NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
19209 | 2eec | 10162 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 H GLY 1 -35.121 46.954 -22.574 2 HA2 GLY 1 1HA GLY 1 -35.588 45.026 -20.549 3 HA3 GLY 1 2HA GLY 1 -35.019 44.232 -22.010 4 H SER 2 H SER 2 -33.632 44.219 -19.557 5 HA SER 2 HA SER 2 -31.062 45.063 -20.438 6 HB2 SER 2 1HB SER 2 -30.643 46.624 -18.494 7 HB3 SER 2 2HB SER 2 -31.722 47.257 -19.737 8 HG SER 2 HG SER 2 -32.842 45.877 -17.578 9 H SER 3 H SER 3 -29.383 44.675 -18.701 10 HA SER 3 HA SER 3 -30.197 42.889 -16.564 11 HB2 SER 3 1HB SER 3 -29.016 40.974 -17.287 12 HB3 SER 3 2HB SER 3 -29.896 41.516 -18.715 13 HG SER 3 HG SER 3 -27.820 41.139 -19.361 14 H GLY 4 H GLY 4 -28.202 42.123 -15.319 15 HA2 GLY 4 1HA GLY 4 -26.350 44.407 -15.137 16 HA3 GLY 4 2HA GLY 4 -26.758 43.325 -13.813 17 H SER 5 H SER 5 -24.183 43.732 -14.074 18 HA SER 5 HA SER 5 -23.148 41.420 -15.579 19 HB2 SER 5 1HB SER 5 -21.824 44.035 -14.844 20 HB3 SER 5 2HB SER 5 -20.930 42.643 -15.455 21 HG SER 5 HG SER 5 -23.157 43.667 -16.848 22 H SER 6 H SER 6 -21.228 40.369 -14.603 23 HA SER 6 HA SER 6 -20.773 40.690 -11.784 24 HB2 SER 6 1HB SER 6 -21.676 38.661 -10.988 25 HB3 SER 6 2HB SER 6 -22.941 39.321 -12.025 26 HG SER 6 HG SER 6 -21.756 37.953 -13.703 27 H GLY 7 H GLY 7 -18.668 40.376 -11.543 28 HA2 GLY 7 1HA GLY 7 -17.380 38.234 -13.112 29 HA3 GLY 7 2HA GLY 7 -16.658 39.833 -13.010 30 H PHE 8 H PHE 8 -14.840 38.417 -12.225 31 HA PHE 8 HA PHE 8 -14.882 38.429 -9.311 32 HB2 PHE 8 1HB PHE 8 -13.829 36.000 -10.747 33 HB3 PHE 8 2HB PHE 8 -14.175 36.192 -9.032 34 HD1 PHE 8 2HD PHE 8 -16.525 36.257 -8.250 35 HD2 PHE 8 1HD PHE 8 -15.504 35.335 -12.278 36 HE1 PHE 8 2HE PHE 8 -18.762 35.293 -8.593 37 HE2 PHE 8 1HE PHE 8 -17.740 34.370 -12.627 38 HZ PHE 8 HZ PHE 8 -19.372 34.347 -10.783 39 H LYS 9 H LYS 9 -13.177 39.562 -8.695 40 HA LYS 9 HA LYS 9 -10.692 39.339 -10.264 41 HB2 LYS 9 1HB LYS 9 -11.736 41.787 -8.829 42 HB3 LYS 9 2HB LYS 9 -10.210 41.680 -9.697 43 HG2 LYS 9 1HG LYS 9 -12.864 41.210 -11.023 44 HG3 LYS 9 2HG LYS 9 -12.119 42.806 -10.904 45 HD2 LYS 9 1HD LYS 9 -10.085 41.822 -12.009 46 HD3 LYS 9 2HD LYS 9 -11.036 40.365 -12.303 47 HE2 LYS 9 1HE LYS 9 -11.267 41.560 -14.283 48 HE3 LYS 9 2HE LYS 9 -12.737 41.963 -13.397 49 HZ1 LYS 9 3HZ LYS 9 -12.100 44.094 -13.134 50 HZ2 LYS 9 1HZ LYS 9 -11.166 43.783 -14.509 51 HZ3 LYS 9 2HZ LYS 9 -10.458 43.720 -12.975 52 H VAL 10 H VAL 10 -9.603 37.898 -9.004 53 HA VAL 10 HA VAL 10 -8.951 38.798 -6.281 54 HB VAL 10 HB VAL 10 -10.563 36.957 -6.101 55 HG11 VAL 10 1HG1 VAL 10 -10.255 34.841 -7.026 56 HG12 VAL 10 2HG1 VAL 10 -9.762 35.932 -8.323 57 HG13 VAL 10 3HG1 VAL 10 -8.543 35.121 -7.339 58 HG21 VAL 10 3HG2 VAL 10 -8.982 35.350 -4.826 59 HG22 VAL 10 1HG2 VAL 10 -7.732 36.530 -5.225 60 HG23 VAL 10 2HG2 VAL 10 -9.134 37.017 -4.272 61 H ARG 11 H ARG 11 -6.850 38.513 -5.641 62 HA ARG 11 HA ARG 11 -4.970 37.815 -7.762 63 HB2 ARG 11 1HB ARG 11 -4.654 39.218 -5.111 64 HB3 ARG 11 2HB ARG 11 -3.280 38.747 -6.101 65 HG2 ARG 11 1HG ARG 11 -4.021 40.169 -7.895 66 HG3 ARG 11 2HG ARG 11 -5.502 40.558 -7.018 67 HD2 ARG 11 1HD ARG 11 -2.881 41.083 -5.706 68 HD3 ARG 11 2HD ARG 11 -3.418 42.173 -6.984 69 HE ARG 11 HE ARG 11 -5.373 41.664 -4.921 70 HH11 ARG 11 1HH1 ARG 11 -2.753 43.686 -6.000 71 HH12 ARG 11 2HH1 ARG 11 -3.235 45.046 -5.041 72 HH21 ARG 11 1HH2 ARG 11 -6.018 43.448 -3.653 73 HH22 ARG 11 2HH2 ARG 11 -5.091 44.910 -3.706 74 H VAL 12 H VAL 12 -3.254 36.345 -7.455 75 HA VAL 12 HA VAL 12 -3.955 34.000 -6.014 76 HB VAL 12 HB VAL 12 -1.363 34.750 -7.372 77 HG11 VAL 12 1HG1 VAL 12 -0.476 32.977 -6.364 78 HG12 VAL 12 2HG1 VAL 12 -2.031 32.520 -5.663 79 HG13 VAL 12 3HG1 VAL 12 -1.599 31.976 -7.285 80 HG21 VAL 12 3HG2 VAL 12 -3.606 32.959 -8.300 81 HG22 VAL 12 1HG2 VAL 12 -3.344 34.616 -8.843 82 HG23 VAL 12 2HG2 VAL 12 -2.146 33.371 -9.198 83 H GLY 13 H GLY 13 -4.052 34.319 -3.825 84 HA2 GLY 13 1HA GLY 13 -1.786 35.544 -2.454 85 HA3 GLY 13 2HA GLY 13 -3.312 35.069 -1.724 86 H GLU 14 H GLU 14 -1.872 32.732 -3.760 87 HA GLU 14 HA GLU 14 -0.749 31.336 -1.423 88 HB2 GLU 14 1HB GLU 14 -2.458 30.206 -3.640 89 HB3 GLU 14 2HB GLU 14 -1.517 29.203 -2.544 90 HG2 GLU 14 1HG GLU 14 -2.764 30.166 -0.646 91 HG3 GLU 14 2HG GLU 14 -3.752 31.073 -1.790 92 HA PRO 15 HA PRO 15 2.922 30.738 -3.751 93 HB2 PRO 15 1HB PRO 15 3.758 28.330 -2.817 94 HB3 PRO 15 2HB PRO 15 3.832 29.812 -1.856 95 HG2 PRO 15 1HG PRO 15 1.800 27.614 -1.795 96 HG3 PRO 15 2HG PRO 15 2.558 28.475 -0.443 97 HD2 PRO 15 1HD PRO 15 0.069 29.063 -1.332 98 HD3 PRO 15 2HD PRO 15 1.152 30.291 -0.647 99 H GLY 16 H GLY 16 0.308 28.503 -3.998 100 HA2 GLY 16 1HA GLY 16 -0.419 27.522 -6.007 101 HA3 GLY 16 2HA GLY 16 1.176 27.796 -6.692 102 H GLN 17 H GLN 17 2.954 26.438 -5.758 103 HA GLN 17 HA GLN 17 1.931 23.738 -5.170 104 HB2 GLN 17 1HB GLN 17 3.125 24.205 -7.412 105 HB3 GLN 17 2HB GLN 17 4.595 24.284 -6.451 106 HG2 GLN 17 1HG GLN 17 3.757 21.972 -5.549 107 HG3 GLN 17 2HG GLN 17 2.847 21.957 -7.059 108 HE21 GLN 17 1HE2 GLN 17 4.747 20.060 -6.558 109 HE22 GLN 17 2HE2 GLN 17 