYS 55 230.537 12.585 -3.120 366 HA LYS 55 HA LYS 55 229.163 15.177 -3.005 367 HB2 LYS 55 HB2 LYS 55 229.844 13.625 -5.507 368 HB3 LYS 55 HB3 LYS 55 228.627 14.893 -5.461 369 HG2 LYS 55 HG2 LYS 55 230.333 16.505 -4.767 370 HG3 LYS 55 HG3 LYS 55 231.554 15.234 -4.840 371 HD2 LYS 55 HD2 LYS 55 229.855 16.097 -7.177 372 HD3 LYS 55 HD3 LYS 55 231.482 16.702 -6.857 373 HE2 LYS 55 HE2 LYS 55 231.760 13.950 -6.728 374 HE3 LYS 55 HE3 LYS 55 230.623 14.192 -8.052 375 HZ1 LYS 55 HZ1 LYS 55 233.225 15.607 -7.843 376 HZ2 LYS 55 HZ2 LYS 55 232.177 15.577 -9.173 377 HZ3 LYS 55 HZ3 LYS 55 233.002 14.173 -8.717 378 H GLN 56 H GLN 56 227.074 14.942 -2.496 379 HA GLN 56 HA GLN 56 225.621 12.572 -3.386 380 HB2 GLN 56 HB2 GLN 56 226.177 13.278 -0.538 381 HB3 GLN 56 HB3 GLN 56 224.604 12.600 -0.935 382 HG2 GLN 56 HG2 GLN 56 226.804 11.119 -2.134 383 HG3 GLN 56 HG3 GLN 56 226.892 11.183 -0.368 384 HE21 GLN 56 HE21 GLN 56 224.028 11.118 -2.456 385 HE22 GLN 56 HE22 GLN 56 223.405 9.628 -1.846 386 H LYS 57 H LYS 57 224.781 14.290 -4.785 387 HA LYS 57 HA LYS 57 223.241 16.438 -3.714 388 HB2 LYS 57 HB2 LYS 57 223.777 15.295 -6.398 389 HB3 LYS 57 HB3 LYS 57 222.285 16.208 -6.228 390 HG2 LYS 57 HG2 LYS 57 223.408 18.186 -5.727 391 HG3 LYS 57 HG3 LYS 57 224.900 17.342 -5.308 392 HD2 LYS 57 HD2 LYS 57 225.604 17.804 -7.375 393 HD3 LYS 57 HD3 LYS 57 224.431 16.616 -7.944 394 HE2 LYS 57 HE2 LYS 57 223.969 18.545 -9.190 395 HE3 LYS 57 HE3 LYS 57 222.741 18.528 -7.927 396 HZ1 LYS 57 HZ1 LYS 57 223.413 20.656 -7.707 397 HZ2 LYS 57 HZ2 LYS 57 224.955 20.373 -8.340 398 HZ3 LYS 57 HZ3 LYS 57 224.616 19.973 -6.733 399 HA PRO 58 HA PRO 58 219.274 14.689 -2.896 400 HB2 PRO 58 HB2 PRO 58 217.560 16.315 -4.317 401 HB3 PRO 58 HB3 PRO 58 218.269 16.729 -2.743 402 HG2 PRO 58 HG2 PRO 58 219.132 17.546 -5.490 403 HG3 PRO 58 HG3 PRO 58 219.055 18.511 -4.004 404 HD2 PRO 58 HD2 PRO 58 221.379 17.541 -4.923 405 HD3 PRO 58 HD3 PRO 58 221.040 17.638 -3.183 406 H HIS 59 H HIS 59 219.930 15.365 -6.311 407 HA HIS 59 HA HIS 59 217.890 13.818 -7.447 408 HB2 HIS 59 HB2 HIS 59 220.514 14.872 -8.380 409 HB3 HIS 59 HB3 HIS 59 219.763 13.589 -9.338 410 HD1 HIS 59 HD1 HIS 59 218.864 17.023 -7.963 411 HD2 HIS 59 HD2 HIS 59 217.922 14.484 -11.115 412 HE1 HIS 59 HE1 HIS 59 217.342 18.349 -9.463 413 HE2 HIS 59 HE2 HIS 59 216.691 16.751 -11.299 414 H ARG 60 H ARG 60 220.914 12.878 -5.989 415 HA ARG 60 HA ARG 60 220.271 10.064 -6.563 416 HB2 ARG 60 HB2 ARG 60 222.943 11.442 -6.738 417 HB3 ARG 60 HB3 ARG 60 222.815 9.704 -6.508 418 HG2 ARG 60 HG2 ARG 60 221.615 9.482 -8.599 419 HG3 ARG 60 HG3 ARG 60 221.635 11.233 -8.821 420 HD2 ARG 60 HD2 ARG 60 224.156 9.622 -8.518 421 HD3 ARG 60 HD3 ARG 60 223.380 9.873 -10.090 422 HE ARG 60 HE ARG 60 223.619 12.384 -9.133 423 HH11 ARG 60 HH11 ARG 60 225.918 9.764 -9.476 424 HH12 ARG 60 HH12 ARG 60 227.271 10.818 -9.700 425 HH21 ARG 60 HH21 ARG 60 225.413 13.768 -9.430 426 HH22 ARG 60 HH22 ARG 60 226.986 13.086 -9.673 427 H ALA 61 H ALA 61 219.865 11.972 -4.246 428 HA ALA 61 HA ALA 61 221.559 11.373 -2.116 429 HB1 ALA 61 HB1 ALA 61 219.503 11.940 -0.705 430 HB2 ALA 61 HB2 ALA 61 218.684 12.216 -2.242 431 HB3 ALA 61 HB3 ALA 61 220.101 13.176 -1.812 432 H TYR 62 H TYR 62 218.688 9.664 -3.302 433 HA TYR 62 HA TYR 62 219.556 7.179 -2.274 434 HB2 TYR 62 HB2 TYR 62 217.801 6.794 -0.593 435 HB3 TYR 62 HB3 TYR 62 218.863 8.117 -0.126 436 HD1 TYR 62 HD1 TYR 62 215.503 7.090 -0.523 437 HD2 TYR 62 HD2 TYR 62 218.017 10.519 -0.723 438 HE1 TYR 62 HE1 TYR 62 213.542 8.541 -0.222 439 HE2 TYR 62 HE2 TYR 62 216.063 11.977 -0.420 440 HH TYR 62 HH TYR 62 213.088 11.202 -0.954 441 H ARG 63 H ARG 63 218.468 5.480 -3.191 442 HA ARG 63 HA ARG 63 216.188 6.191 -4.914 443 HB2 ARG 63 HB2 ARG 63 218.525 5.211 -5.790 444 HB3 ARG 63 HB3 ARG 63 217.713 3.693 -5.428 445 HG2 ARG 63 HG2 ARG 63 215.825 4.426 -6.868 446 HG3 ARG 63 HG3 ARG 63 216.773 5.846 -7.313 447 HD2 ARG 63 HD2 ARG 63 217.139 4.305 -9.045 448 HD3 ARG 63 HD3 ARG 63 218.586 4.215 -8.041 449 HE ARG 63 HE ARG 63 216.676 2.275 -7.238 450 HH11 ARG 63 HH11 ARG 63 219.030 2.953 -9.740 451 HH12 ARG 63 HH12 ARG 63 219.308 1.283 -10.104 452 HH21 ARG 63 HH21 ARG 63 217.048 0.074 -7.724 453 HH22 ARG 63 HH22 ARG 63 218.184 -0.351 -8.961 454 H TYR 64 H TYR 64 214.297 5.418 -4.305 455 HA TYR 64 HA TYR 64 214.054 3.556 -2.159 456 HB2 TYR 64 HB2 TYR 64 212.494 5.491 -2.738 457 HB3 TYR 64 HB3 TYR 64 211.808 4.432 -3.972 458 HD1 TYR 64 HD1 TYR 64 210.151 2.868 -3.379 459 HD2 TYR 64 HD2 TYR 64 212.441 4.751 -0.326 460 HE1 TYR 64 HE1 TYR 64 208.632 1.951 -1.677 461 HE2 TYR 64 HE2 TYR 64 210.933 3.836 1.379 462 HH TYR 64 HH TYR 64 209.296 2.251 1.748 463 H VAL 65 H VAL 65 214.183 1.454 -2.285 464 HA VAL 65 HA VAL 65 213.011 0.075 -4.580 465 HB VAL 65 HB VAL 65 214.976 -1.674 -4.117 466 HG11 VAL 65 HG11 VAL 65 215.926 -1.031 -6.143 467 HG12 VAL 65 HG12 VAL 65 215.588 0.678 -5.870 468 HG13 VAL 65 HG13 VAL 65 214.270 -0.432 -6.244 469 HG21 VAL 65 HG21 VAL 65 216.683 -0.911 -2.927 470 HG22 VAL 65 HG22 VAL 65 215.924 0.672 -2.775 471 HG23 VAL 65 HG23 VAL 65 216.961 0.320 -4.157 472 H GLY 66 H GLY 66 211.411 -1.072 -3.788 473 HA2 GLY 66 HA2 GLY 66 210.669 -1.539 -1.244 474 HA3 GLY 66 HA3 GLY 66 210.281 -2.650 -2.551 475 H GLU 67 H GLU 67 210.428 -3.557 -0.014 476 HA GLU 67 HA GLU 67 211.195 -5.402 1.079 477 HB2 GLU 67 HB2 GLU 67 212.319 -5.692 -1.490 478 HB3 GLU 67 HB3 GLU 67 213.624 -6.008 -0.345 479 HG2 GLU 67 HG2 GLU 67 211.103 -7.308 0.345 480 HG3 GLU 67 HG3 GLU 67 211.775 -7.821 -1.201 481 H ASN 68 H ASN 68 212.150 -2.625 1.566 482 HA ASN 68 HA ASN 68 213.558 -1.536 2.975 483 HB2 ASN 68 HB2 ASN 68 213.016 -3.804 4.267 484 HB3 ASN 68 HB3 ASN 68 214.739 -4.068 4.019 485 HD21 ASN 68 HD21 ASN 68 213.461 -3.732 6.530 486 HD22 ASN 68 HD22 ASN 68 214.093 -2.285 7.251 487 H THR 69 H THR 69 214.500 -2.658 0.295 488 HA THR 69 HA THR 69 217.373 -2.849 0.730 489 HB THR 69 HB THR 69 217.547 -3.479 -1.570 490 HG1 THR 69 HG1 THR 69 214.814 -2.770 -1.863 491 HG21 THR 69 HG21 THR 69 215.257 -4.751 -0.152 492 HG22 THR 69 HG22 THR 69 216.842 -5.409 -0.550 493 HG23 THR 69 HG23 THR 69 215.631 -5.208 -1.813 494 H TYR 70 H TYR 70 218.872 -1.426 -0.260 495 HA TYR 70 HA TYR 70 217.736 1.135 -1.163 496 HB2 TYR 70 HB2 TYR 70 218.495 1.444 1.127 497 HB3 TYR 70 HB3 TYR 70 220.064 0.750 0.730 498 HD1 TYR 70 HD1 TYR 70 221.450 1.992 -1.079 499 HD2 TYR 70 HD2 TYR 70 218.184 3.751 1.009 500 HE1 TYR 70 HE1 TYR 70 222.298 4.224 -1.644 501 HE2 TYR 70 HE2 TYR 70 219.029 5.988 0.447 502 HH TYR 70 HH TYR 70 220.956 7.114 -0.263 503 H GLN 71 H GLN 71 218.619 1.979 -2.956 504 HA GLN 71 HA GLN 71 221.151 0.859 -3.928 505 HB2 GLN 71 HB2 GLN 71 218.825 0.051 -5.002 506 HB3 GLN 71 HB3 GLN 71 219.086 1.502 -5.961 507 HG2 GLN 71 HG2 GLN 71 220.790 0.598 -7.108 508 HG3 GLN 71 HG3 GLN 71 221.426 -0.254 -5.704 509 HE21 GLN 71 HE21 GLN 71 219.581 -1.935 -4.923 510 HE22 GLN 71 HE22 GLN 71 219.113 -3.031 -6.185 511 H ALA 72 H ALA 72 222.531 2.305 -4.852 512 HA ALA 72 HA ALA 72 221.555 4.918 -5.653 513 HB1 ALA 72 HB1 ALA 72 223.331 6.042 -4.226 514 HB2 ALA 72 HB2 ALA 72 223.415 4.528 -3.326 515 HB3 ALA 72 HB3 ALA 72 221.903 5.435 -3.387 516 H VAL 73 H VAL 73 222.683 5.709 -7.348 517 HA VAL 73 HA VAL 73 224.882 4.157 -8.398 518 HB VAL 73 HB VAL 73 223.770 6.740 -9.503 519 HG11 VAL 73 HG11 VAL 73 225.031 6.405 -11.343 520 HG12 VAL 73 HG12 VAL 73 224.858 4.652 -11.274 521 HG13 VAL 73 HG13 VAL 73 226.033 5.463 -10.239 522 HG21 VAL 73 HG21 VAL 73 221.935 5.206 -9.299 523 HG22 VAL 73 HG22 VAL 73 222.890 3.900 -10.001 524 HG23 VAL 73 HG23 VAL 73 222.416 5.279 -10.994 525 H VAL 74 H VAL 74 227.010 4.619 -8.256 526 HA VAL 74 HA VAL 74 227.796 7.274 -7.242 527 HB VAL 74 HB VAL 74 229.132 4.689 -6.439 528 HG11 VAL 74 HG11 VAL 74 229.378 7.457 -5.274 529 HG12 VAL 74 HG12 VAL 74 230.520 6.741 -6.410 530 HG13 VAL 74 HG13 VAL 74 230.296 6.024 -4.814 531 HG21 VAL 74 HG21 VAL 74 228.079 5.105 -4.206 532 HG22 VAL 74 HG22 VAL 74 226.945 4.640 -5.475 533 HG23 VAL 74 HG23 VAL 74 227.067 6.328 -4.977 534 H ASP 75 H ASP 75 229.642 8.177 -8.063 535 HA ASP 75 HA ASP 75 230.743 6.902 -10.460 536 HB2 ASP 75 HB2 ASP 75 229.900 9.233 -10.619 537 HB3 ASP 75 HB3 ASP 75 231.119 9.728 -9.436 538 H GLU 76 H GLU 76 232.685 5.941 -10.436 539 HA GLU 76 HA GLU 76 234.526 6.596 -8.226 540 HB2 GLU 76 HB2 GLU 76 234.612 3.976 -9.679 541 HB3 GLU 76 HB3 GLU 76 235.185 4.368 -8.065 542 HG2 GLU 76 HG2 GLU 76 232.269 4.403 -8.756 543 HG3 GLU 76 HG3 GLU 76 233.099 2.927 -8.272 544 H LYS 77 H LYS 77 236.839 6.199 -8.683 545 HA LYS 77 HA LYS 77 237.517 6.865 -11.475 546 HB2 LYS 77 HB2 LYS 77 237.854 8.633 -9.614 547 HB3 LYS 77 HB3 LYS 77 239.211 7.634 -9.112 548 HG2 LYS 77 HG2 LYS 77 240.396 8.039 -11.081 549 HG3 LYS 77 HG3 LYS 77 238.960 8.605 -11.936 550 HD2 LYS 77 HD2 LYS 77 238.895 10.601 -10.544 551 HD3 LYS 77 HD3 LYS 77 240.286 10.023 -9.623 552 HE2 LYS 77 HE2 LYS 77 241.167 9.913 -12.235 553 HE3 LYS 77 HE3 LYS 77 240.179 11.374 -12.205 554 HZ1 LYS 77 HZ1 LYS 77 242.237 12.148 -11.572 555 HZ2 LYS 77 HZ2 LYS 77 242.627 10.759 -10.687 556 HZ3 LYS 77 HZ3 LYS 77 241.517 11.875 -10.065 557 H ALA 78 H ALA 78 239.836 6.300 -12.036 558 HA ALA 78 HA ALA 78 240.249 3.525 -11.635 559 HB1 ALA 78 HB1 ALA 78 242.285 5.449 -12.732 560 HB2 ALA 78 HB2 ALA 78 240.906 4.879 -13.668 561 HB3 ALA 78 HB3 ALA 78 242.107 3.730 -13.083 562 H GLY 79 H GLY 79 241.037 2.602 -9.864 563 HA2 GLY 79 HA2 GLY 79 243.250 2.404 -8.656 564 HA3 GLY 79 HA3 GLY 79 243.000 4.107 -8.260 565 H ALA 80 H ALA 80 243.276 1.719 -6.532 566 HA ALA 80 HA ALA 80 240.815 0.973 -5.410 567 HB1 ALA 80 HB1 ALA 80 243.646 0.837 -4.549 568 HB2 ALA 80 HB2 ALA 80 242.435 -0.438 -4.683 569 HB3 ALA 80 HB3 ALA 80 242.414 0.656 -3.300 570 H PHE 81 H PHE 81 239.526 1.818 -3.850 571 HA PHE 81 HA PHE 81 240.389 4.228 -2.428 572 HB2 PHE 81 HB2 PHE 81 238.006 5.146 -2.925 573 HB3 PHE 81 HB3 PHE 81 239.262 5.319 -4.144 574 HD1 PHE 81 HD1 PHE 81 238.906 4.544 -6.304 575 HD2 PHE 81 HD2 PHE 81 236.416 3.140 -3.151 576 HE1 PHE 81 HE1 PHE 81 237.463 3.419 -7.948 577 HE2 PHE 81 HE2 PHE 81 234.972 2.012 -4.790 578 HZ PHE 81 HZ PHE 81 235.494 2.148 -7.190 579 H ARG 82 H ARG 82 239.387 4.601 -0.471 580 HA ARG 82 HA ARG 82 237.776 2.356 0.550 581 HB2 ARG 82 HB2 ARG 82 240.010 3.877 1.661 582 HB3 ARG 82 HB3 ARG 82 238.646 3.762 2.766 583 HG2 ARG 82 HG2 ARG 82 238.736 1.415 2.808 584 HG3 ARG 82 HG3 ARG 82 239.795 1.351 1.393 585 HD2 ARG 82 HD2 ARG 82 241.156 2.920 3.261 586 HD3 ARG 82 HD3 ARG 82 240.469 1.589 4.192 587 HE ARG 82 HE ARG 82 241.914 0.152 3.149 588 HH11 ARG 82 HH11 ARG 82 241.878 3.182 1.394 589 HH12 ARG 82 HH12 ARG 82 243.206 2.750 0.372 590 HH21 ARG 82 HH21 ARG 82 243.661 -0.418 1.791 591 HH22 ARG 82 HH22 ARG 82 244.217 0.705 0.597 592 H MET 83 H MET 83 235.839 2.729 1.562 593 HA MET 83 HA MET 83 235.003 5.443 2.169 594 HB2 MET 83 HB2 MET 83 232.920 5.171 0.756 595 HB3 MET 83 HB3 MET 83 234.417 5.450 -0.120 596 HG2 MET 83 HG2 MET 83 233.485 3.777 -1.367 597 HG3 MET 83 HG3 MET 83 234.493 2.848 -0.260 598 HE1 MET 83 HE1 MET 83 232.041 0.271 -0.381 599 HE2 MET 83 HE2 MET 83 232.982 0.511 1.090 600 HE3 MET 83 HE3 MET 83 233.694 0.874 -0.481 601 H GLN 84 H GLN 84 232.563 5.383 2.824 602 HA GLN 84 HA GLN 84 231.603 2.923 3.949 603 HB2 GLN 84 HB2 GLN 84 231.621 3.628 6.287 604 HB3 GLN 84 HB3 GLN 84 233.259 3.556 5.652 605 HG2 GLN 84 HG2 GLN 84 233.615 5.653 6.245 606 HG3 GLN 84 HG3 GLN 84 232.247 6.188 5.257 607 HE21 GLN 84 HE21 GLN 84 230.072 5.898 6.298 608 HE22 GLN 84 HE22 GLN 84 229.958 6.261 7.991 609 H TYR 85 H TYR 85 229.413 3.007 4.400 610 HA TYR 85 HA TYR 85 228.073 5.487 3.592 611 HB2 TYR 85 HB2 TYR 85 227.577 2.741 3.088 612 HB3 TYR 85 HB3 TYR 85 226.239 3.330 4.067 613 HD1 TYR 85 HD1 TYR 85 225.528 5.874 3.222 614 HD2 TYR 85 HD2 TYR 85 227.143 2.746 0.831 615 HE1 TYR 85 HE1 TYR 85 224.511 6.881 1.228 616 HE2 TYR 85 HE2 TYR 85 226.126 3.747 -1.171 617 HH TYR 85 HH TYR 85 223.748 6.085 -1.058 618 H ALA 86 H ALA 86 226.580 6.542 4.854 619 HA ALA 86 HA ALA 86 225.713 5.517 7.388 620 HB1 ALA 86 HB1 ALA 86 227.669 7.809 7.389 621 HB2 ALA 86 HB2 ALA 86 227.955 6.190 8.026 622 HB3 ALA 86 HB3 ALA 86 226.756 7.239 8.786 623 H SER 87 H SER 87 223.727 6.271 7.717 624 HA SER 87 HA SER 87 222.626 8.345 6.089 625 HB2 SER 87 HB2 SER 87 221.568 6.224 7.463 626 HB3 SER 87 HB3 SER 87 221.102 7.587 8.492 627 HG SER 87 HG SER 87 219.720 8.190 7.030 628 H LYS 88 H LYS 88 221.119 10.006 7.392 629 HA LYS 88 HA LYS 88 222.979 11.685 8.846 630 HB2 LYS 88 HB2 LYS 88 220.401 12.055 7.461 631 HB3 LYS 88 HB3 LYS 88 220.635 13.070 8.878 632 HG2 LYS 88 HG2 LYS 88 222.920 12.964 7.035 633 HG3 LYS 88 HG3 LYS 88 221.456 13.702 6.380 634 HD2 LYS 88 HD2 LYS 88 222.628 14.480 9.044 635 HD3 LYS 88 HD3 LYS 88 223.088 15.264 7.531 636 HE2 LYS 88 HE2 LYS 88 221.123 16.368 7.348 637 HE3 LYS 88 HE3 LYS 88 220.190 15.040 8.034 638 HZ1 LYS 88 HZ1 LYS 88 220.424 17.207 9.365 639 HZ2 LYS 88 HZ2 LYS 88 221.975 16.650 9.746 640 HZ3 LYS 88 HZ3 LYS 88 220.618 15.739 10.182 641 H ASP 89 H ASP 89 219.799 10.194 9.473 642 HA ASP 89 HA ASP 89 220.017 10.908 12.296 643 HB2 ASP 89 HB2 ASP 89 217.763 9.698 10.679 644 HB3 ASP 89 HB3 ASP 89 217.686 9.959 12.427 645 H TRP 90 H TRP 90 221.959 9.119 11.616 646 HA TRP 90 HA TRP 90 222.839 7.044 11.993 647 HB2 TRP 90 HB2 TRP 90 220.978 7.013 14.368 648 HB3 TRP 90 HB3 TRP 90 222.565 6.263 14.230 649 HD1 TRP 90 HD1 TRP 90 224.690 7.810 14.612 650 HE1 TRP 90 HE1 TRP 90 224.977 10.164 15.609 651 HE3 TRP 90 HE3 TRP 90 219.807 9.325 14.541 652 HZ2 TRP 90 HZ2 TRP 90 223.350 12.373 16.277 653 HZ3 TRP 90 HZ3 TRP 90 219.258 11.571 15.375 654 HH2 TRP 90 HH2 TRP 90 220.994 13.063 16.225 655 H SER 91 H SER 91 220.774 6.904 10.139 656 HA SER 91 HA SER 91 219.062 4.667 10.822 657 HB2 SER 91 HB2 SER 91 219.174 6.706 8.720 658 HB3 SER 91 HB3 SER 91 218.752 5.107 8.109 659 HG SER 91 HG SER 91 217.361 6.783 9.840 660 HA PRO 92 HA PRO 92 221.018 1.094 9.121 661 HB2 PRO 92 HB2 PRO 92 219.694 0.926 6.581 662 HB3 PRO 92 HB3 PRO 92 219.381 -0.023 8.044 663 HG2 PRO 92 HG2 PRO 92 217.983 2.369 7.010 664 HG3 PRO 92 HG3 PRO 92 217.383 1.079 8.066 665 HD2 PRO 92 HD2 PRO 92 217.887 3.547 8.996 666 HD3 PRO 92 HD3 PRO 92 218.197 2.096 9.984 667 H GLN 93 H GLN 93 223.062 1.287 8.516 668 HA GLN 93 HA GLN 93 223.682 2.651 5.979 669 HB2 GLN 93 HB2 GLN 93 225.901 3.219 7.088 670 HB3 GLN 93 HB3 GLN 93 224.492 4.102 7.651 671 HG2 GLN 93 HG2 GLN 93 224.473 2.080 9.408 672 HG3 GLN 93 HG3 GLN 93 226.197 2.146 9.054 673 HE21 GLN 93 HE21 GLN 93 227.013 4.531 8.987 674 HE22 GLN 93 HE22 GLN 93 226.538 5.494 10.352 675 H PHE 94 H PHE 94 226.239 2.068 5.552 676 HA PHE 94 HA PHE 94 226.421 -0.867 5.685 677 HB2 PHE 94 HB2 PHE 94 226.085 -0.751 3.442 678 HB3 PHE 94 HB3 PHE 94 226.551 0.943 3.357 679 HD1 PHE 94 HD1 PHE 94 228.254 -2.288 4.180 680 HD2 PHE 94 HD2 PHE 94 228.327 1.352 1.978 681 HE1 PHE 94 HE1 PHE 94 230.417 -2.929 3.202 682 HE2 PHE 94 HE2 PHE 94 230.490 0.718 0.997 683 HZ PHE 94 HZ PHE 94 231.538 -1.424 1.608 684 H THR 95 H THR 95 228.286 -1.719 6.348 685 HA THR 95 HA THR 95 230.809 -0.376 6.179 686 HB THR 95 HB THR 95 230.909 -0.749 8.874 687 HG1 THR 95 HG1 THR 95 228.727 -1.128 9.108 688 HG21 THR 95 HG21 THR 95 231.028 1.542 9.138 689 HG22 THR 95 HG22 THR 95 229.854 1.854 7.860 690 HG23 THR 95 HG23 THR 95 231.482 1.317 7.448 691 H ALA 96 H ALA 96 232.036 -2.031 5.563 692 HA ALA 96 HA ALA 96 231.547 -4.689 6.714 693 HB1 ALA 96 HB1 ALA 96 233.303 -4.096 4.349 694 HB2 ALA 96 HB2 ALA 96 231.558 -4.310 4.199 695 HB3 ALA 96 HB3 ALA 96 232.562 -5.626 4.811 696 H ASP 97 H ASP 97 232.761 -5.182 8.407 697 HA ASP 97 HA ASP 97 235.275 -3.882 8.911 698 HB2 ASP 97 HB2 ASP 97 235.302 -5.642 10.859 699 HB3 ASP 97 HB3 ASP 97 234.194 -4.269 10.907 700 H GLY 98 H GLY 98 237.209 -4.501 8.245 701 HA2 GLY 98 HA2 GLY 98 238.832 -5.739 7.151 702 HA3 GLY 98 HA3 GLY 98 238.396 -6.955 8.354 703 H LEU 99 H LEU 99 236.684 -5.673 5.502 704 HA LEU 99 HA LEU 99 236.295 -8.447 4.609 705 HB2 LEU 99 HB2 LEU 99 234.244 -7.241 5.105 706 HB3 LEU 99 HB3 LEU 99 234.711 -5.944 4.027 707 HG LEU 99 HG LEU 99 232.953 -7.545 3.168 708 HD11 LEU 99 HD11 LEU 99 233.575 -7.188 1.005 709 HD12 LEU 99 HD12 LEU 99 235.265 -7.596 1.304 710 HD13 LEU 99 HD13 LEU 99 234.625 -6.039 1.833 711 HD21 LEU 99 HD21 LEU 99 233.843 -9.638 2.147 712 HD22 LEU 99 HD22 LEU 99 233.824 -9.642 3.909 713 HD23 LEU 99 HD23 LEU 99 235.339 -9.379 3.046 714 H GLU 100 H GLU 100 236.788 -5.177 3.240 715 HA GLU 100 HA GLU 100 237.832 -4.453 1.356 716 HB2 GLU 100 HB2 GLU 100 239.368 -6.916 2.043 717 HB3 GLU 100 HB3 GLU 100 239.604 -6.237 0.441 718 HG2 GLU 100 HG2 GLU 100 241.200 -5.515 2.272 719 HG3 GLU 100 HG3 GLU 100 240.478 -4.248 1.284 720 H LEU 101 H LEU 101 235.837 -4.568 0.312 721 HA LEU 101 HA LEU 101 234.913 -6.851 -1.082 722 HB2 LEU 101 HB2 LEU 101 233.457 -5.023 -0.333 723 HB3 LEU 101 HB3 LEU 101 234.227 -3.941 -1.493 724 HG LEU 101 HG LEU 101 232.991 -6.427 -2.565 725 HD11 LEU 101 HD11 LEU 101 231.243 -5.832 -1.095 726 HD12 LEU 101 HD12 LEU 101 230.791 -5.190 -2.672 727 HD13 LEU 101 HD13 LEU 101 231.439 -4.113 -1.435 728 HD21 LEU 101 HD21 LEU 101 233.030 -3.558 -3.498 729 HD22 LEU 101 HD22 LEU 101 232.440 -4.947 -4.411 730 HD23 LEU 101 HD23 LEU 101 234.151 -4.817 -4.012 731 H THR 102 H THR 102 234.872 -7.335 -3.244 732 HA THR 102 HA THR 102 236.890 -5.987 -4.924 733 HB THR 102 HB THR 102 236.063 -8.903 -4.864 734 HG1 THR 102 HG1 THR 102 237.503 -8.625 -3.270 735 HG21 THR 102 HG21 THR 102 236.640 -8.055 -7.161 736 HG22 THR 102 HG22 THR 102 237.628 -9.382 -6.554 737 HG23 THR 102 HG23 THR 102 238.260 -7.736 -6.541 738 HA PRO 103 HA PRO 103 233.832 -4.707 -7.868 739 HB2 PRO 103 HB2 PRO 103 235.542 -6.245 -9.790 740 HB3 PRO 103 HB3 PRO 103 234.830 -4.637 -9.966 741 HG2 PRO 103 HG2 PRO 103 237.403 -4.933 -9.324 742 HG3 PRO 103 HG3 PRO 103 236.418 -3.634 -8.613 743 HD2 PRO 103 HD2 PRO 103 237.459 -6.110 -7.369 744 HD3 PRO 103 HD3 PRO 103 237.013 -4.569 -6.616 745 H GLY 104 H GLY 104 231.925 -5.752 -7.610 746 HA2 GLY 104 HA2 GLY 104 230.237 -7.209 -8.266 747 HA3 GLY 104 HA3 GLY 104 231.433 -8.133 -9.181 748 H LYS 105 H LYS 105 231.690 -7.314 -5.754 749 HA LYS 105 HA LYS 105 231.184 -10.133 -5.057 750 HB2 LYS 105 HB2 LYS 105 233.696 -9.164 -5.168 751 HB3 LYS 105 HB3 LYS 105 233.272 -8.692 -3.518 752 HG2 LYS 105 HG2 LYS 105 232.469 -11.397 -3.934 753 HG3 LYS 105 HG3 LYS 105 234.141 -11.209 -4.465 754 HD2 LYS 105 HD2 LYS 105 233.580 -9.852 -1.944 755 HD3 LYS 105 HD3 LYS 105 233.301 -11.593 -1.870 756 HE2 LYS 105 HE2 LYS 105 235.588 -11.874 -2.912 757 HE3 LYS 105 HE3 LYS 105 235.836 -10.153 -2.625 758 HZ1 LYS 105 HZ1 LYS 105 234.934 -11.709 -0.338 759 HZ2 LYS 105 HZ2 LYS 105 236.080 -10.467 -0.421 760 HZ3 LYS 105 HZ3 LYS 105 236.504 -12.039 -0.880 761 H THR 106 H THR 106 230.584 -10.511 -2.882 762 HA THR 106 HA THR 106 229.004 -8.321 -1.785 763 HB THR 106 HB THR 106 229.048 -11.095 -0.643 764 HG1 THR 106 HG1 THR 106 228.612 -11.699 -2.639 765 HG21 THR 106 HG21 THR 106 227.432 -8.792 -0.276 766 HG22 THR 106 HG22 THR 106 227.315 -10.366 0.508 767 HG23 THR 106 HG23 THR 106 226.447 -10.063 -0.996 768 H ALA 107 H ALA 107 229.161 -7.534 0.284 769 HA ALA 107 HA ALA 107 231.570 -8.288 1.811 770 HB1 ALA 107 HB1 ALA 107 231.837 -5.949 2.450 771 HB2 ALA 107 HB2 ALA 107 230.438 -5.512 1.470 772 HB3 ALA 107 HB3 ALA 107 231.897 -6.135 0.697 773 H SER 108 H SER 108 231.434 -8.264 4.040 774 HA SER 108 HA SER 108 228.894 -8.875 5.163 775 HB2 SER 108 HB2 SER 108 231.269 -8.164 6.860 776 HB3 SER 108 HB3 SER 108 230.044 -9.407 7.120 777 HG SER 108 HG SER 108 230.977 -10.550 5.343 778 H LEU 109 H LEU 109 227.627 -7.740 6.611 779 HA LEU 109 HA LEU 109 228.312 -4.907 7.032 780 HB2 LEU 109 HB2 LEU 109 226.553 -5.417 5.201 781 HB3 LEU 109 HB3 LEU 109 225.486 -5.785 6.543 782 HG LEU 109 HG LEU 109 226.885 -3.185 6.692 783 HD11 LEU 109 HD11 LEU 109 224.907 -2.302 5.214 784 HD12 LEU 109 HD12 LEU 109 225.022 -3.904 4.486 785 HD13 LEU 109 HD13 LEU 109 226.420 -2.830 4.480 786 HD21 LEU 109 HD21 LEU 109 223.978 -3.344 6.958 787 HD22 LEU 109 HD22 LEU 109 225.184 -2.668 8.050 788 HD23 LEU 109 HD23 LEU 109 224.862 -4.402 8.058 789 H LYS 110 H LYS 110 228.029 -4.170 9.061 790 HA LYS 110 HA LYS 110 226.485 -5.831 10.940 791 HB2 LYS 110 HB2 LYS 110 229.094 -5.971 11.029 792 HB3 LYS 110 HB3 LYS 110 228.971 -4.406 11.819 793 HG2 LYS 110 HG2 LYS 110 227.116 -6.015 13.130 794 HG3 LYS 110 HG3 LYS 110 228.527 -7.044 12.882 795 HD2 LYS 110 HD2 LYS 110 229.416 -4.465 13.719 796 HD3 LYS 110 HD3 LYS 110 228.148 -5.010 14.820 797 HE2 LYS 110 HE2 LYS 110 229.928 -5.995 15.834 798 HE3 LYS 110 HE3 LYS 110 229.541 -7.270 14.680 799 HZ1 LYS 110 HZ1 LYS 110 231.206 -6.190 13.162 800 HZ2 LYS 110 HZ2 LYS 110 231.855 -6.906 14.551 801 HZ3 LYS 110 HZ3 LYS 110 231.680 -5.227 14.470 802 H ARG 111 H ARG 111 228.249 -2.718 10.980 803 HA ARG 111 HA ARG 111 225.931 -1.118 11.213 804 HB2 ARG 111 HB2 ARG 111 226.308 -0.363 13.580 805 HB3 ARG 111 HB3 ARG 111 225.671 -1.991 13.415 806 HG2 ARG 111 HG2 ARG 111 227.414 -2.878 14.470 807 HG3 ARG 111 HG3 ARG 111 228.566 -1.974 13.488 808 HD2 ARG 111 HD2 ARG 111 228.808 -1.393 15.833 809 HD3 ARG 111 HD3 ARG 111 228.226 -0.009 14.907 810 HE ARG 111 HE ARG 111 226.118 -1.547 16.106 811 HH11 ARG 111 HH11 ARG 111 228.439 1.014 16.653 812 HH12 ARG 111 HH12 ARG 111 227.506 1.761 17.906 813 HH21 ARG 111 HH21 ARG 111 224.890 -0.556 17.758 814 HH22 ARG 111 HH22 ARG 111 225.494 0.871 18.533 815 H GLY 112 H GLY 112 226.406 1.059 11.011 816 HA2 GLY 112 HA2 GLY 112 229.024 1.693 10.069 817 HA3 GLY 112 HA3 GLY 112 227.684 2.820 10.260 818 H GLY 113 H GLY 113 228.092 4.424 11.616 819 HA2 GLY 113 HA2 GLY 113 228.968 5.639 13.354 820 HA3 GLY 113 HA3 GLY 113 228.961 4.120 14.260 821 H TYR 114 H TYR 114 230.791 5.074 11.362 822 HA TYR 114 HA TYR 114 233.011 5.132 10.899 823 HB2 TYR 114 HB2 TYR 114 233.120 5.749 13.851 824 HB3 TYR 114 HB3 TYR 114 234.556 5.722 12.836 825 HD1 TYR 114 HD1 TYR 114 234.327 7.195 10.620 826 HD2 TYR 114 HD2 TYR 114 232.079 7.777 14.185 827 HE1 TYR 114 HE1 TYR 114 233.922 9.533 9.976 828 HE2 TYR 114 HE2 TYR 114 231.666 10.116 13.549 829 HH TYR 114 HH TYR 114 231.602 11.411 11.215 830 H GLY 115 H GLY 115 233.070 2.953 10.267 831 HA2 GLY 115 HA2 GLY 115 234.238 1.109 12.263 832 HA3 GLY 115 HA3 GLY 115 233.222 0.589 10.927 833 H GLN 116 H GLN 116 234.599 -0.725 9.844 834 HA GLN 116 HA GLN 116 237.291 0.201 9.219 835 HB2 GLN 116 HB2 GLN 116 236.222 -2.313 9.723 836 HB3 GLN 116 HB3 GLN 116 236.473 -2.315 7.983 837 HG2 GLN 116 HG2 GLN 116 238.664 -1.416 9.801 838 HG3 GLN 116 HG3 GLN 116 238.351 -3.134 9.573 839 HE21 GLN 116 HE21 GLN 116 240.312 -3.502 8.553 840 HE22 GLN 116 HE22 GLN 116 240.643 -2.942 6.953 841 H ASP 117 H ASP 117 237.761 1.232 7.392 842 HA ASP 117 HA ASP 117 235.818 1.783 5.412 843 HB2 ASP 117 HB2 ASP 117 238.824 2.118 5.337 844 HB3 ASP 117 HB3 ASP 117 237.715 2.783 4.147 845 H THR 118 H THR 118 235.153 0.580 3.760 846 HA THR 118 HA THR 118 236.437 -1.916 3.151 847 HB THR 118 HB THR 118 234.345 -0.867 1.324 848 HG1 THR 118 HG1 THR 118 233.236 -0.202 3.005 849 HG21 THR 118 HG21 THR 118 235.331 -3.400 2.125 850 HG22 THR 118 HG22 THR 118 234.129 -3.014 0.893 851 HG23 THR 118 HG23 THR 118 233.625 -3.296 2.559 852 H ALA 119 H ALA 119 238.173 -2.062 1.925 853 HA ALA 119 HA ALA 119 238.720 -0.019 -0.091 854 HB1 ALA 119 HB1 ALA 119 240.524 -2.279 0.743 855 HB2 ALA 119 HB2 ALA 119 240.447 -0.739 1.598 856 HB3 ALA 119 HB3 ALA 119 240.965 -0.786 -0.087 857 H VAL 120 H VAL 120 238.308 -0.343 -2.172 858 HA VAL 120 HA VAL 120 238.023 -3.116 -3.127 859 HB VAL 120 HB VAL 120 235.875 -1.934 -3.145 860 HG11 VAL 120 HG11 VAL 120 235.497 -0.022 -4.608 861 HG12 VAL 120 HG12 VAL 120 237.207 -0.001 -5.037 862 HG13 VAL 120 HG13 VAL 120 236.709 0.349 -3.382 863 HG21 VAL 120 HG21 VAL 120 236.355 -3.625 -4.862 864 HG22 VAL 120 HG22 VAL 120 236.957 -2.357 -5.929 865 HG23 VAL 120 HG23 VAL 120 235.260 -2.375 -5.452 866 H THR 121 H THR 121 239.246 -3.747 -4.805 867 HA THR 121 HA THR 121 241.263 -1.945 -5.794 868 HB THR 121 HB THR 121 240.667 -4.867 -6.146 869 HG1 THR 121 HG1 THR 121 241.766 -4.332 -4.288 870 HG21 THR 121 HG21 THR 121 242.728 -5.119 -7.434 871 HG22 THR 121 HG22 THR 121 242.877 -3.365 -7.536 872 HG23 THR 121 HG23 THR 121 241.521 -4.183 -8.312 873 H LEU 122 H LEU 122 240.838 -0.565 -7.390 874 HA LEU 122 HA LEU 122 239.241 -1.513 -9.677 875 HB2 LEU 122 HB2 LEU 122 238.768 0.729 -7.930 876 HB3 LEU 122 HB3 LEU 122 239.059 1.303 -9.560 877 HG LEU 122 HG LEU 122 236.700 1.032 -9.263 878 HD11 LEU 122 HD11 LEU 122 236.211 -0.162 -11.172 879 HD12 LEU 122 HD12 LEU 122 237.412 -1.408 -10.828 880 HD13 LEU 122 HD13 LEU 122 237.927 0.180 -11.390 881 HD21 LEU 122 HD21 LEU 122 237.510 -1.504 -7.986 882 HD22 LEU 122 HD22 LEU 122 236.024 -1.543 -8.934 883 HD23 LEU 122 HD23 LEU 122 236.187 -0.406 -7.596 884 HA PRO 123 HA PRO 123 243.157 -0.215 -11.528 885 HB2 PRO 123 HB2 PRO 123 243.099 -1.849 -13.640 886 HB3 PRO 123 HB3 PRO 123 243.418 -2.469 -12.007 887 HG2 PRO 123 HG2 PRO 123 240.898 -2.562 -13.616 888 HG3 PRO 123 HG3 PRO 123 241.605 -3.802 -12.566 889 HD2 PRO 123 HD2 PRO 123 239.554 -2.071 -11.845 890 HD3 PRO 123 HD3 PRO 123 240.595 -2.952 -10.710 891 H GLU 124 H GLU 124 240.096 0.645 -12.311 892 HA GLU 124 HA GLU 124 240.913 2.546 -14.276 893 HB2 GLU 124 HB2 GLU 124 240.651 0.356 -15.573 894 HB3 GLU 124 HB3 GLU 124 238.928 0.500 -15.256 895 HG2 GLU 124 HG2 GLU 124 239.176 2.855 -16.303 896 HG3 GLU 124 HG3 GLU 124 240.689 2.212 -16.961 897 H ALA 125 H ALA 125 239.348 4.109 -14.725 898 HA ALA 125 HA ALA 125 237.374 4.447 -12.660 899 HB1 ALA 125 HB1 ALA 125 236.834 6.532 -14.129 900 HB2 ALA 125 HB2 ALA 125 238.335 6.107 -14.951 901 HB3 ALA 125 HB3 ALA 125 238.346 6.464 -13.225 902 H GLY 126 H GLY 126 235.157 4.409 -12.830 903 HA2 GLY 126 HA2 GLY 126 233.711 4.236 -15.246 904 HA3 GLY 126 HA3 GLY 126 233.992 2.608 -14.634 905 H GLN 127 H GLN 127 231.436 3.610 -14.956 906 HA GLN 127 HA GLN 127 230.339 4.776 -12.630 907 HB2 GLN 127 HB2 GLN 127 229.384 4.247 -15.111 908 HB3 GLN 127 HB3 GLN 127 228.607 2.962 -14.196 909 HG2 GLN 127 HG2 GLN 127 227.800 4.744 -12.605 910 HG3 GLN 127 HG3 GLN 127 228.371 5.930 -13.790 911 HE21 GLN 127 HE21 GLN 127 226.949 6.576 -15.250 912 HE22 GLN 127 HE22 GLN 127 225.510 5.736 -15.707 913 H TYR 128 H TYR 128 229.518 3.933 -10.790 914 HA TYR 128 HA TYR 128 229.646 1.008 -10.454 915 HB2 TYR 128 HB2 TYR 128 231.270 2.864 -9.183 916 HB3 TYR 128 HB3 TYR 128 230.025 2.517 -7.988 917 HD1 TYR 128 HD1 TYR 128 229.562 0.009 -7.506 918 HD2 TYR 128 HD2 TYR 128 233.091 1.436 -9.406 919 HE1 TYR 128 HE1 TYR 128 230.722 -2.070 -6.903 920 HE2 TYR 128 HE2 TYR 128 234.260 -0.639 -8.804 921 HH TYR 128 HH TYR 128 233.622 -2.543 -6.615 922 H VAL 129 H VAL 129 228.113 0.067 -9.061 923 HA VAL 129 HA VAL 129 225.859 1.818 -8.332 924 HB VAL 129 HB VAL 129 224.324 -0.074 -8.810 925 HG11 VAL 129 HG11 VAL 129 225.654 0.319 -11.404 926 HG12 VAL 129 HG12 VAL 129 225.299 1.794 -10.504 927 HG13 VAL 129 HG13 VAL 129 223.999 0.673 -10.906 928 HG21 VAL 129 HG21 VAL 129 225.758 -1.972 -8.667 929 HG22 VAL 129 HG22 VAL 129 226.822 -1.341 -9.923 930 HG23 VAL 129 HG23 VAL 129 225.194 -1.875 -10.334 931 H TRP 130 H TRP 130 225.244 1.736 -6.278 932 HA TRP 130 HA TRP 130 226.340 -0.394 -4.579 933 HB2 TRP 130 HB2 TRP 130 225.982 2.460 -4.249 934 HB3 TRP 130 HB3 TRP 130 225.207 1.575 -2.938 935 HD1 TRP 130 HD1 TRP 130 226.746 0.653 -1.073 936 HE1 TRP 130 HE1 TRP 130 229.290 0.581 -0.699 937 HE3 TRP 130 HE3 TRP 130 228.287 2.239 -5.680 938 HZ2 TRP 130 HZ2 TRP 130 231.642 1.127 -2.165 939 HZ3 TRP 130 HZ3 TRP 130 230.700 2.436 -6.114 940 HH2 TRP 130 HH2 TRP 130 232.341 1.890 -4.390 941 H SER 131 H SER 131 224.986 -2.012 -4.169 942 HA SER 131 HA SER 131 222.187 -1.379 -3.537 943 HB2 SER 131 HB2 SER 131 221.460 -3.391 -4.790 944 HB3 SER 131 HB3 SER 131 222.213 -2.192 -5.839 945 HG SER 131 HG SER 131 224.019 -3.442 -5.978 946 H LEU 132 H LEU 132 221.553 -2.231 -1.647 947 HA LEU 132 HA LEU 132 222.622 -4.781 -0.761 948 HB2 LEU 132 HB2 LEU 132 223.052 -3.738 1.563 949 HB3 LEU 132 HB3 LEU 132 224.265 -3.583 0.315 950 HG LEU 132 HG LEU 132 223.884 -1.533 1.707 951 HD11 LEU 132 HD11 LEU 132 223.219 -0.711 -1.047 952 HD12 LEU 132 HD12 LEU 132 224.638 -1.742 -0.850 953 HD13 LEU 132 HD13 LEU 132 224.539 -0.204 0.008 954 HD21 LEU 132 HD21 LEU 132 221.389 -1.119 0.097 955 HD22 LEU 132 HD22 LEU 132 221.959 -0.231 1.508 956 HD23 LEU 132 HD23 LEU 132 221.349 -1.875 1.690 957 H LYS 133 H LYS 133 221.395 -5.828 0.802 958 HA LYS 133 HA LYS 133 218.695 -4.700 1.149 959 HB2 LYS 133 HB2 LYS 133 218.773 -6.774 -0.173 960 HB3 LYS 133 HB3 LYS 133 219.571 -7.597 1.174 961 HG2 LYS 133 HG2 LYS 133 217.597 -7.299 2.556 962 HG3 LYS 133 HG3 LYS 133 216.800 -6.409 1.257 963 HD2 LYS 133 HD2 LYS 133 216.416 -8.292 0.018 964 HD3 LYS 133 HD3 LYS 133 217.828 -9.135 0.657 965 HE2 LYS 133 HE2 LYS 133 215.867 -8.572 2.719 966 HE3 LYS 133 HE3 LYS 133 215.181 -9.520 1.403 967 HZ1 LYS 133 HZ1 LYS 133 217.361 -10.897 1.726 968 HZ2 LYS 133 HZ2 LYS 133 216.025 -11.156 2.729 969 HZ3 LYS 133 HZ3 LYS 133 217.323 -10.224 3.278 970 H PHE 134 H PHE 134 217.852 -4.446 3.137 971 HA PHE 134 HA PHE 134 219.503 -5.336 5.408 972 HB2 PHE 134 HB2 PHE 134 217.710 -2.908 5.211 973 HB3 PHE 134 HB3 PHE 134 218.581 -3.407 6.656 974 HD1 PHE 134 HD1 PHE 134 221.168 -4.232 5.361 975 HD2 PHE 134 HD2 PHE 134 218.692 -0.812 4.791 976 HE1 PHE 134 HE1 PHE 134 223.123 -2.942 4.615 977 HE2 PHE 134 HE2 PHE 134 220.649 0.481 4.045 978 HZ PHE 134 HZ PHE 134 222.867 -0.583 3.955 979 H THR 135 H THR 135 218.540 -6.221 7.189 980 HA THR 135 HA THR 135 216.005 -7.518 6.723 981 HB THR 135 HB THR 135 217.842 -8.762 7.711 982 HG1 THR 135 HG1 THR 135 216.026 -8.479 9.831 983 HG21 THR 135 HG21 THR 135 218.767 -8.333 9.847 984 HG22 THR 135 HG22 THR 135 217.630 -7.020 10.146 985 HG23 THR 135 HG23 THR 135 218.881 -6.841 8.922 986 H ASP 136 H ASP 136 214.333 -7.605 8.445 987 HA ASP 136 HA ASP 136 213.726 -4.905 9.370 988 HB2 ASP 136 HB2 ASP 136 211.466 -5.769 9.800 989 HB3 ASP 136 HB3 ASP 136 211.977 -6.101 8.149 990 H SER 137 H SER 137 214.104 -8.185 10.707 991 HA SER 137 HA SER 137 213.534 -7.435 13.387 992 HB2 SER 137 HB2 SER 137 214.776 -9.631 13.904 993 HB3 SER 137 HB3 SER 137 213.307 -9.731 12.932 994 HG SER 137 HG SER 137 215.992 -10.007 12.142 995 H GLY 