6.100 20.295 -7.605 110 H ALA 18 H ALA 18 2.850 22.567 -3.536 111 HA ALA 18 HA ALA 18 5.267 23.393 -2.228 112 HB1 ALA 18 3HB ALA 18 3.810 25.033 -1.241 113 HB2 ALA 18 1HB ALA 18 2.638 23.788 -0.808 114 HB3 ALA 18 2HB ALA 18 4.218 23.823 -0.025 115 H GLY 19 H GLY 19 6.222 21.662 -1.345 116 HA2 GLY 19 1HA GLY 19 5.518 19.087 -1.681 117 HA3 GLY 19 2HA GLY 19 6.446 19.612 -0.284 118 H ASN 20 H ASN 20 3.413 18.468 -1.430 119 HA ASN 20 HA ASN 20 2.417 18.423 1.341 120 HB2 ASN 20 1HB ASN 20 1.186 20.082 -0.051 121 HB3 ASN 20 2HB ASN 20 0.715 18.777 -1.136 122 HD21 ASN 20 1HD2 ASN 20 -1.266 20.177 -0.113 123 HD22 ASN 20 2HD2 ASN 20 -2.092 19.309 1.132 124 HA PRO 21 HA PRO 21 2.606 14.056 0.202 125 HB2 PRO 21 1HB PRO 21 2.423 13.162 2.759 126 HB3 PRO 21 2HB PRO 21 3.935 13.741 2.050 127 HG2 PRO 21 1HG PRO 21 2.013 15.175 3.841 128 HG3 PRO 21 2HG PRO 21 3.785 15.153 3.891 129 HD2 PRO 21 1HD PRO 21 2.384 17.205 2.816 130 HD3 PRO 21 2HD PRO 21 3.978 16.715 2.208 131 H ALA 22 H ALA 22 0.261 15.739 2.199 132 HA ALA 22 HA ALA 22 -1.636 13.672 2.439 133 HB1 ALA 22 3HB ALA 22 -3.219 15.784 2.615 134 HB2 ALA 22 1HB ALA 22 -2.095 15.355 3.905 135 HB3 ALA 22 2HB ALA 22 -1.675 16.624 2.753 136 H LEU 23 H LEU 23 -1.234 16.238 0.027 137 HA LEU 23 HA LEU 23 -3.540 15.902 -1.447 138 HB2 LEU 23 1HB LEU 23 -0.771 16.770 -2.110 139 HB3 LEU 23 2HB LEU 23 -1.901 16.484 -3.432 140 HG LEU 23 HG LEU 23 -2.494 18.367 -1.159 141 HD11 LEU 23 1HD1 LEU 23 -1.754 19.514 -3.752 142 HD12 LEU 23 2HD1 LEU 23 -0.426 18.749 -2.880 143 HD13 LEU 23 3HD1 LEU 23 -1.353 20.041 -2.117 144 HD21 LEU 23 3HD2 LEU 23 -4.330 17.414 -2.641 145 HD22 LEU 23 1HD2 LEU 23 -3.608 18.351 -3.950 146 HD23 LEU 23 2HD2 LEU 23 -4.234 19.171 -2.519 147 H VAL 24 H VAL 24 -0.650 13.927 -1.395 148 HA VAL 24 HA VAL 24 -0.975 12.447 -3.720 149 HB VAL 24 HB VAL 24 0.077 11.486 -1.056 150 HG11 VAL 24 1HG1 VAL 24 -0.481 9.615 -2.498 151 HG12 VAL 24 2HG1 VAL 24 0.429 10.340 -3.825 152 HG13 VAL 24 3HG1 VAL 24 1.270 9.789 -2.375 153 HG21 VAL 24 3HG2 VAL 24 1.554 12.584 -3.447 154 HG22 VAL 24 1HG2 VAL 24 1.230 13.470 -1.956 155 HG23 VAL 24 2HG2 VAL 24 2.268 12.044 -1.927 156 H SER 25 H SER 25 -2.413 10.994 -4.390 157 HA SER 25 HA SER 25 -4.154 9.716 -2.386 158 HB2 SER 25 1HB SER 25 -5.043 10.519 -5.160 159 HB3 SER 25 2HB SER 25 -6.049 9.946 -3.830 160 HG SER 25 HG SER 25 -4.777 12.438 -4.152 161 H ALA 26 H ALA 26 -4.948 7.621 -2.922 162 HA ALA 26 HA ALA 26 -3.628 6.276 -5.167 163 HB1 ALA 26 3HB ALA 26 -2.753 4.528 -3.863 164 HB2 ALA 26 1HB ALA 26 -2.319 6.005 -3.002 165 HB3 ALA 26 2HB ALA 26 -3.669 5.020 -2.438 166 H TYR 27 H TYR 27 -4.903 4.854 -6.202 167 HA TYR 27 HA TYR 27 -7.121 3.561 -4.888 168 HB2 TYR 27 1HB TYR 27 -8.824 4.455 -6.459 169 HB3 TYR 27 2HB TYR 27 -8.165 5.690 -5.392 170 HD1 TYR 27 2HD TYR 27 -8.224 4.422 -8.846 171 HD2 TYR 27 1HD TYR 27 -6.881 7.524 -6.262 172 HE1 TYR 27 2HE TYR 27 -7.656 5.798 -10.803 173 HE2 TYR 27 1HE TYR 27 -6.310 8.909 -8.212 174 HH TYR 27 HH TYR 27 -7.332 8.145 -11.371 175 H GLY 28 H GLY 28 -8.199 1.993 -6.284 176 HA2 GLY 28 1HA GLY 28 -7.688 1.362 -8.882 177 HA3 GLY 28 2HA GLY 28 -6.301 0.707 -8.025 178 H THR 29 H THR 29 -6.815 -1.426 -8.513 179 HA THR 29 HA THR 29 -9.300 -2.453 -7.311 180 HB THR 29 HB THR 29 -7.576 -3.769 -9.420 181 HG1 THR 29 1HG THR 29 -8.662 -1.995 -10.301 182 HG21 THR 29 3HG2 THR 29 -9.964 -4.608 -7.878 183 HG22 THR 29 1HG2 THR 29 -8.649 -5.575 -8.543 184 HG23 THR 29 2HG2 THR 29 -9.944 -5.005 -9.596 185 H GLY 30 H GLY 30 -5.879 -2.479 -7.116 186 HA2 GLY 30 1HA GLY 30 -5.554 -5.012 -5.844 187 HA3 GLY 30 2HA GLY 30 -4.385 -3.699 -5.858 188 H LEU 31 H LEU 31 -6.274 -1.783 -4.692 189 HA LEU 31 HA LEU 31 -5.757 -2.385 -1.937 190 HB2 LEU 31 1HB LEU 31 -7.256 -0.120 -3.243 191 HB3 LEU 31 2HB LEU 31 -6.899 -0.218 -1.520 192 HG LEU 31 HG LEU 31 -4.778 -0.137 -3.661 193 HD11 LEU 31 1HD1 LEU 31 -5.017 2.059 -3.842 194 HD12 LEU 31 2HD1 LEU 31 -4.961 2.252 -2.090 195 HD13 LEU 31 3HD1 LEU 31 -6.499 1.942 -2.894 196 HD21 LEU 31 3HD2 LEU 31 -4.570 -0.935 -1.077 197 HD22 LEU 31 1HD2 LEU 31 -4.245 0.792 -0.927 198 HD23 LEU 31 2HD2 LEU 31 -3.261 -0.199 -2.005 199 H GLU 32 H GLU 32 -8.402 -2.817 -4.093 200 HA GLU 32 HA GLU 32 -10.580 -2.761 -2.357 201 HB2 GLU 32 1HB GLU 32 -10.162 -4.594 -4.724 202 HB3 GLU 32 2HB GLU 32 -11.706 -4.216 -3.974 203 HG2 GLU 32 1HG GLU 32 -10.050 -1.966 -4.974 204 HG3 GLU 32 2HG GLU 32 -10.873 -2.988 -6.151 205 H GLY 33 H GLY 33 -8.344 -5.403 -3.118 206 HA2 GLY 33 1HA GLY 33 -8.630 -6.588 -0.560 207 HA3 GLY 33 2HA GLY 33 -9.602 -7.463 -1.734 208 H GLY 34 H GLY 34 -7.901 -9.072 -0.756 209 HA2 GLY 34 1HA GLY 34 -5.452 -8.977 -2.396 210 HA3 GLY 34 2HA GLY 34 -5.626 -9.877 -0.896 211 H THR 35 H THR 35 -5.794 -10.007 -4.272 212 HA THR 35 HA THR 35 -7.280 -12.538 -4.244 213 HB THR 35 HB THR 35 -6.352 -11.222 -6.770 214 HG1 THR 35 1HG THR 35 -7.684 -9.601 -6.506 215 HG21 THR 35 3HG2 THR 35 -7.634 -12.797 -7.682 216 HG22 THR 35 1HG2 THR 35 -9.034 -12.196 -6.796 217 HG23 THR 35 2HG2 THR 35 -7.995 -13.423 -6.073 218 H THR 36 H THR 36 -5.940 -14.178 -3.771 219 HA THR 36 HA THR 36 -3.188 -14.229 -4.541 220 HB THR 36 HB THR 36 -4.606 -16.734 -3.750 221 HG1 THR 36 1HG THR 36 -4.478 -14.381 -2.251 222 HG21 THR 36 3HG2 THR 36 -1.951 -15.911 -3.992 223 HG22 THR 36 1HG2 THR 36 -2.535 -17.402 -3.255 224 HG23 THR 36 2HG2 THR 36 -2.251 -15.977 -2.256 225 H GLY 37 H GLY 37 -2.662 -14.417 -6.631 226 HA2 GLY 37 1HA GLY 37 -2.319 -16.202 -8.323 227 HA3 GLY 37 2HA GLY 37 -4.045 -16.505 -8.201 228 H ILE 38 H ILE 38 -4.234 -13.407 -7.951 229 HA ILE 38 HA ILE 38 -4.171 -12.927 -10.857 230 HB ILE 38 HB ILE 38 -5.966 -11.630 -8.803 231 HG12 ILE 38 1HG1 ILE 38 -6.486 -13.781 -10.861 232 HG13 ILE 38 2HG1 ILE 38 -6.641 -13.919 -9.113 233 HG21 ILE 38 1HG2 ILE 38 -5.272 -10.946 -11.524 234 HG22 ILE 38 2HG2 ILE 38 -7.002 -11.239 -11.351 235 HG23 ILE 38 3HG2 ILE 38 -6.206 -10.036 -10.337 236 HD11 ILE 38 3HD1 ILE 38 -8.330 -11.843 -9.719 237 HD12 ILE 38 1HD1 ILE 38 -8.532 -12.940 -11.085 238 HD13 ILE 38 2HD1 ILE 38 -8.801 -13.520 -9.440 239 H GLN 39 H GLN 39 -3.372 -10.990 -11.639 240 HA GLN 39 HA GLN 39 -1.581 -9.583 -9.821 241 HB2 GLN 39 1HB GLN 39 -0.500 -10.216 -11.818 242 HB3 GLN 39 2HB GLN 39 -1.850 -9.691 -12.815 243 HG2 GLN 39 1HG GLN 39 -1.344 -7.383 -12.374 244 HG3 GLN 39 2HG GLN 39 -0.081 -7.842 -11.233 245 HE21 GLN 39 1HE2 GLN 39 -1.036 -7.954 -14.614 246 HE22 GLN 39 2HE2 GLN 39 0.565 -8.055 -15.255 247 H SER 40 H SER 40 -2.370 -7.889 -8.769 248 HA SER 40 HA SER 40 -4.452 -6.256 -10.034 249 HB2 SER 40 1HB SER 40 -4.442 -5.257 -7.585 250 HB3 SER 40 2HB SER 40 -5.260 -6.781 -7.935 251 HG SER 40 HG SER 40 -3.183 -6.310 -6.292 252 H GLU 41 H GLU 41 -4.326 -3.933 -9.905 253 HA GLU 41 HA GLU 41 -1.694 -2.788 -9.395 254 HB2 GLU 41 1HB GLU 41 -1.666 -1.636 -11.582 255 HB3 GLU 41 2HB GLU 41 -1.560 -3.384 -11.740 256 HG2 GLU 41 1HG GLU 41 -4.040 -1.727 -12.143 257 HG3 GLU 41 2HG GLU 41 -3.036 -2.420 -13.416 258 H PHE 42 H PHE 42 -1.710 -0.528 -9.081 259 HA PHE 42 HA PHE 42 -4.313 0.801 -9.072 260 HB2 PHE 42 1HB PHE 42 -4.069 1.574 -6.788 261 HB3 PHE 42 2HB PHE 42 -3.993 -0.185 -6.814 262 HD1 PHE 42 1HD PHE 42 -1.922 2.876 -6.618 263 HD2 PHE 42 2HD PHE 42 -2.135 -1.323 -5.958 264 HE1 PHE 42 1HE PHE 42 0.225 2.959 -5.419 265 HE2 PHE 42 2HE PHE 42 0.011 -1.247 -4.757 266 HZ PHE 42 HZ PHE 42 1.194 0.896 -4.485 267 H PHE 43 H PHE 43 -4.225 2.963 -9.475 268 HA PHE 43 HA PHE 43 -1.681 4.005 -10.379 269 HB2 PHE 43 1HB PHE 43 -4.535 4.882 -10.588 270 HB3 PHE 43 2HB PHE 43 -3.255 6.059 -10.862 271 HD1 PHE 43 1HD PHE 43 -1.263 4.888 -12.388 272 HD2 PHE 43 2HD PHE 43 -5.435 4.054 -12.516 273 HE1 PHE 43 1HE PHE 43 -1.030 4.096 -14.706 274 HE2 PHE 43 2HE PHE 43 -5.209 3.260 -14.833 275 HZ PHE 43 HZ PHE 43 -3.005 3.280 -15.931 276 H ILE 44 H ILE 44 -0.718 5.933 -9.647 277 HA ILE 44 HA ILE 44 -1.482 6.684 -6.901 278 HB ILE 44 HB ILE 44 1.260 6.755 -8.167 279 HG12 ILE 44 1HG1 ILE 44 0.293 5.066 -5.857 280 HG13 ILE 44 2HG1 ILE 44 0.311 4.495 -7.522 281 HG21 ILE 44 1HG2 ILE 44 0.960 7.117 -5.263 282 HG22 ILE 44 2HG2 ILE 44 2.047 7.910 -6.402 283 HG23 ILE 44 3HG2 ILE 44 0.374 8.450 -6.258 284 HD11 ILE 44 3HD1 ILE 44 2.311 3.685 -6.871 285 HD12 ILE 44 1HD1 ILE 44 2.842 5.301 -7.333 286 HD13 ILE 44 2HD1 ILE 44 2.538 4.924 -5.637 287 H ASN 45 H ASN 45 -2.601 8.531 -7.035 288 HA ASN 45 HA ASN 45 -2.258 10.476 -9.063 289 HB2 ASN 45 1HB ASN 45 -4.264 9.990 -7.405 290 HB3 ASN 45 2HB ASN 45 -3.456 11.210 -6.425 291 HD21 ASN 45 1HD2 ASN 45 -4.816 12.881 -6.621 292 HD22 ASN 45 2HD2 ASN 45 -5.243 13.632 -8.117 293 H THR 46 H THR 46 -0.338 11.465 -9.262 294 HA THR 46 HA THR 46 0.701 12.888 -6.904 295 HB THR 46 HB THR 46 3.002 12.513 -7.726 296 HG1 THR 46 1HG THR 46 2.101 11.987 -9.956 297 HG21 THR 46 3HG2 THR 46 1.274 10.153 -7.048 298 HG22 THR 46 1HG2 THR 46 2.405 11.030 -6.018 299 HG23 THR 46 2HG2 THR 46 3.011 9.973 -7.293 300 H THR 47 H THR 47 -1.021 13.735 -9.156 301 HA THR 47 HA THR 47 0.650 15.434 -10.795 302 HB THR 47 HB THR 47 -1.554 16.280 -11.680 303 HG1 THR 47 1HG THR 47 -2.649 14.138 -10.156 304 HG21 THR 47 3HG2 THR 47 -1.856 13.397 -12.007 305 HG22 THR 47 1HG2 THR 47 -0.194 13.945 -12.220 306 HG23 THR 47 2HG2 THR 47 -1.484 14.637 -13.204 307 H ARG 48 H ARG 48 -1.607 15.798 -8.103 308 HA ARG 48 HA ARG 48 -1.421 18.665 -8.081 309 HB2 ARG 48 1HB ARG 48 -2.555 16.710 -6.075 310 HB3 ARG 48 2HB ARG 48 -2.669 18.458 -5.926 311 HG2 ARG 48 1HG ARG 48 -3.756 16.922 -8.270 312 HG3 ARG 48 2HG ARG 48 -4.703 17.323 -6.836 313 HD2 ARG 48 1HD ARG 48 -3.264 19.397 -8.471 314 HD3 ARG 48 2HD ARG 48 -4.918 18.893 -8.816 315 HE ARG 48 HE ARG 48 -4.918 19.558 -6.159 316 HH11 ARG 48 1HH1 ARG 48 -4.111 21.179 -9.132 317 HH12 ARG 48 2HH1 ARG 48 -4.549 22.750 -8.547 318 HH21 ARG 48 1HH2 ARG 48 -5.499 21.621 -5.377 319 HH22 ARG 48 2HH2 ARG 48 -5.337 23.000 -6.411 320 H ALA 49 H ALA 49 0.120 15.997 -6.406 321 HA ALA 49 HA ALA 49 1.397 17.576 -4.409 322 HB1 ALA 49 3HB ALA 49 1.894 15.585 -3.563 323 HB2 ALA 49 1HB ALA 49 1.111 14.844 -4.960 324 HB3 ALA 49 2HB ALA 49 2.846 15.165 -4.987 325 H GLY 50 H GLY 50 2.717 15.938 -7.300 326 HA2 GLY 50 1HA GLY 