138 H GLY 138 216.403 -7.289 11.436 996 HA2 GLY 138 HA2 GLY 138 218.216 -5.855 11.950 997 HA3 GLY 138 HA3 GLY 138 217.798 -5.987 13.658 998 H ASP 139 H ASP 139 218.086 -8.795 11.549 999 HA ASP 139 HA ASP 139 220.481 -9.563 13.072 1000 HB2 ASP 139 HB2 ASP 139 218.086 -11.074 12.230 1001 HB3 ASP 139 HB3 ASP 139 219.619 -11.927 12.067 1002 HA PRO 140 HA PRO 140 221.777 -11.042 8.764 1003 HB2 PRO 140 HB2 PRO 140 220.019 -11.441 6.774 1004 HB3 PRO 140 HB3 PRO 140 220.249 -12.622 8.068 1005 HG2 PRO 140 HG2 PRO 140 218.091 -10.577 7.734 1006 HG3 PRO 140 HG3 PRO 140 217.962 -12.266 8.256 1007 HD2 PRO 140 HD2 PRO 140 217.976 -10.131 9.975 1008 HD3 PRO 140 HD3 PRO 140 218.506 -11.764 10.419 1009 H GLU 141 H GLU 141 222.940 -9.534 7.746 1010 HA GLU 141 HA GLU 141 221.597 -7.494 6.150 1011 HB2 GLU 141 HB2 GLU 141 222.650 -6.917 8.674 1012 HB3 GLU 141 HB3 GLU 141 223.869 -6.346 7.542 1013 HG2 GLU 141 HG2 GLU 141 222.563 -4.689 6.746 1014 HG3 GLU 141 HG3 GLU 141 221.074 -5.632 6.923 1015 H GLN 142 H GLN 142 222.391 -7.771 4.175 1016 HA GLN 142 HA GLN 142 225.283 -8.254 3.874 1017 HB2 GLN 142 HB2 GLN 142 223.175 -9.934 3.086 1018 HB3 GLN 142 HB3 GLN 142 223.759 -9.191 1.606 1019 HG2 GLN 142 HG2 GLN 142 225.413 -10.649 1.557 1020 HG3 GLN 142 HG3 GLN 142 226.039 -9.965 3.060 1021 HE21 GLN 142 HE21 GLN 142 226.354 -12.642 2.340 1022 HE22 GLN 142 HE22 GLN 142 225.466 -13.622 3.450 1023 H ILE 143 H ILE 143 226.325 -7.314 2.086 1024 HA ILE 143 HA ILE 143 224.827 -5.449 0.418 1025 HB ILE 143 HB ILE 143 225.369 -3.976 2.193 1026 HG12 ILE 143 HG12 ILE 143 226.120 -3.415 -0.299 1027 HG13 ILE 143 HG13 ILE 143 226.405 -2.295 1.026 1028 HG21 ILE 143 HG21 ILE 143 228.195 -5.006 2.112 1029 HG22 ILE 143 HG22 ILE 143 226.983 -5.406 3.327 1030 HG23 ILE 143 HG23 ILE 143 227.568 -3.752 3.180 1031 HD11 ILE 143 HD11 ILE 143 228.365 -2.442 -0.346 1032 HD12 ILE 143 HD12 ILE 143 228.398 -4.197 -0.185 1033 HD13 ILE 143 HD13 ILE 143 228.703 -3.176 1.219 1034 H MET 144 H MET 144 225.682 -5.239 -1.606 1035 HA MET 144 HA MET 144 228.445 -6.036 -2.096 1036 HB2 MET 144 HB2 MET 144 227.943 -7.666 -3.754 1037 HB3 MET 144 HB3 MET 144 226.995 -8.085 -2.336 1038 HG2 MET 144 HG2 MET 144 225.413 -8.353 -3.929 1039 HG3 MET 144 HG3 MET 144 225.162 -6.645 -3.573 1040 HE1 MET 144 HE1 MET 144 226.529 -8.629 -7.367 1041 HE2 MET 144 HE2 MET 144 226.276 -9.341 -5.774 1042 HE3 MET 144 HE3 MET 144 227.830 -8.608 -6.176 1043 H VAL 145 H VAL 145 229.304 -5.259 -4.082 1044 HA VAL 145 HA VAL 145 227.586 -3.411 -5.584 1045 HB VAL 145 HB VAL 145 229.344 -1.697 -5.613 1046 HG11 VAL 145 HG11 VAL 145 228.123 -0.853 -3.966 1047 HG12 VAL 145 HG12 VAL 145 229.224 -1.619 -2.823 1048 HG13 VAL 145 HG13 VAL 145 227.762 -2.458 -3.336 1049 HG21 VAL 145 HG21 VAL 145 230.780 -3.685 -3.900 1050 HG22 VAL 145 HG22 VAL 145 231.108 -1.962 -3.728 1051 HG23 VAL 145 HG23 VAL 145 231.376 -2.759 -5.276 1052 H SER 146 H SER 146 228.136 -3.095 -7.738 1053 HA SER 146 HA SER 146 230.398 -4.661 -8.770 1054 HB2 SER 146 HB2 SER 146 229.080 -5.664 -10.481 1055 HB3 SER 146 HB3 SER 146 228.174 -5.877 -8.983 1056 HG SER 146 HG SER 146 226.636 -5.037 -10.171 1057 H LYS 147 H LYS 147 231.175 -4.001 -10.857 1058 HA LYS 147 HA LYS 147 230.586 -1.176 -11.442 1059 HB2 LYS 147 HB2 LYS 147 232.857 -1.113 -12.471 1060 HB3 LYS 147 HB3 LYS 147 232.873 -1.463 -10.739 1061 HG2 LYS 147 HG2 LYS 147 233.647 -3.579 -11.035 1062 HG3 LYS 147 HG3 LYS 147 232.847 -3.776 -12.594 1063 HD2 LYS 147 HD2 LYS 147 234.506 -2.278 -13.619 1064 HD3 LYS 147 HD3 LYS 147 235.315 -2.121 -12.060 1065 HE2 LYS 147 HE2 LYS 147 236.354 -3.769 -13.644 1066 HE3 LYS 147 HE3 LYS 147 235.942 -4.411 -12.056 1067 HZ1 LYS 147 HZ1 LYS 147 233.959 -4.666 -14.199 1068 HZ2 LYS 147 HZ2 LYS 147 234.291 -5.707 -12.907 1069 HZ3 LYS 147 HZ3 LYS 147 235.314 -5.678 -14.253 1070 H CYS 148 H CYS 148 230.552 -0.484 -13.650 1071 HA CYS 148 HA CYS 148 229.362 -2.455 -15.409 1072 HB2 CYS 148 HB2 CYS 148 229.879 0.489 -15.884 1073 HB3 CYS 148 HB3 CYS 148 228.873 -0.561 -16.876 1074 HA PRO 149 HA PRO 149 232.990 -3.328 -17.772 1075 HB2 PRO 149 HB2 PRO 149 231.895 -3.970 -20.174 1076 HB3 PRO 149 HB3 PRO 149 231.802 -5.031 -18.757 1077 HG2 PRO 149 HG2 PRO 149 229.751 -3.147 -19.856 1078 HG3 PRO 149 HG3 PRO 149 229.539 -4.793 -19.233 1079 HD2 PRO 149 HD2 PRO 149 228.959 -2.583 -17.771 1080 HD3 PRO 149 HD3 PRO 149 229.531 -4.094 -17.037 Start of MODEL 7 1 H1 THR 1 H1 THR 1 215.345 -22.659 19.338 2 H2 THR 1 H2 THR 1 214.567 -21.174 18.971 3 H3 THR 1 H3 THR 1 214.709 -22.391 17.769 4 HA THR 1 HA THR 1 213.227 -23.787 18.845 5 HB THR 1 HB THR 1 213.073 -21.781 21.101 6 HG1 THR 1 HG1 THR 1 214.566 -24.192 21.093 7 HG21 THR 1 HG21 THR 1 211.587 -23.113 22.068 8 HG22 THR 1 HG22 THR 1 212.539 -24.558 21.726 9 HG23 THR 1 HG23 THR 1 211.437 -23.919 20.504 10 HA PRO 2 HA PRO 2 210.712 -20.580 16.706 11 HB2 PRO 2 HB2 PRO 2 209.444 -22.336 15.061 12 HB3 PRO 2 HB3 PRO 2 211.034 -21.654 14.704 13 HG2 PRO 2 HG2 PRO 2 210.330 -24.325 15.858 14 HG3 PRO 2 HG3 PRO 2 211.545 -23.919 14.632 15 HD2 PRO 2 HD2 PRO 2 212.181 -24.370 17.225 16 HD3 PRO 2 HD3 PRO 2 213.086 -23.236 16.201 17 H SER 3 H SER 3 209.086 -19.893 17.964 18 HA SER 3 HA SER 3 206.654 -21.350 18.158 19 HB2 SER 3 HB2 SER 3 208.401 -22.199 20.042 20 HB3 SER 3 HB3 SER 3 207.661 -20.847 20.900 21 HG SER 3 HG SER 3 206.667 -23.279 20.478 22 H ALA 4 H ALA 4 205.043 -20.177 19.579 23 HA ALA 4 HA ALA 4 203.868 -18.297 20.058 24 HB1 ALA 4 HB1 ALA 4 206.447 -16.859 20.574 25 HB2 ALA 4 HB2 ALA 4 205.851 -18.105 21.669 26 HB3 ALA 4 HB3 ALA 4 204.885 -16.661 21.369 27 H SER 5 H SER 5 203.379 -18.289 17.734 28 HA SER 5 HA SER 5 202.961 -17.187 15.797 29 HB2 SER 5 HB2 SER 5 202.824 -15.251 17.584 30 HB3 SER 5 HB3 SER 5 204.293 -14.696 16.780 31 HG SER 5 HG SER 5 203.125 -14.696 14.814 32 H GLY 6 H GLY 6 204.296 -18.304 14.424 33 HA2 GLY 6 HA2 GLY 6 206.887 -17.009 13.835 34 HA3 GLY 6 HA3 GLY 6 206.725 -18.757 13.887 35 H LEU 7 H LEU 7 204.616 -19.405 12.469 36 HA LEU 7 HA LEU 7 203.726 -19.650 10.394 37 HB2 LEU 7 HB2 LEU 7 203.361 -17.140 10.648 38 HB3 LEU 7 HB3 LEU 7 204.805 -16.929 9.679 39 HG LEU 7 HG LEU 7 202.483 -18.552 8.673 40 HD11 LEU 7 HD11 LEU 7 201.909 -16.128 9.391 41 HD12 LEU 7 HD12 LEU 7 201.412 -16.700 7.799 42 HD13 LEU 7 HD13 LEU 7 202.835 -15.673 7.962 43 HD21 LEU 7 HD21 LEU 7 204.032 -18.926 7.097 44 HD22 LEU 7 HD22 LEU 7 205.034 -17.574 7.622 45 HD23 LEU 7 HD23 LEU 7 203.656 -17.288 6.560 46 H THR 8 H THR 8 206.569 -17.644 9.605 47 HA THR 8 HA THR 8 208.265 -17.957 8.129 48 HB THR 8 HB THR 8 208.988 -19.215 10.160 49 HG1 THR 8 HG1 THR 8 210.491 -18.960 8.557 50 HG21 THR 8 HG21 THR 8 207.905 -21.559 8.641 51 HG22 THR 8 HG22 THR 8 207.616 -21.097 10.319 52 HG23 THR 8 HG23 THR 8 209.193 -21.720 9.834 53 H LYS 9 H LYS 9 209.325 -19.964 6.659 54 HA LYS 9 HA LYS 9 207.081 -20.760 4.922 55 HB2 LYS 9 HB2 LYS 9 208.969 -19.042 4.195 56 HB3 LYS 9 HB3 LYS 9 209.852 -20.522 3.840 57 HG2 LYS 9 HG2 LYS 9 208.750 -19.751 1.852 58 HG3 LYS 9 HG3 LYS 9 207.989 -21.248 2.394 59 HD2 LYS 9 HD2 LYS 9 206.059 -20.124 2.164 60 HD3 LYS 9 HD3 LYS 9 206.502 -19.345 3.686 61 HE2 LYS 9 HE2 LYS 9 206.719 -17.372 2.682 62 HE3 LYS 9 HE3 LYS 9 207.812 -18.049 1.477 63 HZ1 LYS 9 HZ1 LYS 9 204.968 -18.620 1.153 64 HZ2 LYS 9 HZ2 LYS 9 206.151 -18.314 -0.016 65 HZ3 LYS 9 HZ3 LYS 9 205.468 -17.032 0.849 66 H VAL 10 H VAL 10 206.703 -22.864 4.829 67 HA VAL 10 HA VAL 10 208.952 -24.738 4.827 68 HB VAL 10 HB VAL 10 207.667 -26.254 6.388 69 HG11 VAL 10 HG11 VAL 10 208.874 -25.500 8.154 70 HG12 VAL 10 HG12 VAL 10 208.306 -23.841 7.976 71 HG13 VAL 10 HG13 VAL 10 209.579 -24.456 6.921 72 HG21 VAL 10 HG21 VAL 10 206.091 -25.071 7.944 73 HG22 VAL 10 HG22 VAL 10 205.487 -25.299 6.303 74 HG23 VAL 10 HG23 VAL 10 206.091 -23.721 6.810 75 H ALA 11 H ALA 11 207.314 -23.865 2.685 76 HA ALA 11 HA ALA 11 205.174 -25.624 2.134 77 HB1 ALA 11 HB1 ALA 11 206.672 -24.534 -0.165 78 HB2 ALA 11 HB2 ALA 11 206.042 -23.357 0.989 79 HB3 ALA 11 HB3 ALA 11 204.945 -24.487 0.196 80 H THR 12 H THR 12 205.067 -27.577 1.148 81 HA THR 12 HA THR 12 207.594 -28.994 0.766 82 HB THR 12 HB THR 12 204.841 -30.217 0.659 83 HG1 THR 12 HG1 THR 12 204.737 -29.451 2.644 84 HG21 THR 12 HG21 THR 12 207.554 -31.312 1.347 85 HG22 THR 12 HG22 THR 12 206.525 -31.751 -0.016 86 HG23 THR 12 HG23 THR 12 206.040 -32.172 1.626 87 H VAL 13 H VAL 13 208.333 -29.670 -1.157 88 HA VAL 13 HA VAL 13 208.556 -29.976 -3.394 89 HB VAL 13 HB VAL 13 205.538 -30.108 -3.510 90 HG11 VAL 13 HG11 VAL 13 205.781 -31.227 -5.560 91 HG12 VAL 13 HG12 VAL 13 207.507 -31.491 -5.311 92 HG13 VAL 13 HG13 VAL 13 206.903 -29.871 -5.651 93 HG21 VAL 13 HG21 VAL 13 207.117 -31.736 -1.982 94 HG22 VAL 13 HG22 VAL 13 207.027 -32.628 -3.499 95 HG23 VAL 13 HG23 VAL 13 205.547 -32.180 -2.651 96 H SER 14 H SER 14 209.401 -27.943 -3.813 97 HA SER 14 HA SER 14 207.510 -25.903 -4.775 98 HB2 SER 14 HB2 SER 14 209.420 -24.304 -4.443 99 HB3 SER 14 HB3 SER 14 208.844 -25.058 -2.958 100 HG SER 14 HG SER 14 210.856 -25.607 -2.708 101 H ALA 15 H ALA 15 207.919 -24.814 -6.735 102 HA ALA 15 HA ALA 15 209.552 -26.361 -8.626 103 HB1 ALA 15 HB1 ALA 15 207.729 -26.247 -9.895 104 HB2 ALA 15 HB2 ALA 15 208.017 -24.515 -10.063 105 HB3 ALA 15 HB3 ALA 15 206.961 -25.113 -8.785 106 H ALA 16 H ALA 16 211.404 -25.548 -9.363 107 HA ALA 16 HA ALA 16 211.756 -22.636 -9.492 108 HB1 ALA 16 HB1 ALA 16 213.568 -22.547 -8.143 109 HB2 ALA 16 HB2 ALA 16 214.135 -24.147 -8.615 110 HB3 ALA 16 HB3 ALA 16 212.840 -23.986 -7.429 111 H SER 17 H SER 17 212.166 -22.182 -11.555 112 HA SER 17 HA SER 17 213.844 -24.045 -13.108 113 HB2 SER 17 HB2 SER 17 212.665 -22.952 -15.118 114 HB3 SER 17 HB3 SER 17 211.723 -24.080 -14.142 115 HG SER 17 HG SER 17 210.625 -22.086 -14.635 116 H SER 18 H SER 18 215.603 -23.264 -14.170 117 HA SER 18 HA SER 18 215.976 -20.495 -14.756 118 HB2 SER 18 HB2 SER 18 217.130 -21.617 -12.262 119 HB3 SER 18 HB3 SER 18 218.200 -20.612 -13.237 120 HG SER 18 HG SER 18 215.615 -19.857 -12.329 121 H LEU 19 H LEU 19 216.411 -21.244 -16.811 122 HA LEU 19 HA LEU 19 218.873 -22.833 -17.126 123 HB2 LEU 19 HB2 LEU 19 216.535 -22.491 -19.001 124 HB3 LEU 19 HB3 LEU 19 218.013 -23.337 -19.415 125 HG LEU 19 HG LEU 19 217.184 -24.550 -17.051 126 HD11 LEU 19 HD11 LEU 19 214.800 -24.288 -18.870 127 HD12 LEU 19 HD12 LEU 19 215.005 -23.356 -17.387 128 HD13 LEU 19 HD13 LEU 19 214.892 -25.114 -17.315 129 HD21 LEU 19 HD21 LEU 19 218.123 -25.925 -18.635 130 HD22 LEU 19 HD22 LEU 19 217.158 -25.254 -19.950 131 HD23 LEU 19 HD23 LEU 19 216.419 -26.355 -18.787 132 H ILE 20 H ILE 20 217.458 -19.750 -17.707 133 HA ILE 20 HA ILE 20 219.757 -19.010 -19.396 134 HB ILE 20 HB ILE 20 218.384 -17.222 -20.375 135 HG12 ILE 20 HG12 ILE 20 216.785 -17.181 -18.344 136 HG13 ILE 20 HG13 ILE 20 216.093 -16.920 -19.951 137 HG21 ILE 20 HG21 ILE 20 217.449 -20.058 -20.651 138 HG22 ILE 20 HG22 ILE 20 218.519 -19.136 -21.708 139 HG23 ILE 20 HG23 ILE 20 216.796 -18.761 -21.653 140 HD11 ILE 20 HD11 ILE 20 216.072 -19.719 -19.283 141 HD12 ILE 20 HD12 ILE 20 214.735 -18.647 -19.702 142 HD13 ILE 20 HD13 ILE 20 215.280 -18.764 -18.029 143 H GLY 21 H GLY 21 220.898 -17.180 -18.886 144 HA2 GLY 21 HA2 GLY 21 220.017 -15.702 -16.482 145 HA3 GLY 21 HA3 GLY 21 221.681 -16.269 -16.654 146 H GLU 22 H GLU 22 220.444 -13.542 -16.391 147 HA GLU 22 HA GLU 22 221.683 -12.337 -18.779 148 HB2 GLU 22 HB2 GLU 22 219.027 -12.053 -17.829 149 HB3 GLU 22 HB3 GLU 22 219.844 -10.528 -17.530 150 HG2 GLU 22 HG2 GLU 22 219.404 -11.916 -20.144 151 HG3 GLU 22 HG3 GLU 22 218.860 -10.320 -19.633 152 H GLY 23 H GLY 23 222.896 -10.469 -18.502 153 HA2 GLY 23 HA2 GLY 23 224.105 -10.221 -15.865 154 HA3 GLY 23 HA3 GLY 23 224.676 -9.472 -17.357 155 H PHE 24 H PHE 24 221.376 -9.218 -16.121 156 HA PHE 24 HA PHE 24 221.373 -6.388 -16.323 157 HB2 PHE 24 HB2 PHE 24 219.121 -6.478 -15.481 158 HB3 PHE 24 HB3 PHE 24 219.345 -7.845 -16.579 159 HD1 PHE 24 HD1 PHE 24 218.569 -6.797 -13.212 160 HD2 PHE 24 HD2 PHE 24 219.643 -10.135 -15.626 161 HE1 PHE 24 HE1 PHE 24 217.804 -8.322 -11.440 162 HE2 PHE 24 HE2 PHE 24 218.880 -11.664 -13.856 163 HZ PHE 24 HZ PHE 24 217.959 -10.757 -11.759 164 H MET 25 H MET 25 221.645 -8.632 -13.599 165 HA MET 25 HA MET 25 221.550 -6.716 -11.537 166 HB2 MET 25 HB2 MET 25 222.608 -8.453 -10.134 167 HB3 MET 25 HB3 MET 25 221.241 -9.066 -11.050 168 HG2 MET 25 HG2 MET 25 222.905 -9.939 -12.729 169 HG3 MET 25 HG3 MET 25 224.166 -9.524 -11.571 170 HE1 MET 25 HE1 MET 25 222.950 -12.019 -13.131 171 HE2 MET 25 HE2 MET 25 222.394 -13.341 -12.105 172 HE3 MET 25 HE3 MET 25 224.107 -12.930 -12.159 173 H ALA 26 H ALA 26 224.130 -7.758 -13.652 174 HA ALA 26 HA ALA 26 226.164 -6.373 -12.099 175 HB1 ALA 26 HB1 ALA 26 227.586 -7.133 -14.147 176 HB2 ALA 26 HB2 ALA 26 226.194 -8.163 -14.490 177 HB3 ALA 26 HB3 ALA 26 227.053 -8.322 -12.958 178 H GLN 27 H GLN 27 223.824 -5.186 -13.929 179 HA GLN 27 HA GLN 27 225.527 -3.313 -15.420 180 HB2 GLN 27 HB2 GLN 27 223.201 -4.726 -16.149 181 HB3 GLN 27 HB3 GLN 27 222.716 -3.043 -16.000 182 HG2 GLN 27 HG2 GLN 27 225.011 -4.037 -17.670 183 HG3 GLN 27 HG3 GLN 27 223.403 -3.652 -18.277 184 HE21 GLN 27 HE21 GLN 27 226.454 -2.503 -17.964 185 HE22 GLN 27 HE22 GLN 27 226.134 -0.798 -18.031 186 H CYS 28 H CYS 28 224.523 -3.365 -12.452 187 HA CYS 28 HA CYS 28 223.950 -1.848 -10.866 188 HB2 CYS 28 HB2 CYS 28 224.405 0.356 -12.865 189 HB3 CYS 28 HB3 CYS 28 224.702 0.367 -11.132 190 H ASP 29 H ASP 29 221.736 -2.919 -11.787 191 HA ASP 29 HA ASP 29 219.827 -0.765 -11.650 192 HB2 ASP 29 HB2 ASP 29 220.545 -1.181 -14.145 193 HB3 ASP 29 HB3 ASP 29 219.458 -2.570 -13.997 194 H ASN 30 H ASN 30 220.519 -3.143 -10.095 195 HA ASN 30 HA ASN 30 218.402 -5.051 -10.480 196 HB2 ASN 30 HB2 ASN 30 220.782 -5.333 -9.356 197 HB3 ASN 30 HB3 ASN 30 219.903 -4.849 -7.906 198 HD21 ASN 30 HD21 ASN 30 220.157 -6.852 -6.939 199 HD22 ASN 30 HD22 ASN 30 219.277 -8.252 -7.472 200 HA PRO 31 HA PRO 31 215.657 -2.537 -7.950 201 HB2 PRO 31 HB2 PRO 31 213.373 -3.668 -9.052 202 HB3 PRO 31 HB3 PRO 31 214.219 -2.220 -9.608 203 HG2 PRO 31 HG2 PRO 31 213.974 -4.688 -10.982 204 HG3 PRO 31 HG3 PRO 31 214.952 -3.288 -11.449 205 HD2 PRO 31 HD2 PRO 31 215.768 -5.787 -10.050 206 HD3 PRO 31 HD3 PRO 31 216.705 -4.742 -11.139 207 H THR 32 H THR 32 215.948 -3.386 -5.984 208 HA THR 32 HA THR 32 214.332 -5.745 -5.272 209 HB THR 32 HB THR 32 216.082 -5.547 -3.194 210 HG1 THR 32 HG1 THR 32 217.417 -4.040 -4.063 211 HG21 THR 32 HG21 THR 32 217.388 -7.102 -5.193 212 HG22 THR 32 HG22 THR 32 215.647 -7.361 -5.291 213 HG23 THR 32 HG23 THR 32 216.495 -7.634 -3.770 214 H ILE 33 H ILE 33 212.458 -4.719 -4.651 215 HA ILE 33 HA ILE 33 212.758 -2.969 -2.310 216 HB ILE 33 HB ILE 33 210.710 -1.707 -3.173 217 HG12 ILE 33 HG12 ILE 33 211.436 -2.024 -5.947 218 HG13 ILE 33 HG13 ILE 33 210.967 -3.581 -5.272 219 HG21 ILE 33 HG21 ILE 33 212.788 -0.928 -5.035 220 HG22 ILE 33 HG22 ILE 33 213.433 -1.275 -3.431 221 HG23 ILE 33 HG23 ILE 33 212.153 -0.078 -3.627 222 HD11 ILE 33 HD11 ILE 33 208.913 -2.349 -4.376 223 HD12 ILE 33 HD12 ILE 33 208.989 -2.706 -6.101 224 HD13 ILE 33 HD13 ILE 33 209.353 -1.080 -5.519 225 H GLU 34 H GLU 34 212.068 -4.253 -0.757 226 HA GLU 34 HA GLU 34 209.255 -4.981 -0.731 227 HB2 GLU 34 HB2 GLU 34 211.258 -6.915 -1.231 228 HB3 GLU 34 HB3 GLU 34 210.755 -7.150 0.437 229 HG2 GLU 34 HG2 GLU 34 208.693 -7.864 -0.136 230 HG3 GLU 34 HG3 GLU 34 208.599 -6.807 -1.544 231 H GLY 35 H GLY 35 208.681 -3.752 1.031 232 HA2 GLY 35 HA2 GLY 35 208.549 -3.777 3.453 233 HA3 GLY 35 HA3 GLY 35 210.257 -4.210 3.489 234 H ASP 36 H ASP 36 211.026 -2.559 4.693 235 HA ASP 36 HA ASP 36 211.780 -0.534 5.297 236 HB2 ASP 36 HB2 ASP 36 211.726 -0.461 2.343 237 HB3 ASP 36 HB3 ASP 36 211.789 1.113 3.142 238 H GLY 37 H GLY 37 209.753 0.795 2.754 239 HA2 GLY 37 HA2 GLY 37 207.483 1.575 3.110 240 HA3 GLY 37 HA3 GLY 37 207.888 1.815 4.802 241 HA PRO 38 HA PRO 38 208.927 6.061 4.298 242 HB2 PRO 38 HB2 PRO 38 211.765 5.552 5.041 243 HB3 PRO 38 HB3 PRO 38 210.587 6.666 5.760 244 HG2 PRO 38 HG2 PRO 38 211.244 4.411 7.004 245 HG3 PRO 38 HG3 PRO 38 209.567 4.989 7.002 246 HD2 PRO 38 HD2 PRO 38 210.824 2.805 5.387 247 HD3 PRO 38 HD3 PRO 38 209.223 2.863 6.152 248 H ILE 39 H ILE 39 208.714 6.065 2.010 249 HA ILE 39 HA ILE 39 210.886 5.565 0.243 250 HB ILE 39 HB ILE 39 208.616 7.412 -0.439 251 HG12 ILE 39 HG12 ILE 39 207.771 4.896 -1.234 252 HG13 ILE 39 HG13 ILE 39 208.414 4.616 0.380 253 HG21 ILE 39 HG21 ILE 39 209.425 7.216 -2.491 254 HG22 ILE 39 HG22 ILE 39 209.234 5.465 -2.426 255 HG23 ILE 39 HG23 ILE 39 210.733 6.208 -1.867 256 HD11 ILE 39 HD11 ILE 39 206.260 5.117 0.891 257 HD12 ILE 39 HD12 ILE 39 206.071 6.208 -0.482 258 HD13 ILE 39 HD13 ILE 39 206.958 6.736 0.947 259 H GLY 40 H GLY 40 212.084 7.109 -0.995 260 HA2 GLY 40 HA2 GLY 40 213.149 9.116 -1.415 261 HA3 GLY 40 HA3 GLY 40 211.999 9.904 -0.344 262 H LYS 41 H LYS 41 214.163 7.208 0.433 263 HA LYS 41 HA LYS 41 215.154 8.673 2.725 264 HB2 LYS 41 HB2 LYS 41 214.889 5.932 2.016 265 HB3 LYS 41 HB3 LYS 41 216.593 6.235 2.320 266 HG2 LYS 41 HG2 LYS 41 214.772 7.386 4.309 267 HG3 LYS 41 HG3 LYS 41 214.763 5.624 4.221 268 HD2 LYS 41 HD2 LYS 41 217.417 6.927 4.208 269 HD3 LYS 41 HD3 LYS 41 216.507 7.023 5.714 270 HE2 LYS 41 HE2 LYS 41 217.177 4.494 4.209 271 HE3 LYS 41 HE3 LYS 41 217.974 5.064 5.673 272 HZ1 LYS 41 HZ1 LYS 41 215.250 3.986 5.354 273 HZ2 LYS 41 HZ2 LYS 41 215.610 5.005 6.655 274 HZ3 LYS 41 HZ3 LYS 41 216.447 3.548 6.468 275 H THR 42 H THR 42 217.066 9.678 2.917 276 HA THR 42 HA THR 42 218.934 9.516 0.644 277 HB THR 42 HB THR 42 218.513 11.843 2.525 278 HG1 THR 42 HG1 THR 42 217.432 11.246 -0.012 279 HG21 THR 42 HG21 THR 42 219.681 13.145 0.786 280 HG22 THR 42 HG22 THR 42 220.059 11.639 -0.051 281 HG23 THR 42 HG23 THR 42 220.710 11.941 1.560 282 H LEU 43 H LEU 43 221.134 9.494 1.018 283 HA LEU 43 HA LEU 43 222.042 9.152 3.790 284 HB2 LEU 43 HB2 LEU 43 222.782 7.322 1.505 285 HB3 LEU 43 HB3 LEU 43 223.420 7.235 3.134 286 HG LEU 43 HG LEU 43 220.476 6.942 2.636 287 HD11 LEU 43 HD11 LEU 43 220.620 4.793 1.967 288 HD12 LEU 43 HD12 LEU 43 222.099 4.492 2.878 289 HD13 LEU 43 HD13 LEU 43 222.173 5.328 1.327 290 HD21 LEU 43 HD21 LEU 43 220.418 5.957 4.742 291 HD22 LEU 43 HD22 LEU 43 221.588 7.263 4.938 292 HD23 LEU 43 HD23 LEU 43 222.146 5.603 4.732 293 H TYR 44 H TYR 44 224.536 9.094 3.843 294 HA TYR 44 HA TYR 44 225.616 10.948 1.821 295 HB2 TYR 44 HB2 TYR 44 225.486 11.216 4.739 296 HB3 TYR 44 HB3 TYR 44 227.093 11.489 4.080 297 HD1 TYR 44 HD1 TYR 44 223.644 12.366 2.905 298 HD2 TYR 44 HD2 TYR 44 227.537 13.744 3.936 299 HE1 TYR 44 HE1 TYR 44 222.997 14.651 2.276 300 HE2 TYR 44 HE2 TYR 44 226.899 16.032 3.310 301 HH TYR 44 HH TYR 44 224.688 16.887 1.462 302 H VAL 45 H VAL 45 227.230 10.071 0.722 303 HA VAL 45 HA VAL 45 228.866 7.983 2.007 304 HB VAL 45 HB VAL 45 227.592 7.205 0.042 305 HG11 VAL 45 HG11 VAL 45 229.204 8.513 -1.981 306 HG12 VAL 45 HG12 VAL 45 228.237 9.663 -1.058 307 HG13 VAL 45 HG13 VAL 45 227.453 8.316 -1.881 308 HG21 VAL 45 HG21 VAL 45 229.353 5.812 0.123 309 HG22 VAL 45 HG22 VAL 45 230.519 7.127 0.252 310 HG23 VAL 45 HG23 VAL 45 229.878 6.671 -1.325 311 H VAL 46 H VAL 46 231.039 8.233 2.151 312 HA VAL 46 HA VAL 46 232.272 10.488 0.718 313 HB VAL 46 HB VAL 46 233.594 11.072 2.678 314 HG11 VAL 46 HG11 VAL 46 231.262 11.431 4.158 315 HG12 VAL 46 HG12 VAL 46 230.736 11.371 2.476 316 HG13 VAL 46 HG13 VAL 46 231.956 12.541 2.976 317 HG21 VAL 46 HG21 VAL 46 233.804 9.049 3.876 318 HG22 VAL 46 HG22 VAL 46 232.056 8.854 4.004 319 HG23 VAL 46 HG23 VAL 46 232.871 10.125 4.916 320 H GLY 47 H GLY 47 234.081 9.973 -0.335 321 HA2 GLY 47 HA2 GLY 47 235.280 7.334 0.191 322 HA3 GLY 47 HA3 GLY 47 235.430 8.255 -1.311 323 H ASP 48 H ASP 48 237.721 7.266 -0.371 324 HA ASP 48 HA ASP 48 239.227 9.632 0.225 325 HB2 ASP 48 HB2 ASP 48 238.743 9.283 2.485 326 HB3 ASP 48 HB3 ASP 48 238.836 7.525 2.336 327 H PHE 49 H PHE 49 240.218 9.169 -1.692 328 HA PHE 49 HA PHE 49 242.647 7.970 -1.774 329 HB2 PHE 49 HB2 PHE 49 240.616 5.940 -1.828 330 HB3 PHE 49 HB3 PHE 49 241.434 5.975 -3.392 331 HD1 PHE 49 HD1 PHE 49 241.403 4.146 -0.622 332 HD2 PHE 49 HD2 PHE 49 244.183 6.541 -2.782 333 HE1 PHE 49 HE1 PHE 49 243.258 2.830 0.313 334 HE2 PHE 49 HE2 PHE 49 246.042 5.228 -1.846 335 HZ PHE 49 HZ PHE 49 245.581 3.369 -0.299 336 H ALA 50 H ALA 50 240.157 7.149 -4.147 337 HA ALA 50 HA ALA 50 241.480 8.810 -6.143 338 HB1 ALA 50 HB1 ALA 50 239.017 7.308 -6.812 339 HB2 ALA 50 HB2 ALA 50 240.432 6.353 -6.365 340 HB3 ALA 50 HB3 ALA 50 240.521 7.481 -7.718 341 H ASP 51 H ASP 51 238.365 8.423 -4.523 342 HA ASP 51 HA ASP 51 237.650 11.148 -5.362 343 HB2 ASP 51 HB2 ASP 51 236.190 9.305 -6.314 344 HB3 ASP 51 HB3 ASP 51 235.668 8.975 -4.656 345 H ALA 52 H ALA 52 239.028 11.548 -3.418 346 HA ALA 52 HA ALA 52 237.846 11.011 -0.833 347 HB1 ALA 52 HB1 ALA 52 240.241 10.948 -0.958 348 HB2 ALA 52 HB2 ALA 52 239.778 12.339 0.019 349 HB3 ALA 52 HB3 ALA 52 240.295 12.568 -1.653 350 H SER 53 H SER 53 237.389 13.186 -3.294 351 HA SER 53 HA SER 53 237.094 15.684 -2.168 352 HB2 SER 53 HB2 SER 53 235.265 14.436 -4.229 353 HB3 SER 53 HB3 SER 53 235.478 16.163 -3.935 354 HG SER 53 HG SER 53 237.033 16.017 -5.328 355 H TRP 54 H TRP 54 235.097 12.876 -1.633 356 HA TRP 54 HA TRP 54 233.363 12.472 -0.230 357 HB2 TRP 54 HB2 TRP 54 234.379 15.075 0.878 358 HB3 TRP 54 HB3 TRP 54 232.867 14.390 1.496 359 HD1 TRP 54 HD1 TRP 54 235.643 11.981 0.545 360 HE1 TRP 54 HE1 TRP 54 236.603 10.902 2.676 361 HE3 TRP 54 HE3 TRP 54 233.290 14.880 4.032 362 HZ2 TRP 54 HZ2 TRP 54 236.384 11.245 5.474 363 HZ3 TRP 54 HZ3 TRP 54 233.717 14.438 6.414 364 HH2 TRP 54 HH2 TRP 54 235.231 12.658 7.118 365 H LYS 55 H LYS 55 232.381 12.840 -2.513 366 HA LYS 55 HA LYS 55 230.529 15.102 -2.558 367 HB2 LYS 55 HB2 LYS 55 231.052 12.997 -4.672 368 HB3 LYS 55 HB3 LYS 55 230.038 14.422 -4.861 369 HG2 LYS 55 HG2 LYS 55 231.780 15.666 -5.425 370 HG3 LYS 55 HG3 LYS 55 232.663 15.185 -3.975 371 HD2 LYS 55 HD2 LYS 55 234.011 14.470 -5.760 372 HD3 LYS 55 HD3 LYS 55 233.178 13.014 -5.214 373 HE2 LYS 55 HE2 LYS 55 233.180 13.135 -7.641 374 HE3 LYS 55 HE3 LYS 55 231.539 13.283 -7.014 375 HZ1 LYS 55 HZ1 LYS 55 233.018 15.761 -7.475 376 HZ2 LYS 55 HZ2 LYS 55 231.374 15.425 -7.691 377 HZ3 LYS 55 HZ3 LYS 55 232.499 14.909 -8.843 378 H GLN 56 H GLN 56 228.492 14.913 -1.913 379 HA GLN 56 HA GLN 56 227.295 12.220 -1.811 380 HB2 GLN 56 HB2 GLN 56 226.766 14.568 0.023 381 HB3 GLN 56 HB3 GLN 56 225.940 13.018 0.095 382 HG2 GLN 56 HG2 GLN 56 227.478 12.558 1.655 383 HG3 GLN 56 HG3 GLN 56 228.502 12.198 0.256 384 HE21 GLN 56 HE21 GLN 56 229.412 12.988 2.830 385 HE22 GLN 56 HE22 GLN 56 230.226 14.501 2.655 386 H LYS 57 H LYS 57 226.885 13.041 -4.143 387 HA LYS 57 HA LYS 57 224.962 15.017 -4.664 388 HB2 LYS 57 HB2 LYS 57 226.495 13.232 -6.173 389 HB3 LYS 57 HB3 LYS 57 224.829 12.812 -6.547 390 HG2 LYS 57 HG2 LYS 57 224.674 14.538 -7.916 391 HG3 LYS 57 HG3 LYS 57 225.080 15.647 -6.603 392 HD2 LYS 57 HD2 LYS 57 227.255 14.110 -7.961 393 HD3 LYS 57 HD3 LYS 57 226.575 15.536 -8.748 394 HE2 LYS 57 HE2 LYS 57 227.443 15.684 -5.892 395 HE3 LYS 57 HE3 LYS 57 228.647 15.768 -7.176 396 HZ1 LYS 57 HZ1 LYS 57 227.945 17.802 -7.823 397 HZ2 LYS 57 HZ2 LYS 57 227.410 17.900 -6.223 398 HZ3 LYS 57 HZ3 LYS 57 226.320 17.505 -7.453 399 HA PRO 58 HA PRO 58 221.186 13.175 -3.275 400 HB2 PRO 58 HB2 PRO 58 219.430 14.370 -5.015 401 HB3 PRO 58 HB3 PRO 58 220.108 15.164 -3.581 402 HG2 PRO 58 HG2 PRO 58 220.934 15.386 -6.447 403 HG3 PRO 58 HG3 PRO 58 220.825 16.648 -5.207 404 HD2 PRO 58 HD2 PRO 58 223.179 15.542 -5.949 405 HD3 PRO 58 HD3 PRO 58 222.872 16.106 -4.293 406 H HIS 59 H HIS 59 221.368 13.418 -6.851 407 HA HIS 59 HA HIS 59 219.724 11.165 -7.317 408 HB2 HIS 59 HB2 HIS 59 220.895 13.150 -8.889 409 HB3 HIS 59 HB3 HIS 59 221.625 11.642 -9.460 410 HD1 HIS 59 HD1 HIS 59 219.315 13.596 -10.790 411 HD2 HIS 59 HD2 HIS 59 218.915 9.756 -9.251 412 HE1 HIS 59 HE1 HIS 59 217.271 12.636 -11.898 413 HE2 HIS 59 HE2 HIS 59 216.982 10.359 -10.859 414 H ARG 60 H ARG 60 222.887 11.307 -6.137 415 HA ARG 60 HA ARG 60 223.662 8.731 -7.265 416 HB2 ARG 60 HB2 ARG 60 225.129 10.737 -5.549 417 HB3 ARG 60 HB3 ARG 60 225.795 9.165 -5.967 418 HG2 ARG 60 HG2 ARG 60 224.958 11.245 -7.977 419 HG3 ARG 60 HG3 ARG 60 226.607 11.021 -7.394 420 HD2 ARG 60 HD2 ARG 60 226.950 9.243 -8.712 421 HD3 ARG 60 HD3 ARG 60 225.367 8.549 -8.332 422 HE ARG 60 HE ARG 60 224.516 9.512 -10.231 423 HH11 ARG 60 HH11 ARG 60 227.674 10.887 -9.588 424 HH12 ARG 60 HH12 ARG 60 227.769 11.696 -11.115 425 HH21 ARG 60 HH21 ARG 60 224.647 10.585 -12.240 426 HH22 ARG 60 HH22 ARG 60 226.050 11.526 -12.620 427 H ALA 61 H ALA 61 222.345 10.104 -4.360 428 HA ALA 61 HA ALA 61 222.331 7.427 -3.153 429 HB1 ALA 61 HB1 ALA 61 222.801 8.521 -0.914 430 HB2 ALA 61 HB2 ALA 61 223.333 9.933 -1.826 431 HB3 ALA 61 HB3 ALA 61 224.164 8.391 -2.026 432 H TYR 62 H TYR 62 220.116 7.906 -4.235 433 HA TYR 62 HA TYR 62 218.321 8.866 -2.118 434 HB2 TYR 62 HB2 TYR 62 218.689 10.062 -4.744 435 HB3 TYR 62 HB3 TYR 62 217.022 9.575 -4.477 436 HD1 TYR 62 HD1 TYR 62 215.600 11.089 -3.477 437 HD2 TYR 62 HD2 TYR 62 219.773 11.393 -2.698 438 HE1 TYR 62 HE1 TYR 62 215.205 13.145 -2.189 439 HE2 TYR 62 HE2 TYR 62 219.386 13.447 -1.408 440 HH TYR 62 HH TYR 62 216.914 15.306 -1.602 441 H ARG 63 H ARG 63 219.139 6.164 -3.341 442 HA ARG 63 HA ARG 63 216.471 5.284 -4.221 443 HB2 ARG 63 HB2 ARG 63 219.232 4.360 -4.813 444 HB3 ARG 63 HB3 ARG 63 217.991 3.120 -4.705 445 HG2 ARG 63 HG2 ARG 63 217.364 5.486 -6.365 446 HG3 ARG 63 HG3 ARG 63 218.601 4.385 -6.970 447 HD2 ARG 63 HD2 ARG 63 215.764 3.686 -6.218 448 HD3 ARG 63 HD3 ARG 63 216.439 3.744 -7.845 449 HE ARG 63 HE ARG 63 216.617 1.586 -5.991 450 HH11 ARG 63 HH11 ARG 63 218.364 3.173 -8.580 451 HH12 ARG 63 HH12 ARG 63 219.212 1.740 -9.053 452 HH21 ARG 63 HH21 ARG 63 217.736 -0.301 -6.624 453 HH22 ARG 63 HH22 ARG 63 218.855 -0.232 -7.942 454 H TYR 64 H TYR 64 215.242 4.438 -2.682 455 HA TYR 64 HA TYR 64 216.537 3.058 -0.440 456 HB2 TYR 64 HB2 TYR 64 214.768 3.633 0.927 457 HB3 TYR 64 HB3 TYR 64 214.788 5.015 -0.176 458 HD1 TYR 64 HD1 TYR 64 213.290 4.388 -2.444 459 HD2 TYR 64 HD2 TYR 64 212.682 2.933 1.510 460 HE1 TYR 64 HE1 TYR 64 210.931 3.946 -2.973 461 HE2 TYR 64 HE2 TYR 64 210.321 2.497 0.992 462 HH TYR 64 HH TYR 64 208.646 2.921 -0.511 463 H VAL 65 H VAL 65 216.575 0.915 -0.452 464 HA VAL 65 HA VAL 65 214.549 -0.476 -2.070 465 HB VAL 65 HB VAL 65 216.366 -2.415 -1.826 466 HG11 VAL 65 HG11 VAL 65 216.907 -0.301 -3.875 467 HG12 VAL 65 HG12 VAL 65 215.378 -1.180 -3.876 468 HG13 VAL 65 HG13 VAL 65 216.898 -2.055 -4.052 469 HG21 VAL 65 HG21 VAL 65 218.186 -0.042 -2.088 470 HG22 VAL 65 HG22 VAL 65 218.590 -1.733 -1.785 471 HG23 VAL 65 HG23 VAL 65 217.846 -0.763 -0.513 472 H GLY 66 H GLY 66 213.098 -1.622 -1.026 473 HA2 GLY 66 HA2 GLY 66 212.826 -1.766 1.708 474 HA3 GLY 66 HA3 GLY 66 212.044 -2.871 0.583 475 H GLU 67 H GLU 67 212.599 -3.786 3.032 476 HA GLU 67 HA GLU 67 213.415 -5.689 3.990 477 HB2 GLU 67 HB2 GLU 67 213.987 -6.123 1.301 478 HB3 GLU 67 HB3 GLU 67 215.537 -6.368 2.106 479 HG2 GLU 67 HG2 GLU 67 213.193 -7.665 3.347 480 HG3 GLU 67 HG3 GLU 67 213.705 -8.293 1.780 481 H ASN 68 H ASN 68 214.480 -3.017 4.376 482 HA ASN 68 HA ASN 68 216.097 -1.951 5.552 483 HB2 ASN 68 HB2 ASN 68 217.153 -4.703 6.222 484 HB3 ASN 68 HB3 ASN 68 217.451 -3.210 7.104 485 HD21 ASN 68 HD21 ASN 68 216.184 -5.852 7.797 486 HD22 ASN 68 HD22 ASN 68 214.668 -5.421 8.524 487 H THR 69 H THR 69 216.560 -2.921 2.709 488 HA THR 69 HA THR 69 219.481 -3.040 2.652 489 HB THR 69 HB THR 69 219.212 -3.552 0.264 490 HG1 THR 69 HG1 THR 69 217.093 -3.820 -0.556 491 HG21 THR 69 HG21 THR 69 219.029 -5.656 0.890 492 HG22 THR 69 HG22 THR 69 217.275 -5.467 0.877 493 HG23 THR 69 HG23 THR 69 218.184 -5.195 2.364 494 H TYR 70 H TYR 70 220.698 -1.613 1.281 495 HA TYR 70 HA TYR 70 219.343 0.943 0.724 496 HB2 TYR 70 HB2 TYR 70 222.115 0.607 1.897 497 HB3 TYR 70 HB3 TYR 70 221.353 2.139 1.478 498 HD1 TYR 70 HD1 TYR 70 220.700 -0.887 3.590 499 HD2 TYR 70 HD2 TYR 70 220.314 3.329 3.167 500 HE1 TYR 70 HE1 TYR 70 219.734 -0.755 5.844 501 HE2 TYR 70 HE2 TYR 70 219.350 3.472 5.423 502 HH TYR 70 HH TYR 70 219.450 0.901 7.638 503 H GLN 71 H GLN 71 219.741 1.814 -1.240 504 HA GLN 71 HA GLN 71 221.954 0.694 -2.824 505 HB2 GLN 71 HB2 GLN 71 219.751 -0.310 -3.475 506 HB3 GLN 71 HB3 GLN 71 219.205 1.300 -3.927 507 HG2 GLN 71 HG2 GLN 71 220.075 1.011 -5.938 508 HG3 GLN 71 HG3 GLN 71 221.675 0.890 -5.213 509 HE21 GLN 71 HE21 GLN 71 221.389 -1.504 -3.821 510 HE22 GLN 71 HE22 GLN 71 221.227 -2.796 -4.971 511 H ALA 72 H ALA 72 223.211 2.165 -3.778 512 HA ALA 72 HA ALA 72 222.118 4.750 -4.503 513 HB1 ALA 72 HB1 ALA 72 224.155 5.843 -3.314 514 HB2 ALA 72 HB2 ALA 72 224.118 4.392 -2.316 515 HB3 ALA 72 HB3 ALA 72 222.708 5.449 -2.387 516 H VAL 73 H VAL 73 223.017 5.503 -6.329 517 HA VAL 73 HA VAL 73 225.128 3.976 -7.590 518 HB VAL 73 HB VAL 73 223.755 6.463 -8.627 519 HG11 VAL 73 HG11 VAL 73 224.774 4.381 -10.453 520 HG12 VAL 73 HG12 VAL 73 225.992 5.322 -9.593 521 HG13 VAL 73 HG13 VAL 73 224.798 6.137 -10.602 522 HG21 VAL 73 HG21 VAL 73 222.445 4.169 -8.033 523 HG22 VAL 73 HG22 VAL 73 222.955 3.837 -9.687 524 HG23 VAL 73 HG23 VAL 73 221.983 5.267 -9.334 525 H VAL 74 H VAL 74 227.240 4.479 -7.527 526 HA VAL 74 HA VAL 74 227.980 7.258 -6.871 527 HB VAL 74 HB VAL 74 229.525 4.837 -5.936 528 HG11 VAL 74 HG11 VAL 74 230.413 6.679 -4.338 529 HG12 VAL 74 HG12 VAL 74 229.793 7.794 -5.555 530 HG13 VAL 74 HG13 VAL 74 231.022 6.608 -5.992 531 HG21 VAL 74 HG21 VAL 74 227.458 6.493 -4.504 532 HG22 VAL 74 HG22 VAL 74 228.640 5.492 -3.660 533 HG23 VAL 74 HG23 VAL 74 227.471 4.747 -4.751 534 H ASP 75 H ASP 75 229.652 8.153 -7.991 535 HA ASP 75 HA ASP 75 230.847 6.495 -10.117 536 HB2 ASP 75 HB2 ASP 75 229.259 8.708 -10.464 537 HB3 ASP 75 HB3 ASP 75 230.880 9.414 -10.515 538 H GLU 76 H GLU 76 232.986 6.218 -10.002 539 HA GLU 76 HA GLU 76 234.627 8.283 -8.722 540 HB2 GLU 76 HB2 GLU 76 234.560 5.360 -8.006 541 HB3 GLU 76 HB3 GLU 76 235.955 6.373 -7.658 542 HG2 GLU 76 HG2 GLU 76 233.965 7.888 -6.633 543 HG3 GLU 76 HG3 GLU 76 233.319 6.271 -6.367 544 H LYS 77 H LYS 77 236.973 7.914 -9.082 545 HA LYS 77 HA LYS 77 237.417 7.325 -11.885 546 HB2 LYS 77 HB2 LYS 77 239.826 8.099 -11.194 547 HB3 LYS 77 HB3 LYS 77 238.533 9.272 -11.372 548 HG2 LYS 77 HG2 LYS 77 238.950 8.112 -8.678 549 HG3 LYS 77 HG3 LYS 77 240.166 9.240 -9.280 550 HD2 LYS 77 HD2 LYS 77 237.337 10.041 -9.615 551 HD3 LYS 77 HD3 LYS 77 237.955 10.015 -7.961 552 HE2 LYS 77 HE2 LYS 77 239.669 11.569 -8.483 553 HE3 LYS 77 HE3 LYS 77 239.383 11.406 -10.215 554 HZ1 LYS 77 HZ1 LYS 77 238.466 13.467 -9.201 555 HZ2 LYS 77 HZ2 LYS 77 237.383 12.511 -8.320 556 HZ3 LYS 77 HZ3 LYS 77 237.314 12.527 -10.010 557 H ALA 78 H ALA 78 239.639 6.287 -12.396 558 HA ALA 78 HA ALA 78 239.528 3.576 -11.635 559 HB1 ALA 78 HB1 ALA 78 240.453 4.537 -13.784 560 HB2 ALA 78 HB2 ALA 78 241.392 3.241 -13.045 561 HB3 ALA 78 HB3 ALA 78 241.917 4.916 -12.876 562 H GLY 79 H GLY 79 240.531 2.417 -10.098 563 HA2 GLY 79 HA2 GLY 79 242.639 2.109 -8.817 564 HA3 GLY 79 HA3 GLY 79 242.507 3.822 -8.418 565 H ALA 80 H ALA 80 242.612 1.400 -6.708 566 HA ALA 80 HA ALA 80 240.075 0.917 -5.563 567 HB1 ALA 80 HB1 ALA 80 242.192 -0.478 -5.316 568 HB2 ALA 80 HB2 ALA 80 241.200 -0.273 -3.874 569 HB3 ALA 80 HB3 ALA 80 242.672 0.676 -4.071 570 H PHE 81 H PHE 81 238.959 1.906 -3.951 571 HA PHE 81 HA PHE 81 240.214 4.104 -2.478 572 HB2 PHE 81 HB2 PHE 81 238.077 5.459 -2.911 573 HB3 PHE 81 HB3 PHE 81 239.249 5.352 -4.224 574 HD1 PHE 81 HD1 PHE 81 238.573 4.641 -6.327 575 HD2 PHE 81 HD2 PHE 81 236.127 3.782 -2.952 576 HE1 PHE 81 HE1 PHE 81 236.813 3.790 -7.821 577 HE2 PHE 81 HE2 PHE 81 234.365 2.930 -4.440 578 HZ PHE 81 HZ PHE 81 234.706 2.935 -6.877 579 H ARG 82 H ARG 82 239.295 4.579 -0.498 580 HA ARG 82 HA ARG 82 237.430 2.540 0.513 581 HB2 ARG 82 HB2 ARG 82 239.693 4.044 1.689 582 HB3 ARG 82 HB3 ARG 82 238.309 3.808 2.747 583 HG2 ARG 82 HG2 ARG 82 238.450 1.349 2.170 584 HG3 ARG 82 HG3 ARG 82 240.013 1.716 1.430 585 HD2 ARG 82 HD2 ARG 82 240.303 2.919 3.837 586 HD3 ARG 82 HD3 ARG 82 239.238 1.584 4.272 587 HE ARG 82 HE ARG 82 240.953 0.105 3.862 588 HH11 ARG 82 HH11 ARG 82 241.858 3.282 2.698 589 HH12 ARG 82 HH12 ARG 82 243.506 2.842 2.405 590 HH21 ARG 82 HH21 ARG 82 243.125 -0.475 3.459 591 HH22 ARG 82 HH22 ARG 82 244.224 0.709 2.835 592 H MET 83 H MET 83 235.422 3.093 1.203 593 HA MET 83 HA MET 83 234.855 5.932 1.687 594 HB2 MET 83 HB2 MET 83 232.786 5.808 0.394 595 HB3 MET 83 HB3 MET 83 234.183 5.465 -0.616 596 HG2 MET 83 HG2 MET 83 232.948 3.096 0.580 597 HG3 MET 83 HG3 MET 83 231.909 3.984 -0.534 598 HE1 MET 83 HE1 MET 83 233.478 1.246 -0.106 599 HE2 MET 83 HE2 MET 83 234.911 1.007 -1.107 600 HE3 MET 83 HE3 MET 83 233.309 0.709 -1.777 601 H GLN 84 H GLN 84 232.714 6.280 2.738 602 HA GLN 84 HA GLN 84 231.755 4.004 4.304 603 HB2 GLN 84 HB2 GLN 84 233.593 5.474 5.482 604 HB3 GLN 84 HB3 GLN 84 232.256 6.583 5.738 605 HG2 GLN 84 HG2 GLN 84 231.091 4.369 6.629 606 HG3 GLN 84 HG3 GLN 84 232.779 3.917 6.922 607 HE21 GLN 84 HE21 GLN 84 230.533 6.628 7.409 608 HE22 GLN 84 HE22 GLN 84 231.147 7.076 8.971 609 H TYR 85 H TYR 85 229.648 4.303 5.199 610 HA TYR 85 HA TYR 85 228.156 6.530 3.975 611 HB2 TYR 85 HB2 TYR 85 227.771 3.717 3.734 612 HB3 TYR 85 HB3 TYR 85 226.400 4.380 4.616 613 HD1 TYR 85 HD1 TYR 85 227.266 3.409 1.504 614 HD2 TYR 85 HD2 TYR 85 225.798 6.882 3.474 615 HE1 TYR 85 HE1 TYR 85 226.284 4.189 -0.611 616 HE2 TYR 85 HE2 TYR 85 224.815 7.670 1.368 617 HH TYR 85 HH TYR 85 223.985 6.458 -0.841 618 H ALA 86 H ALA 86 226.667 7.630 5.182 619 HA ALA 86 HA ALA 86 225.854 6.760 7.792 620 HB1 ALA 86 HB1 ALA 86 228.082 7.566 8.349 621 HB2 ALA 86 HB2 ALA 86 226.853 8.624 9.044 622 HB3 ALA 86 HB3 ALA 86 227.725 9.120 7.593 623 H SER 87 H SER 87 223.945 7.665 8.340 624 HA SER 87 HA SER 87 222.733 9.509 6.473 625 HB2 SER 87 HB2 SER 87 221.814 7.558 8.377 626 HB3 SER 87 HB3 SER 87 221.006 9.106 8.676 627 HG SER 87 HG SER 87 219.775 8.271 7.128 628 H LYS 88 H LYS 88 221.734 11.509 7.059 629 HA LYS 88 HA LYS 88 223.362 13.160 8.682 630 HB2 LYS 88 HB2 LYS 88 221.735 14.929 8.193 631 HB3 LYS 88 HB3 LYS 88 222.185 14.047 6.744 632 HG2 LYS 88 HG2 LYS 88 220.088 12.754 6.911 633 HG3 LYS 88 HG3 LYS 88 219.633 13.724 8.313 634 HD2 LYS 88 HD2 LYS 88 220.368 15.078 5.751 635 HD3 LYS 88 HD3 LYS 88 218.765 14.360 5.930 636 HE2 LYS 88 HE2 LYS 88 218.693 15.682 8.158 637 HE3 LYS 88 HE3 LYS 88 220.007 16.622 7.452 638 HZ1 LYS 88 HZ1 LYS 88 217.465 17.242 7.112 639 HZ2 LYS 88 HZ2 LYS 88 217.648 16.208 5.787 640 HZ3 LYS 88 HZ3 LYS 88 218.640 17.569 5.941 641 H ASP 89 H ASP 89 220.394 11.406 9.305 642 HA ASP 89 HA ASP 89 220.059 12.733 11.890 643 HB2 ASP 89 HB2 ASP 89 218.341 10.939 10.206 644 HB3 ASP 89 HB3 ASP 89 218.010 11.097 11.937 645 H TRP 90 H TRP 90 222.343 10.948 11.387 646 HA TRP 90 HA TRP 90 223.498 9.242 12.344 647 HB2 TRP 90 HB2 TRP 90 221.669 10.107 14.567 648 HB3 TRP 90 HB3 TRP 90 222.812 8.791 14.800 649 HD1 TRP 90 HD1 TRP 90 225.301 10.029 13.253 650 HE1 TRP 90 HE1 TRP 90 226.567 12.018 14.284 651 HE3 TRP 90 HE3 TRP 90 221.655 11.781 16.380 652 HZ2 TRP 90 HZ2 TRP 90 226.085 14.060 16.172 653 HZ3 TRP 90 HZ3 TRP 90 222.139 13.754 17.767 654 HH2 TRP 90 HH2 TRP 90 224.310 14.869 17.665 655 H SER 91 H SER 91 221.482 8.369 10.633 656 HA SER 91 HA SER 91 220.080 6.176 11.918 657 HB2 SER 91 HB2 SER 91 219.788 7.676 9.482 658 HB3 SER 91 HB3 SER 91 219.889 5.959 9.094 659 HG SER 91 HG SER 91 217.770 6.353 9.517 660 HA PRO 92 HA PRO 92 222.555 2.590 11.176 661 HB2 PRO 92 HB2 PRO 92 221.320 1.610 8.772 662 HB3 PRO 92 HB3 PRO 92 221.135 1.004 10.426 663 HG2 PRO 92 HG2 PRO 92 219.398 2.829 8.882 664 HG3 PRO 92 HG3 PRO 92 218.994 1.771 10.243 665 HD2 PRO 92 HD2 PRO 92 219.105 4.439 10.511 666 HD3 PRO 92 HD3 PRO 92 219.628 3.349 11.820 667 H GLN 93 H GLN 93 224.565 2.636 10.411 668 HA GLN 93 HA GLN 93 225.084 3.948 7.834 669 HB2 GLN 93 HB2 GLN 93 226.890 3.405 10.195 670 HB3 GLN 93 HB3 GLN 93 227.432 4.126 8.688 671 HG2 GLN 93 HG2 GLN 93 226.793 6.132 9.360 672 HG3 GLN 93 HG3 GLN 93 225.156 5.556 9.674 673 HE21 GLN 93 HE21 GLN 93 228.130 6.536 11.031 674 HE22 GLN 93 HE22 GLN 93 227.713 6.289 12.699 675 H PHE 94 H PHE 94 227.394 3.051 6.975 676 HA PHE 94 HA PHE 94 227.209 0.117 6.880 677 HB2 PHE 94 HB2 PHE 94 226.367 0.497 4.790 678 HB3 PHE 94 HB3 PHE 94 227.116 2.081 4.658 679 HD1 PHE 94 HD1 PHE 94 228.404 -1.410 5.037 680 HD2 PHE 94 HD2 PHE 94 228.492 2.233 2.843 681 HE1 PHE 94 HE1 PHE 94 230.129 -2.348 3.555 682 HE2 PHE 94 HE2 PHE 94 230.215 1.303 1.357 683 HZ PHE 94 HZ PHE 94 231.038 -0.989 1.711 684 H THR 95 H THR 95 229.039 -0.843 7.444 685 HA THR 95 HA THR 95 231.612 0.269 6.698 686 HB THR 95 HB THR 95 232.044 -0.395 9.375 687 HG1 THR 95 HG1 THR 95 229.848 -0.219 9.834 688 HG21 THR 95 HG21 THR 95 232.151 2.017 7.746 689 HG22 THR 95 HG22 THR 95 233.291 1.392 8.938 690 HG23 THR 95 HG23 THR 95 231.883 2.318 9.462 691 H ALA 96 H ALA 96 232.986 -1.325 6.156 692 HA ALA 96 HA ALA 96 232.302 -4.070 6.985 693 HB1 ALA 96 HB1 ALA 96 233.985 -3.257 4.617 694 HB2 ALA 96 HB2 ALA 96 232.254 -3.580 4.536 695 HB3 ALA 96 HB3 ALA 96 233.372 -4.866 4.993 696 H ASP 97 H ASP 97 233.472 -4.644 8.687 697 HA ASP 97 HA ASP 97 235.933 -3.520 9.444 698 HB2 ASP 97 HB2 ASP 97 234.157 -5.628 10.401 699 HB3 ASP 97 HB3 ASP 97 235.864 -5.998 10.684 700 H GLY 98 H GLY 98 237.481 -3.595 7.877 701 HA2 GLY 98 HA2 GLY 98 239.178 -4.436 6.581 702 HA3 GLY 98 HA3 GLY 98 239.231 -5.737 7.774 703 H LEU 99 H LEU 99 237.765 -4.705 4.717 704 HA LEU 99 HA LEU 99 237.425 -7.552 4.056 705 HB2 LEU 99 HB2 LEU 99 235.254 -6.400 4.595 706 HB3 LEU 99 HB3 LEU 99 235.520 -5.372 3.203 707 HG LEU 99 HG LEU 99 233.944 -7.316 2.867 708 HD11 LEU 99 HD11 LEU 99 236.207 -7.600 0.956 709 HD12 LEU 99 HD12 LEU 99 235.389 -6.044 1.094 710 HD13 LEU 99 HD13 LEU 99 234.474 -7.484 0.650 711 HD21 LEU 99 HD21 LEU 99 234.857 -9.511 2.526 712 HD22 LEU 99 HD22 LEU 99 235.299 -8.957 4.141 713 HD23 LEU 99 HD23 LEU 99 236.490 -8.928 2.841 714 H GLU 100 H GLU 100 236.837 -4.587 2.164 715 HA GLU 100 HA GLU 100 237.699 -3.817 0.212 716 HB2 GLU 100 HB2 GLU 100 240.142 -5.507 0.731 717 HB3 GLU 100 HB3 GLU 100 240.028 -4.032 -0.212 718 HG2 GLU 100 HG2 GLU 100 239.553 -2.789 1.818 719 HG3 GLU 100 HG3 GLU 100 239.738 -4.271 2.751 720 H LEU 101 H LEU 101 236.701 -4.514 -1.594 721 HA LEU 101 HA LEU 101 237.515 -7.076 -2.732 722 HB2 LEU 101 HB2 LEU 101 235.292 -7.895 -3.071 723 HB3 LEU 101 HB3 LEU 101 235.530 -7.562 -1.359 724 HG LEU 101 HG LEU 101 233.326 -6.881 -1.892 725 HD11 LEU 101 HD11 LEU 101 234.882 -5.267 -0.600 726 HD12 LEU 101 HD12 LEU 101 233.289 -4.718 -1.116 727 HD13 LEU 101 HD13 LEU 101 234.721 -4.248 -2.032 728 HD21 LEU 101 HD21 LEU 101 233.899 -4.854 -3.902 729 HD22 LEU 101 HD22 LEU 101 232.636 -6.082 -3.852 730 HD23 LEU 101 HD23 LEU 101 234.242 -6.496 -4.444 731 H THR 102 H THR 102 237.191 -7.331 -4.928 732 HA THR 102 HA THR 102 237.269 -4.895 -6.456 733 HB THR 102 HB THR 102 237.340 -7.806 -7.291 734 HG1 THR 102 HG1 THR 102 239.169 -7.309 -6.174 735 HG21 THR 102 HG21 THR 102 238.074 -7.196 -9.431 736 HG22 THR 102 HG22 THR 102 238.247 -5.499 -8.980 737 HG23 THR 102 HG23 THR 102 236.641 -6.214 -9.127 738 HA PRO 103 HA PRO 103 233.042 -4.243 -7.634 739 HB2 PRO 103 HB2 PRO 103 234.137 -4.335 -10.421 740 HB3 PRO 103 HB3 PRO 103 233.024 -3.172 -9.691 741 HG2 PRO 103 HG2 PRO 103 235.591 -2.563 -10.015 742 HG3 PRO 103 HG3 PRO 103 234.713 -2.064 -8.551 743 HD2 PRO 103 HD2 PRO 103 236.755 -4.194 -8.902 744 HD3 PRO 103 HD3 PRO 103 236.381 -3.213 -7.473 745 H GLY 104 H GLY 104 231.441 -5.675 -7.790 746 HA2 GLY 104 HA2 GLY 104 230.174 -7.413 -8.705 747 HA3 GLY 104 HA3 GLY 104 231.549 -7.842 -9.732 748 H LYS 105 H LYS 105 231.982 -7.375 -6.301 749 HA LYS 105 HA LYS 105 232.050 -10.283 -5.878 750 HB2 LYS 105 HB2 LYS 105 234.348 -9.434 -6.279 751 HB3 LYS 105 HB3 LYS 105 234.154 -8.332 -4.911 752 HG2 LYS 105 HG2 LYS 105 233.818 -10.321 -3.449 753 HG3 LYS 105 HG3 LYS 105 234.208 -11.343 -4.834 754 HD2 LYS 105 HD2 LYS 105 236.287 -9.563 -4.825 755 HD3 LYS 105 HD3 LYS 105 235.963 -9.764 -3.101 756 HE2 LYS 105 HE2 LYS 105 236.017 -12.238 -4.710 757 HE3 LYS 105 HE3 LYS 105 237.558 -11.400 -4.532 758 HZ1 LYS 105 HZ1 LYS 105 237.606 -11.769 -2.294 759 HZ2 LYS 105 HZ2 LYS 105 236.780 -13.158 -2.785 760 HZ3 LYS 105 HZ3 LYS 105 235.923 -11.851 -2.136 761 H THR 106 H THR 106 231.727 -10.978 -3.753 762 HA THR 106 HA THR 106 229.908 -9.333 -2.260 763 HB THR 106 HB THR 106 231.032 -12.035 -1.502 764 HG1 THR 106 HG1 THR 106 228.832 -11.343 -3.146 765 HG21 THR 106 HG21 THR 106 228.522 -10.602 -0.677 766 HG22 THR 106 HG22 THR 106 229.877 -11.071 0.348 767 HG23 THR 106 HG23 THR 106 228.843 -12.308 -0.368 768 H ALA 107 H ALA 107 230.128 -8.536 -0.195 769 HA ALA 107 HA ALA 107 232.830 -8.572 0.976 770 HB1 ALA 107 HB1 ALA 107 232.818 -6.447 0.064 771 HB2 ALA 107 HB2 ALA 107 232.237 -6.151 1.702 772 HB3 ALA 107 HB3 ALA 107 231.095 -6.215 0.359 773 H SER 108 H SER 108 232.910 -8.968 3.116 774 HA SER 108 HA SER 108 230.572 -9.783 4.503 775 HB2 SER 108 HB2 SER 108 233.474 -9.584 5.129 776 HB3 SER 108 HB3 SER 108 232.364 -9.633 6.498 777 HG SER 108 HG SER 108 231.615 -11.601 5.815 778 H LEU 109 H LEU 109 229.204 -8.656 5.739 779 HA LEU 109 HA LEU 109 229.921 -5.887 6.429 780 HB2 LEU 109 HB2 LEU 109 227.928 -6.302 4.942 781 HB3 LEU 109 HB3 LEU 109 227.157 -7.088 6.306 782 HG LEU 109 HG LEU 109 227.518 -4.877 7.562 783 HD11 LEU 109 HD11 LEU 109 227.475 -3.513 4.940 784 HD12 LEU 109 HD12 LEU 109 229.026 -4.163 5.473 785 HD13 LEU 109 HD13 LEU 109 228.164 -3.000 6.480 786 HD21 LEU 109 HD21 LEU 109 225.372 -4.370 7.116 787 HD22 LEU 109 HD22 LEU 109 225.413 -5.870 6.189 788 HD23 LEU 109 HD23 LEU 109 225.631 -4.321 5.373 789 H LYS 110 H LYS 110 229.818 -5.178 8.512 790 HA LYS 110 HA LYS 110 229.210 -7.214 10.553 791 HB2 LYS 110 HB2 LYS 110 231.601 -6.313 10.315 792 HB3 LYS 110 HB3 LYS 110 230.973 -4.812 10.980 793 HG2 LYS 110 HG2 LYS 110 230.841 -5.633 13.064 794 HG3 LYS 110 HG3 LYS 110 230.309 -7.224 12.519 795 HD2 LYS 110 HD2 LYS 110 232.912 -7.073 11.609 796 HD3 LYS 110 HD3 LYS 110 232.982 -6.268 13.178 797 HE2 LYS 110 HE2 LYS 110 233.207 -8.350 13.988 798 HE3 LYS 110 HE3 LYS 110 231.460 -8.439 13.768 799 HZ1 LYS 110 HZ1 LYS 110 231.661 -9.828 12.018 800 HZ2 LYS 110 HZ2 LYS 110 233.138 -10.212 12.745 801 HZ3 LYS 110 HZ3 LYS 110 233.092 -9.121 11.452 802 H ARG 111 H ARG 111 229.344 -3.649 10.282 803 HA ARG 111 HA ARG 111 226.635 -3.314 11.070 804 HB2 ARG 111 HB2 ARG 111 227.215 -2.078 13.232 805 HB3 ARG 111 HB3 ARG 111 227.264 -3.833 13.276 806 HG2 ARG 111 HG2 ARG 111 229.759 -3.634 12.868 807 HG3 ARG 111 HG3 ARG 111 229.570 -1.913 13.210 808 HD2 ARG 111 HD2 ARG 111 228.399 -3.835 15.141 809 HD3 ARG 111 HD3 ARG 111 230.155 -3.696 15.100 810 HE ARG 111 HE ARG 111 229.346 -1.122 15.241 811 HH11 ARG 111 HH11 ARG 111 228.583 -3.958 17.151 812 HH12 ARG 111 HH12 ARG 111 228.310 -3.058 18.603 813 HH21 ARG 111 HH21 ARG 111 228.984 0.058 17.164 814 HH22 ARG 111 HH22 ARG 111 228.538 -0.782 18.611 815 H GLY 112 H GLY 112 226.478 -0.809 11.941 816 HA2 GLY 112 HA2 GLY 112 228.080 0.774 10.032 817 HA3 GLY 112 HA3 GLY 112 226.357 1.042 10.278 818 H GLY 113 H GLY 113 229.412 2.073 11.114 819 HA2 GLY 113 HA2 GLY 113 228.438 4.035 12.915 820 HA3 GLY 113 HA3 GLY 113 229.237 2.742 13.813 821 H TYR 114 H TYR 114 231.375 2.851 14.065 822 HA TYR 114 HA TYR 114 232.905 4.623 12.277 823 HB2 TYR 114 HB2 TYR 114 232.338 5.211 14.899 824 HB3 TYR 114 HB3 TYR 114 233.909 4.431 15.034 825 HD1 TYR 114 HD1 TYR 114 232.185 7.455 14.279 826 HD2 TYR 114 HD2 TYR 114 235.803 5.341 13.542 827 HE1 TYR 114 HE1 TYR 114 233.274 9.559 13.628 828 HE2 TYR 114 HE2 TYR 114 236.903 7.441 12.888 829 HH TYR 114 HH TYR 114 235.243 10.247 12.181 830 H GLY 115 H GLY 115 232.785 1.985 11.695 831 HA2 GLY 115 HA2 GLY 115 235.044 0.619 12.926 832 HA3 GLY 115 HA3 GLY 115 233.946 -0.053 11.728 833 H GLN 116 H GLN 116 235.255 -0.734 10.129 834 HA GLN 116 HA GLN 116 237.380 1.058 9.189 835 HB2 GLN 116 HB2 GLN 116 236.995 -1.860 9.230 836 HB3 GLN 116 HB3 GLN 116 237.680 -1.237 7.734 837 HG2 GLN 116 HG2 GLN 116 239.490 -0.198 8.954 838 HG3 GLN 116 HG3 GLN 116 238.781 -0.709 10.485 839 HE21 GLN 116 HE21 GLN 116 240.480 -1.728 7.625 840 HE22 GLN 116 HE22 GLN 116 240.939 -3.287 8.210 841 H ASP 117 H ASP 117 237.392 1.943 7.189 842 HA ASP 117 HA ASP 117 234.929 2.060 5.744 843 HB2 ASP 117 HB2 ASP 117 237.649 3.269 5.407 844 HB3 ASP 117 HB3 ASP 117 236.508 3.335 4.069 845 H THR 118 H THR 118 234.280 0.935 4.012 846 HA THR 118 HA THR 118 235.829 -1.317 3.134 847 HB THR 118 HB THR 118 233.288 -0.297 1.865 848 HG1 THR 118 HG1 THR 118 232.308 -1.812 3.422 849 HG21 THR 118 HG21 THR 118 234.135 -2.099 0.613 850 HG22 THR 118 HG22 THR 118 232.871 -2.777 1.640 851 HG23 THR 118 HG23 THR 118 234.567 -3.006 2.063 852 H ALA 119 H ALA 119 236.837 -1.645 1.194 853 HA ALA 119 HA ALA 119 237.008 0.672 -0.615 854 HB1 ALA 119 HB1 ALA 119 239.066 -0.214 0.957 855 HB2 ALA 119 HB2 ALA 119 239.244 0.721 -0.527 856 HB3 ALA 119 HB3 ALA 119 239.377 -1.037 -0.572 857 H VAL 120 H VAL 120 237.078 0.270 -2.799 858 HA VAL 120 HA VAL 120 236.619 -2.533 -3.579 859 HB VAL 120 HB VAL 120 235.585 -0.123 -5.078 860 HG11 VAL 120 HG11 VAL 120 235.679 -2.945 -5.619 861 HG12 VAL 120 HG12 VAL 120 235.136 -1.626 -6.652 862 HG13 VAL 120 HG13 VAL 120 234.007 -2.392 -5.537 863 HG21 VAL 120 HG21 VAL 120 233.968 -1.891 -3.255 864 HG22 VAL 120 HG22 VAL 120 233.458 -0.408 -4.063 865 HG23 VAL 120 HG23 VAL 120 234.636 -0.339 -2.754 866 H THR 121 H THR 121 238.091 -3.399 -4.892 867 HA THR 121 HA THR 121 240.270 -1.824 -5.876 868 HB THR 121 HB THR 121 239.500 -4.724 -6.048 869 HG1 THR 121 HG1 THR 121 241.660 -3.328 -4.859 870 HG21 THR 121 HG21 THR 121 241.436 -3.348 -7.758 871 HG22 THR 121 HG22 THR 121 240.683 -4.932 -7.932 872 HG23 THR 121 HG23 THR 121 242.083 -4.734 -6.878 873 H LEU 122 H LEU 122 239.508 -0.358 -7.379 874 HA LEU 122 HA LEU 122 238.208 -1.445 -9.779 875 HB2 LEU 122 HB2 LEU 122 238.067 1.121 -8.336 876 HB3 LEU 122 HB3 LEU 122 238.096 1.256 -10.084 877 HG LEU 122 HG LEU 122 236.201 -0.692 -9.692 878 HD11 LEU 122 HD11 LEU 122 235.671 1.398 -7.603 879 HD12 LEU 122 HD12 LEU 122 236.379 -0.171 -7.225 880 HD13 LEU 122 HD13 LEU 122 234.765 -0.077 -7.928 881 HD21 LEU 122 HD21 LEU 122 235.692 2.277 -9.828 882 HD22 LEU 122 HD22 LEU 122 234.611 0.986 -10.352 883 HD23 LEU 122 HD23 LEU 122 236.126 1.268 -11.207 884 HA PRO 123 HA PRO 123 242.226 -0.614 -11.638 885 HB2 PRO 123 HB2 PRO 123 241.978 -2.257 -13.729 886 HB3 PRO 123 HB3 PRO 123 242.210 -2.892 -12.088 887 HG2 PRO 123 HG2 PRO 123 239.708 -2.700 -13.713 888 HG3 PRO 123 HG3 PRO 123 240.250 -3.999 -12.637 889 HD2 PRO 123 HD2 PRO 123 238.425 -2.009 -11.967 890 HD3 PRO 123 HD3 PRO 123 239.329 -3.004 -10.810 891 H GLU 124 H GLU 124 239.284 0.563 -12.415 892 HA GLU 124 HA GLU 124 240.258 2.370 -14.385 893 HB2 GLU 124 HB2 GLU 124 238.787 1.731 -16.222 894 HB3 GLU 124 HB3 GLU 124 239.885 0.416 -15.833 895 HG2 GLU 124 HG2 GLU 124 237.832 -0.316 -14.304 896 HG3 GLU 124 HG3 GLU 124 236.945 0.596 -15.536 897 H ALA 125 H ALA 125 238.824 4.073 -14.812 898 HA ALA 125 HA ALA 125 237.016 4.661 -12.686 899 HB1 ALA 125 HB1 ALA 125 236.737 6.777 -13.686 900 HB2 ALA 125 HB2 ALA 125 237.194 6.174 -15.278 901 HB3 ALA 125 HB3 ALA 125 238.409 6.323 -14.009 902 H GLY 126 H GLY 126 234.815 4.538 -12.590 903 HA2 GLY 126 HA2 GLY 126 233.099 4.393 -14.821 904 HA3 GLY 126 HA3 GLY 126 233.449 2.756 -14.276 905 H GLN 127 H GLN 127 230.884 3.546 -14.262 906 HA GLN 127 HA GLN 127 230.166 4.586 -11.656 907 HB2 GLN 127 HB2 GLN 127 228.936 4.574 -14.152 908 HB3 GLN 127 HB3 GLN 127 227.973 3.453 -13.199 909 HG2 GLN 127 HG2 GLN 127 227.490 5.113 -11.572 910 HG3 GLN 127 HG3 GLN 127 228.673 6.227 -12.275 911 HE21 GLN 127 HE21 GLN 127 226.138 7.090 -11.837 912 HE22 GLN 127 HE22 GLN 127 225.305 7.293 -13.337 913 H TYR 128 H TYR 128 229.554 3.453 -9.932 914 HA TYR 128 HA TYR 128 228.958 0.594 -10.225 915 HB2 TYR 128 HB2 TYR 128 230.352 0.041 -8.311 916 HB3 TYR 128 HB3 TYR 128 231.326 0.835 -9.540 917 HD1 TYR 128 HD1 TYR 128 231.773 3.366 -9.227 918 HD2 TYR 128 HD2 TYR 128 230.350 0.832 -6.117 919 HE1 TYR 128 HE1 TYR 128 232.536 4.997 -7.553 920 HE2 TYR 128 HE2 TYR 128 231.110 2.457 -4.438 921 HH TYR 128 HH TYR 128 232.948 4.338 -4.383 922 H VAL 129 H VAL 129 227.567 -0.271 -8.642 923 HA VAL 129 HA VAL 129 226.167 1.767 -7.036 924 HB VAL 129 HB VAL 129 224.211 0.125 -7.128 925 HG11 VAL 129 HG11 VAL 129 223.603 0.917 -9.479 926 HG12 VAL 129 HG12 VAL 129 225.177 1.713 -9.482 927 HG13 VAL 129 HG13 VAL 129 223.969 2.150 -8.272 928 HG21 VAL 129 HG21 VAL 129 225.770 -1.692 -8.114 929 HG22 VAL 129 HG22 VAL 129 225.474 -0.879 -9.649 930 HG23 VAL 129 HG23 VAL 129 224.125 -1.549 -8.732 931 H TRP 130 H TRP 130 226.025 1.501 -4.901 932 HA TRP 130 HA TRP 130 227.280 -0.842 -3.719 933 HB2 TRP 130 HB2 TRP 130 226.850 1.919 -2.925 934 HB3 TRP 130 HB3 TRP 130 226.379 0.802 -1.648 935 HD1 TRP 130 HD1 TRP 130 229.209 2.749 -2.426 936 HE1 TRP 130 HE1 TRP 130 231.417 1.684 -1.656 937 HE3 TRP 130 HE3 TRP 130 227.592 -2.050 -1.705 938 HZ2 TRP 130 HZ2 TRP 130 232.355 -0.854 -0.849 939 HZ3 TRP 130 HZ3 TRP 130 229.210 -3.735 -0.932 940 HH2 TRP 130 HH2 TRP 130 231.543 -3.147 -0.513 941 H SER 131 H SER 131 226.103 -2.566 -3.252 942 HA SER 131 HA SER 131 223.285 -2.181 -2.494 943 HB2 SER 131 HB2 SER 131 223.611 -3.410 -4.623 944 HB3 SER 131 HB3 SER 131 224.547 -4.628 -3.754 945 HG SER 131 HG SER 131 222.301 -5.169 -4.050 946 H LEU 132 H LEU 132 222.569 -2.980 -0.615 947 HA LEU 132 HA LEU 132 224.300 -4.783 0.933 948 HB2 LEU 132 HB2 LEU 132 222.871 -2.375 2.075 949 HB3 LEU 132 HB3 LEU 132 223.886 -3.499 2.958 950 HG LEU 132 HG LEU 132 225.749 -2.701 1.300 951 HD11 LEU 132 HD11 LEU 132 225.360 -0.936 0.006 952 HD12 LEU 132 HD12 LEU 132 224.601 -0.044 1.324 953 HD13 LEU 132 HD13 LEU 132 223.647 -1.164 0.354 954 HD21 LEU 132 HD21 LEU 132 225.365 -2.273 3.849 955 HD22 LEU 132 HD22 LEU 132 224.955 -0.644 3.311 956 HD23 LEU 132 HD23 LEU 132 226.545 -1.317 2.955 957 H LYS 133 H LYS 133 223.200 -6.416 1.953 958 HA LYS 133 HA LYS 133 220.327 -6.159 2.368 959 HB2 LYS 133 HB2 LYS 133 220.812 -7.075 0.012 960 HB3 LYS 133 HB3 LYS 133 221.338 -8.546 0.838 961 HG2 LYS 133 HG2 LYS 133 219.244 -9.199 1.248 962 HG3 LYS 133 HG3 LYS 133 218.728 -7.581 1.725 963 HD2 LYS 133 HD2 LYS 133 218.394 -6.935 -0.550 964 HD3 LYS 133 HD3 LYS 133 219.157 -8.415 -1.141 965 HE2 LYS 133 HE2 LYS 133 216.762 -8.612 0.625 966 HE3 LYS 133 HE3 LYS 133 216.542 -8.180 -1.069 967 HZ1 LYS 133 HZ1 LYS 133 218.042 -10.582 -0.183 968 HZ2 LYS 133 HZ2 LYS 133 217.531 -10.208 -1.750 969 HZ3 LYS 133 HZ3 LYS 133 216.393 -10.605 -0.564 970 H PHE 134 H PHE 134 219.847 -6.913 4.307 971 HA PHE 134 HA PHE 134 221.162 -9.330 5.289 972 HB2 PHE 134 HB2 PHE 134 221.646 -8.365 7.463 973 HB3 PHE 134 HB3 PHE 134 222.459 -7.443 6.207 974 HD1 PHE 134 HD1 PHE 134 221.403 -5.256 5.459 975 HD2 PHE 134 HD2 PHE 134 220.218 -7.334 8.978 976 HE1 PHE 134 HE1 PHE 134 220.397 -3.189 6.334 977 HE2 PHE 134 HE2 PHE 134 219.203 -5.268 9.857 978 HZ PHE 134 HZ PHE 134 219.292 -3.193 8.533 979 H THR 135 H THR 135 219.959 -10.541 6.719 980 HA THR 135 HA THR 135 217.122 -10.165 6.549 981 HB THR 135 HB THR 135 216.914 -12.288 7.620 982 HG1 THR 135 HG1 THR 135 218.251 -12.914 9.096 983 HG21 THR 135 HG21 THR 135 219.057 -13.516 6.513 984 HG22 THR 135 HG22 THR 135 218.984 -12.031 5.566 985 HG23 THR 135 HG23 THR 135 217.580 -13.097 5.648 986 H ASP 136 H ASP 136 215.749 -10.474 8.575 987 HA ASP 136 HA ASP 136 216.447 -8.375 10.428 988 HB2 ASP 136 HB2 ASP 136 214.001 -9.936 9.787 989 HB3 ASP 136 HB3 ASP 136 214.121 -9.268 11.412 990 H SER 137 H SER 137 217.252 -11.580 10.332 991 HA SER 137 HA SER 137 216.740 -12.432 12.975 992 HB2 SER 137 HB2 SER 137 219.186 -13.484 11.694 993 HB3 SER 137 HB3 SER 137 217.811 -14.346 12.382 994 HG SER 137 HG SER 137 217.663 -14.697 10.235 995 H GLY 138 H GLY 138 219.212 -10.389 11.600 996 HA2 GLY 138 HA2 GLY 138 220.444 -8.859 12.946 997 HA3 GLY 138 HA3 GLY 138 220.294 -9.980 14.304 998 H ASP 139 H ASP 139 221.069 -12.159 12.191 999 HA ASP 139 HA ASP 139 223.954 -11.781 12.564 1000 HB2 ASP 139 HB2 ASP 139 222.183 -14.081 12.734 1001 HB3 ASP 139 HB3 ASP 139 223.562 -14.396 11.684 1002 HA PRO 140 HA PRO 140 223.622 -13.327 7.923 1003 HB2 PRO 140 HB2 PRO 140 220.776 -12.640 7.396 1004 HB3 PRO 140 HB3 PRO 140 221.727 -14.014 6.824 1005 HG2 PRO 140 HG2 PRO 140 219.911 -14.347 8.731 1006 HG3 PRO 140 HG3 PRO 140 221.472 -15.185 8.819 1007 HD2 PRO 140 HD2 PRO 140 220.548 -12.744 10.287 1008 HD3 PRO 140 HD3 PRO 140 221.491 -14.128 10.881 1009 H GLU 141 H GLU 141 224.901 -11.466 7.777 1010 HA GLU 141 HA GLU 141 223.558 -9.127 6.606 1011 HB2 GLU 141 HB2 GLU 141 225.155 -9.257 9.018 1012 HB3 GLU 141 HB3 GLU 141 225.901 -8.188 7.839 1013 HG2 GLU 141 HG2 GLU 141 223.823 -6.915 7.671 1014 HG3 GLU 141 HG3 GLU 141 223.074 -7.994 8.861 1015 H GLN 142 H GLN 142 224.129 -9.305 4.498 1016 HA GLN 142 HA GLN 142 227.003 -9.461 3.900 1017 HB2 GLN 142 HB2 GLN 142 225.171 -11.486 3.340 1018 HB3 GLN 142 HB3 GLN 142 225.374 -10.648 1.808 1019 HG2 GLN 142 HG2 GLN 142 227.302 -11.664 1.469 1020 HG3 GLN 142 HG3 GLN 142 227.940 -11.023 2.986 1021 HE21 GLN 142 HE21 GLN 142 228.632 -13.520 1.926 1022 HE22 GLN 142 HE22 GLN 142 228.052 -14.748 2.994 1023 H ILE 143 H ILE 143 227.739 -8.111 2.328 1024 HA ILE 143 HA ILE 143 225.777 -6.626 0.727 1025 HB ILE 143 HB ILE 143 226.905 -4.500 1.159 1026 HG12 ILE 143 HG12 ILE 143 228.347 -4.918 3.511 1027 HG13 ILE 143 HG13 ILE 143 228.849 -6.238 2.460 1028 HG21 ILE 143 HG21 ILE 143 226.250 -5.641 3.847 1029 HG22 ILE 143 HG22 ILE 143 225.006 -5.463 2.611 1030 HG23 ILE 143 HG23 ILE 143 225.880 -4.048 3.193 1031 HD11 ILE 143 HD11 ILE 143 229.701 -4.782 0.852 1032 HD12 ILE 143 HD12 ILE 143 230.200 -4.087 2.396 1033 HD13 ILE 143 HD13 ILE 143 228.834 -3.397 1.518 1034 H MET 144 H MET 144 226.477 -6.037 -1.316 1035 HA MET 144 HA MET 144 229.283 -6.534 -1.992 1036 HB2 MET 144 HB2 MET 144 228.712 -7.858 -3.946 1037 HB3 MET 144 HB3 MET 144 228.075 -8.618 -2.494 1038 HG2 MET 144 HG2 MET 144 226.303 -8.843 -3.911 1039 HG3 MET 144 HG3 MET 144 225.897 -7.318 -3.125 1040 HE1 MET 144 HE1 MET 144 228.378 -8.065 -6.464 1041 HE2 MET 144 HE2 MET 144 226.900 -8.200 -7.418 1042 HE3 MET 144 HE3 MET 144 227.132 -9.223 -5.999 1043 H VAL 145 H VAL 145 229.974 -5.588 -3.994 1044 HA VAL 145 HA VAL 145 228.247 -3.385 -4.912 1045 HB VAL 145 HB VAL 145 230.095 -2.531 -3.538 1046 HG11 VAL 145 HG11 VAL 145 231.914 -3.755 -5.607 1047 HG12 VAL 145 HG12 VAL 145 231.700 -4.334 -3.956 1048 HG13 VAL 145 HG13 VAL 145 232.407 -2.747 -4.247 1049 HG21 VAL 145 HG21 VAL 145 229.197 -1.406 -5.706 1050 HG22 VAL 145 HG22 VAL 145 230.798 -1.778 -6.343 1051 HG23 VAL 145 HG23 VAL 145 230.632 -0.758 -4.913 1052 H SER 146 H SER 146 228.127 -3.028 -7.095 1053 HA SER 146 HA SER 146 229.761 -4.753 -8.834 1054 HB2 SER 146 HB2 SER 146 226.790 -4.228 -9.058 1055 HB3 SER 146 HB3 SER 146 227.751 -5.043 -10.290 1056 HG SER 146 HG SER 146 227.464 -5.905 -7.602 1057 H LYS 147 H LYS 147 230.604 -3.815 -10.609 1058 HA LYS 147 HA LYS 147 229.886 -1.002 -11.115 1059 HB2 LYS 147 HB2 LYS 147 232.196 -1.378 -10.284 1060 HB3 LYS 147 HB3 LYS 147 232.507 -2.402 -11.691 1061 HG2 LYS 147 HG2 LYS 147 231.511 0.054 -12.663 1062 HG3 LYS 147 HG3 LYS 147 232.725 0.432 -11.439 1063 HD2 LYS 147 HD2 LYS 147 234.417 -0.336 -12.707 1064 HD3 LYS 147 HD3 LYS 147 233.488 -1.724 -13.277 1065 HE2 LYS 147 HE2 LYS 147 232.735 -0.636 -15.115 1066 HE3 LYS 147 HE3 LYS 147 232.635 0.917 -14.286 1067 HZ1 LYS 147 HZ1 LYS 147 235.158 -0.361 -15.195 1068 HZ2 LYS 147 HZ2 LYS 147 235.011 1.166 -14.483 1069 HZ3 LYS 147 HZ3 LYS 147 234.352 0.881 -16.013 1070 H CYS 148 H CYS 148 229.296 -0.385 -13.133 1071 HA CYS 148 HA CYS 148 229.344 -2.449 -15.238 1072 HB2 CYS 148 HB2 CYS 148 227.327 -1.122 -16.147 1073 HB3 CYS 148 HB3 CYS 148 227.073 -2.171 -14.757 1074 HA PRO 149 HA PRO 149 231.973 0.717 -17.111 1075 HB2 PRO 149 HB2 PRO 149 232.850 -0.834 -19.158 1076 HB3 PRO 149 HB3 PRO 149 233.508 -0.947 -17.516 1077 HG2 PRO 149 HG2 PRO 149 231.478 -2.680 -18.871 1078 HG3 PRO 149 HG3 PRO 149 232.834 -3.148 -17.830 1079 HD2 PRO 149 HD2 PRO 149 230.271 -3.009 -16.946 1080 HD3 PRO 149 HD3 PRO 149 231.669 -2.695 -15.900 Start of MODEL 8 1 H1 THR 1 H1 THR 1 193.618 -25.406 16.754 2 H2 THR 1 H2 THR 1 192.682 -24.204 17.543 3 H3 THR 1 H3 THR 1 194.045 -24.889 18.331 4 HA THR 1 HA THR 1 194.237 -23.425 15.796 5 HB THR 1 HB THR 1 193.258 -21.879 17.332 6 HG1 THR 1 HG1 THR 1 194.945 -20.400 17.588 7 HG21 THR 1 HG21 THR 1 194.357 -21.387 19.537 8 HG22 THR 1 HG22 THR 1 195.215 -22.918 19.357 9 HG23 THR 1 HG23 THR 1 193.453 -22.898 19.448 10 HA PRO 2 HA PRO 2 198.404 -24.918 16.098 11 HB2 PRO 2 HB2 PRO 2 199.622 -23.225 14.387 12 HB3 PRO 2 HB3 PRO 2 198.507 -24.480 13.836 13 HG2 PRO 2 HG2 PRO 2 198.007 -21.559 14.262 14 HG3 PRO 2 HG3 PRO 2 197.495 -22.596 12.918 15 HD2 PRO 2 HD2 PRO 2 195.853 -21.909 14.977 16 HD3 PRO 2 HD3 PRO 2 195.705 -23.437 14.088 17 H SER 3 H SER 3 200.601 -24.226 16.686 18 HA SER 3 HA SER 3 200.574 -21.821 18.390 19 HB2 SER 3 HB2 SER 3 200.804 -24.257 19.395 20 HB3 SER 3 HB3 SER 3 202.487 -24.065 18.903 21 HG SER 3 HG SER 3 202.512 -22.117 20.148 22 H ALA 4 H ALA 4 201.916 -20.251 17.815 23 HA ALA 4 HA ALA 4 203.690 -20.499 15.614 24 HB1 ALA 4 HB1 ALA 4 202.511 -18.406 16.257 25 HB2 ALA 4 HB2 ALA 4 204.244 -18.195 16.007 26 HB3 ALA 4 HB3 ALA 4 203.591 -18.273 17.644 27 H SER 5 H SER 5 205.846 -20.828 15.514 28 HA SER 5 HA SER 5 207.328 -21.048 18.050 29 HB2 SER 5 HB2 SER 5 208.644 -22.882 16.652 30 HB3 SER 5 HB3 SER 5 207.181 -23.295 17.545 31 HG SER 5 HG SER 5 206.195 -23.676 15.722 32 H GLY 6 H GLY 6 207.239 -18.747 16.367 33 HA2 GLY 6 HA2 GLY 6 208.666 -17.203 15.444 34 HA3 GLY 6 HA3 GLY 6 209.976 -18.166 16.108 35 H LEU 7 H LEU 7 207.699 -19.500 13.809 36 HA LEU 7 HA LEU 7 209.430 -19.044 11.537 37 HB2 LEU 7 HB2 LEU 7 209.527 -21.508 13.075 38 HB3 LEU 7 HB3 LEU 7 209.075 -21.807 11.408 39 HG LEU 7 HG LEU 7 211.307 -20.005 11.464 40 HD11 LEU 7 HD11 LEU 7 212.035 -20.793 13.535 41 HD12 LEU 7 HD12 LEU 7 212.926 -21.771 12.369 42 HD13 LEU 7 HD13 LEU 7 211.521 -22.445 13.194 43 HD21 LEU 7 HD21 LEU 7 210.771 -22.773 10.430 44 HD22 LEU 7 HD22 LEU 7 212.341 -21.994 10.241 45 HD23 LEU 7 HD23 LEU 7 210.904 -21.261 9.530 46 H THR 8 H THR 8 207.494 -17.979 10.849 47 HA THR 8 HA THR 8 205.483 -19.855 9.798 48 HB THR 8 HB THR 8 203.762 -18.080 10.159 49 HG1 THR 8 HG1 THR 8 205.702 -16.857 11.824 50 HG21 THR 8 HG21 THR 8 203.828 -19.836 11.778 51 HG22 THR 8 HG22 THR 8 203.572 -18.303 12.612 52 HG23 THR 8 HG23 THR 8 205.165 -19.062 12.630 53 H LYS 9 H LYS 9 206.287 -16.377 9.517 54 HA LYS 9 HA LYS 9 206.253 -16.718 6.589 55 HB2 LYS 9 HB2 LYS 9 204.539 -15.175 7.915 56 HB3 LYS 9 HB3 LYS 9 205.874 -14.035 7.837 57 HG2 LYS 9 HG2 LYS 9 205.865 -14.634 5.298 58 HG3 LYS 9 HG3 LYS 9 204.215 -15.164 5.635 59 HD2 LYS 9 HD2 LYS 9 203.521 -13.021 6.242 60 HD3 LYS 9 HD3 LYS 9 205.171 -12.462 6.521 61 HE2 LYS 9 HE2 LYS 9 204.157 -13.255 3.800 62 HE3 LYS 9 HE3 LYS 9 204.014 -11.615 4.425 63 HZ1 LYS 9 HZ1 LYS 9 206.102 -12.489 3.019 64 HZ2 LYS 9 HZ2 LYS 9 206.669 -12.783 4.585 65 HZ3 LYS 9 HZ3 LYS 9 206.195 -11.221 4.137 66 H VAL 10 H VAL 10 208.293 -16.793 5.868 67 HA VAL 10 HA VAL 10 210.112 -14.627 6.562 68 HB VAL 10 HB VAL 10 211.046 -17.494 6.796 69 HG11 VAL 10 HG11 VAL 10 213.129 -16.701 7.136 70 HG12 VAL 10 HG12 VAL 10 212.564 -15.268 7.993 71 HG13 VAL 10 HG13 VAL 10 212.523 -15.315 6.230 72 HG21 VAL 10 HG21 VAL 10 209.611 -17.159 8.661 73 HG22 VAL 10 HG22 VAL 10 210.253 -15.543 8.951 74 HG23 VAL 10 HG23 VAL 10 211.260 -16.960 9.250 75 H ALA 11 H ALA 11 210.294 -17.803 4.924 76 HA ALA 11 HA ALA 11 211.733 -16.641 2.707 77 HB1 ALA 11 HB1 ALA 11 211.818 -19.089 3.812 78 HB2 ALA 11 HB2 ALA 11 212.319 -18.755 2.155 79 HB3 ALA 11 HB3 ALA 11 210.711 -19.402 2.476 80 H THR 12 H THR 12 210.743 -15.606 1.114 81 HA THR 12 HA THR 12 207.937 -16.153 0.533 82 HB THR 12 HB THR 12 209.724 -14.031 -0.671 83 HG1 THR 12 HG1 THR 12 209.106 -12.710 0.930 84 HG21 THR 12 HG21 THR 12 207.550 -14.578 -1.836 85 HG22 THR 12 HG22 THR 12 207.781 -12.901 -1.337 86 HG23 THR 12 HG23 THR 12 206.739 -13.967 -0.394 87 H VAL 13 H VAL 13 207.344 -17.470 -1.060 88 HA VAL 13 HA VAL 13 209.194 -17.878 -3.319 89 HB VAL 13 HB VAL 13 208.200 -20.217 -3.471 90 HG11 VAL 13 HG11 VAL 13 209.690 -21.051 -1.573 91 HG12 VAL 13 HG12 VAL 13 210.029 -19.351 -1.252 92 HG13 VAL 13 HG13 VAL 13 210.445 -20.053 -2.816 93 HG21 VAL 13 HG21 VAL 13 206.912 -21.104 -1.826 94 HG22 VAL 13 HG22 VAL 13 206.437 -19.419 -1.621 95 HG23 VAL 13 HG23 VAL 13 207.657 -20.124 -0.561 96 H SER 14 H SER 14 208.362 -17.322 -5.218 97 HA SER 14 HA SER 14 205.575 -17.838 -5.837 98 HB2 SER 14 HB2 SER 14 206.650 -15.112 -5.345 99 HB3 SER 14 HB3 SER 14 205.598 -15.304 -6.747 100 HG SER 14 HG SER 14 204.610 -14.805 -4.600 101 H ALA 15 H ALA 15 205.595 -18.748 -7.788 102 HA ALA 15 HA ALA 15 207.646 -17.892 -9.728 103 HB1 ALA 15 HB1 ALA 15 207.653 -20.087 -10.648 104 HB2 ALA 15 HB2 ALA 15 206.248 -20.560 -9.693 105 HB3 ALA 15 HB3 ALA 15 207.793 -20.257 -8.899 106 H ALA 16 H ALA 16 206.545 -16.314 -10.821 107 HA ALA 16 HA ALA 16 204.523 -17.204 -12.676 108 HB1 ALA 16 HB1 ALA 16 202.731 -15.893 -12.001 109 HB2 ALA 16 HB2 ALA 16 203.735 -14.866 -10.980 110 HB3 ALA 16 HB3 ALA 16 203.358 -16.514 -10.475 111 H SER 17 H SER 17 205.796 -16.591 -14.369 112 HA SER 17 HA SER 17 206.031 -13.725 -14.833 113 HB2 SER 17 HB2 SER 17 208.398 -13.896 -15.501 114 HB3 SER 17 HB3 SER 17 208.175 -14.301 -13.801 115 HG SER 17 HG SER 17 209.515 -15.827 -14.767 116 H SER 18 H SER 18 205.588 -13.197 -16.890 117 HA SER 18 HA SER 18 205.703 -15.317 -18.930 118 HB2 SER 18 HB2 SER 18 203.670 -13.856 -19.889 119 HB3 SER 18 HB3 SER 18 203.421 -15.201 -18.776 120 HG SER 18 HG SER 18 202.314 -13.321 -18.097 121 H LEU 19 H LEU 19 206.937 -14.822 -20.612 122 HA LEU 19 HA LEU 19 208.167 -13.681 -22.136 123 HB2 LEU 19 HB2 LEU 19 205.807 -12.718 -22.536 124 HB3 LEU 19 HB3 LEU 19 206.396 -11.292 -21.702 125 HG LEU 19 HG LEU 19 208.112 -10.959 -23.393 126 HD11 LEU 19 HD11 LEU 19 208.844 -12.912 -24.271 127 HD12 LEU 19 HD12 LEU 19 207.667 -12.510 -25.518 128 HD13 LEU 19 HD13 LEU 19 207.246 -13.656 -24.247 129 HD21 LEU 19 HD21 LEU 19 205.884 -9.991 -23.756 130 HD22 LEU 19 HD22 LEU 19 205.410 -11.435 -24.648 131 HD23 LEU 19 HD23 LEU 19 206.687 -10.392 -25.275 132 H ILE 20 H ILE 20 210.039 -13.584 -20.896 133 HA ILE 20 HA ILE 20 210.645 -10.916 -19.830 134 HB ILE 20 HB ILE 20 211.914 -11.886 -17.966 135 HG12 ILE 20 HG12 ILE 20 212.296 -14.120 -19.083 136 HG13 ILE 20 HG13 ILE 20 211.821 -14.203 -17.382 137 HG21 ILE 20 HG21 ILE 20 208.983 -12.412 -18.195 138 HG22 ILE 20 HG22 ILE 20 209.834 -11.176 -17.269 139 HG23 ILE 20 HG23 ILE 20 209.853 -12.854 -16.729 140 HD11 ILE 20 HD11 ILE 20 209.429 -14.321 -18.808 141 HD12 ILE 20 HD12 ILE 20 210.256 -15.645 -17.989 142 HD13 ILE 20 HD13 ILE 20 210.557 -15.343 -19.701 143 H GLY 21 H GLY 21 212.677 -10.156 -20.234 144 HA2 GLY 21 HA2 GLY 21 214.571 -11.989 -21.564 145 HA3 GLY 21 HA3 GLY 21 214.188 -10.417 -22.273 146 H GLU 22 H GLU 22 216.719 -11.635 -21.226 147 HA GLU 22 HA GLU 22 217.373 -9.651 -19.156 148 HB2 GLU 22 HB2 GLU 22 217.889 -12.425 -19.341 149 HB3 GLU 22 HB3 GLU 22 219.437 -11.613 -19.522 150 HG2 GLU 22 HG2 GLU 22 217.538 -11.515 -17.213 151 HG3 GLU 22 HG3 GLU 22 219.222 -12.029 -17.245 152 H GLY 23 H GLY 23 219.015 -8.208 -19.455 153 HA2 GLY 23 HA2 GLY 23 220.531 -8.392 -21.982 154 HA3 GLY 23 HA3 GLY 23 219.713 -6.894 -21.534 155 H PHE 24 H PHE 24 222.537 -7.326 -22.043 156 HA PHE 24 HA PHE 24 224.027 -7.413 -19.639 157 HB2 PHE 24 HB2 PHE 24 225.842 -6.321 -21.037 158 HB3 PHE 24 HB3 PHE 24 225.208 -7.852 -21.655 159 HD1 PHE 24 HD1 PHE 24 224.119 -7.968 -23.757 160 HD2 PHE 24 HD2 PHE 24 225.182 -4.185 -22.116 161 HE1 PHE 24 HE1 PHE 24 223.642 -6.898 -25.919 162 HE2 PHE 24 HE2 PHE 24 224.705 -3.111 -24.278 163 HZ PHE 24 HZ PHE 24 223.933 -4.467 -26.183 164 H MET 25 H MET 25 222.621 -4.728 -21.475 165 HA MET 25 HA MET 25 223.820 -2.644 -19.998 166 HB2 MET 25 HB2 MET 25 222.087 -1.201 -20.950 167 HB3 MET 25 HB3 MET 25 222.792 -2.245 -22.174 168 HG2 MET 25 HG2 MET 25 220.541 -3.585 -21.094 169 HG3 MET 25 HG3 MET 25 220.065 -1.926 -21.451 170 HE1 MET 25 HE1 MET 25 219.535 -5.204 -23.752 171 HE2 MET 25 HE2 MET 25 220.551 -5.223 -22.311 172 HE3 MET 25 HE3 MET 25 221.284 -5.363 -23.909 173 H ALA 26 H ALA 26 221.108 -4.718 -19.330 174 HA ALA 26 HA ALA 26 219.819 -3.101 -17.387 175 HB1 ALA 26 HB1 ALA 26 218.394 -4.734 -18.069 176 HB2 ALA 26 HB2 ALA 26 219.038 -5.528 -16.633 177 HB3 ALA 26 HB3 ALA 26 219.673 -5.940 -18.226 178 H GLN 27 H GLN 27 222.804 -4.717 -17.287 179 HA GLN 27 HA GLN 27 222.772 -5.354 -14.477 180 HB2 GLN 27 HB2 GLN 27 224.196 -6.399 -16.439 181 HB3 GLN 27 HB3 GLN 27 225.306 -5.096 -16.042 182 HG2 GLN 27 HG2 GLN 27 224.269 -6.961 -13.942 183 HG3 GLN 27 HG3 GLN 27 225.664 -7.372 -14.937 184 HE21 GLN 27 HE21 GLN 27 227.282 -5.436 -15.070 185 HE22 GLN 27 HE22 GLN 27 227.693 -4.734 -13.536 186 H CYS 28 H CYS 28 223.760 -2.656 -16.484 187 HA CYS 28 HA CYS 28 225.409 -1.321 -14.625 188 HB2 CYS 28 HB2 CYS 28 225.230 -0.787 -17.070 189 HB3 CYS 28 HB3 CYS 28 223.662 -0.056 -16.748 190 H ASP 29 H ASP 29 221.922 -1.340 -15.141 191 HA ASP 29 HA ASP 29 221.545 -0.152 -12.506 192 HB2 ASP 29 HB2 ASP 29 220.387 0.987 -15.056 193 HB3 ASP 29 HB3 ASP 29 219.732 1.348 -13.450 194 H ASN 30 H ASN 30 220.556 -1.872 -11.587 195 HA ASN 30 HA ASN 30 218.752 -3.578 -12.987 196 HB2 ASN 30 HB2 ASN 30 218.944 -3.349 -9.985 197 HB3 ASN 30 HB3 ASN 30 218.476 -4.750 -10.937 198 HD21 ASN 30 HD21 ASN 30 220.753 -3.842 -8.967 199 HD22 ASN 30 HD22 ASN 30 222.160 -4.559 -9.696 200 HA PRO 31 HA PRO 31 214.995 -1.240 -12.847 201 HB2 PRO 31 HB2 PRO 31 213.288 -3.419 -12.432 202 HB3 PRO 31 HB3 PRO 31 213.785 -2.740 -13.989 203 HG2 PRO 31 HG2 PRO 31 214.802 -5.127 -12.555 204 HG3 PRO 31 HG3 PRO 31 214.665 -4.816 -14.293 205 HD2 PRO 31 HD2 PRO 31 217.032 -4.735 -12.994 206 HD3 PRO 31 HD3 PRO 31 216.674 -3.685 -14.382 207 H THR 32 H THR 32 214.553 -0.060 -11.091 208 HA THR 32 HA THR 32 214.139 -1.462 -8.545 209 HB THR 32 HB THR 32 214.345 1.219 -7.913 210 HG1 THR 32 HG1 THR 32 216.351 0.644 -9.827 211 HG21 THR 32 HG21 THR 32 215.575 -1.048 -7.138 212 HG22 THR 32 HG22 THR 32 216.058 0.574 -6.633 213 HG23 THR 32 HG23 THR 32 216.895 -0.222 -7.966 214 H ILE 33 H ILE 33 212.062 -1.963 -8.549 215 HA ILE 33 HA ILE 33 210.012 0.026 -9.186 216 HB ILE 33 HB ILE 33 209.899 -2.351 -10.025 217 HG12 ILE 33 HG12 ILE 33 207.463 -2.042 -8.374 218 HG13 ILE 33 HG13 ILE 33 207.896 -0.654 -9.368 219 HG21 ILE 33 HG21 ILE 33 209.029 -4.042 -8.415 220 HG22 ILE 33 HG22 ILE 33 209.413 -2.920 -7.110 221 HG23 ILE 33 HG23 ILE 33 210.700 -3.556 -8.136 222 HD11 ILE 33 HD11 ILE 33 208.168 -2.812 -11.073 223 HD12 ILE 33 HD12 ILE 33 206.827 -1.666 -11.024 224 HD13 ILE 33 HD13 ILE 33 206.727 -3.181 -10.127 225 H GLU 34 H GLU 34 208.216 0.325 -7.699 226 HA GLU 34 HA GLU 34 209.135 1.026 -5.123 227 HB2 GLU 34 HB2 GLU 34 207.121 1.959 -6.455 228 HB3 GLU 34 HB3 GLU 34 206.223 0.619 -5.754 229 HG2 GLU 34 HG2 GLU 34 207.030 1.468 -3.496 230 HG3 GLU 34 HG3 GLU 34 207.526 2.929 -4.349 231 H GLY 35 H GLY 35 209.798 -0.446 -3.705 232 HA2 GLY 35 HA2 GLY 35 208.213 -2.904 -3.326 233 HA3 GLY 35 HA3 GLY 35 209.914 -2.714 -2.902 234 H ASP 36 H ASP 36 210.273 -2.600 -0.817 235 HA ASP 36 HA ASP 36 208.206 -1.409 0.916 236 HB2 ASP 36 HB2 ASP 36 208.726 -3.878 1.215 237 HB3 ASP 36 HB3 ASP 36 210.332 -3.387 1.768 238 H GLY 37 H GLY 37 210.368 0.022 -0.510 239 HA2 GLY 37 HA2 GLY 37 212.496 0.638 1.233 240 HA3 GLY 37 HA3 GLY 37 211.942 1.640 -0.098 241 HA PRO 38 HA PRO 38 210.159 2.840 4.387 242 HB2 PRO 38 HB2 PRO 38 212.918 3.729 5.082 243 HB3 PRO 38 HB3 PRO 38 211.660 3.026 6.119 244 HG2 PRO 38 HG2 PRO 38 213.747 1.566 5.351 245 HG3 PRO 38 HG3 PRO 38 212.123 0.856 5.425 246 HD2 PRO 38 HD2 PRO 38 213.691 1.762 3.045 247 HD3 PRO 38 HD3 PRO 38 212.631 0.349 3.228 248 H ILE 39 H ILE 39 209.112 4.581 3.629 249 HA ILE 39 HA ILE 39 210.319 6.620 2.064 250 HB ILE 39 HB ILE 39 207.680 6.776 3.526 251 HG12 ILE 39 HG12 ILE 39 207.049 6.164 0.939 252 HG13 ILE 39 HG13 ILE 39 208.513 5.214 1.167 253 HG21 ILE 39 HG21 ILE 39 207.938 8.895 2.751 254 HG22 ILE 39 HG22 ILE 39 207.272 8.164 1.293 255 HG23 ILE 39 HG23 ILE 39 209.012 8.408 1.440 256 HD11 ILE 39 HD11 ILE 39 206.747 4.927 3.419 257 HD12 ILE 39 HD12 ILE 39 207.419 3.698 2.347 258 HD13 ILE 39 HD13 ILE 39 205.926 4.530 1.909 259 H GLY 40 H GLY 40 210.577 8.854 2.602 260 HA2 GLY 40 HA2 GLY 40 211.085 10.647 3.968 261 HA3 GLY 40 HA3 GLY 40 210.395 9.758 5.316 262 H LYS 41 H LYS 41 212.873 8.231 3.425 263 HA LYS 41 HA LYS 41 214.850 8.861 5.514 264 HB2 LYS 41 HB2 LYS 41 213.903 6.223 4.543 265 HB3 LYS 41 HB3 LYS 41 215.629 6.384 4.830 266 HG2 LYS 41 HG2 LYS 41 214.595 7.481 7.097 267 HG3 LYS 41 HG3 LYS 41 213.408 6.231 6.726 268 HD2 LYS 41 HD2 LYS 41 215.726 4.878 6.324 269 HD3 LYS 41 HD3 LYS 41 216.206 5.990 7.606 270 HE2 LYS 41 HE2 LYS 41 215.277 4.584 9.057 271 HE3 LYS 41 HE3 LYS 41 213.710 5.033 8.389 272 HZ1 LYS 41 HZ1 LYS 41 213.657 2.784 8.112 273 HZ2 LYS 41 HZ2 LYS 41 215.326 2.642 7.888 274 HZ3 LYS 41 HZ3 LYS 41 214.353 3.220 6.632 275 H THR 42 H THR 42 216.808 9.449 4.818 276 HA THR 42 HA THR 42 217.415 9.168 1.950 277 HB THR 42 HB THR 42 218.438 11.309 3.825 278 HG1 THR 42 HG1 THR 42 216.333 11.449 1.925 279 HG21 THR 42 HG21 THR 42 218.553 11.034 0.835 280 HG22 THR 42 HG22 THR 42 219.905 11.102 1.966 281 HG23 THR 42 HG23 THR 42 218.898 12.527 1.707 282 H LEU 43 H LEU 43 219.396 8.396 1.341 283 HA LEU 43 HA LEU 43 221.094 7.338 3.498 284 HB2 LEU 43 HB2 LEU 43 220.012 6.073 1.291 285 HB3 LEU 43 HB3 LEU 43 221.658 6.397 0.787 286 HG LEU 43 HG LEU 43 221.495 4.176 1.739 287 HD11 LEU 43 HD11 LEU 43 223.613 4.836 2.183 288 HD12 LEU 43 HD12 LEU 43 223.045 4.688 3.845 289 HD13 LEU 43 HD13 LEU 43 223.105 6.270 3.072 290 HD21 LEU 43 HD21 LEU 43 219.543 4.629 3.191 291 HD22 LEU 43 HD22 LEU 43 220.604 5.502 4.296 292 HD23 LEU 43 HD23 LEU 43 220.844 3.775 4.020 293 H TYR 44 H TYR 44 223.014 8.287 3.844 294 HA TYR 44 HA TYR 44 223.998 10.180 1.856 295 HB2 TYR 44 HB2 TYR 44 224.032 10.073 4.719 296 HB3 TYR 44 HB3 TYR 44 225.689 10.172 4.132 297 HD1 TYR 44 HD1 TYR 44 225.055 11.786 1.610 298 HD2 TYR 44 HD2 TYR 44 223.883 12.253 5.673 299 HE1 TYR 44 HE1 TYR 44 224.773 14.197 1.247 300 HE2 TYR 44 HE2 TYR 44 223.602 14.671 5.318 301 HH TYR 44 HH TYR 44 224.661 16.235 2.403 302 H VAL 45 H VAL 45 225.743 9.882 0.636 303 HA VAL 45 HA VAL 45 227.347 7.458 1.109 304 HB VAL 45 HB VAL 45 227.757 7.300 -1.241 305 HG11 VAL 45 HG11 VAL 45 225.329 6.876 -0.139 306 HG12 VAL 45 HG12 VAL 45 225.745 6.460 -1.801 307 HG13 VAL 45 HG13 VAL 45 224.899 7.967 -1.455 308 HG21 VAL 45 HG21 VAL 45 226.700 10.077 -1.307 309 HG22 VAL 45 HG22 VAL 45 226.397 9.049 -2.707 310 HG23 VAL 45 HG23 VAL 45 228.052 9.360 -2.181 311 H VAL 46 H VAL 46 229.505 7.635 1.376 312 HA VAL 46 HA VAL 46 230.834 10.150 0.651 313 HB VAL 46 HB VAL 46 231.367 8.823 3.306 314 HG11 VAL 46 HG11 VAL 46 232.098 11.498 2.142 315 HG12 VAL 46 HG12 VAL 46 233.184 10.171 2.560 316 HG13 VAL 46 HG13 VAL 46 232.342 11.053 3.832 317 HG21 VAL 46 HG21 VAL 46 229.009 9.665 3.140 318 HG22 VAL 46 HG22 VAL 46 229.680 11.278 2.906 319 HG23 VAL 46 HG23 VAL 46 229.983 10.405 4.407 320 H GLY 47 H GLY 47 233.212 9.951 0.612 321 HA2 GLY 47 HA2 GLY 47 234.073 7.167 0.121 322 HA3 GLY 47 HA3 GLY 47 234.529 8.500 -0.948 323 H ASP 48 H ASP 48 236.738 7.860 -0.523 324 HA ASP 48 HA ASP 48 238.083 9.511 1.203 325 HB2 ASP 48 HB2 ASP 48 237.039 7.162 2.573 326 HB3 ASP 48 HB3 ASP 48 238.799 7.274 2.696 327 H PHE 49 H PHE 49 240.179 9.531 0.726 328 HA PHE 49 HA PHE 49 242.207 8.974 -0.133 329 HB2 PHE 49 HB2 PHE 49 241.056 6.339 0.483 330 HB3 PHE 49 HB3 PHE 49 242.270 6.321 -0.802 331 HD1 PHE 49 HD1 PHE 49 244.374 7.948 -0.151 332 HD2 PHE 49 HD2 PHE 49 241.852 5.856 2.568 333 HE1 PHE 49 HE1 PHE 49 246.161 7.999 1.542 334 HE2 PHE 49 HE2 PHE 49 243.635 5.905 4.263 335 HZ PHE 49 HZ PHE 49 245.792 6.977 3.750 336 H ALA 50 H ALA 50 242.946 9.346 -2.110 337 HA ALA 50 HA ALA 50 243.081 9.550 -4.367 338 HB1 ALA 50 HB1 ALA 50 241.797 6.914 -4.008 339 HB2 ALA 50 HB2 ALA 50 243.265 7.356 -4.878 340 HB3 ALA 50 HB3 ALA 50 241.687 7.631 -5.614 341 H ASP 51 H ASP 51 240.475 10.399 -2.731 342 HA ASP 51 HA ASP 51 238.416 11.303 -3.164 343 HB2 ASP 51 HB2 ASP 51 240.365 12.881 -4.076 344 HB3 ASP 51 HB3 ASP 51 239.540 12.577 -5.613 345 H ALA 52 H ALA 52 237.813 8.976 -3.854 346 HA ALA 52 HA ALA 52 237.225 8.759 -6.704 347 HB1 ALA 52 HB1 ALA 52 236.198 6.503 -5.722 348 HB2 ALA 52 HB2 ALA 52 237.335 6.873 -4.426 349 HB3 ALA 52 HB3 ALA 52 237.913 6.691 -6.082 350 H SER 53 H SER 53 235.590 9.067 -3.602 351 HA SER 53 HA SER 53 233.095 9.575 -5.080 352 HB2 SER 53 HB2 SER 53 232.713 7.516 -3.984 353 HB3 SER 53 HB3 SER 53 233.498 8.059 -2.506 354 HG SER 53 HG SER 53 230.927 8.581 -3.458 355 H TRP 54 H TRP 54 233.129 9.926 -1.628 356 HA TRP 54 HA TRP 54 232.681 11.720 -0.307 357 HB2 TRP 54 HB2 TRP 54 235.115 12.368 -1.849 358 HB3 TRP 54 HB3 TRP 54 234.311 13.755 -1.101 359 HD1 TRP 54 HD1 TRP 54 236.714 11.042 -0.321 360 HE1 TRP 54 HE1 TRP 54 237.186 10.960 2.211 361 HE3 TRP 54 HE3 TRP 54 232.929 14.074 1.307 362 HZ2 TRP 54 HZ2 TRP 54 236.097 12.044 4.581 363 HZ3 TRP 54 HZ3 TRP 54 232.716 14.502 3.719 364 HH2 TRP 54 HH2 TRP 54 234.266 13.507 5.322 365 H LYS 55 H LYS 55 231.055 11.457 -2.702 366 HA LYS 55 HA LYS 55 230.172 14.248 -2.938 367 HB2 LYS 55 HB2 LYS 55 230.909 12.367 -5.100 368 HB3 LYS 55 HB3 LYS 55 229.409 13.249 -5.342 369 HG2 LYS 55 HG2 LYS 55 230.672 15.362 -4.932 370 HG3 LYS 55 HG3 LYS 55 232.154 14.403 -4.921 371 HD2 LYS 55 HD2 LYS 55 230.386 13.950 -7.230 372 HD3 LYS 55 HD3 LYS 55 231.090 15.565 -7.131 373 HE2 LYS 55 HE2 LYS 55 233.138 13.694 -6.539 374 HE3 LYS 55 HE3 LYS 55 232.303 13.129 -7.985 375 HZ1 LYS 55 HZ1 LYS 55 233.839 14.526 -8.896 376 HZ2 LYS 55 HZ2 LYS 55 233.859 15.580 -7.575 377 HZ3 LYS 55 HZ3 LYS 55 232.574 15.628 -8.675 378 H GLN 56 H GLN 56 228.197 14.398 -2.115 379 HA GLN 56 HA GLN 56 226.408 12.071 -2.335 380 HB2 GLN 56 HB2 GLN 56 225.255 13.367 -0.336 381 HB3 GLN 56 HB3 GLN 56 226.598 12.268 -0.064 382 HG2 GLN 56 HG2 GLN 56 227.044 15.207 -0.473 383 HG3 GLN 56 HG3 GLN 56 226.626 14.542 1.114 384 HE21 GLN 56 HE21 GLN 56 228.023 12.546 1.675 385 HE22 GLN 56 HE22 GLN 56 229.719 12.737 1.414 386 H LYS 57 H LYS 57 225.148 12.433 -4.045 387 HA LYS 57 HA LYS 57 224.035 15.104 -4.493 388 HB2 LYS 57 HB2 LYS 57 225.092 13.307 -6.251 389 HB3 LYS 57 HB3 LYS 57 223.377 12.944 -6.391 390 HG2 LYS 57 HG2 LYS 57 222.881 14.966 -7.321 391 HG3 LYS 57 HG3 LYS 57 224.221 15.790 -6.522 392 HD2 LYS 57 HD2 LYS 57 225.787 14.986 -8.066 393 HD3 LYS 57 HD3 LYS 57 224.700 13.723 -8.646 394 HE2 LYS 57 HE2 LYS 57 223.298 15.350 -9.725 395 HE3 LYS 57 HE3 LYS 57 224.218 16.676 -9.015 396 HZ1 LYS 57 HZ1 LYS 57 225.708 14.758 -10.631 397 HZ2 LYS 57 HZ2 LYS 57 225.886 16.435 -10.502 398 HZ3 LYS 57 HZ3 LYS 57 224.652 15.789 -11.460 399 HA PRO 58 HA PRO 58 220.305 13.794 -2.336 400 HB2 PRO 58 HB2 PRO 58 219.263 16.187 -3.779 401 HB3 PRO 58 HB3 PRO 58 219.144 15.756 -2.061 402 HG2 PRO 58 HG2 PRO 58 220.839 17.642 -2.866 403 HG3 PRO 58 HG3 PRO 58 221.296 16.491 -1.595 404 HD2 PRO 58 HD2 PRO 58 222.105 16.560 -4.473 405 HD3 PRO 58 HD3 PRO 58 223.061 16.125 -3.040 406 H HIS 59 H HIS 59 220.430 14.694 -5.763 407 HA HIS 59 HA HIS 59 217.915 13.758 -6.553 408 HB2 HIS 59 HB2 HIS 59 219.367 15.160 -7.969 409 HB3 HIS 59 HB3 HIS 59 220.482 13.801 -8.156 410 HD1 HIS 59 HD1 HIS 59 219.415 11.656 -9.436 411 HD2 HIS 59 HD2 HIS 59 217.389 15.261 -9.838 412 HE1 HIS 59 HE1 HIS 59 217.935 11.372 -11.447 413 HE2 HIS 59 HE2 HIS 59 216.616 13.515 -11.581 414 H ARG 60 H ARG 60 220.855 12.017 -5.830 415 HA ARG 60 HA ARG 60 219.456 9.501 -6.426 416 HB2 ARG 60 HB2 ARG 60 222.081 10.437 -7.401 417 HB3 ARG 60 HB3 ARG 60 222.054 8.788 -6.793 418 HG2 ARG 60 HG2 ARG 60 220.453 8.117 -8.384 419 HG3 ARG 60 HG3 ARG 60 220.081 9.785 -8.822 420 HD2 ARG 60 HD2 ARG 60 222.819 9.539 -9.259 421 HD3 ARG 60 HD3 ARG 60 222.132 8.013 -9.842 422 HE ARG 60 HE ARG 60 221.140 9.152 -11.565 423 HH11 ARG 60 HH11 ARG 60 222.259 11.470 -9.186 424 HH12 ARG 60 HH12 ARG 60 221.948 12.840 -10.197 425 HH21 ARG 60 HH21 ARG 60 220.732 10.965 -12.889 426 HH22 ARG 60 HH22 ARG 60 221.082 12.555 -12.296 427 H ALA 61 H ALA 61 220.051 11.176 -3.944 428 HA ALA 61 HA ALA 61 221.934 9.832 -2.343 429 HB1 ALA 61 HB1 ALA 61 219.692 11.711 -1.845 430 HB2 ALA 61 HB2 ALA 61 221.398 11.843 -1.416 431 HB3 ALA 61 HB3 ALA 61 220.330 10.807 -0.470 432 H TYR 62 H TYR 62 218.581 9.142 -3.100 433 HA TYR 62 HA TYR 62 218.845 6.541 -1.848 434 HB2 TYR 62 HB2 TYR 62 216.673 6.803 -0.617 435 HB3 TYR 62 HB3 TYR 62 217.999 7.756 0.034 436 HD1 TYR 62 HD1 TYR 62 214.621 7.831 -0.848 437 HD2 TYR 62 HD2 TYR 62 218.133 10.230 -0.981 438 HE1 TYR 62 HE1 TYR 62 213.231 9.852 -1.010 439 HE2 TYR 62 HE2 TYR 62 216.752 12.255 -1.142 440 HH TYR 62 HH TYR 62 213.768 12.379 -2.062 441 H ARG 63 H ARG 63 218.102 5.099 -3.240 442 HA ARG 63 HA ARG 63 215.903 5.874 -5.045 443 HB2 ARG 63 HB2 ARG 63 218.143 5.495 -6.144 444 HB3 ARG 63 HB3 ARG 63 218.039 3.818 -5.628 445 HG2 ARG 63 HG2 ARG 63 216.658 3.278 -7.290 446 HG3 ARG 63 HG3 ARG 63 215.658 4.711 -7.045 447 HD2 ARG 63 HD2 ARG 63 216.734 5.887 -8.638 448 HD3 ARG 63 HD3 ARG 63 218.312 5.232 -8.198 449 HE ARG 63 HE ARG 63 216.523 4.249 -10.223 450 HH11 ARG 63 HH11 ARG 63 219.143 3.389 -8.067 451 HH12 ARG 63 HH12 ARG 63 219.697 2.084 -9.059 452 HH21 ARG 63 HH21 ARG 63 217.256 2.525 -11.527 453 HH22 ARG 63 HH22 ARG 63 218.629 1.595 -11.026 454 H TYR 64 H TYR 64 214.072 4.824 -4.680 455 HA TYR 64 HA TYR 64 213.819 2.757 -2.797 456 HB2 TYR 64 HB2 TYR 64 211.960 3.784 -4.936 457 HB3 TYR 64 HB3 TYR 64 211.507 2.454 -3.864 458 HD1 TYR 64 HD1 TYR 64 212.414 6.044 -3.966 459 HD2 TYR 64 HD2 TYR 64 210.812 2.867 -1.633 460 HE1 TYR 64 HE1 TYR 64 211.658 7.667 -2.285 461 HE2 TYR 64 HE2 TYR 64 210.050 4.485 0.054 462 HH TYR 64 HH TYR 64 209.539 6.804 0.285 463 H VAL 65 H VAL 65 214.384 0.704 -2.957 464 HA VAL 65 HA VAL 65 214.468 -0.546 -5.620 465 HB VAL 65 HB VAL 65 215.695 -1.749 -3.148 466 HG11 VAL 65 HG11 VAL 65 216.868 -3.124 -4.585 467 HG12 VAL 65 HG12 VAL 65 216.715 -2.014 -5.946 468 HG13 VAL 65 HG13 VAL 65 215.323 -2.958 -5.418 469 HG21 VAL 65 HG21 VAL 65 217.139 0.097 -5.047 470 HG22 VAL 65 HG22 VAL 65 217.798 -0.698 -3.619 471 HG23 VAL 65 HG23 VAL 65 216.578 0.562 -3.442 472 H GLY 66 H GLY 66 212.892 -1.935 -6.105 473 HA2 GLY 66 HA2 GLY 66 210.834 -2.554 -4.273 474 HA3 GLY 66 HA3 GLY 66 211.034 -3.265 -5.873 475 H GLU 67 H GLU 67 212.174 -3.413 -2.547 476 HA GLU 67 HA GLU 67 211.844 -6.092 -2.075 477 HB2 GLU 67 HB2 GLU 67 214.226 -5.544 -3.718 478 HB3 GLU 67 HB3 GLU 67 214.543 -6.536 -2.297 479 HG2 GLU 67 HG2 GLU 67 212.189 -7.371 -3.803 480 HG3 GLU 67 HG3 GLU 67 213.688 -7.439 -4.727 481 H ASN 68 H ASN 68 212.074 -3.425 -0.737 482 HA ASN 68 HA ASN 68 212.694 -2.559 1.261 483 HB2 ASN 68 HB2 ASN 68 212.126 -5.109 1.832 484 HB3 ASN 68 HB3 ASN 68 213.842 -5.133 2.231 485 HD21 ASN 68 HD21 ASN 68 213.573 -5.367 4.419 486 HD22 ASN 68 HD22 ASN 68 212.914 -4.115 5.425 487 H THR 69 H THR 69 214.609 -2.793 -1.011 488 HA THR 69 HA THR 69 217.150 -2.633 0.466 489 HB THR 69 HB THR 69 217.969 -2.828 -2.087 490 HG1 THR 69 HG1 THR 69 215.684 -4.492 -2.063 491 HG21 THR 69 HG21 THR 69 218.942 -4.564 -1.137 492 HG22 THR 69 HG22 THR 69 217.487 -5.495 -1.492 493 HG23 THR 69 HG23 THR 69 217.667 -4.701 0.072 494 H TYR 70 H TYR 70 218.680 -1.013 -0.200 495 HA TYR 70 HA TYR 70 217.492 1.306 -1.575 496 HB2 TYR 70 HB2 TYR 70 218.429 1.132 1.153 497 HB3 TYR 70 HB3 TYR 70 219.399 2.292 0.252 498 HD1 TYR 70 HD1 TYR 70 215.791 1.542 -0.233 499 HD2 TYR 70 HD2 TYR 70 218.679 4.328 1.183 500 HE1 TYR 70 HE1 TYR 70 214.022 3.227 0.039 501 HE2 TYR 70 HE2 TYR 70 216.917 6.020 1.460 502 HH TYR 70 HH TYR 70 214.075 5.681 1.830 503 H GLN 71 H GLN 71 218.758 2.220 -3.131 504 HA GLN 71 HA GLN 71 221.618 1.623 -3.157 505 HB2 GLN 71 HB2 GLN 71 221.602 0.862 -5.457 506 HB3 GLN 71 HB3 GLN 71 220.555 -0.158 -4.482 507 HG2 GLN 71 HG2 GLN 71 218.632 1.277 -5.317 508 HG3 GLN 71 HG3 GLN 71 219.776 1.930 -6.489 509 HE21 GLN 71 HE21 GLN 71 219.077 -1.318 -5.215 510 HE22 GLN 71 HE22 GLN 71 218.894 -2.068 -6.769 511 H ALA 72 H ALA 72 222.860 2.929 -4.632 512 HA ALA 72 HA ALA 72 221.571 5.263 -5.795 513 HB1 ALA 72 HB1 ALA 72 223.417 6.664 -4.549 514 HB2 ALA 72 HB2 ALA 72 223.290 5.360 -3.369 515 HB3 ALA 72 HB3 ALA 72 221.868 6.315 -3.784 516 H VAL 73 H VAL 73 222.595 5.900 -7.623 517 HA VAL 73 HA VAL 73 224.886 4.430 -8.531 518 HB VAL 73 HB VAL 73 223.706 6.871 -9.860 519 HG11 VAL 73 HG11 VAL 73 225.957 5.527 -10.496 520 HG12 VAL 73 HG12 VAL 73 224.935 6.345 -11.678 521 HG13 VAL 73 HG13 VAL 73 224.771 4.607 -11.420 522 HG21 VAL 73 HG21 VAL 73 222.677 4.090 -9.671 523 HG22 VAL 73 HG22 VAL 73 222.550 4.909 -11.227 524 HG23 VAL 73 HG23 VAL 73 221.800 5.615 -9.795 525 H VAL 74 H VAL 74 226.972 4.942 -8.332 526 HA VAL 74 HA VAL 74 227.703 7.718 -7.653 527 HB VAL 74 HB VAL 74 229.023 5.283 -6.459 528 HG11 VAL 74 HG11 VAL 74 230.587 6.939 -6.286 529 HG12 VAL 74 HG12 VAL 74 229.685 7.202 -4.791 530 HG13 VAL 74 HG13 VAL 74 229.382 8.224 -6.197 531 HG21 VAL 74 HG21 VAL 74 227.858 5.888 -4.357 532 HG22 VAL 74 HG22 VAL 74 226.761 5.349 -5.630 533 HG23 VAL 74 HG23 VAL 74 226.906 7.068 -5.260 534 H ASP 75 H ASP 75 229.614 8.494 -8.471 535 HA ASP 75 HA ASP 75 230.892 6.840 -10.540 536 HB2 ASP 75 HB2 ASP 75 231.721 8.953 -11.484 537 HB3 ASP 75 HB3 ASP 75 229.959 8.980 -11.316 538 H GLU 76 H GLU 76 233.043 6.339 -10.453 539 HA GLU 76 HA GLU 76 234.614 7.492 -8.251 540 HB2 GLU 76 HB2 GLU 76 235.641 5.211 -7.932 541 HB3 GLU 76 HB3 GLU 76 233.974 5.378 -7.404 542 HG2 GLU 76 HG2 GLU 76 233.910 3.360 -8.480 543 HG3 GLU 76 HG3 GLU 76 233.417 4.450 -9.774 544 H LYS 77 H LYS 77 236.986 7.024 -8.458 545 HA LYS 77 HA LYS 77 237.794 7.472 -11.239 546 HB2 LYS 77 HB2 LYS 77 238.397 8.917 -9.050 547 HB3 LYS 77 HB3 LYS 77 239.743 7.788 -9.023 548 HG2 LYS 77 HG2 LYS 77 240.596 8.555 -11.040 549 HG3 LYS 77 HG3 LYS 77 239.060 9.275 -11.529 550 HD2 LYS 77 HD2 LYS 77 239.375 11.150 -10.243 551 HD3 LYS 77 HD3 LYS 77 240.397 10.310 -9.076 552 HE2 LYS 77 HE2 LYS 77 241.425 10.575 -11.846 553 HE3 LYS 77 HE3 LYS 77 241.366 12.038 -10.865 554 HZ1 LYS 77 HZ1 LYS 77 242.771 11.062 -9.250 555 HZ2 LYS 77 HZ2 LYS 77 243.493 10.755 -10.749 556 HZ3 LYS 77 HZ3 LYS 77 242.651 9.525 -9.950 557 H ALA 78 H ALA 78 240.094 6.649 -11.740 558 HA ALA 78 HA ALA 78 240.063 3.794 -11.482 559 HB1 ALA 78 HB1 ALA 78 241.893 3.787 -13.001 560 HB2 ALA 78 HB2 ALA 78 242.262 5.477 -12.663 561 HB3 ALA 78 HB3 ALA 78 240.788 5.055 -13.531 562 H GLY 79 H GLY 79 240.921 2.647 -9.876 563 HA2 GLY 79 HA2 GLY 79 243.168 2.206 -8.795 564 HA3 GLY 79 HA3 GLY 79 243.060 3.886 -8.265 565 H ALA 80 H ALA 80 243.323 1.498 -6.659 566 HA ALA 80 HA ALA 80 240.872 0.758 -5.469 567 HB1 ALA 80 HB1 ALA 80 243.360 0.672 -3.850 568 HB2 ALA 80 HB2 ALA 80 243.304 -0.279 -5.335 569 HB3 ALA 80 HB3 ALA 80 242.107 -0.550 -4.069 570 H PHE 81 H PHE 81 239.593 1.780 -4.069 571 HA PHE 81 HA PHE 81 240.712 3.833 -2.297 572 HB2 PHE 81 HB2 PHE 81 238.688 5.280 -2.833 573 HB3 PHE 81 HB3 PHE 81 239.933 5.193 -4.075 574 HD1 PHE 81 HD1 PHE 81 239.366 4.633 -6.240 575 HD2 PHE 81 HD2 PHE 81 236.691 3.650 -3.080 576 HE1 PHE 81 HE1 PHE 81 237.701 3.895 -7.884 577 HE2 PHE 81 HE2 PHE 81 235.020 2.910 -4.726 578 HZ PHE 81 HZ PHE 81 235.524 3.030 -7.129 579 H ARG 82 H ARG 82 239.470 4.302 -0.474 580 HA ARG 82 HA ARG 82 237.586 2.170 0.270 581 HB2 ARG 82 HB2 ARG 82 239.019 4.107 2.097 582 HB3 ARG 82 HB3 ARG 82 238.133 2.663 2.569 583 HG2 ARG 82 HG2 ARG 82 240.224 1.812 2.670 584 HG3 ARG 82 HG3 ARG 82 239.915 1.530 0.950 585 HD2 ARG 82 HD2 ARG 82 240.913 4.187 1.310 586 HD3 ARG 82 HD3 ARG 82 241.983 3.050 2.128 587 HE ARG 82 HE ARG 82 241.754 3.439 -0.660 588 HH11 ARG 82 HH11 ARG 82 242.179 0.892 1.703 589 HH12 ARG 82 HH12 ARG 82 243.034 -0.147 0.613 590 HH21 ARG 82 HH21 ARG 82 242.881 2.067 -2.092 591 HH22 ARG 82 HH22 ARG 82 243.435 0.521 -1.540 592 H MET 83 H MET 83 235.554 2.737 1.295 593 HA MET 83 HA MET 83 234.887 5.589 1.169 594 HB2 MET 83 HB2 MET 83 232.678 4.963 0.106 595 HB3 MET 83 HB3 MET 83 234.095 4.861 -0.927 596 HG2 MET 83 HG2 MET 83 233.480 2.357 0.438 597 HG3 MET 83 HG3 MET 83 232.188 2.922 -0.617 598 HE1 MET 83 HE1 MET 83 232.256 3.432 -2.821 599 HE2 MET 83 HE2 MET 83 233.039 2.333 -3.956 600 HE3 MET 83 HE3 MET 83 233.759 3.907 -3.614 601 H GLN 84 H GLN 84 233.528 6.330 2.671 602 HA GLN 84 HA GLN 84 232.432 4.391 4.602 603 HB2 GLN 84 HB2 GLN 84 234.236 6.234 5.239 604 HB3 GLN 84 HB3 GLN 84 232.817 7.271 5.315 605 HG2 GLN 84 HG2 GLN 84 232.055 5.026 6.728 606 HG3 GLN 84 HG3 GLN 84 233.755 5.247 7.170 607 HE21 GLN 84 HE21 GLN 84 233.909 6.300 9.012 608 HE22 GLN 84 HE22 GLN 84 232.947 7.663 9.491 609 H TYR 85 H TYR 85 230.291 4.747 5.369 610 HA TYR 85 HA TYR 85 228.724 6.701 3.803 611 HB2 TYR 85 HB2 TYR 85 228.302 3.773 4.145 612 HB3 TYR 85 HB3 TYR 85 226.883 4.808 4.086 613 HD1 TYR 85 HD1 TYR 85 230.122 4.629 2.194 614 HD2 TYR 85 HD2 TYR 85 225.873 4.804 2.031 615 HE1 TYR 85 HE1 TYR 85 230.221 4.611 -0.262 616 HE2 TYR 85 HE2 TYR 85 225.961 4.785 -0.423 617 HH TYR 85 HH TYR 85 228.757 5.358 -2.176 618 H ALA 86 H ALA 86 226.681 7.281 4.677 619 HA ALA 86 HA ALA 86 226.579 7.119 7.626 620 HB1 ALA 86 HB1 ALA 86 227.254 9.355 6.829 621 HB2 ALA 86 HB2 ALA 86 225.716 9.376 7.695 622 HB3 ALA 86 HB3 ALA 86 225.739 9.470 5.934 623 H SER 87 H SER 87 224.490 7.164 8.592 624 HA SER 87 HA SER 87 222.413 6.030 6.857 625 HB2 SER 87 HB2 SER 87 222.148 6.079 9.835 626 HB3 SER 87 HB3 SER 87 221.618 4.850 8.675 627 HG SER 87 HG SER 87 223.412 3.848 9.067 628 H LYS 88 H LYS 88 220.097 6.536 7.716 629 HA LYS 88 HA LYS 88 219.732 9.373 7.470 630 HB2 LYS 88 HB2 LYS 88 218.209 7.810 6.369 631 HB3 LYS 88 HB3 LYS 88 217.719 7.166 7.927 632 HG2 LYS 88 HG2 LYS 88 216.117 8.769 6.859 633 HG3 LYS 88 HG3 LYS 88 216.596 9.165 8.509 634 HD2 LYS 88 HD2 LYS 88 217.975 10.927 7.804 635 HD3 LYS 88 HD3 LYS 88 218.015 10.345 6.140 636 HE2 LYS 88 HE2 LYS 88 215.743 10.989 5.782 637 HE3 LYS 88 HE3 LYS 88 215.513 11.333 7.496 638 HZ1 LYS 88 HZ1 LYS 88 215.807 13.403 6.489 639 HZ2 LYS 88 HZ2 LYS 88 217.081 12.869 5.514 640 HZ3 LYS 88 HZ3 LYS 88 217.317 13.071 7.178 641 H ASP 89 H ASP 89 220.298 7.376 10.128 642 HA ASP 89 HA ASP 89 218.700 8.913 12.007 643 HB2 ASP 89 HB2 ASP 89 220.382 6.448 12.138 644 HB3 ASP 89 HB3 ASP 89 220.137 7.366 13.632 645 H TRP 90 H TRP 90 220.773 10.304 10.497 646 HA TRP 90 HA TRP 90 222.382 11.863 10.774 647 HB2 TRP 90 HB2 TRP 90 221.276 11.663 13.554 648 HB3 TRP 90 HB3 TRP 90 222.663 12.694 13.225 649 HD1 TRP 90 HD1 TRP 90 221.671 13.819 10.381 650 HE1 TRP 90 HE1 TRP 90 219.750 15.530 10.326 651 HE3 TRP 90 HE3 TRP 90 219.580 12.839 14.943 652 HZ2 TRP 90 HZ2 TRP 90 217.628 16.355 11.995 653 HZ3 TRP 90 HZ3 TRP 90 217.608 14.135 15.639 654 HH2 TRP 90 HH2 TRP 90 216.654 15.857 14.194 655 H SER 91 H SER 91 222.979 8.855 11.267 656 HA SER 91 HA SER 91 225.454 9.145 12.810 657 HB2 SER 91 HB2 SER 91 224.036 7.222 13.384 658 HB3 SER 91 HB3 SER 91 224.115 6.653 11.717 659 HG SER 91 HG SER 91 225.786 6.106 13.671 660 HA PRO 92 HA PRO 92 227.452 9.194 8.793 661 HB2 PRO 92 HB2 PRO 92 229.544 10.678 9.492 662 HB3 PRO 92 HB3 PRO 92 227.911 11.376 9.467 663 HG2 PRO 92 HG2 PRO 92 229.592 10.572 11.786 664 HG3 PRO 92 HG3 PRO 92 228.378 11.856 11.666 665 HD2 PRO 92 HD2 PRO 92 228.037 9.214 12.718 666 HD3 PRO 92 HD3 PRO 92 226.797 10.477 12.517 667 H GLN 93 H GLN 93 227.715 6.673 9.722 668 HA GLN 93 HA GLN 93 230.509 6.138 9.247 669 HB2 GLN 93 HB2 GLN 93 229.307 5.844 11.947 670 HB3 GLN 93 HB3 GLN 93 230.402 4.578 11.411 671 HG2 GLN 93 HG2 GLN 93 232.059 5.850 12.144 672 HG3 GLN 93 HG3 GLN 93 231.736 6.914 10.779 673 HE21 GLN 93 HE21 GLN 93 232.579 8.617 12.099 674 HE22 GLN 93 HE22 GLN 93 231.568 9.371 13.293 675 H PHE 94 H PHE 94 230.694 4.452 8.004 676 HA PHE 94 HA PHE 94 229.011 2.102 8.374 677 HB2 PHE 94 HB2 PHE 94 227.741 2.624 6.578 678 HB3 PHE 94 HB3 PHE 94 228.841 3.884 6.052 679 HD1 PHE 94 HD1 PHE 94 227.656 0.545 5.478 680 HD2 PHE 94 HD2 PHE 94 230.886 3.207 4.702 681 HE1 PHE 94 HE1 PHE 94 228.387 -0.878 3.607 682 HE2 PHE 94 HE2 PHE 94 231.614 1.795 2.837 683 HZ PHE 94 HZ PHE 94 230.375 -0.249 2.283 684 H THR 95 H THR 95 230.275 0.329 8.384 685 HA THR 95 HA THR 95 232.619 0.174 6.702 686 HB THR 95 HB THR 95 234.076 -0.367 8.754 687 HG1 THR 95 HG1 THR 95 232.528 -0.373 10.355 688 HG21 THR 95 HG21 THR 95 233.370 2.515 8.801 689 HG22 THR 95 HG22 THR 95 234.035 1.820 7.322 690 HG23 THR 95 HG23 THR 95 234.950 1.735 8.826 691 H ALA 96 H ALA 96 233.764 -1.919 6.945 692 HA ALA 96 HA ALA 96 232.073 -4.052 8.056 693 HB1 ALA 96 HB1 ALA 96 233.449 -4.673 5.519 694 HB2 ALA 96 HB2 ALA 96 232.068 -3.583 5.407 695 HB3 ALA 96 HB3 ALA 96 231.871 -5.188 6.110 696 H ASP 97 H ASP 97 233.403 -4.538 9.738 697 HA ASP 97 HA ASP 97 236.147 -4.523 9.865 698 HB2 ASP 97 HB2 ASP 97 234.081 -5.315 11.536 699 HB3 ASP 97 HB3 ASP 97 235.022 -6.796 11.308 700 H GLY 98 H GLY 98 237.539 -5.436 8.499 701 HA2 GLY 98 HA2 GLY 98 238.613 -7.002 7.202 702 HA3 GLY 98 HA3 GLY 98 237.903 -8.202 8.288 703 H LEU 99 H LEU 99 237.249 -6.244 5.395 704 HA LEU 99 HA LEU 99 235.582 -8.451 4.402 705 HB2 LEU 99 HB2 LEU 99 233.949 -6.932 5.108 706 HB3 LEU 99 HB3 LEU 99 234.877 -5.544 4.573 707 HG LEU 99 HG LEU 99 234.465 -6.273 2.207 708 HD11 LEU 99 HD11 LEU 99 232.600 -8.211 3.561 709 HD12 LEU 99 HD12 LEU 99 233.990 -8.601 2.550 710 HD13 LEU 99 HD13 LEU 99 232.574 -7.823 1.841 711 HD21 LEU 99 HD21 LEU 99 232.382 -5.224 2.083 712 HD22 LEU 99 HD22 LEU 99 233.118 -4.567 3.543 713 HD23 LEU 99 HD23 LEU 99 231.886 -5.818 3.667 714 H GLU 100 H GLU 100 236.638 -5.245 3.228 715 HA GLU 100 HA GLU 100 237.787 -4.596 1.382 716 HB2 GLU 100 HB2 GLU 100 238.552 -7.461 0.838 717 HB3 GLU 100 HB3 GLU 100 239.415 -6.002 0.388 718 HG2 GLU 100 HG2 GLU 100 239.247 -7.328 3.059 719 HG3 GLU 100 HG3 GLU 100 240.669 -6.911 2.109 720 H LEU 101 H LEU 101 235.786 -4.068 0.508 721 HA LEU 101 HA LEU 101 234.092 -5.776 -0.929 722 HB2 LEU 101 HB2 LEU 101 233.362 -3.618 -0.136 723 HB3 LEU 101 HB3 LEU 101 234.552 -2.801 -1.142 724 HG LEU 101 HG LEU 101 232.765 -4.452 -2.733 725 HD11 LEU 101 HD11 LEU 101 231.599 -2.777 -0.624 726 HD12 LEU 101 HD12 LEU 101 230.892 -4.101 -1.549 727 HD13 LEU 101 HD13 LEU 101 230.969 -2.482 -2.245 728 HD21 LEU 101 HD21 LEU 101 233.932 -1.742 -2.710 729 HD22 LEU 101 HD22 LEU 101 232.391 -1.913 -3.549 730 HD23 LEU 101 HD23 LEU 101 233.771 -2.900 -4.030 731 H THR 102 H THR 102 233.852 -6.237 -3.096 732 HA THR 102 HA THR 102 236.000 -5.381 -4.912 733 HB THR 102 HB THR 102 