50 4.066 17.657 -8.682 327 HA3 GLY 50 2HA GLY 50 5.001 17.790 -7.200 328 HA PRO 51 HA PRO 51 6.564 14.321 -10.030 329 HB2 PRO 51 1HB PRO 51 8.887 15.500 -10.793 330 HB3 PRO 51 2HB PRO 51 7.378 15.676 -11.697 331 HG2 PRO 51 1HG PRO 51 8.641 17.552 -9.735 332 HG3 PRO 51 2HG PRO 51 7.871 17.912 -11.291 333 HD2 PRO 51 1HD PRO 51 6.607 18.267 -8.924 334 HD3 PRO 51 2HD PRO 51 5.746 17.808 -10.407 335 H GLY 52 H GLY 52 7.275 15.887 -7.202 336 HA2 GLY 52 1HA GLY 52 9.799 15.282 -6.401 337 HA3 GLY 52 2HA GLY 52 8.409 15.138 -5.335 338 H THR 53 H THR 53 10.547 13.522 -4.916 339 HA THR 53 HA THR 53 10.352 11.018 -6.264 340 HB THR 53 HB THR 53 11.524 11.285 -3.516 341 HG1 THR 53 1HG THR 53 13.320 12.273 -4.364 342 HG21 THR 53 3HG2 THR 53 12.086 9.188 -4.081 343 HG22 THR 53 1HG2 THR 53 13.274 9.931 -5.151 344 HG23 THR 53 2HG2 THR 53 11.698 9.449 -5.781 345 H LEU 54 H LEU 54 9.719 8.986 -5.293 346 HA LEU 54 HA LEU 54 7.833 9.172 -3.066 347 HB2 LEU 54 1HB LEU 54 6.023 8.326 -4.184 348 HB3 LEU 54 2HB LEU 54 6.751 9.335 -5.432 349 HG LEU 54 HG LEU 54 6.076 7.321 -6.477 350 HD11 LEU 54 1HD1 LEU 54 8.582 8.239 -6.661 351 HD12 LEU 54 2HD1 LEU 54 7.990 6.860 -7.587 352 HD13 LEU 54 3HD1 LEU 54 8.917 6.597 -6.109 353 HD21 LEU 54 3HD2 LEU 54 6.244 6.140 -4.075 354 HD22 LEU 54 1HD2 LEU 54 7.727 5.528 -4.809 355 HD23 LEU 54 2HD2 LEU 54 6.172 5.242 -5.592 356 H SER 55 H SER 55 7.164 6.982 -2.291 357 HA SER 55 HA SER 55 9.047 4.848 -2.951 358 HB2 SER 55 1HB SER 55 8.713 6.059 -0.205 359 HB3 SER 55 2HB SER 55 9.390 4.451 -0.459 360 HG SER 55 HG SER 55 10.416 6.704 -1.813 361 H VAL 56 H VAL 56 8.307 2.773 -2.478 362 HA VAL 56 HA VAL 56 5.655 2.506 -1.274 363 HB VAL 56 HB VAL 56 5.006 2.641 -3.534 364 HG11 VAL 56 1HG1 VAL 56 7.604 1.911 -4.105 365 HG12 VAL 56 2HG1 VAL 56 6.653 0.550 -4.701 366 HG13 VAL 56 3HG1 VAL 56 6.318 2.182 -5.280 367 HG21 VAL 56 3HG2 VAL 56 4.270 0.588 -2.162 368 HG22 VAL 56 1HG2 VAL 56 3.972 0.586 -3.900 369 HG23 VAL 56 2HG2 VAL 56 5.328 -0.325 -3.237 370 H THR 57 H THR 57 5.664 0.899 0.144 371 HA THR 57 HA THR 57 7.463 -1.387 -0.310 372 HB THR 57 HB THR 57 6.949 -0.133 2.392 373 HG1 THR 57 1HG THR 57 8.506 1.185 1.859 374 HG21 THR 57 3HG2 THR 57 8.067 -1.854 3.307 375 HG22 THR 57 1HG2 THR 57 9.264 -1.884 2.013 376 HG23 THR 57 2HG2 THR 57 7.714 -2.697 1.799 377 H ILE 58 H ILE 58 6.671 -3.384 0.217 378 HA ILE 58 HA ILE 58 3.935 -3.482 1.308 379 HB ILE 58 HB ILE 58 5.064 -5.190 -0.913 380 HG12 ILE 58 1HG1 ILE 58 2.818 -3.162 -0.901 381 HG13 ILE 58 2HG1 ILE 58 4.407 -2.927 -1.621 382 HG21 ILE 58 1HG2 ILE 58 3.001 -5.734 0.979 383 HG22 ILE 58 2HG2 ILE 58 2.280 -5.547 -0.619 384 HG23 ILE 58 3HG2 ILE 58 3.563 -6.729 -0.364 385 HD11 ILE 58 3HD1 ILE 58 3.410 -5.289 -2.734 386 HD12 ILE 58 1HD1 ILE 58 2.068 -4.146 -2.731 387 HD13 ILE 58 2HD1 ILE 58 3.590 -3.718 -3.514 388 H GLU 59 H GLU 59 3.638 -4.817 2.980 389 HA GLU 59 HA GLU 59 5.800 -6.712 3.624 390 HB2 GLU 59 1HB GLU 59 4.122 -4.923 5.323 391 HB3 GLU 59 2HB GLU 59 4.657 -6.455 5.999 392 HG2 GLU 59 1HG GLU 59 6.529 -4.446 4.781 393 HG3 GLU 59 2HG GLU 59 6.116 -4.479 6.494 394 H GLY 60 H GLY 60 4.910 -8.473 5.223 395 HA2 GLY 60 1HA GLY 60 2.487 -9.485 5.517 396 HA3 GLY 60 2HA GLY 60 2.709 -9.759 3.795 397 HA PRO 61 HA PRO 61 4.491 -13.277 6.411 398 HB2 PRO 61 1HB PRO 61 2.705 -15.187 5.679 399 HB3 PRO 61 2HB PRO 61 2.470 -14.139 7.083 400 HG2 PRO 61 1HG PRO 61 1.309 -13.911 4.333 401 HG3 PRO 61 2HG PRO 61 0.519 -13.682 5.904 402 HD2 PRO 61 1HD PRO 61 1.350 -11.607 4.375 403 HD3 PRO 61 2HD PRO 61 1.344 -11.544 6.150 404 H SER 62 H SER 62 3.481 -12.743 3.147 405 HA SER 62 HA SER 62 5.617 -14.527 2.218 406 HB2 SER 62 1HB SER 62 2.735 -14.569 1.393 407 HB3 SER 62 2HB SER 62 3.979 -14.995 0.219 408 HG SER 62 HG SER 62 4.717 -16.572 1.738 409 H LYS 63 H LYS 63 7.021 -13.337 1.130 410 HA LYS 63 HA LYS 63 6.715 -10.717 0.333 411 HB2 LYS 63 1HB LYS 63 8.556 -12.910 -0.560 412 HB3 LYS 63 2HB LYS 63 8.606 -11.343 -1.356 413 HG2 LYS 63 1HG LYS 63 8.760 -11.463 1.616 414 HG3 LYS 63 2HG LYS 63 10.184 -11.873 0.656 415 HD2 LYS 63 1HD LYS 63 8.701 -9.372 0.010 416 HD3 LYS 63 2HD LYS 63 9.727 -9.398 1.446 417 HE2 LYS 63 1HE LYS 63 11.660 -9.840 0.187 418 HE3 LYS 63 2HE LYS 63 10.729 -10.310 -1.234 419 HZ1 LYS 63 3HZ LYS 63 10.163 -7.634 -0.416 420 HZ2 LYS 63 1HZ LYS 63 10.649 -8.216 -1.928 421 HZ3 LYS 63 2HZ LYS 63 11.807 -7.848 -0.751 422 H VAL 64 H VAL 64 6.832 -9.872 -1.949 423 HA VAL 64 HA VAL 64 5.389 -11.468 -3.914 424 HB VAL 64 HB VAL 64 3.753 -9.661 -4.350 425 HG11 VAL 64 1HG1 VAL 64 3.505 -10.526 -1.486 426 HG12 VAL 64 2HG1 VAL 64 2.233 -10.313 -2.690 427 HG13 VAL 64 3HG1 VAL 64 3.353 -11.669 -2.820 428 HG21 VAL 64 3HG2 VAL 64 5.047 -7.819 -3.354 429 HG22 VAL 64 1HG2 VAL 64 3.404 -7.901 -2.717 430 HG23 VAL 64 2HG2 VAL 64 4.755 -8.497 -1.752 431 H LYS 65 H LYS 65 5.860 -10.933 -5.998 432 HA LYS 65 HA LYS 65 8.171 -9.373 -6.490 433 HB2 LYS 65 1HB LYS 65 7.166 -11.374 -7.827 434 HB3 LYS 65 2HB LYS 65 6.231 -10.132 -8.650 435 HG2 LYS 65 1HG LYS 65 8.043 -10.331 -10.037 436 HG3 LYS 65 2HG LYS 65 8.556 -9.004 -8.992 437 HD2 LYS 65 1HD LYS 65 9.941 -10.445 -7.703 438 HD3 LYS 65 2HD LYS 65 9.258 -11.885 -8.463 439 HE2 LYS 65 1HE LYS 65 10.740 -9.778 -10.016 440 HE3 LYS 65 2HE LYS 65 11.555 -11.147 -9.261 441 HZ1 LYS 65 3HZ LYS 65 9.295 -11.503 -11.138 442 HZ2 LYS 65 1HZ LYS 65 10.426 -12.654 -10.631 443 HZ3 LYS 65 2HZ LYS 65 10.898 -11.406 -11.670 444 H MET 66 H MET 66 7.922 -7.251 -5.905 445 HA MET 66 HA MET 66 5.650 -5.713 -6.801 446 HB2 MET 66 1HB MET 66 8.041 -5.209 -5.099 447 HB3 MET 66 2HB MET 66 7.265 -3.821 -5.849 448 HG2 MET 66 1HG MET 66 5.332 -4.072 -4.638 449 HG3 MET 66 2HG MET 66 5.599 -5.792 -4.367 450 HE1 MET 66 3HE MET 66 8.347 -2.721 -2.350 451 HE2 MET 66 1HE MET 66 8.134 -2.987 -4.080 452 HE3 MET 66 2HE MET 66 6.907 -2.110 -3.166 453 H ASP 67 H ASP 67 5.561 -4.298 -8.469 454 HA ASP 67 HA ASP 67 8.004 -3.948 -10.079 455 HB2 ASP 67 1HB ASP 67 5.195 -4.557 -10.990 456 HB3 ASP 67 2HB ASP 67 6.398 -3.859 -12.071 457 H CYS 68 H CYS 68 8.252 -1.965 -11.146 458 HA CYS 68 HA CYS 68 6.294 0.130 -10.575 459 HB2 CYS 68 1HB CYS 68 8.302 -0.056 -8.860 460 HB3 CYS 68 2HB CYS 68 9.173 0.791 -10.133 461 HG CYS 68 HG CYS 68 7.975 2.370 -7.897 462 H GLN 69 H GLN 69 5.949 1.380 -12.294 463 HA GLN 69 HA GLN 69 8.032 1.511 -14.370 464 HB2 GLN 69 1HB GLN 69 5.900 0.051 -14.807 465 HB3 GLN 69 2HB GLN 69 5.126 1.605 -15.087 466 HG2 GLN 69 1HG GLN 69 7.064 2.041 -16.715 467 HG3 GLN 69 2HG GLN 69 7.336 0.302 -16.624 468 HE21 GLN 69 1HE2 GLN 69 6.534 1.910 -18.899 469 HE22 GLN 69 2HE2 GLN 69 5.020 1.275 -19.436 470 H GLU 70 H GLU 70 8.083 3.433 -15.630 471 HA GLU 70 HA GLU 70 7.294 5.771 -14.124 472 HB2 GLU 70 1HB GLU 70 9.518 5.379 -15.408 473 HB3 GLU 70 2HB GLU 70 8.594 5.843 -16.830 474 HG2 GLU 70 1HG GLU 70 8.373 8.015 -16.154 475 HG3 GLU 70 2HG GLU 70 8.513 7.613 -14.443 476 H THR 71 H THR 71 5.311 6.560 -14.324 477 HA THR 71 HA THR 71 4.029 6.492 -16.978 478 HB THR 71 HB THR 71 1.858 6.575 -15.809 479 HG1 THR 71 1HG THR 71 1.771 6.873 -13.710 480 HG21 THR 71 3HG2 THR 71 2.422 4.395 -16.387 481 HG22 THR 71 1HG2 THR 71 2.110 4.264 -14.657 482 HG23 THR 71 2HG2 THR 71 3.769 4.336 -15.250 483 HA PRO 72 HA PRO 72 3.885 10.883 -17.017 484 HB2 PRO 72 1HB PRO 72 1.604 11.299 -18.430 485 HB3 PRO 72 2HB PRO 72 3.098 10.710 -19.169 486 HG2 PRO 72 1HG PRO 72 0.680 9.174 -18.300 487 HG3 PRO 72 2HG PRO 72 1.642 9.003 -19.780 488 HD2 PRO 72 1HD PRO 72 1.922 7.342 -17.660 489 HD3 PRO 72 2HD PRO 72 3.278 7.770 -18.724 490 H GLU 73 H GLU 73 1.370 9.028 -15.574 491 HA GLU 73 HA GLU 73 0.068 11.394 -14.454 492 HB2 GLU 73 1HB GLU 73 -1.334 9.567 -15.369 493 HB3 GLU 73 2HB GLU 73 -0.661 8.473 -14.169 494 HG2 GLU 73 1HG GLU 73 -1.732 9.565 -12.402 495 HG3 GLU 73 2HG GLU 73 -2.072 10.994 -13.377 496 H GLY 74 H GLY 74 2.324 8.932 -13.628 497 HA2 GLY 74 1HA GLY 74 3.322 10.059 -11.360 498 HA3 GLY 74 2HA GLY 74 1.957 9.117 -10.778 499 H TYR 75 H TYR 75 2.211 6.984 -10.444 500 HA TYR 75 HA TYR 75 4.358 5.527 -11.738 501 HB2 TYR 75 1HB TYR 75 4.266 5.723 -8.722 502 HB3 TYR 75 2HB TYR 75 5.420 4.802 -9.680 503 HD1 TYR 75 1HD TYR 75 6.850 6.195 -11.372 504 HD2 TYR 75 2HD TYR 75 4.831 7.858 -8.016 505 HE1 TYR 75 1HE TYR 75 8.356 8.139 -11.437 506 HE2 TYR 75 2HE TYR 75 6.331 9.806 -8.072 507 HH TYR 75 HH TYR 75 9.147 9.919 -9.484 508 H LYS 76 H LYS 76 3.688 3.540 -12.202 509 HA LYS 76 HA LYS 76 1.212 2.574 -11.006 510 HB2 LYS 76 1HB LYS 76 1.642 2.581 -13.507 511 HB3 LYS 76 2HB LYS 76 2.802 1.289 -13.226 512 HG2 LYS 76 1HG LYS 76 0.795 0.253 -13.896 513 HG3 LYS 76 2HG LYS 76 0.929 -0.008 -12.155 514 HD2 LYS 76 1HD LYS 76 -0.814 1.395 -11.674 515 HD3 LYS 76 2HD LYS 76 -0.547 2.393 -13.105 516 HE2 LYS 76 1HE LYS 76 -1.647 0.887 -14.505 517 HE3 LYS 76 2HE LYS 76 -1.493 -0.439 -13.355 518 HZ1 LYS 76 3HZ LYS 76 -3.164 0.462 -12.001 519 HZ2 LYS 76 1HZ LYS 76 -3.763 0.603 -13.577 520 HZ3 LYS 76 2HZ LYS 76 -3.132 1.959 -12.788 521 H VAL 77 H VAL 77 1.041 0.820 -9.713 522 HA VAL 77 HA VAL 77 3.510 -0.679 -9.124 523 HB VAL 77 HB VAL 77 1.386 0.190 -7.159 524 HG11 VAL 77 1HG1 VAL 77 2.125 -2.038 -6.604 525 HG12 VAL 77 2HG1 VAL 77 3.815 -1.555 -6.765 526 HG13 VAL 77 3HG1 VAL 77 2.827 -0.893 -5.463 527 HG21 VAL 77 3HG2 VAL 77 3.081 1.897 -7.900 528 HG22 VAL 77 1HG2 VAL 77 3.057 1.560 -6.169 529 HG23 VAL 77 2HG2 VAL 77 4.321 0.867 -7.185 530 H MET 78 H MET 78 3.332 -2.762 -9.592 531 HA MET 78 HA MET 78 0.667 -4.012 -9.452 532 HB2 MET 78 1HB MET 78 2.919 -4.824 -11.294 533 HB3 MET 78 2HB MET 78 1.274 -5.444 -11.294 534 HG2 MET 78 1HG MET 78 0.421 -3.582 -12.312 535 HG3 MET 78 2HG MET 78 1.701 -2.532 -11.710 536 HE1 MET 78 3HE MET 78 3.560 -1.970 -12.548 537 HE2 MET 78 1HE MET 78 4.640 -3.136 -13.312 538 HE3 MET 78 2HE MET 78 3.839 -1.905 -14.289 539 H TYR 79 H TYR 79 0.465 -5.645 -8.069 540 HA TYR 79 HA TYR 79 2.800 -7.267 -7.387 541 HB2 TYR 79 1HB TYR 79 2.521 -7.021 -5.029 542 HB3 TYR 79 2HB TYR 79 2.568 -5.397 -5.707 543 HD1 TYR 79 1HD TYR 79 0.246 -8.024 -4.477 544 HD2 TYR 79 2HD TYR 79 0.807 -3.893 -5.327 545 HE1 TYR 79 1HE TYR 79 -1.898 -7.514 -3.384 546 HE2 TYR 79 2HE TYR 79 -1.335 -3.371 -4.235 547 HH TYR 79 HH TYR 79 -2.796 -4.506 -2.412 548 H THR 80 H THR 80 2.324 -9.368 -7.282 549 HA THR 80 HA THR 80 -0.513 -10.136 -7.035 550 HB THR 80 HB THR 80 1.511 -11.804 -8.506 551 HG1 THR 80 1HG THR 80 1.439 -9.735 -9.512 552 HG21 THR 80 3HG2 THR 80 -1.224 -12.081 -7.820 553 HG22 THR 80 1HG2 THR 80 -0.230 -13.162 -8.797 554 HG23 THR 80 2HG2 THR 80 -1.137 -11.860 -9.568 555 HA PRO 81 HA PRO 81 1.211 -12.153 -3.399 556 HB2 PRO 81 1HB PRO 81 -1.202 -12.790 -2.331 557 HB3 PRO 81 2HB PRO 81 -0.490 -11.177 -2.201 558 HG2 PRO 81 1HG PRO 81 -2.577 -12.179 -4.099 559 HG3 PRO 81 2HG PRO 81 -2.516 -10.645 -3.211 560 HD2 PRO 81 1HD PRO 81 -1.826 -10.846 -5.821 561 HD3 PRO 81 2HD PRO 81 -1.059 -9.686 -4.717 562 H MET 82 H MET 82 1.452 -14.291 -2.772 563 HA MET 82 HA MET 82 0.235 -16.279 -4.573 564 HB2 MET 82 1HB MET 82 2.608 -16.207 -4.916 565 HB3 MET 82 2HB MET 82 2.917 -16.271 -3.186 566 HG2 MET 82 1HG MET 82 2.188 -18.531 -3.060 567 HG3 MET 82 2HG MET 82 1.582 -18.487 -4.714 568 HE1 MET 82 3HE MET 82 2.894 -18.523 -6.771 569 HE2 MET 82 1HE MET 82 4.414 -19.413 -6.871 570 HE3 MET 82 2HE MET 82 2.974 -20.197 -6.220 571 H ALA 83 H ALA 83 0.865 -15.377 -1.275 572 HA ALA 83 HA ALA 83 -0.715 -17.700 -0.383 573 HB1 ALA 83 3HB ALA 83 0.683 -17.216 1.829 574 HB2 ALA 83 1HB ALA 83 1.258 -18.302 0.564 575 HB3 ALA 83 2HB ALA 83 1.856 -16.644 0.642 576 HA PRO 84 HA PRO 84 -3.468 -14.765 1.402 577 HB2 PRO 84 1HB PRO 84 -4.616 -16.339 3.292 578 HB3 PRO 84 2HB PRO 84 -4.968 -16.497 1.567 579 HG2 PRO 84 1HG PRO 84 -3.116 -18.111 3.277 580 HG3 PRO 84 2HG PRO 84 -4.256 -18.661 2.035 581 HD2 PRO 84 1HD PRO 84 -1.600 -18.410 1.568 582 HD3 PRO 84 2HD PRO 84 -2.821 -18.135 0.309 583 H GLY 85 H GLY 85 -4.063 -13.801 3.525 584 HA2 GLY 85 1HA GLY 85 -3.269 -13.910 5.970 585 HA3 GLY 85 2HA GLY 85 -1.680 -13.687 5.253 586 H ASN 86 H ASN 86 -1.793 -11.807 6.797 587 HA ASN 86 HA ASN 86 -3.365 -9.559 5.798 588 HB2 ASN 86 1HB ASN 86 -2.573 -8.391 7.829 589 HB3 ASN 86 2HB ASN 86 -3.370 -9.915 8.209 590 HD21 ASN 86 1HD2 ASN 86 -1.890 -8.941 10.136 591 HD22 ASN 86 2HD2 ASN 86 -0.388 -9.781 10.294 592 H TYR 87 H TYR 87 -2.543 -8.054 4.506 593 HA TYR 87 HA TYR 87 0.389 -7.854 4.285 594 HB2 TYR 87 1HB TYR 87 -1.758 -7.651 2.184 595 HB3 TYR 87 2HB TYR 87 -0.153 -6.975 1.928 596 HD1 TYR 87 1HD TYR 87 -1.718 -10.178 3.064 597 HD2 TYR 87 2HD TYR 87 1.394 -8.301 0.851 598 HE1 TYR 87 1HE TYR 87 -0.912 -12.385 2.335 599 HE2 TYR 87 2HE TYR 87 2.208 -10.502 0.116 600 HH TYR 87 HH TYR 87 0.570 -13.494 1.115 601 H LEU 88 H LEU 88 1.301 -5.795 4.009 602 HA LEU 88 HA LEU 88 -0.496 -3.527 4.547 603 HB2 LEU 88 1HB LEU 88 0.852 -4.355 6.541 604 HB3 LEU 88 2HB LEU 88 2.274 -3.761 5.687 605 HG LEU 88 HG LEU 88 0.851 -1.522 5.641 606 HD11 LEU 88 1HD1 LEU 88 -1.084 -2.627 6.752 607 HD12 LEU 88 2HD1 LEU 88 -0.473 -1.211 7.607 608 HD13 LEU 88 3HD1 LEU 88 -0.082 -2.829 8.190 609 HD21 LEU 88 3HD2 LEU 88 2.942 -1.364 6.582 610 HD22 LEU 88 1HD2 LEU 88 2.647 -2.674 7.726 611 HD23 LEU 88 2HD2 LEU 88 1.917 -1.091 7.992 612 H ILE 89 H ILE 89 -0.194 -1.768 3.310 613 HA ILE 89 HA ILE 89 2.196 -1.706 1.585 614 HB ILE 89 HB ILE 89 -0.532 -0.645 0.848 615 HG12 ILE 89 1HG1 ILE 89 0.736 -3.078 -0.374 616 HG13 ILE 89 2HG1 ILE 89 -0.213 -3.220 1.102 617 HG21 ILE 89 1HG2 ILE 89 1.911 0.038 -0.156 618 HG22 ILE 89 2HG2 ILE 89 1.419 -1.257 -1.245 619 HG23 ILE 89 3HG2 ILE 89 0.386 0.156 -1.033 620 HD11 ILE 89 3HD1 ILE 89 -1.070 -2.744 -1.663 621 HD12 ILE 89 1HD1 ILE 89 -1.898 -3.557 -0.335 622 HD13 ILE 89 2HD1 ILE 89 -1.908 -1.796 -0.434 623 H SER 90 H SER 90 3.490 -0.129 2.256 624 HA SER 90 HA SER 90 2.347 2.282 3.450 625 HB2 SER 90 1HB SER 90 5.212 1.317 3.283 626 HB3 SER 90 2HB SER 90 4.691 2.791 4.099 627 HG SER 90 HG SER 90 4.615 1.403 5.719 628 H VAL 91 H VAL 91 2.694 4.339 2.659 629 HA VAL 91 HA VAL 91 4.052 4.574 0.064 630 HB VAL 91 HB VAL 91 1.323 5.701 0.703 631 HG11 VAL 91 1HG1 VAL 91 1.800 7.304 -0.762 632 HG12 VAL 91 2HG1 VAL 91 3.351 6.560 -1.158 633 HG13 VAL 91 3HG1 VAL 91 1.888 6.055 -2.005 634 HG21 VAL 91 3HG2 VAL 91 2.235 3.590 -1.247 635 HG22 VAL 91 1HG2 VAL 91 1.177 3.372 0.148 636 HG23 VAL 91 2HG2 VAL 91 0.625 4.308 -1.241 637 H LYS 92 H LYS 92 5.733 5.837 0.587 638 HA LYS 92 HA LYS 92 5.244 8.210 2.254 639 HB2 LYS 92 1HB LYS 92 7.702 6.574 1.694 640 HB3 LYS 92 2HB LYS 92 7.837 8.220 2.300 641 HG2 LYS 92 1HG LYS 92 6.501 7.603 4.257 642 HG3 LYS 92 2HG LYS 92 6.393 5.948 3.652 643 HD2 LYS 92 1HD LYS 92 9.034 7.300 4.133 644 HD3 LYS 92 2HD LYS 92 8.175 6.444 5.416 645 HE2 LYS 92 1HE LYS 92 8.245 4.393 4.161 646 HE3 LYS 92 2HE LYS 92 8.929 5.222 2.764 647 HZ1 LYS 92 3HZ LYS 92 10.586 3.993 4.091 648 HZ2 LYS 92 1HZ LYS 92 10.270 5.011 5.404 649 HZ3 LYS 92 2HZ LYS 92 10.929 5.646 3.982 650 H TYR 93 H TYR 93 6.031 10.243 1.608 651 HA TYR 93 HA TYR 93 7.180 10.558 -1.030 652 HB2 TYR 93 1HB TYR 93 4.967 10.532 -1.797 653 HB3 TYR 93 2HB TYR 93 4.364 11.380 -0.377 654 HD1 TYR 93 2HD TYR 93 4.881 13.832 -0.117 655 HD2 TYR 93 1HD TYR 93 5.635 11.713 -3.729 656 HE1 TYR 93 2HE TYR 93 4.994 15.964 -1.338 657 HE2 TYR 93 1HE TYR 93 5.751 13.840 -4.960 658 HH TYR 93 HH TYR 93 5.760 16.912 -3.320 659 H GLY 94 H GLY 94 8.625 12.146 -0.949 660 HA2 GLY 94 1HA GLY 94 9.497 14.251 -0.468 661 HA3 GLY 94 2HA GLY 94 8.105 14.565 0.558 662 H GLY 95 H GLY 95 8.250 12.410 2.304 663 HA2 GLY 95 1HA GLY 95 10.902 12.229 3.417 664 HA3 GLY 95 2HA GLY 95 9.832 13.275 4.338 665 HA PRO 96 HA PRO 96 9.338 9.022 6.041 666 HB2 PRO 96 1HB PRO 96 9.212 9.838 8.627 667 HB3 PRO 96 2HB PRO 96 10.738 9.530 7.791 668 HG2 PRO 96 1HG PRO 96 9.356 12.134 8.313 669 HG3 PRO 96 2HG PRO 96 11.077 11.733 8.455 670 HD2 PRO 96 1HD PRO 96 10.060 13.047 6.318 671 HD3 PRO 96 2HD PRO 96 11.443 11.941 6.189 672 H ASN 97 H ASN 97 7.538 11.936 6.078 673 HA ASN 97 HA ASN 97 5.302 11.042 7.595 674 HB2 ASN 97 1HB ASN 97 5.319 13.197 5.475 675 HB3 ASN 97 2HB ASN 97 4.188 13.026 6.814 676 HD21 ASN 97 1HD2 ASN 97 7.071 14.401 5.756 677 HD22 ASN 97 2HD2 ASN 97 7.615 15.038 7.267 678 H HIS 98 H HIS 98 3.721 9.705 7.025 679 HA HIS 98 HA HIS 98 3.646 8.594 4.371 680 HB2 HIS 98 1HB HIS 98 1.567 7.402 5.434 681 HB3 HIS 98 2HB HIS 98 3.193 6.963 5.949 682 HD2 HIS 98 2HD HIS 98 0.089 8.922 7.334 683 HE1 HIS 98 1HE HIS 98 2.759 8.122 10.533 684 HE2 HIS 98 2HE HIS 98 0.465 8.943 9.893 685 H ILE 99 H ILE 99 1.640 8.440 3.113 686 HA ILE 99 HA ILE 99 0.382 11.039 2.918 687 HB ILE 99 HB ILE 99 -0.651 10.192 0.876 688 HG12 ILE 99 1HG1 ILE 99 0.827 7.602 1.169 689 HG13 ILE 99 2HG1 ILE 99 -0.751 7.787 1.927 690 HG21 ILE 99 1HG2 ILE 99 1.537 11.112 0.633 691 HG22 ILE 99 2HG2 ILE 99 2.289 9.609 1.164 692 HG23 ILE 99 3HG2 ILE 99 1.447 9.675 -0.384 693 HD11 ILE 99 3HD1 ILE 99 -0.132 8.094 -1.001 694 HD12 ILE 99 1HD1 ILE 99 -0.967 6.742 -0.236 695 HD13 ILE 99 2HD1 ILE 99 -1.713 8.340 -0.260 696 H VAL 100 H VAL 100 -2.005 11.160 2.533 697 HA VAL 100 HA VAL 100 -3.409 10.196 4.771 698 HB VAL 100 HB VAL 100 -4.332 11.465 2.203 699 HG11 VAL 100 1HG1 VAL 100 -6.125 10.003 2.871 700 HG12 VAL 100 2HG1 VAL 100 -6.027 10.581 4.535 701 HG13 VAL 100 3HG1 VAL 100 -6.567 11.666 3.254 702 HG21 VAL 100 3HG2 VAL 100 -4.992 13.264 3.891 703 HG22 VAL 100 1HG2 VAL 100 -4.003 12.373 5.047 704 HG23 VAL 100 2HG2 VAL 100 -3.270 13.037 3.587 705 H GLY 101 H GLY 101 -4.894 8.561 5.037 706 HA2 GLY 101 1HA GLY 101 -6.287 6.790 4.314 707 HA3 GLY 101 2HA GLY 101 -5.456 6.801 2.766 708 H SER 102 H SER 102 -2.795 6.789 3.925 709 HA SER 102 HA SER 102 -2.601 3.938 4.389 710 HB2 SER 102 1HB SER 102 -0.714 6.129 3.698 711 HB3 SER 102 2HB SER 102 -0.048 4.745 4.565 712 HG SER 102 HG SER 102 0.032 4.449 2.300 713 HA PRO 103 HA PRO 103 -0.460 2.878 5.099 714 HB2 PRO 103 1HB PRO 103 -0.590 0.709 6.727 715 HB3 PRO 103 2HB PRO 103 0.700 1.913 6.831 716 HG2 PRO 103 1HG PRO 103 -1.769 1.632 8.501 717 HG3 PRO 103 2HG PRO 103 -0.109 1.996 9.010 718 HD2 PRO 103 1HD PRO 103 -2.006 3.911 8.751 719 HD3 PRO 103 2HD PRO 103 -0.287 4.221 8.436 720 H PHE 104 H PHE 104 -1.250 0.939 4.049 721 HA PHE 104 HA PHE 104 -4.181 0.782 4.124 722 HB2 PHE 104 1HB PHE 104 -2.344 -0.236 1.952 723 HB3 PHE 104 2HB PHE 104 -4.090 -0.028 1.864 724 HD1 PHE 104 2HD PHE 104 -4.576 2.605 2.872 725 HD2 PHE 104 1HD PHE 104 -1.343 1.211 0.480 726 HE1 PHE 104 2HE PHE 104 -4.260 4.877 1.981 727 HE2 PHE 104 1HE PHE 104 -1.022 3.481 -0.414 728 HZ PHE 104 HZ PHE 104 -2.482 5.317 0.336 729 H LYS 105 H LYS 105 -5.078 -0.920 5.059 730 HA LYS 105 HA LYS 105 -3.479 -3.367 5.377 731 HB2 LYS 105 1HB LYS 105 -4.211 -2.350 7.476 732 HB3 LYS 105 2HB LYS 105 -5.884 -2.396 6.933 733 HG2 LYS 105 1HG LYS 105 -5.856 -4.255 8.236 734 HG3 LYS 105 2HG LYS 105 -5.368 -4.975 6.700 735 HD2 LYS 105 1HD LYS 105 -3.296 -3.926 8.585 736 HD3 LYS 105 2HD LYS 105 -4.025 -5.508 8.869 737 HE2 LYS 105 1HE LYS 105 -3.435 -5.990 6.415 738 HE3 LYS 105 2HE LYS 105 -2.382 -4.581 6.534 739 HZ1 LYS 105 3HZ LYS 105 -0.983 -5.631 7.979 740 HZ2 LYS 105 1HZ LYS 105 -1.494 -6.961 7.067 741 HZ3 LYS 105 2HZ LYS 105 -2.176 -6.666 8.586 742 H ALA 106 H ALA 106 -3.901 -4.524 3.554 743 HA ALA 106 HA ALA 106 -6.707 -4.967 2.811 744 HB1 ALA 106 3HB ALA 106 -4.990 -4.184 1.108 745 HB2 ALA 106 1HB ALA 106 -4.310 -5.809 1.207 746 HB3 ALA 106 2HB ALA 106 -5.973 -5.580 0.663 747 H LYS 107 H LYS 107 -7.615 -6.982 2.777 748 HA LYS 107 HA LYS 107 -6.087 -9.092 4.131 749 HB2 LYS 107 1HB LYS 107 -8.290 -8.277 5.081 750 HB3 LYS 107 2HB LYS 107 -9.071 -8.998 3.680 751 HG2 LYS 107 1HG LYS 107 -9.294 -10.710 5.153 752 HG3 LYS 107 2HG LYS 107 -7.721 -11.128 4.471 753 HD2 LYS 107 1HD LYS 107 -7.827 -9.331 6.847 754 HD3 LYS 107 2HD LYS 107 -8.101 -11.060 7.076 755 HE2 LYS 107 1HE LYS 107 -5.924 -11.222 5.574 756 HE3 LYS 107 2HE LYS 107 -5.645 -9.611 6.233 757 HZ1 LYS 107 3HZ LYS 107 -6.216 -11.988 7.913 758 HZ2 LYS 107 1HZ LYS 107 -5.688 -10.466 8.430 759 HZ3 LYS 107 2HZ LYS 107 -4.652 -11.463 7.541 760 H VAL 108 H VAL 108 -5.398 -10.791 3.018 761 HA VAL 108 HA VAL 108 -6.474 -11.239 0.324 762 HB VAL 108 HB VAL 108 -3.982 -12.471 1.491 763 HG11 VAL 108 1HG1 VAL 108 -3.395 -12.974 -0.751 764 HG12 VAL 108 2HG1 VAL 108 -5.075 -13.476 -0.547 765 HG13 