235.145 -8.155 -5.343 734 HG1 THR 102 HG1 THR 102 236.322 -8.984 -3.593 735 HG21 THR 102 HG21 THR 102 237.468 -6.546 -5.759 736 HG22 THR 102 HG22 THR 102 237.065 -8.129 -6.424 737 HG23 THR 102 HG23 THR 102 237.902 -8.009 -4.876 738 HA PRO 103 HA PRO 103 232.924 -4.489 -7.937 739 HB2 PRO 103 HB2 PRO 103 234.578 -6.111 -9.817 740 HB3 PRO 103 HB3 PRO 103 233.957 -4.466 -9.998 741 HG2 PRO 103 HG2 PRO 103 236.518 -4.876 -9.427 742 HG3 PRO 103 HG3 PRO 103 235.619 -3.549 -8.652 743 HD2 PRO 103 HD2 PRO 103 236.440 -6.196 -7.533 744 HD3 PRO 103 HD3 PRO 103 236.366 -4.608 -6.743 745 H GLY 104 H GLY 104 231.000 -5.473 -7.881 746 HA2 GLY 104 HA2 GLY 104 229.355 -7.031 -8.294 747 HA3 GLY 104 HA3 GLY 104 230.545 -7.955 -9.213 748 H LYS 105 H LYS 105 230.890 -7.025 -5.831 749 HA LYS 105 HA LYS 105 230.445 -9.822 -5.033 750 HB2 LYS 105 HB2 LYS 105 232.931 -8.974 -5.293 751 HB3 LYS 105 HB3 LYS 105 232.612 -8.225 -3.723 752 HG2 LYS 105 HG2 LYS 105 231.842 -11.053 -3.929 753 HG3 LYS 105 HG3 LYS 105 233.572 -10.730 -4.070 754 HD2 LYS 105 HD2 LYS 105 233.111 -9.200 -1.973 755 HD3 LYS 105 HD3 LYS 105 231.731 -10.280 -1.772 756 HE2 LYS 105 HE2 LYS 105 234.269 -11.638 -2.334 757 HE3 LYS 105 HE3 LYS 105 234.240 -10.747 -0.813 758 HZ1 LYS 105 HZ1 LYS 105 232.714 -13.105 -1.614 759 HZ2 LYS 105 HZ2 LYS 105 231.934 -11.990 -0.610 760 HZ3 LYS 105 HZ3 LYS 105 233.382 -12.707 -0.112 761 H THR 106 H THR 106 229.584 -10.148 -3.008 762 HA THR 106 HA THR 106 228.054 -7.994 -1.922 763 HB THR 106 HB THR 106 227.313 -9.644 -0.237 764 HG1 THR 106 HG1 THR 106 229.019 -11.492 -1.539 765 HG21 THR 106 HG21 THR 106 225.839 -10.249 -1.759 766 HG22 THR 106 HG22 THR 106 226.950 -11.519 -2.271 767 HG23 THR 106 HG23 THR 106 226.984 -9.943 -3.064 768 H ALA 107 H ALA 107 228.266 -6.908 -0.000 769 HA ALA 107 HA ALA 107 230.841 -7.238 1.399 770 HB1 ALA 107 HB1 ALA 107 229.478 -4.828 0.364 771 HB2 ALA 107 HB2 ALA 107 231.198 -5.175 0.542 772 HB3 ALA 107 HB3 ALA 107 230.250 -4.679 1.944 773 H SER 108 H SER 108 230.826 -7.352 3.594 774 HA SER 108 HA SER 108 228.345 -7.876 4.909 775 HB2 SER 108 HB2 SER 108 231.189 -8.136 5.529 776 HB3 SER 108 HB3 SER 108 230.249 -7.591 6.917 777 HG SER 108 HG SER 108 229.642 -9.861 5.318 778 H LEU 109 H LEU 109 227.180 -6.629 6.300 779 HA LEU 109 HA LEU 109 228.110 -3.858 6.679 780 HB2 LEU 109 HB2 LEU 109 225.830 -4.698 5.371 781 HB3 LEU 109 HB3 LEU 109 225.235 -4.297 6.970 782 HG LEU 109 HG LEU 109 226.788 -2.429 5.175 783 HD11 LEU 109 HD11 LEU 109 224.760 -2.456 4.137 784 HD12 LEU 109 HD12 LEU 109 224.440 -1.246 5.379 785 HD13 LEU 109 HD13 LEU 109 223.887 -2.906 5.601 786 HD21 LEU 109 HD21 LEU 109 226.765 -2.309 7.846 787 HD22 LEU 109 HD22 LEU 109 225.257 -1.460 7.511 788 HD23 LEU 109 HD23 LEU 109 226.771 -0.876 6.819 789 H LYS 110 H LYS 110 228.959 -3.862 8.686 790 HA LYS 110 HA LYS 110 227.711 -5.332 10.840 791 HB2 LYS 110 HB2 LYS 110 230.296 -4.398 10.310 792 HB3 LYS 110 HB3 LYS 110 229.752 -3.462 11.695 793 HG2 LYS 110 HG2 LYS 110 229.058 -6.203 12.088 794 HG3 LYS 110 HG3 LYS 110 230.763 -6.087 11.651 795 HD2 LYS 110 HD2 LYS 110 230.888 -5.820 13.927 796 HD3 LYS 110 HD3 LYS 110 230.760 -4.138 13.408 797 HE2 LYS 110 HE2 LYS 110 228.151 -4.748 13.651 798 HE3 LYS 110 HE3 LYS 110 228.827 -5.835 14.863 799 HZ1 LYS 110 HZ1 LYS 110 229.090 -2.882 14.747 800 HZ2 LYS 110 HZ2 LYS 110 229.993 -3.854 15.798 801 HZ3 LYS 110 HZ3 LYS 110 228.309 -3.804 15.933 802 H ARG 111 H ARG 111 228.754 -1.913 10.698 803 HA ARG 111 HA ARG 111 226.255 -0.761 11.147 804 HB2 ARG 111 HB2 ARG 111 226.780 -2.093 13.377 805 HB3 ARG 111 HB3 ARG 111 227.750 -0.672 13.733 806 HG2 ARG 111 HG2 ARG 111 225.951 0.461 14.341 807 HG3 ARG 111 HG3 ARG 111 225.178 0.146 12.787 808 HD2 ARG 111 HD2 ARG 111 224.206 -1.862 13.568 809 HD3 ARG 111 HD3 ARG 111 225.227 -1.882 15.005 810 HE ARG 111 HE ARG 111 223.550 0.430 14.884 811 HH11 ARG 111 HH11 ARG 111 223.608 -2.961 15.761 812 HH12 ARG 111 HH12 ARG 111 222.319 -2.812 16.907 813 HH21 ARG 111 HH21 ARG 111 221.853 0.618 16.395 814 HH22 ARG 111 HH22 ARG 111 221.323 -0.782 17.266 815 H GLY 112 H GLY 112 229.467 -0.273 12.655 816 HA2 GLY 112 HA2 GLY 112 230.713 1.481 11.109 817 HA3 GLY 112 HA3 GLY 112 229.433 2.507 11.755 818 H GLY 113 H GLY 113 230.367 3.830 13.192 819 HA2 GLY 113 HA2 GLY 113 231.420 4.519 15.111 820 HA3 GLY 113 HA3 GLY 113 231.344 2.840 15.657 821 H TYR 114 H TYR 114 233.028 4.380 12.920 822 HA TYR 114 HA TYR 114 235.195 4.354 12.254 823 HB2 TYR 114 HB2 TYR 114 235.457 4.412 15.239 824 HB3 TYR 114 HB3 TYR 114 236.899 4.219 14.249 825 HD1 TYR 114 HD1 TYR 114 235.232 6.565 16.020 826 HD2 TYR 114 HD2 TYR 114 236.677 5.976 12.060 827 HE1 TYR 114 HE1 TYR 114 235.330 9.001 15.699 828 HE2 TYR 114 HE2 TYR 114 236.776 8.410 11.729 829 HH TYR 114 HH TYR 114 235.251 10.602 13.684 830 H GLY 115 H GLY 115 234.378 2.158 11.451 831 HA2 GLY 115 HA2 GLY 115 235.874 -0.052 12.700 832 HA3 GLY 115 HA3 GLY 115 234.513 -0.240 11.606 833 H GLN 116 H GLN 116 235.376 -1.402 9.955 834 HA GLN 116 HA GLN 116 237.910 -0.486 8.784 835 HB2 GLN 116 HB2 GLN 116 237.370 -2.957 9.506 836 HB3 GLN 116 HB3 GLN 116 236.547 -3.016 7.954 837 HG2 GLN 116 HG2 GLN 116 238.523 -3.629 7.136 838 HG3 GLN 116 HG3 GLN 116 238.953 -1.925 7.272 839 HE21 GLN 116 HE21 GLN 116 239.745 -5.057 8.177 840 HE22 GLN 116 HE22 GLN 116 240.886 -4.685 9.419 841 H ASP 117 H ASP 117 237.713 0.888 7.130 842 HA ASP 117 HA ASP 117 235.326 1.304 5.679 843 HB2 ASP 117 HB2 ASP 117 237.691 2.683 5.965 844 HB3 ASP 117 HB3 ASP 117 237.780 2.128 4.300 845 H THR 118 H THR 118 234.722 0.746 3.593 846 HA THR 118 HA THR 118 235.846 -1.749 2.639 847 HB THR 118 HB THR 118 233.913 -1.266 0.851 848 HG1 THR 118 HG1 THR 118 232.486 0.146 1.490 849 HG21 THR 118 HG21 THR 118 233.271 -2.121 3.657 850 HG22 THR 118 HG22 THR 118 233.984 -3.160 2.421 851 HG23 THR 118 HG23 THR 118 232.364 -2.497 2.192 852 H ALA 119 H ALA 119 237.386 -1.852 1.173 853 HA ALA 119 HA ALA 119 237.743 0.402 -0.689 854 HB1 ALA 119 HB1 ALA 119 239.994 0.194 -0.534 855 HB2 ALA 119 HB2 ALA 119 239.929 -1.560 -0.353 856 HB3 ALA 119 HB3 ALA 119 239.586 -0.518 1.029 857 H VAL 120 H VAL 120 237.781 0.039 -2.865 858 HA VAL 120 HA VAL 120 237.331 -2.743 -3.742 859 HB VAL 120 HB VAL 120 235.341 -1.318 -4.048 860 HG11 VAL 120 HG11 VAL 120 236.947 0.726 -4.571 861 HG12 VAL 120 HG12 VAL 120 235.294 0.653 -5.182 862 HG13 VAL 120 HG13 VAL 120 236.642 0.211 -6.230 863 HG21 VAL 120 HG21 VAL 120 236.760 -2.644 -6.267 864 HG22 VAL 120 HG22 VAL 120 235.408 -1.609 -6.725 865 HG23 VAL 120 HG23 VAL 120 235.154 -2.945 -5.603 866 H THR 121 H THR 121 238.785 -3.589 -5.078 867 HA THR 121 HA THR 121 240.981 -1.987 -6.020 868 HB THR 121 HB THR 121 240.291 -4.909 -6.102 869 HG1 THR 121 HG1 THR 121 241.199 -4.036 -4.197 870 HG21 THR 121 HG21 THR 121 242.505 -3.547 -7.584 871 HG22 THR 121 HG22 THR 121 241.417 -4.823 -8.128 872 HG23 THR 121 HG23 THR 121 242.691 -5.189 -6.966 873 H LEU 122 H LEU 122 240.275 -0.609 -7.616 874 HA LEU 122 HA LEU 122 239.335 -1.893 -10.093 875 HB2 LEU 122 HB2 LEU 122 238.307 0.476 -8.642 876 HB3 LEU 122 HB3 LEU 122 238.396 0.614 -10.388 877 HG LEU 122 HG LEU 122 236.844 -1.451 -8.827 878 HD11 LEU 122 HD11 LEU 122 234.923 -0.368 -10.010 879 HD12 LEU 122 HD12 LEU 122 236.035 0.902 -10.518 880 HD13 LEU 122 HD13 LEU 122 235.718 0.644 -8.804 881 HD21 LEU 122 HD21 LEU 122 237.556 -2.619 -10.716 882 HD22 LEU 122 HD22 LEU 122 237.445 -1.195 -11.752 883 HD23 LEU 122 HD23 LEU 122 235.976 -1.987 -11.183 884 HA PRO 123 HA PRO 123 243.122 0.126 -11.438 885 HB2 PRO 123 HB2 PRO 123 243.488 -1.301 -13.672 886 HB3 PRO 123 HB3 PRO 123 243.750 -2.012 -12.068 887 HG2 PRO 123 HG2 PRO 123 241.406 -2.289 -13.910 888 HG3 PRO 123 HG3 PRO 123 242.206 -3.524 -12.922 889 HD2 PRO 123 HD2 PRO 123 239.879 -2.217 -12.217 890 HD3 PRO 123 HD3 PRO 123 240.987 -2.990 -11.067 891 H GLU 124 H GLU 124 240.071 0.670 -12.464 892 HA GLU 124 HA GLU 124 240.893 2.713 -14.340 893 HB2 GLU 124 HB2 GLU 124 240.598 0.591 -15.686 894 HB3 GLU 124 HB3 GLU 124 238.896 0.639 -15.247 895 HG2 GLU 124 HG2 GLU 124 238.564 2.683 -16.419 896 HG3 GLU 124 HG3 GLU 124 240.305 2.886 -16.671 897 H ALA 125 H ALA 125 239.310 4.273 -14.749 898 HA ALA 125 HA ALA 125 237.348 4.523 -12.626 899 HB1 ALA 125 HB1 ALA 125 238.535 6.364 -14.642 900 HB2 ALA 125 HB2 ALA 125 238.399 6.542 -12.894 901 HB3 ALA 125 HB3 ALA 125 236.985 6.784 -13.917 902 H GLY 126 H GLY 126 235.151 4.673 -12.868 903 HA2 GLY 126 HA2 GLY 126 233.770 4.850 -15.321 904 HA3 GLY 126 HA3 GLY 126 233.920 3.151 -14.872 905 H GLN 127 H GLN 127 231.432 4.071 -15.102 906 HA GLN 127 HA GLN 127 230.320 5.246 -12.781 907 HB2 GLN 127 HB2 GLN 127 229.389 4.687 -15.280 908 HB3 GLN 127 HB3 GLN 127 228.581 3.443 -14.339 909 HG2 GLN 127 HG2 GLN 127 227.452 5.013 -13.014 910 HG3 GLN 127 HG3 GLN 127 228.513 6.332 -13.534 911 HE21 GLN 127 HE21 GLN 127 226.666 3.854 -15.302 912 HE22 GLN 127 HE22 GLN 127 225.795 4.972 -16.289 913 H TYR 128 H TYR 128 229.433 4.384 -10.965 914 HA TYR 128 HA TYR 128 229.539 1.459 -10.634 915 HB2 TYR 128 HB2 TYR 128 231.358 3.116 -9.483 916 HB3 TYR 128 HB3 TYR 128 230.114 3.101 -8.241 917 HD1 TYR 128 HD1 TYR 128 229.161 0.535 -7.887 918 HD2 TYR 128 HD2 TYR 128 233.076 1.642 -9.127 919 HE1 TYR 128 HE1 TYR 128 230.022 -1.607 -7.056 920 HE2 TYR 128 HE2 TYR 128 233.949 -0.503 -8.296 921 HH TYR 128 HH TYR 128 231.822 -3.040 -7.153 922 H VAL 129 H VAL 129 227.895 0.546 -9.419 923 HA VAL 129 HA VAL 129 225.809 2.414 -8.489 924 HB VAL 129 HB VAL 129 224.189 0.522 -8.858 925 HG11 VAL 129 HG11 VAL 129 225.371 1.170 -11.504 926 HG12 VAL 129 HG12 VAL 129 224.863 2.506 -10.471 927 HG13 VAL 129 HG13 VAL 129 223.699 1.273 -10.952 928 HG21 VAL 129 HG21 VAL 129 226.400 -1.032 -9.201 929 HG22 VAL 129 HG22 VAL 129 225.914 -0.734 -10.869 930 HG23 VAL 129 HG23 VAL 129 224.777 -1.459 -9.734 931 H TRP 130 H TRP 130 225.498 2.439 -6.382 932 HA TRP 130 HA TRP 130 226.539 0.238 -4.760 933 HB2 TRP 130 HB2 TRP 130 226.136 3.134 -4.361 934 HB3 TRP 130 HB3 TRP 130 225.805 2.128 -2.955 935 HD1 TRP 130 HD1 TRP 130 228.655 3.281 -5.210 936 HE1 TRP 130 HE1 TRP 130 230.888 2.685 -4.085 937 HE3 TRP 130 HE3 TRP 130 226.884 0.451 -1.342 938 HZ2 TRP 130 HZ2 TRP 130 231.785 1.209 -1.848 939 HZ3 TRP 130 HZ3 TRP 130 228.494 -0.518 0.247 940 HH2 TRP 130 HH2 TRP 130 230.894 -0.147 -0.005 941 H SER 131 H SER 131 225.190 -1.276 -4.093 942 HA SER 131 HA SER 131 222.427 -0.513 -3.407 943 HB2 SER 131 HB2 SER 131 222.554 -1.797 -5.564 944 HB3 SER 131 HB3 SER 131 223.236 -3.150 -4.661 945 HG SER 131 HG SER 131 220.902 -3.198 -5.002 946 H LEU 132 H LEU 132 221.572 -1.432 -1.552 947 HA LEU 132 HA LEU 132 223.311 -3.252 -0.025 948 HB2 LEU 132 HB2 LEU 132 222.170 -0.616 0.823 949 HB3 LEU 132 HB3 LEU 132 222.437 -1.871 2.016 950 HG LEU 132 HG LEU 132 224.847 -1.929 1.279 951 HD11 LEU 132 HD11 LEU 132 225.263 0.576 0.269 952 HD12 LEU 132 HD12 LEU 132 223.808 0.066 -0.584 953 HD13 LEU 132 HD13 LEU 132 225.269 -0.917 -0.669 954 HD21 LEU 132 HD21 LEU 132 224.352 0.834 2.196 955 HD22 LEU 132 HD22 LEU 132 225.387 -0.422 2.875 956 HD23 LEU 132 HD23 LEU 132 223.648 -0.458 3.168 957 H LYS 133 H LYS 133 222.282 -4.751 1.249 958 HA LYS 133 HA LYS 133 219.352 -4.876 0.959 959 HB2 LYS 133 HB2 LYS 133 221.271 -6.742 0.224 960 HB3 LYS 133 HB3 LYS 133 220.653 -7.367 1.756 961 HG2 LYS 133 HG2 LYS 133 219.098 -6.763 -0.750 962 HG3 LYS 133 HG3 LYS 133 219.409 -8.342 -0.029 963 HD2 LYS 133 HD2 LYS 133 218.173 -6.643 1.915 964 HD3 LYS 133 HD3 LYS 133 217.230 -6.609 0.429 965 HE2 LYS 133 HE2 LYS 133 216.512 -8.385 1.993 966 HE3 LYS 133 HE3 LYS 133 217.045 -9.012 0.432 967 HZ1 LYS 133 HZ1 LYS 133 219.013 -9.817 1.345 968 HZ2 LYS 133 HZ2 LYS 133 217.865 -10.177 2.533 969 HZ3 LYS 133 HZ3 LYS 133 218.899 -8.852 2.730 970 H PHE 134 H PHE 134 218.217 -4.531 2.750 971 HA PHE 134 HA PHE 134 219.487 -5.094 5.351 972 HB2 PHE 134 HB2 PHE 134 217.343 -3.059 4.695 973 HB3 PHE 134 HB3 PHE 134 217.988 -3.372 6.301 974 HD1 PHE 134 HD1 PHE 134 218.206 -1.294 3.510 975 HD2 PHE 134 HD2 PHE 134 220.633 -3.183 6.454 976 HE1 PHE 134 HE1 PHE 134 219.974 0.371 3.118 977 HE2 PHE 134 HE2 PHE 134 222.403 -1.520 6.066 978 HZ PHE 134 HZ PHE 134 222.075 0.260 4.397 979 H THR 135 H THR 135 218.330 -6.158 6.928 980 HA THR 135 HA THR 135 216.158 -7.818 5.945 981 HB THR 135 HB THR 135 218.087 -8.715 7.286 982 HG1 THR 135 HG1 THR 135 216.719 -10.236 7.665 983 HG21 THR 135 HG21 THR 135 218.613 -7.963 9.291 984 HG22 THR 135 HG22 THR 135 216.969 -8.231 9.867 985 HG23 THR 135 HG23 THR 135 217.398 -6.700 9.103 986 H ASP 136 H ASP 136 214.490 -8.331 7.898 987 HA ASP 136 HA ASP 136 213.113 -5.796 8.336 988 HB2 ASP 136 HB2 ASP 136 212.307 -8.662 8.259 989 HB3 ASP 136 HB3 ASP 136 211.346 -7.573 9.256 990 H SER 137 H SER 137 214.383 -8.533 10.195 991 HA SER 137 HA SER 137 213.475 -7.649 12.723 992 HB2 SER 137 HB2 SER 137 215.504 -9.165 13.481 993 HB3 SER 137 HB3 SER 137 214.052 -9.881 12.783 994 HG SER 137 HG SER 137 216.002 -10.674 11.836 995 H GLY 138 H GLY 138 216.141 -6.666 10.754 996 HA2 GLY 138 HA2 GLY 138 217.444 -4.757 11.056 997 HA3 GLY 138 HA3 GLY 138 216.864 -4.655 12.719 998 H ASP 139 H ASP 139 218.052 -7.742 11.760 999 HA ASP 139 HA ASP 139 220.468 -7.254 13.350 1000 HB2 ASP 139 HB2 ASP 139 218.678 -9.581 13.022 1001 HB3 ASP 139 HB3 ASP 139 220.396 -9.960 13.107 1002 HA PRO 140 HA PRO 140 222.451 -9.585 9.680 1003 HB2 PRO 140 HB2 PRO 140 220.882 -10.636 7.728 1004 HB3 PRO 140 HB3 PRO 140 221.321 -11.520 9.193 1005 HG2 PRO 140 HG2 PRO 140 218.791 -10.049 8.562 1006 HG3 PRO 140 HG3 PRO 140 219.005 -11.633 9.331 1007 HD2 PRO 140 HD2 PRO 140 218.500 -9.390 10.755 1008 HD3 PRO 140 HD3 PRO 140 219.500 -10.714 11.384 1009 H GLU 141 H GLU 141 223.413 -8.185 8.338 1010 HA GLU 141 HA GLU 141 221.806 -6.641 6.449 1011 HB2 GLU 141 HB2 GLU 141 224.029 -5.337 8.002 1012 HB3 GLU 141 HB3 GLU 141 222.787 -4.567 7.028 1013 HG2 GLU 141 HG2 GLU 141 222.193 -6.062 9.570 1014 HG3 GLU 141 HG3 GLU 141 222.562 -4.333 9.526 1015 H GLN 142 H GLN 142 222.566 -7.047 4.528 1016 HA GLN 142 HA GLN 142 225.464 -7.395 4.147 1017 HB2 GLN 142 HB2 GLN 142 223.166 -9.002 3.158 1018 HB3 GLN 142 HB3 GLN 142 224.513 -8.769 2.055 1019 HG2 GLN 142 HG2 GLN 142 225.797 -10.215 3.142 1020 HG3 GLN 142 HG3 GLN 142 225.375 -9.542 4.720 1021 HE21 GLN 142 HE21 GLN 142 224.821 -12.050 2.453 1022 HE22 GLN 142 HE22 GLN 142 223.644 -12.925 3.369 1023 H ILE 143 H ILE 143 226.282 -6.785 2.034 1024 HA ILE 143 HA ILE 143 224.648 -4.711 0.714 1025 HB ILE 143 HB ILE 143 227.649 -4.648 1.050 1026 HG12 ILE 143 HG12 ILE 143 226.245 -2.533 2.425 1027 HG13 ILE 143 HG13 ILE 143 225.702 -4.105 3.004 1028 HG21 ILE 143 HG21 ILE 143 227.146 -2.168 0.469 1029 HG22 ILE 143 HG22 ILE 143 225.656 -2.821 -0.210 1030 HG23 ILE 143 HG23 ILE 143 227.218 -3.372 -0.817 1031 HD11 ILE 143 HD11 ILE 143 227.535 -4.330 4.209 1032 HD12 ILE 143 HD12 ILE 143 228.018 -2.706 3.721 1033 HD13 ILE 143 HD13 ILE 143 228.549 -4.102 2.785 1034 H MET 144 H MET 144 225.028 -4.391 -1.545 1035 HA MET 144 HA MET 144 226.583 -6.469 -2.908 1036 HB2 MET 144 HB2 MET 144 223.805 -6.558 -2.733 1037 HB3 MET 144 HB3 MET 144 224.112 -5.875 -4.325 1038 HG2 MET 144 HG2 MET 144 225.662 -8.273 -3.532 1039 HG3 MET 144 HG3 MET 144 223.951 -8.480 -3.908 1040 HE1 MET 144 HE1 MET 144 226.864 -9.557 -5.848 1041 HE2 MET 144 HE2 MET 144 227.385 -8.150 -4.919 1042 HE3 MET 144 HE3 MET 144 227.414 -8.104 -6.681 1043 H VAL 145 H VAL 145 227.995 -5.463 -4.191 1044 HA VAL 145 HA VAL 145 227.140 -2.975 -5.530 1045 HB VAL 145 HB VAL 145 229.473 -2.193 -5.441 1046 HG11 VAL 145 HG11 VAL 145 229.190 -1.209 -3.431 1047 HG12 VAL 145 HG12 VAL 145 228.926 -2.740 -2.596 1048 HG13 VAL 145 HG13 VAL 145 227.615 -1.997 -3.510 1049 HG21 VAL 145 HG21 VAL 145 230.064 -4.389 -3.484 1050 HG22 VAL 145 HG22 VAL 145 231.187 -3.300 -4.296 1051 HG23 VAL 145 HG23 VAL 145 230.384 -4.578 -5.207 1052 H SER 146 H SER 146 227.879 -2.604 -7.633 1053 HA SER 146 HA SER 146 229.490 -4.595 -8.981 1054 HB2 SER 146 HB2 SER 146 227.844 -5.275 -10.588 1055 HB3 SER 146 HB3 SER 146 227.130 -5.502 -8.992 1056 HG SER 146 HG SER 146 226.107 -3.429 -9.307 1057 H LYS 147 H LYS 147 230.058 -3.961 -11.171 1058 HA LYS 147 HA LYS 147 229.767 -1.060 -11.603 1059 HB2 LYS 147 HB2 LYS 147 231.963 -1.155 -12.762 1060 HB3 LYS 147 HB3 LYS 147 232.058 -1.579 -11.048 1061 HG2 LYS 147 HG2 LYS 147 232.654 -3.722 -11.471 1062 HG3 LYS 147 HG3 LYS 147 231.699 -3.816 -12.951 1063 HD2 LYS 147 HD2 LYS 147 233.925 -1.927 -13.110 1064 HD3 LYS 147 HD3 LYS 147 234.431 -3.593 -12.825 1065 HE2 LYS 147 HE2 LYS 147 232.348 -3.355 -14.853 1066 HE3 LYS 147 HE3 LYS 147 233.820 -2.480 -15.270 1067 HZ1 LYS 147 HZ1 LYS 147 234.898 -4.373 -15.663 1068 HZ2 LYS 147 HZ2 LYS 147 233.392 -5.141 -15.633 1069 HZ3 LYS 147 HZ3 LYS 147 234.349 -5.105 -14.239 1070 H CYS 148 H CYS 148 229.443 -0.308 -13.710 1071 HA CYS 148 HA CYS 148 227.937 -2.038 -15.394 1072 HB2 CYS 148 HB2 CYS 148 229.031 0.704 -16.053 1073 HB3 CYS 148 HB3 CYS 148 227.707 -0.123 -16.867 1074 HA PRO 149 HA PRO 149 231.255 -3.694 -17.829 1075 HB2 PRO 149 HB2 PRO 149 229.821 -4.697 -19.886 1076 HB3 PRO 149 HB3 PRO 149 229.802 -5.426 -18.271 1077 HG2 PRO 149 HG2 PRO 149 227.813 -3.582 -19.543 1078 HG3 PRO 149 HG3 PRO 149 227.526 -5.043 -18.581 1079 HD2 PRO 149 HD2 PRO 149 227.332 -2.531 -17.560 1080 HD3 PRO 149 HD3 PRO 149 227.811 -3.935 -16.588 Start of MODEL 9 1 H1 THR 1 H1 THR 1 247.145 -17.833 39.324 2 H2 THR 1 H2 THR 1 247.740 -18.769 40.635 3 H3 THR 1 H3 THR 1 246.269 -19.205 39.865 4 HA THR 1 HA THR 1 248.098 -20.616 39.235 5 HB THR 1 HB THR 1 247.840 -19.980 36.675 6 HG1 THR 1 HG1 THR 1 245.559 -18.647 37.591 7 HG21 THR 1 HG21 THR 1 246.696 -21.853 37.806 8 HG22 THR 1 HG22 THR 1 245.718 -21.069 36.564 9 HG23 THR 1 HG23 THR 1 245.409 -20.740 38.270 10 HA PRO 2 HA PRO 2 251.934 -18.131 39.344 11 HB2 PRO 2 HB2 PRO 2 252.955 -20.906 38.907 12 HB3 PRO 2 HB3 PRO 2 253.517 -19.662 40.031 13 HG2 PRO 2 HG2 PRO 2 252.068 -21.702 40.915 14 HG3 PRO 2 HG3 PRO 2 251.801 -20.065 41.544 15 HD2 PRO 2 HD2 PRO 2 250.174 -21.636 39.593 16 HD3 PRO 2 HD3 PRO 2 249.642 -20.509 40.857 17 H SER 3 H SER 3 251.015 -20.636 37.007 18 HA SER 3 HA SER 3 252.162 -19.002 34.868 19 HB2 SER 3 HB2 SER 3 252.760 -21.940 35.287 20 HB3 SER 3 HB3 SER 3 253.105 -21.068 33.793 21 HG SER 3 HG SER 3 254.632 -19.896 34.811 22 H ALA 4 H ALA 4 250.858 -18.855 33.132 23 HA ALA 4 HA ALA 4 249.015 -20.959 32.426 24 HB1 ALA 4 HB1 ALA 4 247.005 -19.974 32.935 25 HB2 ALA 4 HB2 ALA 4 247.685 -18.347 32.975 26 HB3 ALA 4 HB3 ALA 4 247.984 -19.462 34.309 27 H SER 5 H SER 5 248.110 -20.721 30.358 28 HA SER 5 HA SER 5 248.810 -18.339 28.818 29 HB2 SER 5 HB2 SER 5 249.608 -21.142 27.984 30 HB3 SER 5 HB3 SER 5 249.765 -19.697 26.984 31 HG SER 5 HG SER 5 251.600 -20.560 28.471 32 H GLY 6 H GLY 6 246.898 -17.689 28.059 33 HA2 GLY 6 HA2 GLY 6 245.440 -18.797 26.081 34 HA3 GLY 6 HA3 GLY 6 244.774 -19.579 27.507 35 H LEU 7 H LEU 7 242.750 -18.658 27.397 36 HA LEU 7 HA LEU 7 241.111 -17.122 27.721 37 HB2 LEU 7 HB2 LEU 7 242.991 -16.638 29.643 38 HB3 LEU 7 HB3 LEU 7 242.848 -15.061 28.891 39 HG LEU 7 HG LEU 7 240.227 -15.678 29.234 40 HD11 LEU 7 HD11 LEU 7 239.894 -16.686 31.385 41 HD12 LEU 7 HD12 LEU 7 241.633 -16.824 31.641 42 HD13 LEU 7 HD13 LEU 7 240.849 -17.784 30.389 43 HD21 LEU 7 HD21 LEU 7 241.826 -13.714 30.016 44 HD22 LEU 7 HD22 LEU 7 241.636 -14.515 31.576 45 HD23 LEU 7 HD23 LEU 7 240.216 -13.936 30.704 46 H THR 8 H THR 8 242.564 -17.042 25.236 47 HA THR 8 HA THR 8 242.107 -14.226 24.512 48 HB THR 8 HB THR 8 243.951 -14.415 22.864 49 HG1 THR 8 HG1 THR 8 245.178 -16.189 22.748 50 HG21 THR 8 HG21 THR 8 244.300 -13.674 25.326 51 HG22 THR 8 HG22 THR 8 245.696 -13.995 24.296 52 HG23 THR 8 HG23 THR 8 245.167 -15.202 25.467 53 H LYS 9 H LYS 9 240.252 -14.262 23.378 54 HA LYS 9 HA LYS 9 239.338 -16.498 21.891 55 HB2 LYS 9 HB2 LYS 9 238.100 -14.344 22.902 56 HB3 LYS 9 HB3 LYS 9 238.275 -13.804 21.238 57 HG2 LYS 9 HG2 LYS 9 237.280 -16.175 20.701 58 HG3 LYS 9 HG3 LYS 9 236.662 -16.042 22.348 59 HD2 LYS 9 HD2 LYS 9 234.933 -15.093 21.177 60 HD3 LYS 9 HD3 LYS 9 235.904 -13.662 21.527 61 HE2 LYS 9 HE2 LYS 9 235.496 -13.383 19.282 62 HE3 LYS 9 HE3 LYS 9 237.041 -14.234 19.242 63 HZ1 LYS 9 HZ1 LYS 9 234.353 -15.444 18.853 64 HZ2 LYS 9 HZ2 LYS 9 235.804 -16.314 18.902 65 HZ3 LYS 9 HZ3 LYS 9 235.529 -15.199 17.660 66 H VAL 10 H VAL 10 240.227 -17.204 20.080 67 HA VAL 10 HA VAL 10 241.249 -15.240 18.137 68 HB VAL 10 HB VAL 10 242.712 -17.018 17.272 69 HG11 VAL 10 HG11 VAL 10 244.000 -17.294 19.602 70 HG12 VAL 10 HG12 VAL 10 242.884 -16.002 20.044 71 HG13 VAL 10 HG13 VAL 10 243.986 -15.790 18.683 72 HG21 VAL 10 HG21 VAL 10 242.828 -18.911 19.286 73 HG22 VAL 10 HG22 VAL 10 242.126 -19.132 17.684 74 HG23 VAL 10 HG23 VAL 10 241.099 -18.668 19.038 75 H ALA 11 H ALA 11 241.098 -15.879 15.843 76 HA ALA 11 HA ALA 11 238.460 -16.520 15.107 77 HB1 ALA 11 HB1 ALA 11 239.409 -15.265 13.475 78 HB2 ALA 11 HB2 ALA 11 239.733 -16.853 12.782 79 HB3 ALA 11 HB3 ALA 11 240.997 -16.006 13.673 80 H THR 12 H THR 12 237.504 -18.437 15.195 81 HA THR 12 HA THR 12 239.120 -20.869 14.923 82 HB THR 12 HB THR 12 236.237 -20.773 15.788 83 HG1 THR 12 HG1 THR 12 238.544 -20.318 17.372 84 HG21 THR 12 HG21 THR 12 236.465 -22.906 16.320 85 HG22 THR 12 HG22 THR 12 237.980 -22.607 17.172 86 HG23 THR 12 HG23 THR 12 237.988 -22.885 15.431 87 H VAL 13 H VAL 13 238.937 -22.202 13.225 88 HA VAL 13 HA VAL 13 236.569 -22.116 11.523 89 HB VAL 13 HB VAL 13 238.052 -22.064 9.465 90 HG11 VAL 13 HG11 VAL 13 236.623 -20.180 10.340 91 HG12 VAL 13 HG12 VAL 13 237.969 -19.703 9.306 92 HG13 VAL 13 HG13 VAL 13 238.088 -19.510 11.056 93 HG21 VAL 13 HG21 VAL 13 240.071 -20.595 11.090 94 HG22 VAL 13 HG22 VAL 13 240.255 -21.437 9.551 95 HG23 VAL 13 HG23 VAL 13 240.138 -22.356 11.052 96 H SER 14 H SER 14 236.017 -24.091 10.772 97 HA SER 14 HA SER 14 238.039 -26.181 10.560 98 HB2 SER 14 HB2 SER 14 235.526 -26.876 12.040 99 HB3 SER 14 HB3 SER 14 237.102 -27.663 12.087 100 HG SER 14 HG SER 14 237.757 -26.290 13.571 101 H ALA 15 H ALA 15 237.532 -25.780 8.291 102 HA ALA 15 HA ALA 15 236.646 -26.459 6.314 103 HB1 ALA 15 HB1 ALA 15 236.330 -28.619 7.874 104 HB2 ALA 15 HB2 ALA 15 235.817 -28.551 6.189 105 HB3 ALA 15 HB3 ALA 15 234.644 -28.284 7.480 106 H ALA 16 H ALA 16 235.481 -25.028 5.248 107 HA ALA 16 HA ALA 16 232.803 -24.323 6.266 108 HB1 ALA 16 HB1 ALA 16 234.988 -22.671 5.125 109 HB2 ALA 16 HB2 ALA 16 233.833 -22.299 6.403 110 HB3 ALA 16 HB3 ALA 16 233.333 -22.221 4.716 111 H SER 17 H SER 17 231.153 -24.944 5.045 112 HA SER 17 HA SER 17 231.637 -25.626 2.225 113 HB2 SER 17 HB2 SER 17 229.079 -26.392 3.535 114 HB3 SER 17 HB3 SER 17 230.074 -27.293 2.392 115 HG SER 17 HG SER 17 230.768 -28.330 4.076 116 H SER 18 H SER 18 230.522 -24.641 0.598 117 HA SER 18 HA SER 18 228.473 -22.666 1.360 118 HB2 SER 18 HB2 SER 18 230.481 -22.219 -0.854 119 HB3 SER 18 HB3 SER 18 229.347 -21.055 -0.171 120 HG SER 18 HG SER 18 231.054 -20.546 0.976 121 H LEU 19 H LEU 19 226.591 -23.137 0.466 122 HA LEU 19 HA LEU 19 226.567 -24.514 -2.140 123 HB2 LEU 19 HB2 LEU 19 224.402 -25.449 -1.502 124 HB3 LEU 19 HB3 LEU 19 225.660 -25.900 -0.367 125 HG LEU 19 HG LEU 19 224.242 -23.487 0.454 126 HD11 LEU 19 HD11 LEU 19 222.554 -25.899 0.749 127 HD12 LEU 19 HD12 LEU 19 222.547 -25.098 -0.821 128 HD13 LEU 19 HD13 LEU 19 222.099 -24.200 0.628 129 HD21 LEU 19 HD21 LEU 19 225.770 -25.346 1.657 130 HD22 LEU 19 HD22 LEU 19 224.167 -25.968 2.050 131 HD23 LEU 19 HD23 LEU 19 224.616 -24.327 2.517 132 H ILE 20 H ILE 20 226.727 -21.634 -1.776 133 HA ILE 20 HA ILE 20 224.301 -20.903 -3.245 134 HB ILE 20 HB ILE 20 224.063 -18.791 -2.064 135 HG12 ILE 20 HG12 ILE 20 226.454 -18.544 -1.392 136 HG13 ILE 20 HG13 ILE 20 225.314 -18.229 -0.078 137 HG21 ILE 20 HG21 ILE 20 224.057 -20.582 0.261 138 HG22 ILE 20 HG22 ILE 20 223.237 -21.207 -1.168 139 HG23 ILE 20 HG23 ILE 20 222.746 -19.662 -0.475 140 HD11 ILE 20 HD11 ILE 20 225.867 -20.900 0.220 141 HD12 ILE 20 HD12 ILE 20 226.604 -19.580 1.125 142 HD13 ILE 20 HD13 ILE 20 227.411 -20.228 -0.301 143 H GLY 21 H GLY 21 224.593 -19.434 -4.872 144 HA2 GLY 21 HA2 GLY 21 227.058 -17.923 -5.090 145 HA3 GLY 21 HA3 GLY 21 226.884 -19.224 -6.274 146 H GLU 22 H GLU 22 226.993 -16.277 -6.560 147 HA GLU 22 HA GLU 22 224.485 -15.944 -8.063 148 HB2 GLU 22 HB2 GLU 22 225.701 -14.232 -6.003 149 HB3 GLU 22 HB3 GLU 22 225.212 -13.377 -7.457 150 HG2 GLU 22 HG2 GLU 22 223.503 -14.930 -5.549 151 HG3 GLU 22 HG3 GLU 22 223.411 -13.227 -5.981 152 H GLY 23 H GLY 23 224.625 -14.909 -10.037 153 HA2 GLY 23 HA2 GLY 23 227.380 -14.396 -10.995 154 HA3 GLY 23 HA3 GLY 23 226.140 -15.159 -11.990 155 H PHE 24 H PHE 24 226.547 -13.535 -13.564 156 HA PHE 24 HA PHE 24 226.394 -10.791 -13.224 157 HB2 PHE 24 HB2 PHE 24 225.828 -10.666 -15.627 158 HB3 PHE 24 HB3 PHE 24 227.174 -11.767 -15.302 159 HD1 PHE 24 HD1 PHE 24 223.709 -11.482 -16.434 160 HD2 PHE 24 HD2 PHE 24 226.905 -14.167 -15.590 161 HE1 PHE 24 HE1 PHE 24 222.535 -13.261 -17.664 162 HE2 PHE 24 HE2 PHE 24 225.735 -15.948 -16.818 163 HZ PHE 24 HZ PHE 24 223.548 -15.498 -17.857 164 H MET 25 H MET 25 223.772 -13.117 -13.540 165 HA MET 25 HA MET 25 221.652 -11.413 -14.108 166 HB2 MET 25 HB2 MET 25 221.547 -13.831 -12.300 167 HB3 MET 25 HB3 MET 25 220.197 -13.111 -13.166 168 HG2 MET 25 HG2 MET 25 220.712 -14.134 -15.086 169 HG3 MET 25 HG3 MET 25 222.444 -13.891 -14.872 170 HE1 MET 25 HE1 MET 25 222.941 -16.445 -11.943 171 HE2 MET 25 HE2 MET 25 223.296 -14.825 -12.540 172 HE3 MET 25 HE3 MET 25 224.006 -16.233 -13.333 173 H ALA 26 H ALA 26 223.324 -11.936 -11.062 174 HA ALA 26 HA ALA 26 221.421 -10.112 -9.746 175 HB1 ALA 26 HB1 ALA 26 223.359 -12.039 -8.472 176 HB2 ALA 26 HB2 ALA 26 221.627 -12.305 -8.682 177 HB3 ALA 26 HB3 ALA 26 222.200 -11.016 -7.625 178 H GLN 27 H GLN 27 224.122 -9.747 -11.408 179 HA GLN 27 HA GLN 27 225.592 -8.141 -9.467 180 HB2 GLN 27 HB2 GLN 27 226.498 -9.770 -11.414 181 HB3 GLN 27 HB3 GLN 27 226.495 -8.243 -12.282 182 HG2 GLN 27 HG2 GLN 27 227.664 -7.615 -9.860 183 HG3 GLN 27 HG3 GLN 27 228.294 -9.218 -10.229 184 HE21 GLN 27 HE21 GLN 27 227.589 -6.200 -11.977 185 HE22 GLN 27 HE22 GLN 27 229.092 -6.160 -12.846 186 H CYS 28 H CYS 28 223.546 -7.758 -12.287 187 HA CYS 28 HA CYS 28 223.011 -5.044 -11.688 188 HB2 CYS 28 HB2 CYS 28 225.269 -4.732 -12.663 189 HB3 CYS 28 HB3 CYS 28 224.718 -5.492 -14.150 190 H ASP 29 H ASP 29 221.102 -6.656 -11.847 191 HA ASP 29 HA ASP 29 219.723 -6.052 -14.318 192 HB2 ASP 29 HB2 ASP 29 220.990 -8.227 -14.697 193 HB3 ASP 29 HB3 ASP 29 219.923 -8.947 -13.481 194 H ASN 30 H ASN 30 219.506 -5.594 -11.325 195 HA ASN 30 HA ASN 30 216.942 -6.880 -10.756 196 HB2 ASN 30 HB2 ASN 30 218.820 -5.278 -9.019 197 HB3 ASN 30 HB3 ASN 30 217.251 -5.865 -8.478 198 HD21 ASN 30 HD21 ASN 30 219.842 -6.491 -7.400 199 HD22 ASN 30 HD22 ASN 30 220.045 -8.210 -7.552 200 HA PRO 31 HA PRO 31 215.002 -3.045 -12.150 201 HB2 PRO 31 HB2 PRO 31 212.490 -4.386 -11.522 202 HB3 PRO 31 HB3 PRO 31 213.132 -3.853 -13.085 203 HG2 PRO 31 HG2 PRO 31 212.890 -6.465 -12.409 204 HG3 PRO 31 HG3 PRO 31 214.131 -5.848 -13.512 205 HD2 PRO 31 HD2 PRO 31 214.365 -6.603 -10.627 206 HD3 PRO 31 HD3 PRO 31 215.500 -6.890 -11.964 207 H THR 32 H THR 32 214.199 -1.282 -11.073 208 HA THR 32 HA THR 32 213.615 -1.667 -8.217 209 HB THR 32 HB THR 32 214.032 1.052 -8.571 210 HG1 THR 32 HG1 THR 32 215.807 1.265 -9.831 211 HG21 THR 32 HG21 THR 32 215.181 -1.069 -7.127 212 HG22 THR 32 HG22 THR 32 215.373 0.666 -6.863 213 HG23 THR 32 HG23 THR 32 216.504 -0.197 -7.903 214 H ILE 33 H ILE 33 211.624 -1.547 -7.635 215 HA ILE 33 HA ILE 33 209.757 0.368 -8.891 216 HB ILE 33 HB ILE 33 209.414 -2.026 -9.670 217 HG12 ILE 33 HG12 ILE 33 206.970 -1.230 -8.156 218 HG13 ILE 33 HG13 ILE 33 207.621 -0.084 -9.325 219 HG21 ILE 33 HG21 ILE 33 208.363 -2.472 -6.886 220 HG22 ILE 33 HG22 ILE 33 209.958 -3.002 -7.420 221 HG23 ILE 33 HG23 ILE 33 208.511 -3.649 -8.193 222 HD11 ILE 33 HD11 ILE 33 207.295 -2.871 -10.240 223 HD12 ILE 33 HD12 ILE 33 207.028 -1.352 -11.095 224 HD13 ILE 33 HD13 ILE 33 205.823 -1.943 -9.951 225 H GLU 34 H GLU 34 207.876 0.805 -7.500 226 HA GLU 34 HA GLU 34 208.685 1.589 -4.924 227 HB2 GLU 34 HB2 GLU 34 206.287 1.778 -6.521 228 HB3 GLU 34 HB3 GLU 34 205.875 1.383 -4.857 229 HG2 GLU 34 HG2 GLU 34 207.146 3.315 -4.080 230 HG3 GLU 34 HG3 GLU 34 207.569 3.709 -5.744 231 H GLY 35 H GLY 35 209.303 0.184 -3.405 232 HA2 GLY 35 HA2 GLY 35 207.611 -2.190 -2.896 233 HA3 GLY 35 HA3 GLY 35 209.352 -2.149 -2.636 234 H ASP 36 H ASP 36 209.581 -2.453 -0.511 235 HA ASP 36 HA ASP 36 207.954 -0.805 1.313 236 HB2 ASP 36 HB2 ASP 36 209.305 -3.468 1.596 237 HB3 ASP 36 HB3 ASP 36 209.011 -2.484 3.036 238 H GLY 37 H GLY 37 210.157 0.367 -0.091 239 HA2 GLY 37 HA2 GLY 37 212.500 0.431 1.516 240 HA3 GLY 37 HA3 GLY 37 212.073 1.584 0.263 241 HA PRO 38 HA PRO 38 211.075 2.930 4.923 242 HB2 PRO 38 HB2 PRO 38 213.954 3.665 5.076 243 HB3 PRO 38 HB3 PRO 38 212.883 3.021 6.334 244 HG2 PRO 38 HG2 PRO 38 214.716 1.469 5.187 245 HG3 PRO 38 HG3 PRO 38 213.110 0.835 5.589 246 HD2 PRO 38 HD2 PRO 38 214.215 1.656 2.935 247 HD3 PRO 38 HD3 PRO 38 213.145 0.298 3.342 248 H ILE 39 H ILE 39 210.045 4.771 4.494 249 HA ILE 39 HA ILE 39 211.110 6.754 2.701 250 HB ILE 39 HB ILE 39 208.652 7.020 4.430 251 HG12 ILE 39 HG12 ILE 39 207.873 6.296 1.830 252 HG13 ILE 39 HG13 ILE 39 209.162 5.175 2.255 253 HG21 ILE 39 HG21 ILE 39 208.071 8.281 2.134 254 HG22 ILE 39 HG22 ILE 39 209.817 8.517 2.171 255 HG23 ILE 39 HG23 ILE 39 208.823 9.075 3.515 256 HD11 ILE 39 HD11 ILE 39 207.264 5.513 4.414 257 HD12 ILE 39 HD12 ILE 39 207.838 4.042 3.625 258 HD13 ILE 39 HD13 ILE 39 206.499 4.955 2.927 259 H GLY 40 H GLY 40 211.431 8.982 3.227 260 HA2 GLY 40 HA2 GLY 40 212.035 10.779 4.545 261 HA3 GLY 40 HA3 GLY 40 211.576 9.850 5.961 262 H LYS 41 H LYS 41 213.786 8.235 3.898 263 HA LYS 41 HA LYS 41 216.059 9.192 5.498 264 HB2 LYS 41 HB2 LYS 41 216.838 7.025 5.968 265 HB3 LYS 41 HB3 LYS 41 215.115 6.969 6.306 266 HG2 LYS 41 HG2 LYS 41 215.238 5.063 5.124 267 HG3 LYS 41 HG3 LYS 41 215.092 6.159 3.749 268 HD2 LYS 41 HD2 LYS 41 217.346 6.013 3.230 269 HD3 LYS 41 HD3 LYS 41 217.791 5.504 4.861 270 HE2 LYS 41 HE2 LYS 41 216.332 3.412 4.280 271 HE3 LYS 41 HE3 LYS 41 216.636 3.908 2.616 272 HZ1 LYS 41 HZ1 LYS 41 219.062 3.979 4.015 273 HZ2 LYS 41 HZ2 LYS 41 218.619 2.967 2.738 274 HZ3 LYS 41 HZ3 LYS 41 218.326 2.491 4.332 275 H THR 42 H THR 42 217.868 9.625 4.382 276 HA THR 42 HA THR 42 217.961 8.792 1.556 277 HB THR 42 HB THR 42 219.615 10.913 1.566 278 HG1 THR 42 HG1 THR 42 218.818 12.500 2.906 279 HG21 THR 42 HG21 THR 42 217.657 10.623 0.097 280 HG22 THR 42 HG22 THR 42 217.853 12.275 0.682 281 HG23 THR 42 HG23 THR 42 216.629 11.227 1.397 282 H LEU 43 H LEU 43 219.876 8.039 0.703 283 HA LEU 43 HA LEU 43 221.776 7.000 2.640 284 HB2 LEU 43 HB2 LEU 43 220.832 6.213 0.057 285 HB3 LEU 43 HB3 LEU 43 222.571 6.405 -0.026 286 HG LEU 43 HG LEU 43 221.920 4.095 0.466 287 HD11 LEU 43 HD11 LEU 43 223.106 4.798 3.040 288 HD12 LEU 43 HD12 LEU 43 223.908 5.533 1.653 289 HD13 LEU 43 HD13 LEU 43 223.726 3.782 1.740 290 HD21 LEU 43 HD21 LEU 43 219.893 4.282 1.629 291 HD22 LEU 43 HD22 LEU 43 220.588 5.357 2.841 292 HD23 LEU 43 HD23 LEU 43 221.041 3.653 2.809 293 H TYR 44 H TYR 44 223.619 7.991 3.132 294 HA TYR 44 HA TYR 44 224.596 10.118 1.348 295 HB2 TYR 44 HB2 TYR 44 224.131 10.104 4.093 296 HB3 TYR 44 HB3 TYR 44 225.879 9.958 3.961 297 HD1 TYR 44 HD1 TYR 44 223.433 11.854 1.870 298 HD2 TYR 44 HD2 TYR 44 226.759 12.023 4.521 299 HE1 TYR 44 HE1 TYR 44 223.595 14.279 1.505 300 HE2 TYR 44 HE2 TYR 44 226.929 14.450 4.160 301 HH TYR 44 HH TYR 44 225.485 16.048 1.671 302 H VAL 45 H VAL 45 226.296 9.637 0.109 303 HA VAL 45 HA VAL 45 228.182 7.583 1.068 304 HB VAL 45 HB VAL 45 226.988 6.839 -0.927 305 HG11 VAL 45 HG11 VAL 45 227.317 7.983 -3.085 306 HG12 VAL 45 HG12 VAL 45 228.121 9.305 -2.240 307 HG13 VAL 45 HG13 VAL 45 226.420 8.964 -1.926 308 HG21 VAL 45 HG21 VAL 45 229.375 6.226 -0.559 309 HG22 VAL 45 HG22 VAL 45 229.830 7.538 -1.647 310 HG23 VAL 45 HG23 VAL 45 228.872 6.184 -2.247 311 H VAL 46 H VAL 46 230.314 8.057 1.179 312 HA VAL 46 HA VAL 46 231.228 10.592 0.008 313 HB VAL 46 HB VAL 46 232.563 11.087 1.992 314 HG11 VAL 46 HG11 VAL 46 229.856 10.688 3.138 315 HG12 VAL 46 HG12 VAL 46 229.989 11.641 1.660 316 HG13 VAL 46 HG13 VAL 46 230.875 12.128 3.105 317 HG21 VAL 46 HG21 VAL 46 233.051 9.060 3.022 318 HG22 VAL 46 HG22 VAL 46 231.370 8.533 3.004 319 HG23 VAL 46 HG23 VAL 46 231.884 9.792 4.123 320 H GLY 47 H GLY 47 232.894 10.290 -1.298 321 HA2 GLY 47 HA2 GLY 47 234.288 7.778 -1.378 322 HA3 GLY 47 HA3 GLY 47 234.564 9.165 -2.430 323 H ASP 48 H ASP 48 235.908 7.274 -0.081 324 HA ASP 48 HA ASP 48 237.464 9.308 1.243 325 HB2 ASP 48 HB2 ASP 48 236.882 6.492 1.650 326 HB3 ASP 48 HB3 ASP 48 238.610 6.829 1.823 327 H PHE 49 H PHE 49 238.590 10.277 -0.426 328 HA PHE 49 HA PHE 49 240.483 10.696 -1.622 329 HB2 PHE 49 HB2 PHE 49 241.273 8.649 0.105 330 HB3 PHE 49 HB3 PHE 49 241.787 8.102 -1.497 331 HD1 PHE 49 HD1 PHE 49 243.716 8.966 -2.475 332 HD2 PHE 49 HD2 PHE 49 241.995 10.959 0.867 333 HE1 PHE 49 HE1 PHE 49 245.694 10.419 -2.329 334 HE2 PHE 49 HE2 PHE 49 243.970 12.417 1.019 335 HZ PHE 49 HZ PHE 49 245.824 12.150 -0.580 336 H ALA 50 H ALA 50 241.899 9.485 -3.465 337 HA ALA 50 HA ALA 50 241.962 8.563 -5.542 338 HB1 ALA 50 HB1 ALA 50 240.822 6.610 -4.362 339 HB2 ALA 50 HB2 ALA 50 240.629 6.722 -6.111 340 HB3 ALA 50 HB3 ALA 50 239.319 7.226 -5.044 341 H ASP 51 H ASP 51 241.188 11.111 -5.386 342 HA ASP 51 HA ASP 51 240.146 12.807 -6.487 343 HB2 ASP 51 HB2 ASP 51 240.616 10.736 -8.372 344 HB3 ASP 51 HB3 ASP 51 239.028 11.423 -8.736 345 H ALA 52 H ALA 52 238.574 11.289 -4.556 346 HA ALA 52 HA ALA 52 235.881 11.374 -5.700 347 HB1 ALA 52 HB1 ALA 52 236.990 9.530 -4.078 348 HB2 ALA 52 HB2 ALA 52 235.256 9.842 -4.173 349 HB3 ALA 52 HB3 ALA 52 236.216 10.573 -2.886 350 H SER 53 H SER 53 237.834 12.789 -3.112 351 HA SER 53 HA SER 53 237.577 14.647 -1.827 352 HB2 SER 53 HB2 SER 53 237.323 15.535 -4.274 353 HB3 SER 53 HB3 SER 53 235.632 15.757 -3.826 354 HG SER 53 HG SER 53 236.176 17.404 -2.635 355 H TRP 54 H TRP 54 235.597 12.394 -1.559 356 HA TRP 54 HA TRP 54 233.644 11.895 -0.496 357 HB2 TRP 54 HB2 TRP 54 234.322 14.431 1.012 358 HB3 TRP 54 HB3 TRP 54 233.235 13.151 1.572 359 HD1 TRP 54 HD1 TRP 54 234.451 10.713 2.072 360 HE1 TRP 54 HE1 TRP 54 236.805 10.226 2.991 361 HE3 TRP 54 HE3 TRP 54 236.654 15.215 1.074 362 HZ2 TRP 54 HZ2 TRP 54 239.271 11.574 3.256 363 HZ3 TRP 54 HZ3 TRP 54 239.014 15.536 1.691 364 HH2 TRP 54 HH2 TRP 54 240.294 13.751 2.759 365 H LYS 55 H LYS 55 232.754 12.630 -2.732 366 HA LYS 55 HA LYS 55 231.043 14.990 -2.532 367 HB2 LYS 55 HB2 LYS 55 231.779 13.158 -4.815 368 HB3 LYS 55 HB3 LYS 55 230.523 14.381 -4.957 369 HG2 LYS 55 HG2 LYS 55 232.168 16.122 -4.427 370 HG3 LYS 55 HG3 LYS 55 233.423 14.887 -4.318 371 HD2 LYS 55 HD2 LYS 55 231.756 15.227 -6.793 372 HD3 LYS 55 HD3 LYS 55 233.212 16.184 -6.520 373 HE2 LYS 55 HE2 LYS 55 233.512 13.287 -6.099 374 HE3 LYS 55 HE3 LYS 55 233.164 13.768 -7.758 375 HZ1 LYS 55 HZ1 LYS 55 235.613 13.680 -6.787 376 HZ2 LYS 55 HZ2 LYS 55 235.237 15.272 -6.357 377 HZ3 LYS 55 HZ3 LYS 55 235.155 14.793 -7.977 378 H GLN 56 H GLN 56 228.853 14.935 -2.444 379 HA GLN 56 HA GLN 56 227.465 12.372 -2.696 380 HB2 GLN 56 HB2 GLN 56 226.205 12.854 -0.579 381 HB3 GLN 56 HB3 GLN 56 227.899 12.456 -0.343 382 HG2 GLN 56 HG2 GLN 56 227.604 15.293 -0.639 383 HG3 GLN 56 HG3 GLN 56 226.496 14.693 0.604 384 HE21 GLN 56 HE21 GLN 56 229.655 13.352 -0.229 385 HE22 GLN 56 HE22 GLN 56 230.404 13.710 1.285 386 H LYS 57 H LYS 57 226.476 13.147 -4.581 387 HA LYS 57 HA LYS 57 225.063 15.650 -4.601 388 HB2 LYS 57 HB2 LYS 57 226.127 14.196 -6.577 389 HB3 LYS 57 HB3 LYS 57 224.484 13.572 -6.650 390 HG2 LYS 57 HG2 LYS 57 223.596 15.606 -7.282 391 HG3 LYS 57 HG3 LYS 57 224.955 16.521 -6.625 392 HD2 LYS 57 HD2 LYS 57 225.586 14.632 -8.811 393 HD3 LYS 57 HD3 LYS 57 224.611 16.035 -9.252 394 HE2 LYS 57 HE2 LYS 57 226.275 17.543 -8.616 395 HE3 LYS 57 HE3 LYS 57 227.120 16.344 -7.639 396 HZ1 LYS 57 HZ1 LYS 57 227.273 16.853 -10.496 397 HZ2 LYS 57 HZ2 LYS 57 227.281 15.222 -10.049 398 HZ3 LYS 57 HZ3 LYS 57 228.455 16.271 -9.434 399 HA PRO 58 HA PRO 58 221.311 14.297 -2.618 400 HB2 PRO 58 HB2 PRO 58 220.100 16.384 -4.370 401 HB3 PRO 58 HB3 PRO 58 219.968 16.160 -2.615 402 HG2 PRO 58 HG2 PRO 58 221.505 18.086 -3.612 403 HG3 PRO 58 HG3 PRO 58 222.033 17.144 -2.204 404 HD2 PRO 58 HD2 PRO 58 222.901 16.933 -5.059 405 HD3 PRO 58 HD3 PRO 58 223.862 16.786 -3.574 406 H HIS 59 H HIS 59 221.636 14.603 -6.102 407 HA HIS 59 HA HIS 59 219.191 13.327 -6.804 408 HB2 HIS 59 HB2 HIS 59 220.428 14.818 -8.326 409 HB3 HIS 59 HB3 HIS 59 221.743 13.641 -8.401 410 HD1 HIS 59 HD1 HIS 59 218.221 12.398 -8.578 411 HD2 HIS 59 HD2 HIS 59 221.335 13.340 -11.165 412 HE1 HIS 59 HE1 HIS 59 217.539 11.477 -10.818 413 HE2 HIS 59 HE2 HIS 59 219.497 11.946 -12.334 414 H ARG 60 H ARG 60 221.957 12.052 -5.375 415 HA ARG 60 HA ARG 60 221.254 9.358 -6.319 416 HB2 ARG 60 HB2 ARG 60 223.823 10.721 -6.434 417 HB3 ARG 60 HB3 ARG 60 223.925 9.200 -5.559 418 HG2 ARG 60 HG2 ARG 60 223.693 7.982 -7.414 419 HG3 ARG 60 HG3 ARG 60 222.404 9.009 -8.040 420 HD2 ARG 60 HD2 ARG 60 224.212 9.178 -9.565 421 HD3 ARG 60 HD3 ARG 60 224.176 10.689 -8.646 422 HE ARG 60 HE ARG 60 226.157 8.539 -8.406 423 HH11 ARG 60 HH11 ARG 60 225.087 11.755 -7.506 424 HH12 ARG 60 HH12 ARG 60 226.608 12.194 -6.810 425 HH21 ARG 60 HH21 ARG 60 228.151 9.138 -7.485 426 HH22 ARG 60 HH22 ARG 60 228.346 10.713 -6.796 427 H ALA 61 H ALA 61 220.594 11.072 -3.890 428 HA ALA 61 HA ALA 61 221.873 10.115 -1.609 429 HB1 ALA 61 HB1 ALA 61 219.071 11.122 -2.028 430 HB2 ALA 61 HB2 ALA 61 220.460 11.993 -1.378 431 HB3 ALA 61 HB3 ALA 61 219.710 10.703 -0.439 432 H TYR 62 H TYR 62 218.480 9.150 -2.075 433 HA TYR 62 HA TYR 62 219.305 6.346 -1.756 434 HB2 TYR 62 HB2 TYR 62 218.540 6.791 0.396 435 HB3 TYR 62 HB3 TYR 62 217.304 7.910 -0.162 436 HD1 TYR 62 HD1 TYR 62 218.152 4.383 0.382 437 HD2 TYR 62 HD2 TYR 62 215.146 7.106 -0.901 438 HE1 TYR 62 HE1 TYR 62 216.472 2.597 0.533 439 HE2 TYR 62 HE2 TYR 62 213.465 5.331 -0.752 440 HH TYR 62 HH TYR 62 214.163 2.132 -0.599 441 H ARG 63 H ARG 63 218.258 4.879 -2.983 442 HA ARG 63 HA ARG 63 216.066 5.851 -4.698 443 HB2 ARG 63 HB2 ARG 63 218.505 5.074 -5.590 444 HB3 ARG 63 HB3 ARG 63 217.667 3.530 -5.605 445 HG2 ARG 63 HG2 ARG 63 215.934 5.412 -6.791 446 HG3 ARG 63 HG3 ARG 63 217.537 5.666 -7.485 447 HD2 ARG 63 HD2 ARG 63 217.621 3.559 -8.408 448 HD3 ARG 63 HD3 ARG 63 216.508 2.881 -7.221 449 HE ARG 63 HE ARG 63 215.835 3.987 -9.749 450 HH11 ARG 63 HH11 ARG 63 214.677 3.701 -6.465 451 HH12 ARG 63 HH12 ARG 63 213.008 3.800 -6.907 452 HH21 ARG 63 HH21 ARG 63 213.627 4.120 -10.334 453 HH22 ARG 63 HH22 ARG 63 212.410 4.037 -9.105 454 H TYR 64 H TYR 64 214.175 4.872 -4.341 455 HA TYR 64 HA TYR 64 213.855 2.769 -2.507 456 HB2 TYR 64 HB2 TYR 64 212.003 3.945 -4.573 457 HB3 TYR 64 HB3 TYR 64 211.511 2.609 -3.527 458 HD1 TYR 64 HD1 TYR 64 212.156 6.178 -3.739 459 HD2 TYR 64 HD2 TYR 64 211.333 2.956 -1.085 460 HE1 TYR 64 HE1 TYR 64 211.528 7.786 -1.989 461 HE2 TYR 64 HE2 TYR 64 210.702 4.557 0.670 462 HH TYR 64 HH TYR 64 210.060 6.780 0.995 463 H VAL 65 H VAL 65 214.308 0.696 -2.725 464 HA VAL 65 HA VAL 65 214.232 -0.500 -5.414 465 HB VAL 65 HB VAL 65 215.503 -1.920 -3.111 466 HG11 VAL 65 HG11 VAL 65 216.587 -1.776 -5.885 467 HG12 VAL 65 HG12 VAL 65 215.142 -2.738 -5.572 468 HG13 VAL 65 HG13 VAL 65 216.643 -3.097 -4.719 469 HG21 VAL 65 HG21 VAL 65 216.425 0.355 -2.994 470 HG22 VAL 65 HG22 VAL 65 216.906 0.236 -4.686 471 HG23 VAL 65 HG23 VAL 65 217.633 -0.829 -3.484 472 H GLY 66 H GLY 66 212.285 -1.380 -5.725 473 HA2 GLY 66 HA2 GLY 66 210.449 -2.122 -3.796 474 HA3 GLY 66 HA3 GLY 66 210.455 -2.736 -5.448 475 H GLU 67 H GLU 67 211.468 -3.265 -2.170 476 HA GLU 67 HA GLU 67 211.101 -5.931 -1.936 477 HB2 GLU 67 HB2 GLU 67 213.446 -5.387 -3.604 478 HB3 GLU 67 HB3 GLU 67 213.808 -6.438 -2.239 479 HG2 GLU 67 HG2 GLU 67 211.377 -7.170 -3.686 480 HG3 GLU 67 HG3 GLU 67 212.845 -7.236 -4.660 481 H ASN 68 H ASN 68 211.611 -3.349 -0.395 482 HA ASN 68 HA ASN 68 212.355 -2.720 1.652 483 HB2 ASN 68 HB2 ASN 68 211.530 -5.264 2.015 484 HB3 ASN 68 HB3 ASN 68 213.232 -5.454 2.425 485 HD21 ASN 68 HD21 ASN 68 212.757 -5.877 4.586 486 HD22 ASN 68 HD22 ASN 68 212.237 -4.625 5.670 487 H THR 69 H THR 69 214.197 -3.069 -0.702 488 HA THR 69 HA THR 69 216.757 -3.230 0.746 489 HB THR 69 HB THR 69 217.713 -3.708 -1.576 490 HG1 THR 69 HG1 THR 69 216.285 -4.388 -3.127 491 HG21 THR 69 HG21 THR 69 217.606 -5.930 -1.256 492 HG22 THR 69 HG22 THR 69 215.855 -5.928 -1.038 493 HG23 THR 69 HG23 THR 69 216.911 -5.446 0.289 494 H TYR 70 H TYR 70 218.453 -1.776 0.067 495 HA TYR 70 HA TYR 70 217.397 0.744 -1.047 496 HB2 TYR 70 HB2 TYR 70 219.915 0.694 0.562 497 HB3 TYR 70 HB3 TYR 70 218.716 1.969 0.404 498 HD1 TYR 70 HD1 TYR 70 220.110 0.474 2.888 499 HD2 TYR 70 HD2 TYR 70 216.244 0.414 1.110 500 HE1 TYR 70 HE1 TYR 70 219.136 -0.196 5.044 501 HE2 TYR 70 HE2 TYR 70 215.261 -0.256 3.258 502 HH TYR 70 HH TYR 70 215.662 -0.401 5.516 503 H GLN 71 H GLN 71 218.670 1.931 -2.516 504 HA GLN 71 HA GLN 71 221.129 0.727 -3.516 505 HB2 GLN 71 HB2 GLN 71 218.876 -0.017 -4.765 506 HB3 GLN 71 HB3 GLN 71 219.174 1.489 -5.619 507 HG2 GLN 71 HG2 GLN 71 220.755 0.557 -6.854 508 HG3 GLN 71 HG3 GLN 71 221.589 -0.060 -5.428 509 HE21 GLN 71 HE21 GLN 71 219.853 -1.826 -4.384 510 HE22 GLN 71 HE22 GLN 71 219.548 -3.121 -5.502 511 H ALA 72 H ALA 72 222.546 2.188 -4.387 512 HA ALA 72 HA ALA 72 221.658 4.875 -5.057 513 HB1 ALA 72 HB1 ALA 72 223.948 4.898 -3.210 514 HB2 ALA 72 HB2 ALA 72 222.391 4.495 -2.487 515 HB3 ALA 72 HB3 ALA 72 222.592 6.016 -3.356 516 H VAL 73 H VAL 73 222.802 5.676 -6.721 517 HA VAL 73 HA VAL 73 224.988 4.121 -7.792 518 HB VAL 73 HB VAL 73 223.912 6.742 -8.844 519 HG11 VAL 73 HG11 VAL 73 226.189 5.686 -9.595 520 HG12 VAL 73 HG12 VAL 73 225.071 6.340 -10.791 521 HG13 VAL 73 HG13 VAL 73 225.150 4.601 -10.515 522 HG21 VAL 73 HG21 VAL 73 222.372 5.569 -10.178 523 HG22 VAL 73 HG22 VAL 73 222.205 4.872 -8.567 524 HG23 VAL 73 HG23 VAL 73 223.112 4.011 -9.810 525 H VAL 74 H VAL 74 227.112 4.619 -7.798 526 HA VAL 74 HA VAL 74 227.943 7.179 -6.600 527 HB VAL 74 HB VAL 74 229.354 4.567 -6.070 528 HG11 VAL 74 HG11 VAL 74 229.687 7.388 -5.194 529 HG12 VAL 74 HG12 VAL 74 230.903 6.177 -5.597 530 HG13 VAL 74 HG13 VAL 74 230.069 6.106 -4.045 531 HG21 VAL 74 HG21 VAL 74 227.107 5.874 -4.590 532 HG22 VAL 74 HG22 VAL 74 228.318 4.935 -3.718 533 HG23 VAL 74 HG23 VAL 74 227.351 4.171 -4.980 534 H ASP 75 H ASP 75 229.838 8.072 -7.364 535 HA ASP 75 HA ASP 75 230.886 6.862 -9.836 536 HB2 ASP 75 HB2 ASP 75 229.778 9.339 -9.560 537 HB3 ASP 75 HB3 ASP 75 231.493 9.705 -9.313 538 H GLU 76 H GLU 76 232.985 6.325 -9.951 539 HA GLU 76 HA GLU 76 234.797 7.319 -7.859 540 HB2 GLU 76 HB2 GLU 76 235.806 4.999 -7.824 541 HB3 GLU 76 HB3 GLU 76 234.214 5.157 -7.097 542 HG2 GLU 76 HG2 GLU 76 233.622 3.411 -8.333 543 HG3 GLU 76 HG3 GLU 76 233.636 4.511 -9.708 544 H LYS 77 H LYS 77 237.123 6.899 -8.372 545 HA LYS 77 HA LYS 77 237.583 7.287 -11.251 546 HB2 LYS 77 HB2 LYS 77 238.446 8.761 -8.953 547 HB3 LYS 77 HB3 LYS 77 239.859 8.105 -9.767 548 HG2 LYS 77 HG2 LYS 77 238.199 9.137 -11.785 549 HG3 LYS 77 HG3 LYS 77 238.215 10.335 -10.489 550 HD2 LYS 77 HD2 LYS 77 240.671 10.301 -10.504 551 HD3 LYS 77 HD3 LYS 77 240.642 9.119 -11.814 552 HE2 LYS 77 HE2 LYS 77 239.780 10.668 -13.345 553 HE3 LYS 77 HE3 LYS 77 239.264 11.773 -12.073 554 HZ1 LYS 77 HZ1 LYS 77 241.748 11.966 -11.566 555 HZ2 LYS 77 HZ2 LYS 77 241.160 12.758 -12.939 556 HZ3 LYS 77 HZ3 LYS 77 241.990 11.292 -13.099 557 H ALA 78 H ALA 78 239.836 6.647 -11.969 558 HA ALA 78 HA ALA 78 240.182 3.878 -11.622 559 HB1 ALA 78 HB1 ALA 78 242.473 4.467 -12.781 560 HB2 ALA 78 HB2 ALA 78 241.690 6.029 -13.019 561 HB3 ALA 78 HB3 ALA 78 240.950 4.564 -13.664 562 H GLY 79 H GLY 79 241.197 2.741 -10.111 563 HA2 GLY 79 HA2 GLY 79 243.338 2.401 -8.919 564 HA3 GLY 79 HA3 GLY 79 243.239 4.104 -8.471 565 H ALA 80 H ALA 80 243.452 1.693 -6.799 566 HA ALA 80 HA ALA 80 241.124 0.899 -5.564 567 HB1 ALA 80 HB1 ALA 80 243.411 1.385 -3.754 568 HB2 ALA 80 HB2 ALA 80 243.705 0.338 -5.142 569 HB3 ALA 80 HB3 ALA 80 242.433 -0.063 -3.989 570 H PHE 81 H PHE 81 239.630 1.811 -4.313 571 HA PHE 81 HA PHE 81 240.262 4.237 -2.802 572 HB2 PHE 81 HB2 PHE 81 238.298 5.414 -3.653 573 HB3 PHE 81 HB3 PHE 81 239.387 4.999 -4.972 574 HD1 PHE 81 HD1 PHE 81 236.055 4.804 -3.749 575 HD2 PHE 81 HD2 PHE 81 238.845 2.894 -6.332 576 HE1 PHE 81 HE1 PHE 81 234.204 3.700 -4.937 577 HE2 PHE 81 HE2 PHE 81 237.002 1.791 -7.521 578 HZ PHE 81 HZ PHE 81 234.678 2.190 -6.824 579 H ARG 82 H ARG 82 238.948 4.644 -1.043 580 HA ARG 82 HA ARG 82 237.198 2.411 -0.229 581 HB2 ARG 82 HB2 ARG 82 238.407 4.382 1.696 582 HB3 ARG 82 HB3 ARG 82 237.821 2.756 2.011 583 HG2 ARG 82 HG2 ARG 82 240.046 2.344 2.092 584 HG3 ARG 82 HG3 ARG 82 239.803 2.135 0.352 585 HD2 ARG 82 HD2 ARG 82 241.446 3.634 0.122 586 HD3 ARG 82 HD3 ARG 82 240.227 4.830 0.559 587 HE ARG 82 HE ARG 82 241.506 3.699 2.850 588 HH11 ARG 82 HH11 ARG 82 241.864 6.101 0.327 589 HH12 ARG 82 HH12 ARG 82 242.930 7.099 1.257 590 HH21 ARG 82 HH21 ARG 82 242.913 5.022 4.072 591 HH22 ARG 82 HH22 ARG 82 243.524 6.487 3.381 592 H MET 83 H MET 83 235.235 3.004 1.022 593 HA MET 83 HA MET 83 234.442 5.812 0.756 594 HB2 MET 83 HB2 MET 83 232.648 3.612 -0.249 595 HB3 MET 83 HB3 MET 83 232.408 5.347 -0.398 596 HG2 MET 83 HG2 MET 83 233.184 5.007 -2.467 597 HG3 MET 83 HG3 MET 83 234.756 5.087 -1.677 598 HE1 MET 83 HE1 MET 83 231.947 2.143 -2.582 599 HE2 MET 83 HE2 MET 83 232.940 1.735 -3.983 600 HE3 MET 83 HE3 MET 83 232.381 3.391 -3.750 601 H GLN 84 H GLN 84 232.739 6.489 2.044 602 HA GLN 84 HA GLN 84 231.906 4.605 4.149 603 HB2 GLN 84 HB2 GLN 84 233.469 6.735 4.635 604 HB3 GLN 84 HB3 GLN 84 231.896 7.517 4.730 605 HG2 GLN 84 HG2 GLN 84 231.706 5.122 6.198 606 HG3 GLN 84 HG3 GLN 84 233.228 5.897 6.662 607 HE21 GLN 84 HE21 GLN 84 232.781 6.731 8.596 608 HE22 GLN 84 HE22 GLN 84 231.484 7.835 8.928 609 H TYR 85 H TYR 85 229.746 4.677 4.795 610 HA TYR 85 HA TYR 85 227.969 6.375 3.165 611 HB2 TYR 85 HB2 TYR 85 227.732 3.428 3.737 612 HB3 TYR 85 HB3 TYR 85 226.372 4.397 3.188 613 HD1 TYR 85 HD1 TYR 85 229.932 3.732 2.228 614 HD2 TYR 85 HD2 TYR 85 225.939 4.409 0.922 615 HE1 TYR 85 HE1 TYR 85 230.640 3.381 -0.100 616 HE2 TYR 85 HE2 TYR 85 226.636 4.059 -1.408 617 HH TYR 85 HH TYR 85 229.898 3.024 -2.227 618 H ALA 86 H ALA 86 225.840 6.670 3.971 619 HA ALA 86 HA ALA 86 225.745 6.696 6.918 620 HB1 ALA 86 HB1 ALA 86 225.774 8.914 5.748 621 HB2 ALA 86 HB2 ALA 86 224.389 8.651 6.810 622 HB3 ALA 86 HB3 ALA 86 224.203 8.498 5.063 623 H SER 87 H SER 87 224.288 5.417 7.850 624 HA SER 87 HA SER 87 222.515 3.786 6.367 625 HB2 SER 87 HB2 SER 87 222.025 4.180 9.275 626 HB3 SER 87 HB3 SER 87 222.135 2.682 8.337 627 HG SER 87 HG SER 87 223.983 2.697 9.473 628 H LYS 88 H LYS 88 220.149 3.584 7.430 629 HA LYS 88 HA LYS 88 218.779 5.970 6.569 630 HB2 LYS 88 HB2 LYS 88 216.741 4.673 6.828 631 HB3 LYS 88 HB3 LYS 88 217.942 3.760 5.932 632 HG2 LYS 88 HG2 LYS 88 218.273 2.252 7.649 633 HG3 LYS 88 HG3 LYS 88 217.664 3.362 8.880 634 HD2 LYS 88 HD2 LYS 88 215.442 2.968 8.316 635 HD3 LYS 88 HD3 LYS 88 215.855 2.362 6.713 636 HE2 LYS 88 HE2 LYS 88 215.112 0.565 8.204 637 HE3 LYS 88 HE3 LYS 88 216.782 0.339 7.686 638 HZ1 LYS 88 HZ1 LYS 88 216.406 -0.094 10.077 639 HZ2 LYS 88 HZ2 LYS 88 215.992 1.532 10.291 640 HZ3 LYS 88 HZ3 LYS 88 217.556 1.115 9.796 641 H ASP 89 H ASP 89 219.883 4.796 9.578 642 HA ASP 89 HA ASP 89 217.831 6.145 11.128 643 HB2 ASP 89 HB2 ASP 89 219.189 3.927 11.685 644 HB3 ASP 89 HB3 ASP 89 220.327 5.085 12.389 645 H TRP 90 H TRP 90 219.173 7.933 9.445 646 HA TRP 90 HA TRP 90 220.313 9.901 9.381 647 HB2 TRP 90 HB2 TRP 90 218.581 9.999 11.503 648 HB3 TRP 90 HB3 TRP 90 220.106 10.425 12.271 649 HD1 TRP 90 HD1 TRP 90 221.432 12.596 11.094 650 HE1 TRP 90 HE1 TRP 90 220.416 14.744 10.106 651 HE3 TRP 90 HE3 TRP 90 216.635 10.972 10.365 652 HZ2 TRP 90 HZ2 TRP 90 217.915 15.634 9.148 653 HZ3 TRP 90 HZ3 TRP 90 214.995 12.536 9.410 654 HH2 TRP 90 HH2 TRP 90 215.623 14.819 8.814 655 H SER 91 H SER 91 221.848 7.408 10.166 656 HA SER 91 HA SER 91 224.030 8.623 11.703 657 HB2 SER 91 HB2 SER 91 222.994 6.277 12.222 658 HB3 SER 91 HB3 SER 91 223.988 5.737 10.868 659 HG SER 91 HG SER 91 225.812 6.534 11.966 660 HA PRO 92 HA PRO 92 226.100 8.885 7.737 661 HB2 PRO 92 HB2 PRO 92 227.874 10.760 8.402 662 HB3 PRO 92 HB3 PRO 92 226.147 11.153 8.264 663 HG2 PRO 92 HG2 PRO 92 227.809 10.721 10.708 664 HG3 PRO 92 HG3 PRO 92 226.489 11.871 10.437 665 HD2 PRO 92 HD2 PRO 92 226.289 9.390 11.739 666 HD3 PRO 92 HD3 PRO 92 224.932 10.377 11.145 667 H GLN 93 H GLN 93 226.746 6.548 9.071 668 HA GLN 93 HA GLN 93 229.611 6.435 8.623 669 HB2 GLN 93 HB2 GLN 93 228.360 6.166 11.306 670 HB3 GLN 93 HB3 GLN 93 229.680 5.074 10.915 671 HG2 GLN 93 HG2 GLN 93 231.236 6.745 10.861 672 HG3 GLN 93 HG3 GLN 93 230.059 7.975 10.412 673 HE21 GLN 93 HE21 GLN 93 232.051 7.084 12.790 674 HE22 GLN 93 HE22 GLN 93 231.198 7.714 14.168 675 H PHE 94 H PHE 94 230.103 4.686 7.536 676 HA PHE 94 HA PHE 94 228.769 2.151 8.083 677 HB2 PHE 94 HB2 PHE 94 227.477 2.367 6.238 678 HB3 PHE 94 HB3 PHE 94 228.435 3.691 5.604 679 HD1 PHE 94 HD1 PHE 94 227.717 0.166 5.407 680 HD2 PHE 94 HD2 PHE 94 230.510 3.175 4.288 681 HE1 PHE 94 HE1 PHE 94 228.647 -1.330 3.690 682 HE2 PHE 94 HE2 PHE 94 231.438 1.691 2.575 683 HZ PHE 94 HZ PHE 94 230.514 -0.566 2.271 684 H THR 95 H THR 95 230.322 0.686 8.424 685 HA THR 95 HA THR 95 232.685 0.652 6.743 686 HB THR 95 HB THR 95 234.268 0.737 8.602 687 HG1 THR 95 HG1 THR 95 231.943 1.101 10.167 688 HG21 THR 95 HG21 THR 95 234.229 3.038 9.126 689 HG22 THR 95 HG22 THR 95 232.492 3.142 8.841 690 HG23 THR 95 HG23 THR 95 233.592 2.870 7.491 691 H ALA 96 H ALA 96 233.198 -1.378 6.276 692 HA ALA 96 HA ALA 96 232.043 -3.537 7.883 693 HB1 ALA 96 HB1 ALA 96 231.481 -3.820 5.630 694 HB2 ALA 96 HB2 ALA 96 232.822 -4.938 5.880 695 HB3 ALA 96 HB3 ALA 96 233.102 -3.393 5.078 696 H ASP 97 H ASP 97 233.364 -3.899 9.576 697 HA ASP 97 HA ASP 97 236.132 -3.670 9.663 698 HB2 ASP 97 HB2 ASP 97 234.067 -4.467 11.421 699 HB3 ASP 97 HB3 ASP 97 235.271 -5.764 11.440 700 H GLY 98 H GLY 98 237.615 -4.714 8.518 701 HA2 GLY 98 HA2 GLY 98 238.780 -6.397 7.474 702 HA3 GLY 98 HA3 GLY 98 237.982 -7.493 8.607 703 H LEU 99 H LEU 99 237.754 -5.962 5.435 704 HA LEU 99 HA LEU 99 236.243 -8.250 4.479 705 HB2 LEU 99 HB2 LEU 99 234.368 -7.015 5.065 706 HB3 LEU 99 HB3 LEU 99 235.122 -5.484 4.666 707 HG LEU 99 HG LEU 99 234.981 -6.167 2.235 708 HD11 LEU 99 HD11 LEU 99 233.371 -7.897 1.646 709 HD12 LEU 99 HD12 LEU 99 233.157 -8.288 3.353 710 HD13 LEU 99 HD13 LEU 99 234.714 -8.566 2.573 711 HD21 LEU 99 HD21 LEU 99 232.909 -5.210 2.009 712 HD22 LEU 99 HD22 LEU 99 233.326 -4.721 3.650 713 HD23 LEU 99 HD23 LEU 99 232.235 -6.080 3.386 714 H GLU 100 H GLU 100 237.198 -4.946 3.468 715 HA GLU 100 HA GLU 100 238.282 -4.169 1.630 716 HB2 GLU 100 HB2 GLU 100 239.249 -6.933 0.950 717 HB3 GLU 100 HB3 GLU 100 240.056 -5.394 0.708 718 HG2 GLU 100 HG2 GLU 100 239.795 -6.998 3.216 719 HG3 GLU 100 HG3 GLU 100 241.249 -6.421 2.409 720 H LEU 101 H LEU 101 236.198 -3.811 0.815 721 HA LEU 101 HA LEU 101 234.603 -5.527 -0.637 722 HB2 LEU 101 HB2 LEU 101 233.858 -3.351 0.088 723 HB3 LEU 101 HB3 LEU 101 235.016 -2.559 -0.980 724 HG LEU 101 HG LEU 101 233.398 -4.231 -2.603 725 HD11 LEU 101 HD11 LEU 101 231.543 -4.389 -1.325 726 HD12 LEU 101 HD12 LEU 101 231.242 -2.777 -1.976 727 HD13 LEU 101 HD13 LEU 101 231.943 -2.963 -0.368 728 HD21 LEU 101 HD21 LEU 101 232.556 -1.627 -2.990 729 HD22 LEU 101 HD22 LEU 101 233.907 -2.420 -3.801 730 HD23 LEU 101 HD23 LEU 101 234.192 -1.449 -2.356 731 H THR 102 H THR 102 234.354 -6.086 -2.760 732 HA THR 102 HA THR 102 236.469 -5.292 -4.641 733 HB THR 102 HB THR 102 235.459 -8.061 -4.904 734 HG1 THR 102 HG1 THR 102 236.748 -8.847 -3.255 735 HG21 THR 102 HG21 THR 102 238.142 -8.244 -4.917 736 HG22 THR 102 HG22 THR 102 237.930 -6.576 -5.453 737 HG23 THR 102 HG23 THR 102 237.164 -7.893 -6.342 738 HA PRO 103 HA PRO 103 233.289 -4.377 -7.562 739 HB2 PRO 103 HB2 PRO 103 234.914 -5.911 -9.539 740 HB3 PRO 103 HB3 PRO 103 234.301 -4.256 -9.632 741 HG2 PRO 103 HG2 PRO 103 236.865 -4.678 -9.140 742 HG3 PRO 103 HG3 PRO 103 235.983 -3.418 -8.245 743 HD2 PRO 103 HD2 PRO 103 236.767 -6.175 -7.361 744 HD3 PRO 103 HD3 PRO 103 236.838 -4.644 -6.465 745 H GLY 104 H GLY 104 231.380 -5.398 -7.499 746 HA2 GLY 104 HA2 GLY 104 229.760 -6.999 -7.836 747 HA3 GLY 104 HA3 GLY 104 230.903 -7.813 -8.912 748 H LYS 105 H LYS 105 231.488 -7.094 -5.512 749 HA LYS 105 HA LYS 105 231.355 -9.979 -4.921 750 HB2 LYS 105 HB2 LYS 105 233.689 -9.053 -5.156 751 HB3 LYS 105 HB3 LYS 105 233.354 -8.040 -3.748 752 HG2 LYS 105 HG2 LYS 105 232.692 -10.754 -3.143 753 HG3 LYS 105 HG3 LYS 105 234.327 -10.676 -3.806 754 HD2 LYS 105 HD2 LYS 105 235.032 -9.154 -2.140 755 HD3 LYS 105 HD3 LYS 105 233.376 -8.833 -1.627 756 HE2 LYS 105 HE2 LYS 105 233.452 -10.509 -0.169 757 HE3 LYS 105 HE3 LYS 105 233.929 -11.642 -1.432 758 HZ1 LYS 105 HZ1 LYS 105 235.574 -11.556 0.325 759 HZ2 LYS 105 HZ2 LYS 105 235.764 -9.889 0.115 760 HZ3 LYS 105 HZ3 LYS 105 236.233 -10.956 -1.112 761 H THR 106 H THR 106 230.685 -10.594 -2.883 762 HA THR 106 HA THR 106 228.805 -8.863 -1.624 763 HB THR 106 HB THR 106 228.476 -11.298 -1.771 764 HG1 THR 106 HG1 THR 106 228.658 -10.460 0.931 765 HG21 THR 106 HG21 THR 106 231.063 -11.423 -0.536 766 HG22 THR 106 HG22 THR 106 230.101 -12.708 -1.262 767 HG23 THR 106 HG23 THR 106 229.867 -12.283 0.432 768 H ALA 107 H ALA 107 228.829 -7.938 0.395 769 HA ALA 107 HA ALA 107 231.426 -7.842 1.787 770 HB1 ALA 107 HB1 ALA 107 230.641 -5.391 2.305 771 HB2 ALA 107 HB2 ALA 107 229.719 -5.602 0.817 772 HB3 ALA 107 HB3 ALA 107 231.472 -5.774 0.797 773 H SER 108 H SER 108 231.383 -7.709 4.007 774 HA SER 108 HA SER 108 228.945 -8.593 5.279 775 HB2 SER 108 HB2 SER 108 231.489 -7.894 6.737 776 HB3 SER 108 HB3 SER 108 230.263 -9.086 7.167 777 HG SER 108 HG SER 108 232.447 -9.335 5.547 778 H LEU 109 H LEU 109 227.538 -7.365 6.393 779 HA LEU 109 HA LEU 109 228.135 -4.516 6.690 780 HB2 LEU 109 HB2 LEU 109 226.048 -5.092 5.578 781 HB3 LEU 109 HB3 LEU 109 225.550 -6.055 6.953 782 HG LEU 109 HG LEU 109 226.086 -3.431 7.906 783 HD11 LEU 109 HD11 LEU 109 225.782 -2.807 5.491 784 HD12 LEU 109 HD12 LEU 109 224.659 -2.046 6.618 785 HD13 LEU 109 HD13 LEU 109 224.127 -3.403 5.625 786 HD21 LEU 109 HD21 LEU 109 223.416 -3.644 8.013 787 HD22 LEU 109 HD22 LEU 109 224.500 -4.474 9.129 788 HD23 LEU 109 HD23 LEU 109 223.838 -5.333 7.739 789 H LYS 110 H LYS 110 229.394 -4.362 8.498 790 HA LYS 110 HA LYS 110 228.821 -5.772 10.918 791 HB2 LYS 110 HB2 LYS 110 231.100 -5.008 10.206 792 HB3 LYS 110 HB3 LYS 110 230.603 -3.359 10.557 793 HG2 LYS 110 HG2 LYS 110 229.997 -4.512 12.901 794 HG3 LYS 110 HG3 LYS 110 231.319 -5.559 12.387 795 HD2 LYS 110 HD2 LYS 110 232.442 -3.903 13.546 796 HD3 LYS 110 HD3 LYS 110 232.546 -3.319 11.885 797 HE2 LYS 110 HE2 LYS 110 231.419 -1.470 12.392 798 HE3 LYS 110 HE3 LYS 110 230.120 -2.400 13.134 799 HZ1 LYS 110 HZ1 LYS 110 232.478 -1.181 14.381 800 HZ2 LYS 110 HZ2 LYS 110 231.838 -2.582 15.076 801 HZ3 LYS 110 HZ3 LYS 110 230.871 -1.204 14.911 802 H ARG 111 H ARG 111 228.870 -2.238 10.306 803 HA ARG 111 HA ARG 111 226.305 -1.744 11.325 804 HB2 ARG 111 HB2 ARG 111 227.992 -2.391 13.386 805 HB3 ARG 111 HB3 ARG 111 228.118 -0.638 13.358 806 HG2 ARG 111 HG2 ARG 111 225.548 -0.662 13.331 807 HG3 ARG 111 HG3 ARG 111 225.708 -2.342 13.847 808 HD2 ARG 111 HD2 ARG 111 227.416 -1.126 15.556 809 HD3 ARG 111 HD3 ARG 111 226.230 0.155 15.321 810 HE ARG 111 HE ARG 111 224.708 -1.077 16.509 811 HH11 ARG 111 HH11 ARG 111 227.379 -3.155 15.612 812 HH12 ARG 111 HH12 ARG 111 226.860 -4.467 16.617 813 HH21 ARG 111 HH21 ARG 111 224.022 -2.812 17.826 814 HH22 ARG 111 HH22 ARG 111 224.954 -4.271 17.872 815 H GLY 112 H GLY 112 229.459 -0.110 11.812 816 HA2 GLY 112 HA2 GLY 112 230.110 1.634 10.194 817 HA3 GLY 112 HA3 GLY 112 228.415 2.108 10.157 818 H GLY 113 H GLY 113 231.397 2.839 11.415 819 HA2 GLY 113 HA2 GLY 113 230.698 5.081 12.804 820 HA3 GLY 113 HA3 GLY 113 230.587 3.792 14.008 821 H TYR 114 H TYR 114 232.783 5.264 11.639 822 HA TYR 114 HA TYR 114 235.036 5.557 11.598 823 HB2 TYR 114 HB2 TYR 114 234.745 5.281 14.598 824 HB3 TYR 114 HB3 TYR 114 236.192 5.850 13.779 825 HD1 TYR 114 HD1 TYR 114 233.753 7.018 15.729 826 HD2 TYR 114 HD2 TYR 114 235.281 7.738 11.822 827 HE1 TYR 114 HE1 TYR 114 232.885 9.316 15.818 828 HE2 TYR 114 HE2 TYR 114 234.415 10.038 11.902 829 HH TYR 114 HH TYR 114 233.327 11.501 14.760 830 H GLY 115 H GLY 115 234.029 2.890 11.233 831 HA2 GLY 115 HA2 GLY 115 235.978 1.168 12.571 832 HA3 GLY 115 HA3 GLY 115 234.643 0.634 11.560 833 H GLN 116 H GLN 116 235.455 -0.450 9.875 834 HA GLN 116 HA GLN 116 237.870 0.613 8.565 835 HB2 GLN 116 HB2 GLN 116 237.715 -1.814 9.552 836 HB3 GLN 116 HB3 GLN 116 236.832 -2.152 8.071 837 HG2 GLN 116 HG2 GLN 116 238.671 -1.813 6.732 838 HG3 GLN 116 HG3 GLN 116 239.473 -0.783 7.915 839 HE21 GLN 116 HE21 GLN 116 241.290 -2.234 7.270 840 HE22 GLN 116 HE22 GLN 116 241.494 -3.700 8.162 841 H ASP 117 H ASP 117 237.402 1.792 6.827 842 HA ASP 117 HA ASP 117 234.953 1.687 5.420 843 HB2 ASP 117 HB2 ASP 117 237.626 2.876 4.638 844 HB3 ASP 117 HB3 ASP 117 236.135 3.118 3.734 845 H THR 118 H THR 118 234.500 0.931 3.289 846 HA THR 118 HA THR 118 235.906 -1.522 2.662 847 HB THR 118 HB THR 118 234.095 -1.289 0.659 848 HG1 THR 118 HG1 THR 118 232.759 -0.112 2.842 849 HG21 THR 118 HG21 THR 118 234.317 -3.099 2.414 850 HG22 THR 118 HG22 THR 118 232.694 -2.764 1.808 851 HG23 THR 118 HG23 THR 118 233.193 -2.147 3.384 852 H ALA 119 H ALA 119 237.668 -1.507 1.470 853 HA ALA 119 HA ALA 119 238.049 0.606 -0.532 854 HB1 ALA 119 HB1 ALA 119 239.756 0.085 1.329 855 HB2 ALA 119 HB2 ALA 119 240.348 0.311 -0.319 856 HB3 ALA 119 HB3 ALA 119 240.176 -1.315 0.343 857 H VAL 120 H VAL 120 237.904 0.165 -2.627 858 HA VAL 120 HA VAL 120 238.012 -2.658 -3.469 859 HB VAL 120 HB VAL 120 235.765 -1.701 -3.718 860 HG11 VAL 120 HG11 VAL 120 236.579 0.653 -4.072 861 HG12 VAL 120 HG12 VAL 120 235.266 0.133 -5.128 862 HG13 VAL 120 HG13 VAL 120 236.916 0.197 -5.742 863 HG21 VAL 120 HG21 VAL 120 235.818 -1.922 -6.406 864 HG22 VAL 120 HG22 VAL 120 235.867 -3.297 -5.304 865 HG23 VAL 120 HG23 VAL 120 237.361 -2.668 -5.996 866 H THR 121 H THR 121 239.602 -3.187 -4.807 867 HA THR 121 HA THR 121 241.326 -1.123 -5.863 868 HB THR 121 HB THR 121 241.450 -4.123 -5.722 869 HG1 THR 121 HG1 THR 121 243.099 -2.079 -4.653 870 HG21 THR 121 HG21 THR 121 243.306 -2.306 -7.222 871 HG22 THR 121 HG22 THR 121 242.566 -3.817 -7.751 872 HG23 THR 121 HG23 THR 121 243.845 -3.841 -6.538 873 H LEU 122 H LEU 122 240.195 -0.138 -7.524 874 HA LEU 122 HA LEU 122 239.887 -1.786 -9.932 875 HB2 LEU 122 HB2 LEU 122 237.684 -1.114 -8.733 876 HB3 LEU 122 HB3 LEU 122 238.006 0.482 -9.381 877 HG LEU 122 HG LEU 122 237.955 -0.395 -11.656 878 HD11 LEU 122 HD11 LEU 122 238.677 -2.544 -11.742 879 HD12 LEU 122 HD12 LEU 122 236.940 -2.849 -11.720 880 HD13 LEU 122 HD13 LEU 122 237.878 -2.992 -10.234 881 HD21 LEU 122 HD21 LEU 122 235.570 -1.042 -11.740 882 HD22 LEU 122 HD22 LEU 122 235.871 0.377 -10.740 883 HD23 LEU 122 HD23 LEU 122 235.578 -1.187 -9.983 884 HA PRO 123 HA PRO 123 242.735 1.570 -11.059 885 HB2 PRO 123 HB2 PRO 123 243.279 -0.171 -13.363 886 HB3 PRO 123 HB3 PRO 123 244.385 0.428 -12.115 887 HG2 PRO 123 HG2 PRO 123 243.637 -2.153 -12.229 888 HG3 PRO 123 HG3 PRO 123 243.937 -1.327 -10.689 889 HD2 PRO 123 HD2 PRO 123 241.324 -1.940 -12.030 890 HD3 PRO 123 HD3 PRO 123 241.777 -2.103 -10.319 891 H GLU 124 H GLU 124 239.798 0.825 -12.261 892 HA GLU 124 HA GLU 124 240.071 2.647 -14.560 893 HB2 GLU 124 HB2 GLU 124 239.544 0.171 -15.038 894 HB3 GLU 124 HB3 GLU 124 237.960 0.509 -14.354 895 HG2 GLU 124 HG2 GLU 124 237.651 2.284 -16.052 896 HG3 GLU 124 HG3 GLU 124 239.196 1.807 -16.775 897 H ALA 125 H ALA 125 238.538 4.239 -14.811 898 HA ALA 125 HA ALA 125 236.834 4.736 -12.473 899 HB1 ALA 125 HB1 ALA 125 236.823 7.024 -13.096 900 HB2 ALA 125 HB2 ALA 125 237.451 6.661 -14.703 901 HB3 ALA 125 HB3 ALA 125 238.483 6.463 -13.289 902 H GLY 126 H GLY 126 234.634 5.056 -12.603 903 HA2 GLY 126 HA2 GLY 126 233.116 5.494 -14.889 904 HA3 GLY 126 HA3 GLY 126 233.260 3.747 -14.724 905 H GLN 127 H GLN 127 230.785 4.604 -14.679 906 HA GLN 127 HA GLN 127 229.772 5.464 -12.177 907 HB2 GLN 127 HB2 GLN 127 228.721 5.220 -14.675 908 HB3 GLN 127 HB3 GLN 127 227.991 3.833 -13.880 909 HG2 GLN 127 HG2 GLN 127 227.083 5.285 -12.147 910 HG3 GLN 127 HG3 GLN 127 227.837 6.686 -12.925 911 HE21 GLN 127 HE21 GLN 127 225.032 4.950 -12.625 912 HE22 GLN 127 HE22 GLN 127 224.214 5.492 -14.047 913 H TYR 128 H TYR 128 228.953 4.355 -10.459 914 HA TYR 128 HA TYR 128 229.154 1.418 -10.515 915 HB2 TYR 128 HB2 TYR 128 230.829 3.145 -9.073 916 HB3 TYR 128 HB3 TYR 128 229.702 2.498 -7.886 917 HD1 TYR 128 HD1 TYR 128 229.326 -0.136 -8.096 918 HD2 TYR 128 HD2 TYR 128 232.766 1.958 -9.469 919 HE1 TYR 128 HE1 TYR 128 230.626 -2.217 -8.002 920 HE2 TYR 128 HE2 TYR 128 234.075 -0.119 -9.373 921 HH TYR 128 HH TYR 128 232.745 -3.114 -9.198 922 H VAL 129 H VAL 129 227.692 0.286 -9.205 923 HA VAL 129 HA VAL 129 225.537 1.912 -8.024 924 HB VAL 129 HB VAL 129 223.918 0.167 -8.672 925 HG11 VAL 129 HG11 VAL 129 224.794 2.225 -10.149 926 HG12 VAL 129 HG12 VAL 129 223.485 1.156 -10.654 927 HG13 VAL 129 HG13 VAL 129 225.118 0.899 -11.267 928 HG21 VAL 129 HG21 VAL 129 224.529 -1.495 -10.376 929 HG22 VAL 129 HG22 VAL 129 225.418 -1.737 -8.874 930 HG23 VAL 129 HG23 VAL 129 226.213 -0.987 -10.258 931 H TRP 130 H TRP 130 225.042 1.465 -5.974 932 HA TRP 130 HA TRP 130 226.263 -0.919 -4.764 933 HB2 TRP 130 HB2 TRP 130 225.827 1.850 -3.842 934 HB3 TRP 130 HB3 TRP 130 225.513 0.602 -2.639 935 HD1 TRP 130 HD1 TRP 130 228.359 1.823 -4.944 936 HE1 TRP 130 HE1 TRP 130 230.600 1.187 -3.853 937 HE3 TRP 130 HE3 TRP 130 226.593 -0.839 -0.955 938 HZ2 TRP 130 HZ2 TRP 130 231.501 -0.242 -1.591 939 HZ3 TRP 130 HZ3 TRP 130 228.210 -1.805 0.628 940 HH2 TRP 130 HH2 TRP 130 230.613 -1.512 0.314 941 H SER 131 H SER 131 224.911 -2.551 -4.527 942 HA SER 131 HA SER 131 222.098 -1.988 -3.870 943 HB2 SER 131 HB2 SER 131 221.521 -4.098 -4.872 944 HB3 SER 131 HB3 SER 131 222.576 -3.250 -6.001 945 HG SER 131 HG SER 131 223.079 -5.521 -5.621 946 H LEU 132 H LEU 132 221.246 -2.751 -1.984 947 HA LEU 132 HA LEU 132 222.879 -4.617 -0.393 948 HB2 LEU 132 HB2 LEU 132 221.417 -2.288 0.833 949 HB3 LEU 132 HB3 LEU 132 222.576 -3.350 1.598 950 HG LEU 132 HG LEU 132 223.673 -1.286 1.314 951 HD11 LEU 132 HD11 LEU 132 224.934 -2.254 -1.082 952 HD12 LEU 132 HD12 LEU 132 224.622 -3.573 0.045 953 HD13 LEU 132 HD13 LEU 132 225.554 -2.171 0.565 954 HD21 LEU 132 HD21 LEU 132 221.923 -0.778 -0.684 955 HD22 LEU 132 HD22 LEU 132 223.405 -1.045 -1.600 956 HD23 LEU 132 HD23 LEU 132 223.356 0.191 -0.343 957 H LYS 133 H LYS 133 221.755 -6.202 0.628 958 HA LYS 133 HA LYS 133 218.832 -6.179 0.309 959 HB2 LYS 133 HB2 LYS 133 219.998 -8.006 -0.843 960 HB3 LYS 133 HB3 LYS 133 220.714 -8.520 0.689 961 HG2 LYS 133 HG2 LYS 133 218.844 -9.942 0.063 962 HG3 LYS 133 HG3 LYS 133 218.494 -9.059 1.550 963 HD2 LYS 133 HD2 LYS 133 216.998 -7.615 0.469 964 HD3 LYS 133 HD3 LYS 133 217.612 -8.032 -1.131 965 HE2 LYS 133 HE2 LYS 133 216.478 -10.243 0.472 966 HE3 LYS 133 HE3 LYS 133 215.338 -9.028 -0.110 967 HZ1 LYS 133 HZ1 LYS 133 217.281 -10.388 -1.890 968 HZ2 LYS 133 HZ2 LYS 133 215.935 -9.463 -2.336 969 HZ3 LYS 133 HZ3 LYS 133 215.718 -10.978 -1.615 970 H PHE 134 H PHE 134 217.517 -6.205 2.023 971 HA PHE 134 HA PHE 134 218.544 -7.035 4.636 972 HB2 PHE 134 HB2 PHE 134 216.957 -4.485 4.336 973 HB3 PHE 134 HB3 PHE 134 217.795 -5.076 5.766 974 HD1 PHE 134 HD1 PHE 134 220.298 -5.096 5.790 975 HD2 PHE 134 HD2 PHE 134 218.051 -3.154 2.742 976 HE1 PHE 134 HE1 PHE 134 222.283 -3.788 5.166 977 HE2 PHE 134 HE2 PHE 134 220.033 -1.842 2.113 978 HZ PHE 134 HZ PHE 134 222.153 -2.157 3.326 979 H THR 135 H THR 135 217.015 -7.869 6.034 980 HA THR 135 HA THR 135 214.362 -8.347 4.838 981 HB THR 135 HB THR 135 214.259 -10.396 6.168 982 HG1 THR 135 HG1 THR 135 216.879 -9.727 7.032 983 HG21 THR 135 HG21 THR 135 216.859 -10.203 4.665 984 HG22 THR 135 HG22 THR 135 215.286 -10.612 3.983 985 HG23 THR 135 HG23 THR 135 216.049 -11.695 5.147 986 H ASP 136 H ASP 136 212.777 -9.076 6.762 987 HA ASP 136 HA ASP 136 212.556 -6.713 8.442 988 HB2 ASP 136 HB2 ASP 136 210.688 -8.158 7.065 989 HB3 ASP 136 HB3 ASP 136 210.492 -8.798 8.693 990 H SER 137 H SER 137 213.508 -10.017 8.742 991 HA SER 137 HA SER 137 212.871 -10.442 11.457 992 HB2 SER 137 HB2 SER 137 214.934 -11.689 9.640 993 HB3 SER 137 HB3 SER 137 214.692 -12.215 11.308 994 HG SER 137 HG SER 137 212.530 -12.698 10.765 995 H GLY 138 H GLY 138 215.500 -8.724 9.921 996 HA2 GLY 138 HA2 GLY 138 216.859 -7.142 11.001 997 HA3 GLY 138 HA3 GLY 138 216.415 -7.853 12.554 998 H ASP 139 H ASP 139 217.122 -10.576 11.171 999 HA ASP 139 HA ASP 139 219.886 -10.528 12.049 1000 HB2 ASP 139 HB2 ASP 139 217.819 -12.554 11.770 1001 HB3 ASP 139 HB3 ASP 139 219.347 -13.092 11.078 1002 HA PRO 140 HA PRO 140 220.515 -12.044 7.463 1003 HB2 PRO 140 HB2 PRO 140 218.006 -11.215 6.155 1004 HB3 PRO 140 HB3 PRO 140 218.889 -12.736 6.024 1005 HG2 PRO 140 HG2 PRO 140 216.557 -12.565 7.342 1006 HG3 PRO 140 HG3 PRO 140 217.855 -13.650 7.874 1007 HD2 PRO 140 HD2 PRO 140 217.043 -10.985 8.966 1008 HD3 PRO 140 HD3 PRO 140 217.556 -12.450 9.827 1009 H GLU 141 H GLU 141 221.933 -10.319 7.469 1010 HA GLU 141 HA GLU 141 221.016 -7.909 6.060 1011 HB2 GLU 141 HB2 GLU 141 221.800 -8.019 8.768 1012 HB3 GLU 141 HB3 GLU 141 223.140 -7.278 7.908 1013 HG2 GLU 141 HG2 GLU 141 221.926 -5.434 7.310 1014 HG3 GLU 141 HG3 GLU 141 220.381 -6.298 7.372 1015 H GLN 142 H GLN 142 222.028 -8.088 4.144 1016 HA GLN 142 HA GLN 142 224.941 -8.491 4.173 1017 HB2 GLN 142 HB2 GLN 142 223.548 -10.528 3.420 1018 HB3 GLN 142 HB3 GLN 142 223.216 -9.591 1.969 1019 HG2 GLN 142 HG2 GLN 142 225.108 -10.320 1.102 1020 HG3 GLN 142 HG3 GLN 142 225.993 -9.461 2.369 1021 HE21 GLN 142 HE21 GLN 142 224.158 -12.473 1.912 1022 HE22 GLN 142 HE22 GLN 142 225.242 -13.468 2.816 1023 H ILE 143 H ILE 143 226.122 -7.339 2.663 1024 HA ILE 143 HA ILE 143 224.648 -5.492 0.907 1025 HB ILE 143 HB ILE 143 226.325 -3.714 1.495 1026 HG12 ILE 143 HG12 ILE 143 226.908 -5.553 3.829 1027 HG13 ILE 143 HG13 ILE 143 228.020 -5.189 2.511 1028 HG21 ILE 143 HG21 ILE 143 223.930 -4.286 2.611 1029 HG22 ILE 143 HG22 ILE 143 224.872 -2.839 2.970 1030 HG23 ILE 143 HG23 ILE 143 224.958 -4.236 4.041 1031 HD11 ILE 143 HD11 ILE 143 227.264 -2.709 3.512 1032 HD12 ILE 143 HD12 ILE 143 228.801 -3.538 3.756 1033 HD13 ILE 143 HD13 ILE 143 227.501 -3.728 4.931 1034 H MET 144 H MET 144 225.600 -5.128 -1.083 1035 HA MET 144 HA MET 144 228.361 -5.959 -1.502 1036 HB2 MET 144 HB2 MET 144 227.867 -7.465 -3.326 1037 HB3 MET 144 HB3 MET 144 227.040 -8.009 -1.876 1038 HG2 MET 144 HG2 MET 144 225.364 -8.267 -3.372 1039 HG3 MET 144 HG3 MET 144 225.061 -6.594 -2.905 1040 HE1 MET 144 HE1 MET 144 226.549 -9.054 -5.131 1041 HE2 MET 144 HE2 MET 144 227.710 -8.060 -6.013 1042 HE3 MET 144 HE3 MET 144 226.161 -8.468 -6.751 1043 H VAL 145 H VAL 145 229.187 -5.368 -3.660 1044 HA VAL 145 HA VAL 145 227.684 -3.124 -4.838 1045 HB VAL 145 HB VAL 145 229.613 -2.363 -3.437 1046 HG11 VAL 145 HG11 VAL 145 231.248 -4.019 -3.698 1047 HG12 VAL 145 HG12 VAL 145 231.884 -2.627 -4.575 1048 HG13 VAL 145 HG13 VAL 145 231.153 -3.964 -5.458 1049 HG21 VAL 145 HG21 VAL 145 228.744 -0.966 -5.220 1050 HG22 VAL 145 HG22 VAL 145 229.780 -1.781 -6.390 1051 HG23 VAL 145 HG23 VAL 145 230.495 -0.800 -5.113 1052 H SER 146 H SER 146 227.827 -2.843 -7.061 1053 HA SER 146 HA SER 146 229.430 -4.730 -8.608 1054 HB2 SER 146 HB2 SER 146 226.469 -4.429 -9.132 1055 HB3 SER 146 HB3 SER 146 227.587 -5.556 -9.895 1056 HG SER 146 HG SER 146 226.203 -5.817 -7.591 1057 H LYS 147 H LYS 147 229.773 -4.098 -10.786 1058 HA LYS 147 HA LYS 147 229.265 -1.237 -11.241 1059 HB2 LYS 147 HB2 LYS 147 231.179 -1.267 -12.752 1060 HB3 LYS 147 HB3 LYS 147 231.632 -1.881 -11.159 1061 HG2 LYS 147 HG2 LYS 147 231.021 -4.194 -12.370 1062 HG3 LYS 147 HG3 LYS 147 231.532 -3.254 -13.772 1063 HD2 LYS 147 HD2 LYS 147 233.521 -2.623 -12.109 1064 HD3 LYS 147 HD3 LYS 147 233.099 -4.199 -11.437 1065 HE2 LYS 147 HE2 LYS 147 234.757 -4.647 -13.035 1066 HE3 LYS 147 HE3 LYS 147 233.240 -5.073 -13.826 1067 HZ1 LYS 147 HZ1 LYS 147 234.349 -3.852 -15.424 1068 HZ2 LYS 147 HZ2 LYS 147 234.990 -2.750 -14.314 1069 HZ3 LYS 147 HZ3 LYS 147 233.353 -2.678 -14.724 1070 H CYS 148 H CYS 148 228.335 -0.502 -13.111 1071 HA CYS 148 HA CYS 148 227.330 -2.551 -14.975 1072 HB2 CYS 148 HB2 CYS 148 225.930 -0.005 -14.134 1073 HB3 CYS 148 HB3 CYS 148 225.311 -1.198 -15.272 1074 HA PRO 149 HA PRO 149 229.661 -0.407 -18.084 1075 HB2 PRO 149 HB2 PRO 149 227.522 -1.431 -19.888 1076 HB3 PRO 149 HB3 PRO 149 229.282 -1.605 -20.009 1077 HG2 PRO 149 HG2 PRO 149 227.765 -3.654 -19.236 1078 HG3 PRO 149 HG3 PRO 149 229.344 -3.353 -18.486 1079 HD2 PRO 149 HD2 PRO 149 226.603 -2.788 -17.432 1080 HD3 PRO 149 HD3 PRO 149 228.046 -3.366 -16.573 Start of MODEL 10 1 H1 THR 1 H1 THR 1 212.548 -30.217 13.339 2 H2 THR 1 H2 THR 1 210.981 -29.733 13.843 3 H3 THR 1 H3 THR 1 212.033 -30.518 14.946 4 HA THR 1 HA THR 1 211.979 -28.233 15.440 5 HB THR 1 HB THR 1 214.587 -28.514 14.013 6 HG1 THR 1 HG1 THR 1 214.816 -30.475 14.695 7 HG21 THR 1 HG21 THR 1 215.375 -27.246 15.645 8 HG22 THR 1 HG22 THR 1 214.677 -28.286 16.885 9 HG23 THR 1 HG23 THR 1 213.708 -27.004 16.164 10 HA PRO 2 HA PRO 2 210.799 -25.458 12.166 11 HB2 PRO 2 HB2 PRO 2 211.910 -23.392 13.990 12 HB3 PRO 2 HB3 PRO 2 210.308 -23.502 13.252 13 HG2 PRO 2 HG2 PRO 2 210.659 -24.041 15.837 14 HG3 PRO 2 HG3 PRO 2 209.527 -24.985 14.851 15 HD2 PRO 2 HD2 PRO 2 212.267 -25.703 15.807 16 HD3 PRO 2 HD3 PRO 2 210.821 -26.721 15.653 17 H SER 3 H SER 3 211.719 -24.094 10.596 18 HA SER 3 HA SER 3 214.547 -23.439 10.739 19 HB2 SER 3 HB2 SER 3 213.411 -25.376 8.719 20 HB3 SER 3 HB3 SER 3 214.917 -24.502 8.445 21 HG SER 3 HG SER 3 214.919 -26.715 9.511 22 H ALA 4 H ALA 4 215.149 -21.744 9.401 23 HA ALA 4 HA ALA 4 212.988 -20.131 8.369 24 HB1 ALA 4 HB1 ALA 4 215.193 -18.764 7.637 25 HB2 ALA 4 HB2 ALA 4 215.852 -19.734 8.954 26 HB3 ALA 4 HB3 ALA 4 214.474 -18.673 9.245 27 H SER 5 H SER 5 212.319 -20.004 6.307 28 HA SER 5 HA SER 5 213.704 -21.607 4.305 29 HB2 SER 5 HB2 SER 5 211.198 -20.127 3.650 30 HB3 SER 5 HB3 SER 5 211.708 -21.745 3.168 31 HG SER 5 HG SER 5 211.267 -22.420 5.325 32 H GLY 6 H GLY 6 215.413 -20.535 3.475 33 HA2 GLY 6 HA2 GLY 6 215.414 -17.716 2.982 34 HA3 GLY 6 HA3 GLY 6 216.650 -18.861 2.480 35 H LEU 7 H LEU 7 215.557 -20.505 0.744 36 HA LEU 7 HA LEU 7 213.983 -18.971 -1.177 37 HB2 LEU 7 HB2 LEU 7 216.696 -19.041 -1.444 38 HB3 LEU 7 HB3 LEU 7 216.225 -20.432 -2.402 39 HG LEU 7 HG LEU 7 214.494 -18.569 -3.355 40 HD11 LEU 7 HD11 LEU 7 216.174 -16.608 -3.807 41 HD12 LEU 7 HD12 LEU 7 216.874 -17.139 -2.278 42 HD13 LEU 7 HD13 LEU 7 215.187 -16.634 -2.347 43 HD21 LEU 7 HD21 LEU 7 215.547 -19.671 -5.021 44 HD22 LEU 7 HD22 LEU 7 217.106 -19.653 -4.198 45 HD23 LEU 7 HD23 LEU 7 216.547 -18.219 -5.059 46 H THR 8 H THR 8 212.276 -20.376 -0.814 47 HA THR 8 HA THR 8 212.403 -22.863 -2.285 48 HB THR 8 HB THR 8 211.219 -23.252 0.404 49 HG1 THR 8 HG1 THR 8 214.034 -23.288 0.053 50 HG21 THR 8 HG21 THR 8 211.464 -25.403 -0.054 51 HG22 THR 8 HG22 THR 8 213.157 -25.198 -0.506 52 HG23 THR 8 HG23 THR 8 211.885 -24.904 -1.692 53 H LYS 9 H LYS 9 210.417 -20.924 -0.041 54 HA LYS 9 HA LYS 9 207.917 -21.796 -0.980 55 HB2 LYS 9 HB2 LYS 9 208.538 -20.436 1.149 56 HB3 LYS 9 HB3 LYS 9 208.345 -19.033 0.109 57 HG2 LYS 9 HG2 LYS 9 206.037 -19.990 -0.445 58 HG3 LYS 9 HG3 LYS 9 206.283 -21.035 0.957 59 HD2 LYS 9 HD2 LYS 9 205.133 -19.202 1.831 60 HD3 LYS 9 HD3 LYS 9 206.819 -18.860 2.224 61 HE2 LYS 9 HE2 LYS 9 206.305 -16.841 1.344 62 HE3 LYS 9 HE3 LYS 9 206.673 -17.663 -0.171 63 HZ1 LYS 9 HZ1 LYS 9 204.504 -17.707 -0.782 64 HZ2 LYS 9 HZ2 LYS 9 204.434 -16.336 0.205 65 HZ3 LYS 9 HZ3 LYS 9 203.923 -17.832 0.804 66 H VAL 10 H VAL 10 206.589 -21.137 -2.593 67 HA VAL 10 HA VAL 10 207.724 -19.350 -4.607 68 HB VAL 10 HB VAL 10 206.902 -21.540 -5.350 69 HG11 VAL 10 HG11 VAL 10 204.187 -21.442 -5.447 70 HG12 VAL 10 HG12 VAL 10 204.507 -20.719 -3.871 71 HG13 VAL 10 HG13 VAL 10 205.121 -22.329 -4.244 72 HG21 VAL 10 HG21 VAL 10 206.047 -20.789 -7.328 73 HG22 VAL 10 HG22 VAL 10 206.666 -19.271 -6.681 74 HG23 VAL 10 HG23 VAL 10 204.949 -19.648 -6.553 75 H ALA 11 H ALA 11 206.567 -17.589 -5.502 76 HA ALA 11 HA ALA 11 205.205 -15.971 -3.655 77 HB1 ALA 11 HB1 ALA 11 206.167 -14.666 -5.240 78 HB2 ALA 11 HB2 ALA 11 204.554 -14.766 -5.943 79 HB3 ALA 11 HB3 ALA 11 205.843 -15.812 -6.541 80 H THR 12 H THR 12 203.220 -16.220 -2.894 81 HA THR 12 HA THR 12 201.182 -17.484 -4.594 82 HB THR 12 HB THR 12 200.856 -17.119 -1.636 83 HG1 THR 12 HG1 THR 12 202.452 -19.080 -2.915 84 HG21 THR 12 HG21 THR 12 199.550 -18.651 -3.712 85 HG22 THR 12 HG22 THR 12 199.013 -18.261 -2.080 86 HG23 THR 12 HG23 THR 12 200.055 -19.657 -2.354 87 H VAL 13 H VAL 13 199.533 -16.325 -5.318 88 HA VAL 13 HA VAL 13 197.989 -14.696 -5.615 89 HB VAL 13 HB VAL 13 198.555 -13.829 -2.775 90 HG11 VAL 13 HG11 VAL 13 195.859 -13.567 -3.920 91 HG12 VAL 13 HG12 VAL 13 197.085 -12.526 -4.643 92 HG13 VAL 13 HG13 VAL 13 196.778 -12.453 -2.908 93 HG21 VAL 13 HG21 VAL 13 197.702 -16.319 -3.498 94 HG22 VAL 13 HG22 VAL 13 196.176 -15.463 -3.286 95 HG23 VAL 13 HG23 VAL 13 197.339 -15.535 -1.962 96 H SER 14 H SER 14 198.622 -13.259 -7.065 97 HA SER 14 HA SER 14 199.447 -11.367 -8.007 98 HB2 SER 14 HB2 SER 14 200.106 -10.383 -5.229 99 HB3 SER 14 HB3 SER 14 199.783 -9.419 -6.668 100 HG SER 14 HG SER 14 197.633 -10.080 -6.581 101 H ALA 15 H ALA 15 201.194 -12.231 -9.073 102 HA ALA 15 HA ALA 15 203.793 -11.476 -8.105 103 HB1 ALA 15 HB1 ALA 15 203.381 -14.414 -8.597 104 HB2 ALA 15 HB2 ALA 15 203.312 -13.694 -6.990 105 HB3 ALA 15 HB3 ALA 15 204.800 -13.607 -7.931 106 H ALA 16 H ALA 16 204.151 -10.326 -9.954 107 HA ALA 16 HA ALA 16 205.090 -11.696 -12.242 108 HB1 ALA 16 HB1 ALA 16 202.808 -12.062 -12.829 109 HB2 ALA 16 HB2 ALA 16 203.428 -10.789 -13.880 110 HB3 ALA 16 HB3 ALA 16 202.396 -10.377 -12.512 111 H SER 17 H SER 17 206.693 -10.457 -12.983 112 HA SER 17 HA SER 17 206.335 -7.638 -13.420 113 HB2 SER 17 HB2 SER 17 207.833 -8.635 -11.066 114 HB3 SER 17 HB3 SER 17 208.623 -7.363 -11.997 115 HG SER 17 HG SER 17 205.973 -7.237 -10.977 116 H SER 18 H SER 18 206.799 -8.092 -15.545 117 HA SER 18 HA SER 18 208.069 -8.260 -17.411 118 HB2 SER 18 HB2 SER 18 210.168 -7.612 -15.370 119 HB3 SER 18 HB3 SER 18 210.647 -8.024 -17.015 120 HG SER 18 HG SER 18 209.384 -6.309 -17.762 121 H LEU 19 H LEU 19 207.817 -10.230 -18.258 122 HA LEU 19 HA LEU 19 208.772 -12.618 -17.037 123 HB2 LEU 19 HB2 LEU 19 206.915 -12.066 -18.960 124 HB3 LEU 19 HB3 LEU 19 208.226 -12.714 -19.929 125 HG LEU 19 HG LEU 19 208.152 -14.623 -18.066 126 HD11 LEU 19 HD11 LEU 19 206.255 -13.319 -16.938 127 HD12 LEU 19 HD12 LEU 19 206.041 -15.053 -17.176 128 HD13 LEU 19 HD13 LEU 19 205.247 -13.911 -18.259 129 HD21 LEU 19 HD21 LEU 19 207.220 -15.965 -19.674 130 HD22 LEU 19 HD22 LEU 19 207.698 -14.578 -20.652 131 HD23 LEU 19 HD23 LEU 19 206.021 -14.760 -20.141 132 H ILE 20 H ILE 20 209.920 -10.652 -19.774 133 HA ILE 20 HA ILE 20 212.125 -12.367 -20.360 134 HB ILE 20 HB ILE 20 211.175 -10.941 -22.090 135 HG12 ILE 20 HG12 ILE 20 213.718 -11.575 -21.874 136 HG13 ILE 20 HG13 ILE 20 213.163 -10.501 -23.163 137 HG21 ILE 20 HG21 ILE 20 211.795 -8.463 -22.025 138 HG22 ILE 20 HG22 ILE 20 212.033 -8.697 -20.294 139 HG23 ILE 20 HG23 ILE 20 210.452 -8.999 -21.015 140 HD11 ILE 20 HD11 ILE 20 213.913 -9.078 -20.734 141 HD12 ILE 20 HD12 ILE 20 214.399 -8.809 -22.407 142 HD13 ILE 20 HD13 ILE 20 215.232 -10.018 -21.431 143 H GLY 21 H GLY 21 214.260 -12.190 -19.807 144 HA2 GLY 21 HA2 GLY 21 215.601 -10.070 -18.677 145 HA3 GLY 21 HA3 GLY 21 214.849 -10.913 -17.318 146 H GLU 22 H GLU 22 217.700 -10.524 -18.277 147 HA GLU 22 HA GLU 22 218.485 -13.366 -18.261 148 HB2 GLU 22 HB2 GLU 22 219.055 -11.455 -20.205 149 HB3 GLU 22 HB3 GLU 22 220.530 -11.564 -19.259 150 HG2 GLU 22 HG2 GLU 22 220.574 -13.956 -19.615 151 HG3 GLU 22 HG3 GLU 22 219.108 -13.831 -20.583 152 H GLY 23 H GLY 23 220.000 -14.010 -16.792 153 HA2 GLY 23 HA2 GLY 23 220.399 -12.515 -14.459 154 HA3 GLY 23 HA3 GLY 23 221.341 -13.940 -14.927 155 H PHE 24 H PHE 24 222.228 -12.531 -17.441 156 HA PHE 24 HA PHE 24 224.664 -11.512 -16.487 157 HB2 PHE 24 HB2 PHE 24 223.536 -12.132 -19.007 158 HB3 PHE 24 HB3 PHE 24 224.069 -10.448 -19.097 159 HD1 PHE 24 HD1 PHE 24 226.482 -10.272 -17.645 160 HD2 PHE 24 HD2 PHE 24 225.056 -13.531 -19.983 161 HE1 PHE 24 HE1 PHE 24 228.795 -11.027 -17.995 162 HE2 PHE 24 HE2 PHE 24 227.369 -14.294 -20.336 163 HZ PHE 24 HZ PHE 24 229.242 -13.042 -19.340 164 H MET 25 H MET 25 221.817 -9.804 -17.811 165 HA MET 25 HA MET 25 222.955 -7.231 -17.141 166 HB2 MET 25 HB2 MET 25 220.937 -6.265 -18.072 167 HB3 MET 25 HB3 MET 25 221.570 -7.485 -19.165 168 HG2 MET 25 HG2 MET 25 219.402 -8.086 -19.243 169 HG3 MET 25 HG3 MET 25 219.845 -9.001 -17.804 170 HE1 MET 25 HE1 MET 25 218.381 -9.219 -16.167 171 HE2 MET 25 HE2 MET 25 216.925 -8.891 -17.106 172 HE3 MET 25 HE3 MET 25 217.172 -8.092 -15.552 173 H ALA 26 H ALA 26 220.990 -9.577 -15.570 174 HA ALA 26 HA ALA 26 219.785 -7.691 -13.726 175 HB1 ALA 26 HB1 ALA 26 219.109 -10.243 -14.609 176 HB2 ALA 26 HB2 ALA 26 218.297 -9.299 -13.362 177 HB3 ALA 26 HB3 ALA 26 219.554 -10.452 -12.916 178 H GLN 27 H GLN 27 222.869 -8.503 -13.909 179 HA GLN 27 HA GLN 27 223.259 -9.316 -11.138 180 HB2 GLN 27 HB2 GLN 27 225.584 -9.585 -11.668 181 HB3 GLN 27 HB3 GLN 27 224.642 -10.327 -12.950 182 HG2 GLN 27 HG2 GLN 27 225.718 -9.118 -14.450 183 HG3 GLN 27 HG3 GLN 27 225.148 -7.635 -13.689 184 HE21 GLN 27 HE21 GLN 27 226.446 -6.754 -11.940 185 HE22 GLN 27 HE22 GLN 27 228.164 -7.010 -11.954 186 H CYS 28 H CYS 28 223.536 -6.481 -13.159 187 HA CYS 28 HA CYS 28 224.498 -4.954 -10.833 188 HB2 CYS 28 HB2 CYS 28 225.276 -3.264 -12.564 189 HB3 CYS 28 HB3 CYS 28 226.169 -4.779 -12.499 190 H ASP 29 H ASP 29 222.124 -5.076 -13.439 191 HA ASP 29 HA ASP 29 220.769 -2.762 -12.229 192 HB2 ASP 29 HB2 ASP 29 221.227 -3.534 -15.053 193 HB3 ASP 29 HB3 ASP 29 219.623 -2.893 -14.672 194 H ASN 30 H ASN 30 219.386 -3.708 -10.834 195 HA ASN 30 HA ASN 30 217.683 -5.912 -11.746 196 HB2 ASN 30 HB2 ASN 30 217.798 -4.716 -8.970 197 HB3 ASN 30 HB3 ASN 30 217.109 -6.265 -9.440 198 HD21 ASN 30 HD21 ASN 30 219.405 -5.268 -7.619 199 HD22 ASN 30 HD22 ASN 30 220.703 -6.348 -8.023 200 HA PRO 31 HA PRO 31 214.118 -3.401 -12.443 201 HB2 PRO 31 HB2 PRO 31 212.143 -4.947 -11.316 202 HB3 PRO 31 HB3 PRO 31 212.823 -5.170 -12.933 203 HG2 PRO 31 HG2 PRO 31 213.407 -6.639 -10.417 204 HG3 PRO 31 HG3 PRO 31 213.317 -7.233 -12.085 205 HD2 PRO 31 HD2 PRO 31 215.670 -6.799 -10.807 206 HD3 PRO 31 HD3 PRO 31 215.479 -6.611 -12.562 207 H THR 32 H THR 32 213.744 -1.577 -11.349 208 HA THR 32 HA THR 32 213.416 -1.727 -8.445 209 HB THR 32 HB THR 32 213.445 0.974 -9.502 210 HG1 THR 32 HG1 THR 32 214.855 0.555 -11.031 211 HG21 THR 32 HG21 THR 32 215.769 0.407 -8.018 212 HG22 THR 32 HG22 THR 32 214.439 -0.481 -7.268 213 HG23 THR 32 HG23 THR 32 214.319 1.265 -7.499 214 H ILE 33 H ILE 33 211.656 -1.000 -7.397 215 HA ILE 33 HA ILE 33 209.384 0.127 -8.852 216 HB ILE 33 HB ILE 33 209.161 -2.321 -9.077 217 HG12 ILE 33 HG12 ILE 33 207.087 -1.422 -7.088 218 HG13 ILE 33 HG13 ILE 33 207.167 -0.721 -8.702 219 HG21 ILE 33 HG21 ILE 33 208.869 -2.468 -6.093 220 HG22 ILE 33 HG22 ILE 33 210.396 -2.781 -6.920 221 HG23 ILE 33 HG23 ILE 33 208.990 -3.792 -7.253 222 HD11 ILE 33 HD11 ILE 33 207.246 -3.501 -9.052 223 HD12 ILE 33 HD12 ILE 33 205.924 -2.395 -9.428 224 HD13 ILE 33 HD13 ILE 33 205.994 -3.181 -7.851 225 H GLU 34 H GLU 34 207.624 0.705 -7.375 226 HA GLU 34 HA GLU 34 208.576 2.210 -5.199 227 HB2 GLU 34 HB2 GLU 34 206.153 2.503 -4.606 228 HB3 GLU 34 HB3 GLU 34 206.557 2.921 -6.264 229 HG2 GLU 34 HG2 GLU 34 205.721 0.147 -5.957 230 HG3 GLU 34 HG3 GLU 34 204.493 1.302 -5.451 231 H GLY 35 H GLY 35 209.463 1.339 -3.447 232 HA2 GLY 35 HA2 GLY 35 207.904 -0.561 -1.858 233 HA3 GLY 35 HA3 GLY 35 209.523 -1.053 -2.343 234 H ASP 36 H ASP 36 209.975 -1.192 -0.052 235 HA ASP 36 HA ASP 36 210.924 -0.437 1.870 236 HB2 ASP 36 HB2 ASP 36 211.451 2.211 0.525 237 HB3 ASP 36 HB3 ASP 36 212.387 1.418 1.797 238 H GLY 37 H GLY 37 209.646 2.679 0.661 239 HA2 GLY 37 HA2 GLY 37 207.681 3.764 1.436 240 HA3 GLY 37 HA3 GLY 37 207.659 2.680 2.823 241 HA PRO 38 HA PRO 38 209.304 6.271 4.937 242 HB2 PRO 38 HB2 PRO 38 209.600 5.129 7.382 243 HB3 PRO 38 HB3 PRO 38 208.027 5.643 6.739 244 HG2 PRO 38 HG2 PRO 38 209.247 2.906 6.812 245 HG3 PRO 38 HG3 PRO 38 207.582 3.400 7.175 246 HD2 PRO 38 HD2 PRO 38 208.298 2.297 4.803 247 HD3 PRO 38 HD3 PRO 38 206.993 3.492 4.951 248 H ILE 39 H ILE 39 210.889 3.183 4.621 249 HA ILE 39 HA ILE 39 213.379 4.136 5.781 250 HB ILE 39 HB ILE 39 213.124 1.517 4.334 251 HG12 ILE 39 HG12 ILE 39 212.244 2.020 7.190 252 HG13 ILE 39 HG13 ILE 39 211.164 1.672 5.846 253 HG21 ILE 39 HG21 ILE 39 214.843 2.665 6.493 254 HG22 ILE 39 HG22 ILE 39 215.307 1.829 5.012 255 HG23 ILE 39 HG23 ILE 39 214.637 0.918 6.363 256 HD11 ILE 39 HD11 ILE 39 212.295 -0.519 5.582 257 HD12 ILE 39 HD12 ILE 39 211.473 -0.317 7.129 258 HD13 ILE 39 HD13 ILE 39 213.226 -0.163 7.036 259 H GLY 40 H GLY 40 215.442 3.721 4.490 260 HA2 GLY 40 HA2 GLY 40 216.724 3.948 2.578 261 HA3 GLY 40 HA3 GLY 40 215.252 3.864 1.622 262 H LYS 41 H LYS 41 216.395 6.103 4.146 263 HA LYS 41 HA LYS 41 215.487 8.381 2.591 264 HB2 LYS 41 HB2 LYS 41 216.242 9.704 4.559 265 HB3 LYS 41 HB3 LYS 41 215.068 8.459 4.958 266 HG2 LYS 41 HG2 LYS 41 217.602 7.279 5.269 267 HG3 LYS 41 HG3 LYS 41 217.696 8.877 6.011 268 HD2 LYS 41 HD2 LYS 41 215.490 6.901 6.571 269 HD3 LYS 41 HD3 LYS 41 216.954 7.033 7.545 270 HE2 LYS 41 HE2 LYS 41 216.180 8.827 8.624 271 HE3 LYS 41 HE3 LYS 41 215.706 9.615 7.120 272 HZ1 LYS 41 HZ1 LYS 41 213.740 9.315 8.330 273 HZ2 LYS 41 HZ2 LYS 41 214.128 7.729 8.768 274 HZ3 LYS 41 HZ3 LYS 41 213.710 8.084 7.167 275 H THR 42 H THR 42 216.820 10.207 2.150 276 HA THR 42 HA THR 42 219.093 9.623 0.665 277 HB THR 42 HB THR 42 218.005 11.652 0.168 278 HG1 THR 42 HG1 THR 42 219.673 13.023 0.109 279 HG21 THR 42 HG21 THR 42 218.011 13.581 1.809 280 HG22 THR 42 HG22 THR 42 218.326 12.374 3.057 281 HG23 THR 42 HG23 THR 42 216.850 12.286 2.095 282 H LEU 43 H LEU 43 221.079 9.049 1.198 283 HA LEU 43 HA LEU 43 222.162 9.878 3.814 284 HB2 LEU 43 HB2 LEU 43 222.958 7.385 2.319 285 HB3 LEU 43 HB3 LEU 43 223.361 7.820 3.968 286 HG LEU 43 HG LEU 43 220.539 7.725 3.840 287 HD11 LEU 43 HD11 LEU 43 220.405 6.423 1.930 288 HD12 LEU 43 HD12 LEU 43 220.425 5.216 3.215 289 HD13 LEU 43 HD13 LEU 43 221.892 5.549 2.294 290 HD21 LEU 43 HD21 LEU 43 222.353 7.092 5.629 291 HD22 LEU 43 HD22 LEU 43 222.162 5.480 4.937 292 HD23 LEU 43 HD23 LEU 43 220.771 6.312 5.631 293 H TYR 44 H TYR 44 224.704 9.536 3.750 294 HA TYR 44 HA TYR 44 225.741 10.611 1.218 295 HB2 TYR 44 HB2 TYR 44 225.874 11.794 3.933 296 HB3 TYR 44 HB3 TYR 44 227.359 11.856 2.987 297 HD1 TYR 44 HD1 TYR 44 223.701 12.495 2.500 298 HD2 TYR 44 HD2 TYR 44 227.690 13.749 1.713 299 HE1 TYR 44 HE1 TYR 44 222.840 14.450 1.287 300 HE2 TYR 44 HE2 TYR 44 226.839 15.710 0.498 301 HH TYR 44 HH TYR 44 224.226 16.076 -0.797 302 H VAL 45 H VAL 45 227.272 9.326 0.431 303 HA VAL 45 HA VAL 45 228.722 7.548 2.252 304 HB VAL 45 HB VAL 45 227.634 6.494 0.317 305 HG11 VAL 45 HG11 VAL 45 229.548 7.417 -1.680 306 HG12 VAL 45 HG12 VAL 45 228.463 8.686 -1.113 307 HG13 VAL 45 HG13 VAL 45 227.802 7.201 -1.794 308 HG21 VAL 45 HG21 VAL 45 230.118 5.977 1.290 309 HG22 VAL 45 HG22 VAL 45 230.445 6.124 -0.436 310 HG23 VAL 45 HG23 VAL 45 229.257 4.954 0.142 311 H VAL 46 H VAL 46 230.827 7.777 2.701 312 HA VAL 46 HA VAL 46 232.499 9.441 0.968 313 HB VAL 46 HB VAL 46 233.215 10.942 2.569 314 HG11 VAL 46 HG11 VAL 46 230.439 10.545 3.628 315 HG12 VAL 46 HG12 VAL 46 230.740 11.153 1.999 316 HG13 VAL 46 HG13 VAL 46 231.332 12.048 3.399 317 HG21 VAL 46 HG21 VAL 46 233.941 9.786 4.396 318 HG22 VAL 46 HG22 VAL 46 232.446 8.863 4.550 319 HG23 VAL 46 HG23 VAL 46 232.500 10.547 5.068 320 H GLY 47 H GLY 47 234.852 9.462 2.109 321 HA2 GLY 47 HA2 GLY 47 236.372 8.048 3.430 322 HA3 GLY 47 HA3 GLY 47 235.463 6.662 2.830 323 H ASP 48 H ASP 48 235.397 8.195 0.136 324 HA ASP 48 HA ASP 48 237.175 6.766 -1.292 325 HB2 ASP 48 HB2 ASP 48 235.640 9.162 -1.729 326 HB3 ASP 48 HB3 ASP 48 237.179 9.222 -2.607 327 H PHE 49 H PHE 49 237.988 10.217 -0.990 328 HA PHE 49 HA PHE 49 239.952 11.301 -0.607 329 HB2 PHE 49 HB2 PHE 49 240.111 8.964 1.037 330 HB3 PHE 49 HB3 PHE 49 241.709 9.317 0.374 331 HD1 PHE 49 HD1 PHE 49 241.758 12.233 0.305 332 HD2 PHE 49 HD2 PHE 49 240.158 9.605 3.249 333 HE1 PHE 49 HE1 PHE 49 242.093 13.959 2.027 334 HE2 PHE 49 HE2 PHE 49 240.489 11.329 4.971 335 HZ PHE 49 HZ PHE 49 241.460 13.508 4.362 336 H ALA 50 H ALA 50 239.546 9.010 -2.870 337 HA ALA 50 HA ALA 50 242.308 9.168 -3.870 338 HB1 ALA 50 HB1 ALA 50 241.648 7.243 -5.325 339 HB2 ALA 50 HB2 ALA 50 240.109 7.190 -4.466 340 HB3 ALA 50 HB3 ALA 50 241.612 6.889 -3.596 341 H ASP 51 H ASP 51 241.303 11.464 -4.277 342 HA ASP 51 HA ASP 51 240.884 13.033 -5.867 343 HB2 ASP 51 HB2 ASP 51 242.067 11.181 -7.347 344 HB3 ASP 51 HB3 ASP 51 240.437 10.998 -8.012 345 H ALA 52 H ALA 52 238.774 11.375 -4.386 346 HA ALA 52 HA ALA 52 236.488 11.814 -6.182 347 HB1 ALA 52 HB1 ALA 52 237.071 9.702 -4.526 348 HB2 ALA 52 HB2 ALA 52 235.489 10.067 -5.213 349 HB3 ALA 52 HB3 ALA 52 235.893 10.622 -3.589 350 H SER 53 H SER 53 237.666 12.584 -2.924 351 HA SER 53 HA SER 53 237.311 14.384 -1.576 352 HB2 SER 53 HB2 SER 53 235.621 15.649 -3.734 353 HB3 SER 53 HB3 SER 53 236.523 16.447 -2.447 354 HG SER 53 HG SER 53 238.305 16.291 -3.586 355 H TRP 54 H TRP 54 235.433 12.071 -1.818 356 HA TRP 54 HA TRP 54 233.416 11.359 -1.055 357 HB2 TRP 54 HB2 TRP 54 233.715 13.685 0.856 358 HB3 TRP 54 HB3 TRP 54 232.824 12.181 1.131 359 HD1 TRP 54 HD1 TRP 54 235.636 10.735 -0.357 360 HE1 TRP 54 HE1 TRP 54 237.499 10.132 1.304 361 HE3 TRP 54 HE3 TRP 54 234.170 13.643 3.580 362 HZ2 TRP 54 HZ2 TRP 54 238.255 10.810 3.949 363 HZ3 TRP 54 HZ3 TRP 54 235.516 13.611 5.639 364 HH2 TRP 54 HH2 TRP 54 237.517 12.224 5.817 365 H LYS 55 H LYS 55 232.709 12.381 -3.247 366 HA LYS 55 HA LYS 55 230.825 14.584 -2.874 367 HB2 LYS 55 HB2 LYS 55 231.987 13.226 -5.291 368 HB3 LYS 55 HB3 LYS 55 230.570 14.257 -5.426 369 HG2 LYS 55 HG2 LYS 55 231.864 16.107 -4.429 370 HG3 LYS 55 HG3 LYS 55 233.288 15.065 -4.416 371 HD2 LYS 55 HD2 LYS 55 231.723 15.798 -6.890 372 HD3 LYS 55 HD3 LYS 55 233.195 16.613 -6.361 373 HE2 LYS 55 HE2 LYS 55 234.469 14.589 -6.616 374 HE3 LYS 55 HE3 LYS 55 233.009 13.661 -6.961 375 HZ1 LYS 55 HZ1 LYS 55 232.714 14.961 -8.982 376 HZ2 LYS 55 HZ2 LYS 55 234.212 14.179 -8.982 377 HZ3 LYS 55 HZ3 LYS 55 234.124 15.835 -8.653 378 H GLN 56 H GLN 56 228.646 14.381 -2.993 379 HA GLN 56 HA GLN 56 227.509 11.786 -3.755 380 HB2 GLN 56 HB2 GLN 56 227.677 11.786 -1.309 381 HB3 GLN 56 HB3 GLN 56 226.807 13.311 -1.237 382 HG2 GLN 56 HG2 GLN 56 225.307 11.544 -0.663 383 HG3 GLN 56 HG3 GLN 56 224.840 12.188 -2.243 384 HE21 GLN 56 HE21 GLN 56 224.806 10.850 -3.974 385 HE22 GLN 56 HE22 GLN 56 225.236 9.176 -3.920 386 H LYS 57 H LYS 57 226.630 12.542 -5.642 387 HA LYS 57 HA LYS 57 225.346 15.011 -5.997 388 HB2 LYS 57 HB2 LYS 57 225.124 12.399 -7.490 389 HB3 LYS 57 HB3 LYS 57 224.249 13.840 -7.987 390 HG2 LYS 57 HG2 LYS 57 227.005 14.497 -7.594 391 HG3 LYS 57 HG3 LYS 57 226.875 13.086 -8.647 392 HD2 LYS 57 HD2 LYS 57 226.570 14.598 -10.280 393 HD3 LYS 57 HD3 LYS 57 224.923 14.699 -9.654 394 HE2 LYS 57 HE2 LYS 57 225.609 16.567 -8.207 395 HE3 LYS 57 HE3 LYS 57 227.238 16.475 -8.879 396 HZ1 LYS 57 HZ1 LYS 57 224.761 17.103 -10.399 397 HZ2 LYS 57 HZ2 LYS 57 226.313 16.989 -11.063 398 HZ3 LYS 57 HZ3 LYS 57 225.958 18.210 -9.948 399 HA PRO 58 HA PRO 58 221.697 14.281 -3.466 400 HB2 PRO 58 HB2 PRO 58 220.768 16.649 -5.019 401 HB3 PRO 58 HB3 PRO 58 220.770 16.374 -3.265 402 HG2 PRO 58 HG2 PRO 58 222.556 18.000 -4.382 403 HG3 PRO 58 HG3 PRO 58 223.018 16.920 -3.053 404 HD2 PRO 58 HD2 PRO 58 223.551 16.663 -5.983 405 HD3 PRO 58 HD3 PRO 58 224.597 16.258 -4.605 406 H HIS 59 H HIS 59 221.652 14.863 -6.958 407 HA HIS 59 HA HIS 59 219.007 14.145 -7.510 408 HB2 HIS 59 HB2 HIS 59 221.530 14.315 -9.057 409 HB3 HIS 59 HB3 HIS 59 220.256 13.301 -9.751 410 HD1 HIS 59 HD1 HIS 59 218.002 14.524 -10.371 411 HD2 HIS 59 HD2 HIS 59 221.123 17.036 -9.268 412 HE1 HIS 59 HE1 HIS 59 217.324 16.818 -11.144 413 HE2 HIS 59 HE2 HIS 59 219.181 18.337 -10.375 414 H ARG 60 H ARG 60 221.728 12.154 -6.658 415 HA ARG 60 HA ARG 60 220.049 9.765 -6.997 416 HB2 ARG 60 HB2 ARG 60 222.973 10.072 -7.688 417 HB3 ARG 60 HB3 ARG 60 222.189 8.510 -7.500 418 HG2 ARG 60 HG2 ARG 60 220.598 9.171 -9.301 419 HG3 ARG 60 HG3 ARG 60 221.565 10.626 -9.547 420 HD2 ARG 60 HD2 ARG 60 223.464 9.360 -10.201 421 HD3 ARG 60 HD3 ARG 60 222.712 7.844 -9.676 422 HE ARG 60 HE ARG 60 221.020 8.785 -11.583 423 HH11 ARG 60 HH11 ARG 60 224.462 8.120 -11.518 424 HH12 ARG 60 HH12 ARG 60 224.544 7.743 -13.206 425 HH21 ARG 60 HH21 ARG 60 221.138 8.280 -13.804 426 HH22 ARG 60 HH22 ARG 60 222.659 7.835 -14.501 427 H ALA 61 H ALA 61 220.782 11.596 -4.707 428 HA ALA 61 HA ALA 61 222.570 10.471 -2.922 429 HB1 ALA 61 HB1 ALA 61 220.163 12.174 -2.665 430 HB2 ALA 61 HB2 ALA 61 221.818 12.456 -2.124 431 HB3 ALA 61 HB3 ALA 61 220.756 11.395 -1.199 432 H TYR 62 H TYR 62 219.340 9.388 -3.764 433 HA TYR 62 HA TYR 62 219.781 6.852 -2.521 434 HB2 TYR 62 HB2 TYR 62 217.951 6.912 -0.920 435 HB3 TYR 62 HB3 TYR 62 219.100 8.192 -0.552 436 HD1 TYR 62 HD1 TYR 62 218.479 10.483 -1.931 437 HD2 TYR 62 HD2 TYR 62 215.737 7.484 -0.671 438 HE1 TYR 62 HE1 TYR 62 216.659 12.130 -1.997 439 HE2 TYR 62 HE2 TYR 62 213.910 9.126 -0.730 440 HH TYR 62 HH TYR 62 213.831 11.734 -2.305 441 H ARG 63 H ARG 63 218.694 5.316 -3.604 442 HA ARG 63 HA ARG 63 216.422 6.149 -5.294 443 HB2 ARG 63 HB2 ARG 63 218.788 5.309 -6.277 444 HB3 ARG 63 HB3 ARG 63 217.997 3.754 -6.071 445 HG2 ARG 63 HG2 ARG 63 216.447 4.166 -7.694 446 HG3 ARG 63 HG3 ARG 63 216.493 5.914 -7.450 447 HD2 ARG 63 HD2 ARG 63 217.715 5.960 -9.326 448 HD3 ARG 63 HD3 ARG 63 219.036 5.390 -8.309 449 HE ARG 63 HE ARG 63 217.554 3.867 -10.278 450 HH11 ARG 63 HH11 ARG 63 219.753 3.739 -7.548 451 HH12 ARG 63 HH12 ARG 63 220.352 2.166 -7.951 452 HH21 ARG 63 HH21 ARG 63 218.347 1.791 -10.791 453 HH22 ARG 63 HH22 ARG 63 219.556 1.063 -9.788 454 H TYR 64 H TYR 64 214.572 5.314 -4.544 455 HA TYR 64 HA TYR 64 214.434 3.308 -2.594 456 HB2 TYR 64 HB2 TYR 64 212.438 4.677 -4.330 457 HB3 TYR 64 HB3 TYR 64 211.945 3.164 -3.557 458 HD1 TYR 64 HD1 TYR 64 213.007 6.641 -2.975 459 HD2 TYR 64 HD2 TYR 64 211.616 3.045 -1.178 460 HE1 TYR 64 HE1 TYR 64 212.558 7.860 -0.888 461 HE2 TYR 64 HE2 TYR 64 211.164 4.254 0.909 462 HH TYR 64 HH TYR 64 211.599 6.192 2.048 463 H VAL 65 H VAL 65 214.800 1.232 -2.736 464 HA VAL 65 HA VAL 65 214.498 -0.110 -5.332 465 HB VAL 65 HB VAL 65 215.751 -1.421 -2.940 466 HG11 VAL 65 HG11 VAL 65 215.195 -2.401 -5.353 467 HG12 VAL 65 HG12 VAL 65 216.605 -2.910 -4.425 468 HG13 VAL 65 HG13 VAL 65 216.778 -1.709 -5.704 469 HG21 VAL 65 HG21 VAL 65 217.942 -0.561 -3.613 470 HG22 VAL 65 HG22 VAL 65 216.866 0.729 -3.080 471 HG23 VAL 65 HG23 VAL 65 217.166 0.484 -4.801 472 H GLY 66 H GLY 66 212.337 -0.562 -5.416 473 HA2 GLY 66 HA2 GLY 66 210.580 -1.191 -3.444 474 HA3 GLY 66 HA3 GLY 66 210.467 -1.864 -5.069 475 H GLU 67 H GLU 67 211.554 -2.348 -1.815 476 HA GLU 67 HA GLU 67 210.980 -4.934 -1.402 477 HB2 GLU 67 HB2 GLU 67 213.209 -4.727 -3.295 478 HB3 GLU 67 HB3 GLU 67 213.589 -5.738 -1.910 479 HG2 GLU 67 HG2 GLU 67 210.981 -6.330 -3.048 480 HG3 GLU 67 HG3 GLU 67 212.297 -6.508 -4.208 481 H ASN 68 H ASN 68 211.897 -2.349 -0.062 482 HA ASN 68 HA ASN 68 212.873 -1.708 1.873 483 HB2 ASN 68 HB2 ASN 68 211.944 -4.277 2.350 484 HB3 ASN 68 HB3 ASN 68 213.620 -4.342 2.887 485 HD21 ASN 68 HD21 ASN 68 213.552 -4.212 5.032 486 HD22 ASN 68 HD22 ASN 68 212.700 -2.999 5.938 487 H THR 69 H THR 69 214.486 -2.272 -0.573 488 HA THR 69 HA THR 69 217.122 -2.695 0.673 489 HB THR 69 HB THR 69 217.664 -2.922 -1.957 490 HG1 THR 69 HG1 THR 69 215.116 -4.131 -1.768 491 HG21 THR 69 HG21 THR 69 217.320 -4.757 0.180 492 HG22 THR 69 HG22 THR 69 218.335 -4.895 -1.255 493 HG23 THR 69 HG23 THR 69 216.669 -5.472 -1.295 494 H TYR 70 H TYR 70 218.881 -1.320 -0.056 495 HA TYR 70 HA TYR 70 217.925 1.271 -1.099 496 HB2 TYR 70 HB2 TYR 70 220.394 1.082 0.591 497 HB3 TYR 70 HB3 TYR 70 219.304 2.444 0.362 498 HD1 TYR 70 HD1 TYR 70 216.689 1.345 1.025 499 HD2 TYR 70 HD2 TYR 70 220.461 0.625 2.862 500 HE1 TYR 70 HE1 TYR 70 215.551 0.772 3.124 501 HE2 TYR 70 HE2 TYR 70 219.331 0.049 4.966 502 HH TYR 70 HH TYR 70 216.074 -0.625 5.179 503 H GLN 71 H GLN 71 218.920 2.134 -2.823 504 HA GLN 71 HA GLN 71 221.521 1.096 -3.660 505 HB2 GLN 71 HB2 GLN 71 218.976 0.619 -5.034 506 HB3 GLN 71 HB3 GLN 71 220.209 1.317 -6.072 507 HG2 GLN 71 HG2 GLN 71 220.916 -0.761 -6.378 508 HG3 GLN 71 HG3 GLN 71 221.585 -0.651 -4.751 509 HE21 GLN 71 HE21 GLN 71 219.220 -2.097 -6.772 510 HE22 GLN 71 HE22 GLN 71 218.508 -3.130 -5.571 511 H ALA 72 H ALA 72 222.833 2.614 -4.484 512 HA ALA 72 HA ALA 72 221.740 5.080 -5.581 513 HB1 ALA 72 HB1 ALA 72 221.896 5.558 -3.193 514 HB2 ALA 72 HB2 ALA 72 223.066 6.512 -4.105 515 HB3 ALA 72 HB3 ALA 72 223.596 5.091 -3.204 516 H VAL 73 H VAL 73 222.815 5.476 -7.403 517 HA VAL 73 HA VAL 73 225.312 4.176 -7.992 518 HB VAL 73 HB VAL 73 223.921 6.313 -9.616 519 HG11 VAL 73 HG11 VAL 73 225.906 6.157 -10.689 520 HG12 VAL 73 HG12 VAL 73 225.138 4.747 -11.419 521 HG13 VAL 73 HG13 VAL 73 226.246 4.545 -10.062 522 HG21 VAL 73 HG21 VAL 73 223.651 3.353 -10.058 523 HG22 VAL 73 HG22 VAL 73 222.690 4.663 -10.743 524 HG23 VAL 73 HG23 VAL 73 222.528 4.251 -9.036 525 H VAL 74 H VAL 74 227.335 4.980 -7.800 526 HA VAL 74 HA VAL 74 227.623 7.863 -7.254 527 HB VAL 74 HB VAL 74 229.566 7.229 -5.750 528 HG11 VAL 74 HG11 VAL 74 226.978 6.214 -4.642 529 HG12 VAL 74 HG12 VAL 74 227.159 7.908 -5.098 530 HG13 VAL 74 HG13 VAL 74 228.212 7.208 -3.869 531 HG21 VAL 74 HG21 VAL 74 229.382 4.967 -4.696 532 HG22 VAL 74 HG22 VAL 74 229.921 4.944 -6.375 533 HG23 VAL 74 HG23 VAL 74 228.255 4.519 -5.977 534 H ASP 75 H ASP 75 229.180 8.926 -8.330 535 HA ASP 75 HA ASP 75 230.899 7.361 -10.131 536 HB2 ASP 75 HB2 ASP 75 229.250 9.166 -10.998 537 HB3 ASP 75 HB3 ASP 75 230.425 10.327 -10.365 538 H GLU 76 H GLU 76 232.714 6.929 -8.987 539 HA GLU 76 HA GLU 76 234.207 9.229 -7.905 540 HB2 GLU 76 HB2 GLU 76 234.427 6.468 -6.729 541 HB3 GLU 76 HB3 GLU 76 234.888 8.007 -6.017 542 HG2 GLU 76 HG2 GLU 76 232.778 8.483 -5.324 543 HG3 GLU 76 HG3 GLU 76 232.026 7.620 -6.659 544 H LYS 77 H LYS 77 236.588 8.754 -7.662 545 HA LYS 77 HA LYS 77 237.676 8.035 -10.158 546 HB2 LYS 77 HB2 LYS 77 238.598 9.394 -7.970 547 HB3 LYS 77 HB3 LYS 77 239.521 7.901 -7.872 548 HG2 LYS 77 HG2 LYS 77 240.873 9.320 -9.115 549 HG3 LYS 77 HG3 LYS 77 240.094 8.310 -10.333 550 HD2 LYS 77 HD2 LYS 77 238.578 10.719 -9.681 551 HD3 LYS 77 HD3 LYS 77 240.181 11.059 -10.334 552 HE2 LYS 77 HE2 LYS 77 239.669 10.243 -12.379 553 HE3 LYS 77 HE3 LYS 77 238.636 8.970 -11.732 554 HZ1 LYS 77 HZ1 LYS 77 236.819 10.338 -11.689 555 HZ2 LYS 77 HZ2 LYS 77 237.615 10.952 -13.047 556 HZ3 LYS 77 HZ3 LYS 77 237.728 11.761 -11.566 557 H ALA 78 H ALA 78 239.526 6.413 -10.353 558 HA ALA 78 HA ALA 78 238.723 3.864 -9.104 559 HB1 ALA 78 HB1 ALA 78 238.962 4.615 -11.864 560 HB2 ALA 78 HB2 ALA 78 238.338 3.126 -11.156 561 HB3 ALA 78 HB3 ALA 78 240.062 3.289 -11.491 562 H GLY 79 H GLY 79 240.283 2.452 -8.424 563 HA2 GLY 79 HA2 GLY 79 242.484 1.612 -8.228 564 HA3 GLY 79 HA3 GLY 79 243.097 3.164 -8.802 565 H ALA 80 H ALA 80 242.157 1.275 -6.073 566 HA ALA 80 HA ALA 80 242.448 1.506 -3.838 567 HB1 ALA 80 HB1 ALA 80 244.196 3.014 -3.027 568 HB2 ALA 80 HB2 ALA 80 244.279 3.774 -4.616 569 HB3 ALA 80 HB3 ALA 80 244.740 2.083 -4.421 570 H PHE 81 H PHE 81 240.135 2.169 -3.966 571 HA PHE 81 HA PHE 81 239.812 4.819 -2.744 572 HB2 PHE 81 HB2 PHE 81 237.646 5.081 -3.973 573 HB3 PHE 81 HB3 PHE 81 239.066 5.137 -5.006 574 HD1 PHE 81 HD1 PHE 81 235.938 3.526 -4.342 575 HD2 PHE 81 HD2 PHE 81 239.674 3.065 -6.332 576 HE1 PHE 81 HE1 PHE 81 234.970 1.751 -5.745 577 HE2 PHE 81 HE2 PHE 81 238.708 1.290 -7.736 578 HZ PHE 81 HZ PHE 81 236.356 0.631 -7.444 579 H ARG 82 H ARG 82 238.409 4.913 -1.046 580 HA ARG 82 HA ARG 82 237.032 2.407 -0.324 581 HB2 ARG 82 HB2 ARG 82 238.091 4.418 1.659 582 HB3 ARG 82 HB3 ARG 82 237.517 2.786 1.976 583 HG2 ARG 82 HG2 ARG 82 239.823 2.609 2.142 584 HG3 ARG 82 HG3 ARG 82 239.476 2.015 0.513 585 HD2 ARG 82 HD2 ARG 82 240.427 3.831 -0.498 586 HD3 ARG 82 HD3 ARG 82 240.043 4.916 0.836 587 HE ARG 82 HE ARG 82 242.445 3.420 0.471 588 HH11 ARG 82 HH11 ARG 82 240.315 4.765 2.902 589 HH12 ARG 82 HH12 ARG 82 241.558 4.899 4.097 590 HH21 ARG 82 HH21 ARG 82 244.081 3.589 2.050 591 HH22 ARG 82 HH22 ARG 82 243.702 4.229 3.613 592 H MET 83 H MET 83 235.047 2.635 0.929 593 HA MET 83 HA MET 83 233.898 5.283 1.129 594 HB2 MET 83 HB2 MET 83 231.866 4.638 -0.217 595 HB3 MET 83 HB3 MET 83 233.334 4.944 -1.136 596 HG2 MET 83 HG2 MET 83 233.565 2.294 -0.809 597 HG3 MET 83 HG3 MET 83 231.810 2.440 -0.748 598 HE1 MET 83 HE1 MET 83 230.354 3.089 -2.349 599 HE2 MET 83 HE2 MET 83 230.613 3.031 -4.092 600 HE3 MET 83 HE3 MET 83 230.874 4.536 -3.210 601 H GLN 84 H GLN 84 231.906 5.365 2.285 602 HA GLN 84 HA GLN 84 230.821 2.973 3.468 603 HB2 GLN 84 HB2 GLN 84 231.312 3.418 5.744 604 HB3 GLN 84 HB3 GLN 84 232.838 3.566 4.889 605 HG2 GLN 84 HG2 GLN 84 233.122 5.614 5.673 606 HG3 GLN 84 HG3 GLN 84 231.572 6.128 4.992 607 HE21 GLN 84 HE21 GLN 84 229.664 5.832 6.281 608 HE22 GLN 84 HE22 GLN 84 229.783 5.835 8.014 609 H TYR 85 H TYR 85 228.716 3.255 4.168 610 HA TYR 85 HA TYR 85 227.541 5.860 3.531 611 HB2 TYR 85 HB2 TYR 85 226.550 3.063 3.573 612 HB3 TYR 85 HB3 TYR 85 225.386 4.318 3.978 613 HD1 TYR 85 HD1 TYR 85 227.903 3.425 1.375 614 HD2 TYR 85 HD2 TYR 85 224.246 5.409 2.268 615 HE1 TYR 85 HE1 TYR 85 227.567 3.868 -1.016 616 HE2 TYR 85 HE2 TYR 85 223.900 5.856 -0.124 617 HH TYR 85 HH TYR 85 225.390 6.078 -2.193 618 H ALA 86 H ALA 86 226.323 7.060 4.927 619 HA ALA 86 HA ALA 86 225.558 6.144 7.525 620 HB1 ALA 86 HB1 ALA 86 227.925 6.512 7.965 621 HB2 ALA 86 HB2 ALA 86 226.933 7.677 8.841 622 HB3 ALA 86 HB3 ALA 86 227.786 8.169 7.378 623 H SER 87 H SER 87 223.695 7.142 7.961 624 HA SER 87 HA SER 87 222.845 9.411 6.432 625 HB2 SER 87 HB2 SER 87 221.114 7.906 6.946 626 HB3 SER 87 HB3 SER 87 221.604 7.781 8.643 627 HG SER 87 HG SER 87 220.646 9.674 9.066 628 H LYS 88 H LYS 88 221.891 11.368 7.510 629 HA LYS 88 HA LYS 88 223.885 12.661 9.074 630 HB2 LYS 88 HB2 LYS 88 221.086 13.693 8.649 631 HB3 LYS 88 HB3 LYS 88 222.558 14.619 8.902 632 HG2 LYS 88 HG2 LYS 88 223.351 13.643 6.677 633 HG3 LYS 88 HG3 LYS 88 221.673 13.153 6.438 634 HD2 LYS 88 HD2 LYS 88 222.542 15.983 7.017 635 HD3 LYS 88 HD3 LYS 88 222.272 15.345 5.394 636 HE2 LYS 88 HE2 LYS 88 220.091 14.971 7.365 637 HE3 LYS 88 HE3 LYS 88 220.380 16.616 6.800 638 HZ1 LYS 88 HZ1 LYS 88 219.447 14.272 5.303 639 HZ2 LYS 88 HZ2 LYS 88 220.348 15.443 4.478 640 HZ3 LYS 88 HZ3 LYS 88 218.904 15.874 5.245 641 H ASP 89 H ASP 89 220.535 11.670 9.807 642 HA ASP 89 HA ASP 89 220.926 12.284 12.623 643 HB2 ASP 89 HB2 ASP 89 218.717 12.324 10.908 644 HB3 ASP 89 HB3 ASP 89 218.414 10.965 11.999 645 H TRP 90 H TRP 90 222.539 10.137 11.582 646 HA TRP 90 HA TRP 90 223.172 7.990 12.012 647 HB2 TRP 90 HB2 TRP 90 222.890 9.161 14.354 648 HB3 TRP 90 HB3 TRP 90 221.560 8.022 14.534 649 HD1 TRP 90 HD1 TRP 90 225.382 8.016 13.921 650 HE1 TRP 90 HE1 TRP 90 226.342 5.832 14.883 651 HE3 TRP 90 HE3 TRP 90 221.015 5.733 15.294 652 HZ2 TRP 90 HZ2 TRP 90 225.382 3.455 16.063 653 HZ3 TRP 90 HZ3 TRP 90 221.125 3.506 16.332 654 HH2 TRP 90 HH2 TRP 90 223.265 2.392 16.709 655 H SER 91 H SER 91 220.938 8.142 10.352 656 HA SER 91 HA SER 91 218.998 6.168 11.229 657 HB2 SER 91 HB2 SER 91 219.110 8.245 9.225 658 HB3 SER 91 HB3 SER 91 218.617 6.723 8.488 659 HG SER 91 HG SER 91 217.135 6.676 10.466 660 HA PRO 92 HA PRO 92 220.221 2.398 9.250 661 HB2 PRO 92 HB2 PRO 92 218.510 2.996 6.866 662 HB3 PRO 92 HB3 PRO 92 218.644 1.501 7.814 663 HG2 PRO 92 HG2 PRO 92 216.577 3.142 8.155 664 HG3 PRO 92 HG3 PRO 92 217.327 2.321 9.536 665 HD2 PRO 92 HD2 PRO 92 217.493 5.172 8.706 666 HD3 PRO 92 HD3 PRO 92 217.575 4.456 10.333 667 H GLN 93 H GLN 93 222.288 2.478 8.653 668 HA GLN 93 HA GLN 93 222.942 3.559 5.994 669 HB2 GLN 93 HB2 GLN 93 225.189 4.167 6.986 670 HB3 GLN 93 HB3 GLN 93 223.832 5.140 7.531 671 HG2 GLN 93 HG2 GLN 93 223.718 3.830 9.590 672 HG3 GLN 93 HG3 GLN 93 225.081 2.856 9.041 673 HE21 GLN 93 HE21 GLN 93 224.065 5.895 10.349 674 HE22 GLN 93 HE22 GLN 93 225.653 6.513 10.690 675 H PHE 94 H PHE 94 225.472 2.772 5.640 676 HA PHE 94 HA PHE 94 225.459 -0.133 6.110 677 HB2 PHE 94 HB2 PHE 94 225.181 -0.304 3.874 678 HB3 PHE 94 HB3 PHE 94 225.623 1.373 3.596 679 HD1 PHE 94 HD1 PHE 94 227.254 -1.854 4.556 680 HD2 PHE 94 HD2 PHE 94 227.497 1.771 2.342 681 HE1 PHE 94 HE1 PHE 94 229.404 -2.580 3.610 682 HE2 PHE 94 HE2 PHE 94 229.647 1.051 1.391 683 HZ PHE 94 HZ PHE 94 230.604 -1.128 2.025 684 H THR 95 H THR 95 227.115 -0.785 7.283 685 HA THR 95 HA THR 95 229.671 0.654 7.084 686 HB THR 95 HB THR 95 229.912 0.058 9.585 687 HG1 THR 95 HG1 THR 95 228.017 -0.243 10.688 688 HG21 THR 95 HG21 THR 95 229.325 2.360 8.510 689 HG22 THR 95 HG22 THR 95 229.166 2.116 10.250 690 HG23 THR 95 HG23 THR 95 227.739 2.056 9.216 691 H ALA 96 H ALA 96 231.451 -0.580 6.880 692 HA ALA 96 HA ALA 96 231.178 -3.494 7.249 693 HB1 ALA 96 HB1 ALA 96 232.166 -3.963 5.227 694 HB2 ALA 96 HB2 ALA 96 232.982 -2.402 5.141 695 HB3 ALA 96 HB3 ALA 96 231.251 -2.511 4.821 696 H ASP 97 H ASP 97 232.879 -4.564 8.190 697 HA ASP 97 HA ASP 97 235.222 -2.940 8.935 698 HB2 ASP 97 HB2 ASP 97 233.249 -3.906 10.686 699 HB3 ASP 97 HB3 ASP 97 234.654 -4.955 10.918 700 H GLY 98 H GLY 98 236.817 -3.772 7.733 701 HA2 GLY 98 HA2 GLY 98 238.426 -5.249 7.024 702 HA3 GLY 98 HA3 GLY 98 237.903 -6.308 8.335 703 H LEU 99 H LEU 99 237.897 -5.764 4.952 704 HA LEU 99 HA LEU 99 236.931 -8.380 4.415 705 HB2 LEU 99 HB2 LEU 99 234.903 -7.781 3.160 706 HB3 LEU 99 HB3 LEU 99 234.765 -7.442 4.874 707 HG LEU 99 HG LEU 99 235.569 -5.234 3.023 708 HD11 LEU 99 HD11 LEU 99 233.370 -4.739 2.390 709 HD12 LEU 99 HD12 LEU 99 232.688 -5.906 3.521 710 HD13 LEU 99 HD13 LEU 99 233.551 -6.468 2.089 711 HD21 LEU 99 HD21 LEU 99 235.646 -4.722 5.346 712 HD22 LEU 99 HD22 LEU 99 234.051 -5.424 5.618 713 HD23 LEU 99 HD23 LEU 99 234.216 -3.936 4.684 714 H GLU 100 H GLU 100 237.525 -5.136 3.091 715 HA GLU 100 HA GLU 100 238.475 -4.418 1.165 716 HB2 GLU 100 HB2 GLU 100 239.687 -7.102 0.631 717 HB3 GLU 100 HB3 GLU 100 240.368 -5.503 0.394 718 HG2 GLU 100 HG2 GLU 100 240.652 -5.267 2.778 719 HG3 GLU 100 HG3 GLU 100 239.963 -6.869 3.018 720 H LEU 101 H LEU 101 236.321 -4.357 0.421 721 HA LEU 101 HA LEU 101 234.948 -6.320 -0.963 722 HB2 LEU 101 HB2 LEU 101 233.923 -4.246 -0.222 723 HB3 LEU 101 HB3 LEU 101 234.894 -3.330 -1.374 724 HG LEU 101 HG LEU 101 233.052 -5.462 -2.387 725 HD11 LEU 101 HD11 LEU 101 231.514 -3.250 -2.605 726 HD12 LEU 101 HD12 LEU 101 232.252 -2.986 -1.025 727 HD13 LEU 101 HD13 LEU 101 231.340 -4.464 -1.336 728 HD21 LEU 101 HD21 LEU 101 233.603 -4.594 -4.357 729 HD22 LEU 101 HD22 LEU 101 234.759 -3.551 -3.529 730 HD23 LEU 101 HD23 LEU 101 233.117 -2.982 -3.835 731 H THR 102 H THR 102 234.741 -6.927 -3.067 732 HA THR 102 HA THR 102 236.669 -5.846 -5.003 733 HB THR 102 HB THR 102 235.965 -8.772 -4.953 734 HG1 THR 102 HG1 THR 102 237.664 -9.178 -3.620 735 HG21 THR 102 HG21 THR 102 238.249 -8.976 -5.926 736 HG22 THR 102 HG22 THR 102 238.297 -7.217 -6.033 737 HG23 THR 102 HG23 THR 102 237.084 -8.124 -6.938 738 HA PRO 103 HA PRO 103 233.276 -5.145 -7.753 739 HB2 PRO 103 HB2 PRO 103 235.036 -6.519 -9.747 740 HB3 PRO 103 HB3 PRO 103 234.153 -4.992 -9.890 741 HG2 PRO 103 HG2 PRO 103 236.770 -4.992 -9.435 742 HG3 PRO 103 HG3 PRO 103 235.706 -3.818 -8.626 743 HD2 PRO 103 HD2 PRO 103 237.041 -6.241 -7.530 744 HD3 PRO 103 HD3 PRO 103 236.642 -4.709 -6.730 745 H GLY 104 H GLY 104 231.488 -6.354 -7.596 746 HA2 GLY 104 HA2 GLY 104 230.017 -8.072 -8.114 747 HA3 GLY 104 HA3 GLY 104 231.349 -8.930 -8.895 748 H LYS 105 H LYS 105 231.392 -7.738 -5.574 749 HA LYS 105 HA LYS 105 231.208 -10.510 -4.595 750 HB2 LYS 105 HB2 LYS 105 233.583 -9.424 -4.751 751 HB3 LYS 105 HB3 LYS 105 233.067 -8.531 -3.316 752 HG2 LYS 105 HG2 LYS 105 232.537 -11.366 -3.065 753 HG3 LYS 105 HG3 LYS 105 234.241 -11.039 -3.389 754 HD2 LYS 105 HD2 LYS 105 234.405 -9.602 -1.493 755 HD3 LYS 105 HD3 LYS 105 232.657 -9.615 -1.258 756 HE2 LYS 105 HE2 LYS 105 233.080 -11.217 0.253 757 HE3 LYS 105 HE3 LYS 105 233.235 -12.272 -1.151 758 HZ1 LYS 105 HZ1 LYS 105 235.105 -12.261 0.576 759 HZ2 LYS 105 HZ2 LYS 105 235.570 -10.789 -0.114 760 HZ3 LYS 105 HZ3 LYS 105 235.537 -12.192 -1.059 761 H THR 106 H THR 106 230.239 -10.804 -2.606 762 HA THR 106 HA THR 106 228.454 -8.705 -1.774 763 HB THR 106 HB THR 106 227.569 -10.931 -1.775 764 HG1 THR 106 HG1 THR 106 226.908 -9.577 -0.028 765 HG21 THR 106 HG21 THR 106 229.876 -11.642 0.002 766 HG22 THR 106 HG22 THR 106 229.394 -12.379 -1.526 767 HG23 THR 106 HG23 THR 106 228.406 -12.611 -0.084 768 H ALA 107 H ALA 107 228.523 -7.469 0.020 769 HA ALA 107 HA ALA 107 230.963 -7.634 1.664 770 HB1 ALA 107 HB1 ALA 107 231.054 -5.362 1.752 771 HB2 ALA 107 HB2 ALA 107 229.303 -5.174 1.663 772 HB3 ALA 107 HB3 ALA 107 230.226 -5.539 0.204 773 H SER 108 H SER 108 230.851 -7.501 3.890 774 HA SER 108 HA SER 108 228.378 -8.436 5.060 775 HB2 SER 108 HB2 SER 108 230.877 -7.723 6.598 776 HB3 SER 108 HB3 SER 108 229.634 -8.906 7.007 777 HG SER 108 HG SER 108 231.332 -10.059 6.211 778 H LEU 109 H LEU 109 226.954 -7.297 6.291 779 HA LEU 109 HA LEU 109 227.496 -4.425 6.619 780 HB2 LEU 109 HB2 LEU 109 225.507 -5.053 5.306 781 HB3 LEU 109 HB3 LEU 109 224.879 -5.934 6.685 782 HG LEU 109 HG LEU 109 224.803 -3.776 7.949 783 HD11 LEU 109 HD11 LEU 109 226.471 -2.792 6.107 784 HD12 LEU 109 HD12 LEU 109 225.393 -1.786 7.074 785 HD13 LEU 109 HD13 LEU 109 224.937 -2.242 5.432 786 HD21 LEU 109 HD21 LEU 109 223.140 -3.232 5.587 787 HD22 LEU 109 HD22 LEU 109 222.684 -3.454 7.276 788 HD23 LEU 109 HD23 LEU 109 222.988 -4.857 6.254 789 H LYS 110 H LYS 110 227.302 -3.415 8.586 790 HA LYS 110 HA LYS 110 227.233 -5.205 10.910 791 HB2 LYS 110 HB2 LYS 110 229.268 -3.903 10.692 792 HB3 LYS 110 HB3 LYS 110 228.343 -2.412 10.606 793 HG2 LYS 110 HG2 LYS 110 227.582 -2.741 12.899 794 HG3 LYS 110 HG3 LYS 110 228.494 -4.249 12.986 795 HD2 LYS 110 HD2 LYS 110 230.495 -3.189 13.162 796 HD3 LYS 110 HD3 LYS 110 229.988 -1.833 12.155 797 HE2 LYS 110 HE2 LYS 110 228.666 -2.129 14.790 798 HE3 LYS 110 HE3 LYS 110 230.356 -1.626 14.792 799 HZ1 LYS 110 HZ1 LYS 110 228.052 -0.260 13.528 800 HZ2 LYS 110 HZ2 LYS 110 229.654 0.126 13.139 801 HZ3 LYS 110 HZ3 LYS 110 229.093 0.336 14.722 802 H ARG 111 H ARG 111 226.378 -1.755 10.446 803 HA ARG 111 HA ARG 111 223.637 -1.997 10.914 804 HB2 ARG 111 HB2 ARG 111 224.496 -2.775 13.176 805 HB3 ARG 111 HB3 ARG 111 225.095 -1.142 13.422 806 HG2 ARG 111 HG2 ARG 111 223.069 -1.099 14.513 807 HG3 ARG 111 HG3 ARG 111 222.652 -0.433 12.933 808 HD2 ARG 111 HD2 ARG 111 220.969 -1.966 13.191 809 HD3 ARG 111 HD3 ARG 111 222.173 -2.951 12.360 810 HE ARG 111 HE ARG 111 222.380 -3.087 15.220 811 HH11 ARG 111 HH11 ARG 111 220.730 -4.404 12.424 812 HH12 ARG 111 HH12 ARG 111 220.345 -5.901 13.202 813 HH21 ARG 111 HH21 ARG 111 221.864 -5.067 16.240 814 HH22 ARG 111 HH22 ARG 111 220.985 -6.276 15.365 815 H GLY 112 H GLY 112 226.111 0.184 12.297 816 HA2 GLY 112 HA2 GLY 112 226.252 2.195 10.530 817 HA3 GLY 112 HA3 GLY 112 224.681 2.493 11.273 818 H GLY 113 H GLY 113 227.215 4.055 11.306 819 HA2 GLY 113 HA2 GLY 113 227.613 5.620 13.125 820 HA3 GLY 113 HA3 GLY 113 227.470 4.258 14.244 821 H TYR 114 H TYR 114 229.073 2.463 12.595 822 HA TYR 114 HA TYR 114 231.692 3.726 12.488 823 HB2 TYR 114 HB2 TYR 114 231.451 2.947 14.830 824 HB3 TYR 114 HB3 TYR 114 231.151 1.316 14.242 825 HD1 TYR 114 HD1 TYR 114 232.973 -0.009 13.267 826 HD2 TYR 114 HD2 TYR 114 233.679 3.876 14.853 827 HE1 TYR 114 HE1 TYR 114 235.388 -0.469 13.300 828 HE2 TYR 114 HE2 TYR 114 236.096 3.426 14.889 829 HH TYR 114 HH TYR 114 237.416 0.416 14.650 830 H GLY 115 H GLY 115 231.889 3.303 10.325 831 HA2 GLY 115 HA2 GLY 115 231.943 0.447 9.573 832 HA3 GLY 115 HA3 GLY 115 231.254 1.673 8.519 833 H GLN 116 H GLN 116 234.091 0.065 9.522 834 HA GLN 116 HA GLN 116 236.132 1.803 8.863 835 HB2 GLN 116 HB2 GLN 116 235.817 -1.094 9.079 836 HB3 GLN 116 HB3 GLN 116 237.043 -0.631 7.907 837 HG2 GLN 116 HG2 GLN 116 237.753 0.972 9.926 838 HG3 GLN 116 HG3 GLN 116 237.014 -0.339 10.844 839 HE21 GLN 116 HE21 GLN 116 239.215 0.069 8.074 840 HE22 GLN 116 HE22 GLN 116 240.331 -1.151 8.572 841 H ASP 117 H ASP 117 237.229 2.359 7.006 842 HA ASP 117 HA ASP 117 235.687 2.587 4.660 843 HB2 ASP 117 HB2 ASP 117 238.691 2.851 4.745 844 HB3 ASP 117 HB3 ASP 117 237.567 3.642 3.651 845 H THR 118 H THR 118 235.291 1.184 3.112 846 HA THR 118 HA THR 118 236.875 -1.270 2.923 847 HB THR 118 HB THR 118 234.259 -0.472 1.617 848 HG1 THR 118 HG1 THR 118 233.308 -1.484 3.228 849 HG21 THR 118 HG21 THR 118 235.895 -2.392 0.656 850 HG22 THR 118 HG22 THR 118 234.137 -2.420 0.534 851 HG23 THR 118 HG23 THR 118 234.946 -3.310 1.823 852 H ALA 119 H ALA 119 238.555 -1.249 1.582 853 HA ALA 119 HA ALA 119 238.656 0.634 -0.627 854 HB1 ALA 119 HB1 ALA 119 240.908 0.431 -0.560 855 HB2 ALA 119 HB2 ALA 119 240.856 -1.301 -0.227 856 HB3 ALA 119 HB3 ALA 119 240.561 -0.144 1.072 857 H VAL 120 H VAL 120 238.602 0.168 -2.747 858 HA VAL 120 HA VAL 120 238.274 -2.653 -3.539 859 HB VAL 120 HB VAL 120 236.852 -0.337 -4.859 860 HG11 VAL 120 HG11 VAL 120 237.244 -2.382 -6.212 861 HG12 VAL 120 HG12 VAL 120 235.536 -2.031 -5.949 862 HG13 VAL 120 HG13 VAL 120 236.327 -3.304 -5.020 863 HG21 VAL 120 HG21 VAL 120 235.896 -0.394 -2.711 864 HG22 VAL 120 HG22 VAL 120 235.928 -2.157 -2.651 865 HG23 VAL 120 HG23 VAL 120 234.798 -1.331 -3.725 866 H THR 121 H THR 121 239.492 -3.324 -5.235 867 HA THR 121 HA THR 121 241.343 -1.397 -6.397 868 HB THR 121 HB THR 121 241.220 -4.395 -6.264 869 HG1 THR 121 HG1 THR 121 242.212 -3.539 -4.523 870 HG21 THR 121 HG21 THR 121 243.485 -4.335 -7.416 871 HG22 THR 121 HG22 THR 121 243.010 -2.749 -8.023 872 HG23 THR 121 HG23 THR 121 242.060 -4.175 -8.440 873 H LEU 122 H LEU 122 240.133 -0.285 -7.901 874 HA LEU 122 HA LEU 122 239.314 -1.835 -10.265 875 HB2 LEU 122 HB2 LEU 122 237.511 -0.650 -8.587 876 HB3 LEU 122 HB3 LEU 122 237.781 0.628 -9.754 877 HG LEU 122 HG LEU 122 235.831 -0.817 -10.286 878 HD11 LEU 122 HD11 LEU 122 236.272 -0.986 -12.619 879 HD12 LEU 122 HD12 LEU 122 238.012 -1.065 -12.346 880 HD13 LEU 122 HD13 LEU 122 237.134 0.428 -12.017 881 HD21 LEU 122 HD21 LEU 122 235.954 -3.053 -10.611 882 HD22 LEU 122 HD22 LEU 122 237.308 -2.896 -9.490 883 HD23 LEU 122 HD23 LEU 122 237.605 -2.986 -11.227 884 HA PRO 123 HA PRO 123 242.182 1.299 -11.853 885 HB2 PRO 123 HB2 PRO 123 242.820 0.020 -14.132 886 HB3 PRO 123 HB3 PRO 123 243.473 -0.476 -12.558 887 HG2 PRO 123 HG2 PRO 123 241.205 -1.651 -14.126 888 HG3 PRO 123 HG3 PRO 123 242.510 -2.476 -13.256 889 HD2 PRO 123 HD2 PRO 123 239.993 -2.140 -12.241 890 HD3 PRO 123 HD3 PRO 123 241.447 -2.292 -11.235 891 H GLU 124 H GLU 124 239.066 0.747 -12.647 892 HA GLU 124 HA GLU 124 239.143 2.553 -14.973 893 HB2 GLU 124 HB2 GLU 124 238.280 0.021 -15.123 894 HB3 GLU 124 HB3 GLU 124 236.795 0.783 -14.579 895 HG2 GLU 124 HG2 GLU 124 236.627 2.109 -16.496 896 HG3 GLU 124 HG3 GLU 124 238.315 1.818 -16.948 897 H ALA 125 H ALA 125 238.369 4.497 -14.485 898 HA ALA 125 HA ALA 125 236.747 4.937 -12.142 899 HB1 ALA 125 HB1 ALA 125 236.770 7.350 -13.282 900 HB2 ALA 125 HB2 ALA 125 238.157 6.639 -14.107 901 HB3 ALA 125 HB3 ALA 125 238.127 6.722 -12.346 902 H GLY 126 H GLY 126 234.614 5.524 -12.033 903 HA2 GLY 126 HA2 GLY 126 232.976 6.429 -14.075 904 HA3 GLY 126 HA3 GLY 126 232.918 4.669 -14.159 905 H GLN 127 H GLN 127 230.600 5.100 -13.732 906 HA GLN 127 HA GLN 127 230.002 5.767 -10.952 907 HB2 GLN 127 HB2 GLN 127 227.671 5.884 -11.631 908 HB3 GLN 127 HB3 GLN 127 228.664 6.871 -12.692 909 HG2 GLN 127 HG2 GLN 127 228.656 4.692 -14.176 910 HG3 GLN 127 HG3 GLN 127 227.178 4.356 -13.261 911 HE21 GLN 127 HE21 GLN 127 225.616 4.713 -14.723 912 HE22 GLN 127 HE22 GLN 127 225.388 6.190 -15.589 913 H TYR 128 H TYR 128 229.749 4.245 -9.478 914 HA TYR 128 HA TYR 128 229.242 1.486 -10.363 915 HB2 TYR 128 HB2 TYR 128 230.172 2.181 -7.597 916 HB3 TYR 128 HB3 TYR 128 230.424 0.701 -8.512 917 HD1 TYR 128 HD1 TYR 128 231.446 2.036 -11.073 918 HD2 TYR 128 HD2 TYR 128 232.418 2.608 -6.970 919 HE1 TYR 128 HE1 TYR 128 233.687 2.816 -11.718 920 HE2 TYR 128 HE2 TYR 128 234.660 3.392 -7.605 921 HH TYR 128 HH TYR 128 235.951 2.993 -10.703 922 H VAL 129 H VAL 129 227.778 0.161 -9.125 923 HA VAL 129 HA VAL 129 225.667 1.764 -7.846 924 HB VAL 129 HB VAL 129 224.094 -0.034 -8.428 925 HG11 VAL 129 HG11 VAL 129 225.299 0.535 -11.051 926 HG12 VAL 129 HG12 VAL 129 225.000 1.938 -10.026 927 HG13 VAL 129 HG13 VAL 129 223.674 0.858 -10.451 928 HG21 VAL 129 HG21 VAL 129 224.810 -2.064 -8.976 929 HG22 VAL 129 HG22 VAL 129 226.479 -1.496 -8.988 930 HG23 VAL 129 HG23 VAL 129 225.506 -1.408 -10.455 931 H TRP 130 H TRP 130 225.428 1.551 -5.740 932 HA TRP 130 HA TRP 130 226.516 -0.824 -4.401 933 HB2 TRP 130 HB2 TRP 130 226.390 2.004 -3.742 934 HB3 TRP 130 HB3 TRP 130 225.728 1.014 -2.445 935 HD1 TRP 130 HD1 TRP 130 227.533 0.627 -0.688 936 HE1 TRP 130 HE1 TRP 130 230.054 0.111 -0.703 937 HE3 TRP 130 HE3 TRP 130 228.363 0.747 -5.734 938 HZ2 TRP 130 HZ2 TRP 130 232.121 -0.201 -2.599 939 HZ3 TRP 130 HZ3 TRP 130 230.640 0.328 -6.564 940 HH2 TRP 130 HH2 TRP 130 232.479 -0.135 -5.027 941 H SER 131 H SER 131 225.075 -2.386 -4.057 942 HA SER 131 HA SER 131 222.352 -1.622 -3.219 943 HB2 SER 131 HB2 SER 131 221.527 -3.660 -4.352 944 HB3 SER 131 HB3 SER 131 222.300 -2.551 -5.481 945 HG SER 131 HG SER 131 222.913 -4.801 -5.709 946 H LEU 132 H LEU 132 221.581 -2.534 -1.379 947 HA LEU 132 HA LEU 132 222.981 -4.875 -0.303 948 HB2 LEU 132 HB2 LEU 132 222.371 -3.487 1.992 949 HB3 LEU 132 HB3 LEU 132 223.960 -3.677 1.293 950 HG LEU 132 HG LEU 132 223.496 -1.364 1.948 951 HD11 LEU 132 HD11 LEU 132 223.540 -0.945 -0.926 952 HD12 LEU 132 HD12 LEU 132 224.646 -2.211 -0.395 953 HD13 LEU 132 HD13 LEU 132 224.761 -0.593 0.295 954 HD21 LEU 132 HD21 LEU 132 221.842 -0.304 0.057 955 HD22 LEU 132 HD22 LEU 132 221.392 -0.672 1.721 956 HD23 LEU 132 HD23 LEU 132 221.043 -1.829 0.439 957 H LYS 133 H LYS 133 221.708 -6.366 0.678 958 HA LYS 133 HA LYS 133 218.872 -5.658 1.052 959 HB2 LYS 133 HB2 LYS 133 219.003 -7.016 -0.931 960 HB3 LYS 133 HB3 LYS 133 220.033 -8.196 -0.116 961 HG2 LYS 133 HG2 LYS 133 217.745 -9.008 -0.375 962 HG3 LYS 133 HG3 LYS 133 218.185 -8.842 1.325 963 HD2 LYS 133 HD2 LYS 133 217.085 -6.491 1.104 964 HD3 LYS 133 HD3 LYS 133 216.310 -7.185 -0.321 965 HE2 LYS 133 HE2 LYS 133 216.228 -8.502 2.385 966 HE3 LYS 133 HE3 LYS 133 215.023 -7.327 1.862 967 HZ1 LYS 133 HZ1 LYS 133 214.757 -9.930 1.479 968 HZ2 LYS 133 HZ2 LYS 133 215.552 -9.539 0.038 969 HZ3 LYS 133 HZ3 LYS 133 214.090 -8.782 0.430 970 H PHE 134 H PHE 134 218.253 -5.848 3.065 971 HA PHE 134 HA PHE 134 219.206 -8.066 4.697 972 HB2 PHE 134 HB2 PHE 134 219.893 -6.745 6.535 973 HB3 PHE 134 HB3 PHE 134 220.666 -6.029 5.129 974 HD1 PHE 134 HD1 PHE 134 219.174 -5.238 8.087 975 HD2 PHE 134 HD2 PHE 134 218.971 -4.186 3.969 976 HE1 PHE 134 HE1 PHE 134 218.230 -3.049 8.696 977 HE2 PHE 134 HE2 PHE 134 218.025 -2.002 4.570 978 HZ PHE 134 HZ PHE 134 217.656 -1.427 6.938 979 H THR 135 H THR 135 217.867 -8.566 6.452 980 HA THR 135 HA THR 135 215.095 -8.142 5.912 981 HB THR 135 HB THR 135 214.663 -9.692 7.634 982 HG1 THR 135 HG1 THR 135 215.746 -8.767 9.334 983 HG21 THR 135 HG21 THR 135 217.431 -10.615 7.041 984 HG22 THR 135 HG22 THR 135 216.247 -10.516 5.735 985 HG23 THR 135 HG23 THR 135 215.926 -11.535 7.138 986 H ASP 136 H ASP 136 213.517 -7.285 7.418 987 HA ASP 136 HA ASP 136 214.513 -4.884 8.748 988 HB2 ASP 136 HB2 ASP 136 212.458 -5.110 7.080 989 HB3 ASP 136 HB3 ASP 136 211.598 -5.489 8.570 990 H SER 137 H SER 137 213.594 -8.043 9.595 991 HA SER 137 HA SER 137 212.628 -7.301 12.241 992 HB2 SER 137 HB2 SER 137 211.511 -9.104 10.929 993 HB3 SER 137 HB3 SER 137 212.981 -10.067 11.065 994 HG SER 137 HG SER 137 212.701 -10.116 13.293 995 H GLY 138 H GLY 138 215.609 -7.163 11.216 996 HA2 GLY 138 HA2 GLY 138 217.519 -7.082 12.583 997 HA3 GLY 138 HA3 GLY 138 216.692 -8.116 13.753 998 H ASP 139 H ASP 139 216.134 -9.745 11.031 999 HA ASP 139 HA ASP 139 217.973 -11.799 11.536 1000 HB2 ASP 139 HB2 ASP 139 215.804 -11.269 9.672 1001 HB3 ASP 139 HB3 ASP 139 217.116 -12.131 8.885 1002 HA PRO 140 HA PRO 140 221.695 -11.529 9.124 1003 HB2 PRO 140 HB2 PRO 140 220.330 -12.716 6.730 1004 HB3 PRO 140 HB3 PRO 140 221.930 -13.068 7.398 1005 HG2 PRO 140 HG2 PRO 140 219.892 -14.688 7.904 1006 HG3 PRO 140 HG3 PRO 140 221.068 -14.297 9.172 1007 HD2 PRO 140 HD2 PRO 140 218.267 -13.381 8.844 1008 HD3 PRO 140 HD3 PRO 140 219.218 -13.597 10.325 1009 H GLU 141 H GLU 141 222.778 -10.235 7.632 1010 HA GLU 141 HA GLU 141 221.215 -8.458 5.919 1011 HB2 GLU 141 HB2 GLU 141 223.180 -6.805 7.013 1012 HB3 GLU 141 HB3 GLU 141 221.461 -6.758 7.378 1013 HG2 GLU 141 HG2 GLU 141 221.729 -8.089 9.302 1014 HG3 GLU 141 HG3 GLU 141 223.372 -8.541 8.857 1015 H GLN 142 H GLN 142 222.082 -8.676 3.952 1016 HA GLN 142 HA GLN 142 225.010 -8.954 3.728 1017 HB2 GLN 142 HB2 GLN 142 223.119 -10.826 2.966 1018 HB3 GLN 142 HB3 GLN 142 223.507 -10.009 1.459 1019 HG2 GLN 142 HG2 GLN 142 225.488 -10.993 1.309 1020 HG3 GLN 142 HG3 GLN 142 225.876 -10.675 3.005 1021 HE21 GLN 142 HE21 GLN 142 224.040 -12.824 0.878 1022 HE22 GLN 142 HE22 GLN 142 224.138 -14.211 1.904 1023 H ILE 143 H ILE 143 226.017 -8.068 1.858 1024 HA ILE 143 HA ILE 143 224.455 -5.951 0.516 1025 HB ILE 143 HB ILE 143 227.388 -5.741 1.198 1026 HG12 ILE 143 HG12 ILE 143 225.246 -4.229 2.660 1027 HG13 ILE 143 HG13 ILE 143 225.691 -5.850 3.182 1028 HG21 ILE 143 HG21 ILE 143 227.069 -4.222 -0.479 1029 HG22 ILE 143 HG22 ILE 143 226.652 -3.229 0.918 1030 HG23 ILE 143 HG23 ILE 143 225.376 -3.950 -0.063 1031 HD11 ILE 143 HD11 ILE 143 226.826 -3.863 4.308 1032 HD12 ILE 143 HD12 ILE 143 227.754 -3.719 2.816 1033 HD13 ILE 143 HD13 ILE 143 227.840 -5.199 3.768 1034 H MET 144 H MET 144 225.189 -5.363 -1.629 1035 HA MET 144 HA MET 144 226.898 -7.350 -2.956 1036 HB2 MET 144 HB2 MET 144 224.151 -7.347 -3.210 1037 HB3 MET 144 HB3 MET 144 224.671 -6.419 -4.609 1038 HG2 MET 144 HG2 MET 144 226.257 -8.814 -4.245 1039 HG3 MET 144 HG3 MET 144 224.537 -9.169 -4.402 1040 HE1 MET 144 HE1 MET 144 227.241 -9.692 -5.940 1041 HE2 MET 144 HE2 MET 144 227.770 -8.260 -6.822 1042 HE3 MET 144 HE3 MET 144 226.929 -9.557 -7.671 1043 H VAL 145 H VAL 145 228.332 -6.507 -4.365 1044 HA VAL 145 HA VAL 145 227.946 -3.711 -5.206 1045 HB VAL 145 HB VAL 145 229.666 -3.822 -3.455 1046 HG11 VAL 145 HG11 VAL 145 231.811 -5.003 -4.911 1047 HG12 VAL 145 HG12 VAL 145 230.481 -6.154 -4.818 1048 HG13 VAL 145 HG13 VAL 145 231.150 -5.463 -3.343 1049 HG21 VAL 145 HG21 VAL 145 229.759 -2.189 -5.359 1050 HG22 VAL 145 HG22 VAL 145 230.952 -3.246 -6.114 1051 HG23 VAL 145 HG23 VAL 145 231.298 -2.498 -4.556 1052 H SER 146 H SER 146 228.089 -3.346 -7.323 1053 HA SER 146 HA SER 146 229.614 -5.170 -9.021 1054 HB2 SER 146 HB2 SER 146 227.755 -5.464 -10.587 1055 HB3 SER 146 HB3 SER 146 227.314 -6.067 -8.991 1056 HG SER 146 HG SER 146 226.489 -3.686 -10.266 1057 H LYS 147 H LYS 147 230.378 -4.249 -10.920 1058 HA LYS 147 HA LYS 147 229.889 -1.355 -11.200 1059 HB2 LYS 147 HB2 LYS 147 232.192 -2.016 -10.428 1060 HB3 LYS 147 HB3 LYS 147 232.411 -2.822 -11.986 1061 HG2 LYS 147 HG2 LYS 147 231.758 -0.482 -12.952 1062 HG3 LYS 147 HG3 LYS 147 232.252 0.088 -11.357 1063 HD2 LYS 147 HD2 LYS 147 234.251 0.223 -12.464 1064 HD3 LYS 147 HD3 LYS 147 234.356 -1.423 -11.840 1065 HE2 LYS 147 HE2 LYS 147 234.941 -1.753 -14.037 1066 HE3 LYS 147 HE3 LYS 147 233.204 -2.043 -14.106 1067 HZ1 LYS 147 HZ1 LYS 147 234.771 0.090 -15.281 1068 HZ2 LYS 147 HZ2 LYS 147 233.324 0.596 -14.560 1069 HZ3 LYS 147 HZ3 LYS 147 233.298 -0.575 -15.778 1070 H CYS 148 H CYS 148 228.468 -1.165 -12.838 1071 HA CYS 148 HA CYS 148 229.040 -2.629 -15.332 1072 HB2 CYS 148 HB2 CYS 148 226.570 -2.221 -13.848 1073 HB3 CYS 148 HB3 CYS 148 226.422 -1.692 -15.518 1074 HA PRO 149 HA PRO 149 229.802 1.309 -17.183 1075 HB2 PRO 149 HB2 PRO 149 229.518 0.645 -19.799 1076 HB3 PRO 149 HB3 PRO 149 230.917 0.155 -18.830 1077 HG2 PRO 149 HG2 PRO 149 228.483 -1.417 -19.580 1078 HG3 PRO 149 HG3 PRO 149 230.180 -1.928 -19.541 1079 HD2 PRO 149 HD2 PRO 149 228.401 -2.521 -17.570 1080 HD3 PRO 149 HD3 PRO 149 230.140 -2.320 -17.278
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