VAL 108 3HG1 VAL 108 -4.699 -11.971 -1.388 766 HG21 VAL 108 3HG2 VAL 108 -4.450 -9.735 0.746 767 HG22 VAL 108 1HG2 VAL 108 -2.998 -10.480 1.414 768 HG23 VAL 108 2HG2 VAL 108 -3.260 -10.468 -0.330 769 H THR 109 H THR 109 -7.592 -13.020 -0.180 770 HA THR 109 HA THR 109 -7.709 -15.188 1.815 771 HB THR 109 HB THR 109 -10.037 -15.610 1.067 772 HG1 THR 109 1HG THR 109 -9.513 -13.295 -0.489 773 HG21 THR 109 3HG2 THR 109 -10.226 -12.787 1.834 774 HG22 THR 109 1HG2 THR 109 -9.150 -13.742 2.853 775 HG23 THR 109 2HG2 THR 109 -10.834 -14.226 2.651 776 H GLY 110 H GLY 110 -8.979 -17.139 0.558 777 HA2 GLY 110 1HA GLY 110 -8.931 -18.682 -1.171 778 HA3 GLY 110 2HA GLY 110 -8.055 -17.512 -2.147 779 H GLN 111 H GLN 111 -7.832 -20.299 -0.194 780 HA GLN 111 HA GLN 111 -5.351 -20.448 0.822 781 HB2 GLN 111 1HB GLN 111 -6.595 -22.584 -0.920 782 HB3 GLN 111 2HB GLN 111 -5.307 -22.837 0.251 783 HG2 GLN 111 1HG GLN 111 -8.101 -21.913 0.884 784 HG3 GLN 111 2HG GLN 111 -7.473 -23.544 1.114 785 HE21 GLN 111 1HE2 GLN 111 -8.590 -21.976 3.151 786 HE22 GLN 111 2HE2 GLN 111 -7.355 -21.629 4.308 787 H ARG 112 H ARG 112 -3.259 -21.003 0.107 788 HA ARG 112 HA ARG 112 -2.214 -19.636 -1.997 789 HB2 ARG 112 1HB ARG 112 -0.277 -21.171 -1.902 790 HB3 ARG 112 2HB ARG 112 -0.806 -20.652 -0.308 791 HG2 ARG 112 1HG ARG 112 -1.807 -22.750 0.144 792 HG3 ARG 112 2HG ARG 112 -1.632 -23.267 -1.535 793 HD2 ARG 112 1HD ARG 112 0.712 -23.463 -1.332 794 HD3 ARG 112 2HD ARG 112 0.729 -22.581 0.194 795 HE ARG 112 HE ARG 112 -0.801 -25.001 0.313 796 HH11 ARG 112 1HH1 ARG 112 2.400 -23.649 0.531 797 HH12 ARG 112 2HH1 ARG 112 3.018 -24.935 1.514 798 HH21 ARG 112 1HH2 ARG 112 0.001 -26.700 1.606 799 HH22 ARG 112 2HH2 ARG 112 1.653 -26.671 2.124 800 H LEU 113 H LEU 113 -1.226 -20.427 -4.032 801 HA LEU 113 HA LEU 113 -3.202 -21.795 -5.602 802 HB2 LEU 113 1HB LEU 113 -0.441 -20.870 -6.382 803 HB3 LEU 113 2HB LEU 113 -1.732 -21.346 -7.483 804 HG LEU 113 HG LEU 113 -2.996 -19.360 -6.253 805 HD11 LEU 113 1HD1 LEU 113 -1.463 -18.593 -4.710 806 HD12 LEU 113 2HD1 LEU 113 -1.176 -17.514 -6.074 807 HD13 LEU 113 3HD1 LEU 113 -0.088 -18.869 -5.778 808 HD21 LEU 113 3HD2 LEU 113 -1.600 -19.719 -8.697 809 HD22 LEU 113 1HD2 LEU 113 -1.295 -18.077 -8.129 810 HD23 LEU 113 2HD2 LEU 113 -2.952 -18.640 -8.350 811 H VAL 114 H VAL 114 -2.478 -23.526 -7.182 812 HA VAL 114 HA VAL 114 -0.800 -25.491 -5.763 813 HB VAL 114 HB VAL 114 -3.107 -26.035 -7.637 814 HG11 VAL 114 1HG1 VAL 114 -2.574 -28.218 -7.626 815 HG12 VAL 114 2HG1 VAL 114 -0.959 -27.640 -7.211 816 HG13 VAL 114 3HG1 VAL 114 -2.054 -28.187 -5.941 817 HG21 VAL 114 3HG2 VAL 114 -3.598 -25.118 -5.294 818 HG22 VAL 114 1HG2 VAL 114 -4.406 -26.609 -5.778 819 HG23 VAL 114 2HG2 VAL 114 -3.008 -26.672 -4.705 820 H SER 115 H SER 115 1.013 -26.075 -6.746 821 HA SER 115 HA SER 115 1.163 -26.420 -9.595 822 HB2 SER 115 1HB SER 115 2.347 -24.023 -8.274 823 HB3 SER 115 2HB SER 115 3.284 -24.808 -9.545 824 HG SER 115 HG SER 115 0.571 -24.227 -9.978 825 HA PRO 116 HA PRO 116 4.125 -29.401 -8.297 826 HB2 PRO 116 1HB PRO 116 5.419 -29.796 -10.651 827 HB3 PRO 116 2HB PRO 116 3.789 -30.405 -10.336 828 HG2 PRO 116 1HG PRO 116 4.640 -27.954 -11.830 829 HG3 PRO 116 2HG PRO 116 3.388 -29.139 -12.245 830 HD2 PRO 116 1HD PRO 116 2.812 -26.741 -11.125 831 HD3 PRO 116 2HD PRO 116 1.846 -28.198 -10.813 832 H GLY 117 H GLY 117 5.706 -28.733 -6.962 833 HA2 GLY 117 1HA GLY 117 8.207 -27.869 -8.033 834 HA3 GLY 117 2HA GLY 117 7.370 -26.551 -7.228 835 H SER 118 H SER 118 8.407 -26.243 -5.363 836 HA SER 118 HA SER 118 9.291 -26.617 -3.300 837 HB2 SER 118 1HB SER 118 7.311 -28.877 -3.509 838 HB3 SER 118 2HB SER 118 8.313 -28.667 -2.073 839 HG SER 118 HG SER 118 7.173 -26.975 -1.518 840 H ALA 119 H ALA 119 10.867 -27.436 -5.434 841 HA ALA 119 HA ALA 119 11.992 -30.023 -4.660 842 HB1 ALA 119 3HB ALA 119 12.456 -28.241 -7.040 843 HB2 ALA 119 1HB ALA 119 13.411 -29.688 -6.712 844 HB3 ALA 119 2HB ALA 119 11.676 -29.822 -7.001 845 H ASN 120 H ASN 120 13.781 -30.200 -3.474 846 HA ASN 120 HA ASN 120 15.163 -27.786 -2.642 847 HB2 ASN 120 1HB ASN 120 14.442 -29.874 -1.188 848 HB3 ASN 120 2HB ASN 120 15.992 -30.510 -1.733 849 HD21 ASN 120 1HD2 ASN 120 14.392 -28.072 0.150 850 HD22 ASN 120 2HD2 ASN 120 15.791 -27.527 1.006 851 H GLU 121 H GLU 121 17.128 -27.157 -3.301 852 HA GLU 121 HA GLU 121 18.356 -28.489 -5.517 853 HB2 GLU 121 1HB GLU 121 19.043 -26.047 -3.901 854 HB3 GLU 121 2HB GLU 121 20.148 -26.675 -5.115 855 HG2 GLU 121 1HG GLU 121 18.434 -26.409 -6.826 856 HG3 GLU 121 2HG GLU 121 17.312 -25.797 -5.612 857 H THR 122 H THR 122 20.591 -29.183 -5.591 858 HA THR 122 HA THR 122 21.235 -30.954 -3.470 859 HB THR 122 HB THR 122 21.835 -31.380 -5.845 860 HG1 THR 122 1HG THR 122 24.081 -31.305 -4.087 861 HG21 THR 122 3HG2 THR 122 23.452 -30.196 -6.992 862 HG22 THR 122 1HG2 THR 122 24.203 -29.585 -5.519 863 HG23 THR 122 2HG2 THR 122 22.671 -28.909 -6.074 864 H SER 123 H SER 123 23.318 -30.994 -2.322 865 HA SER 123 HA SER 123 24.683 -30.062 -0.751 866 HB2 SER 123 1HB SER 123 25.111 -28.274 -3.138 867 HB3 SER 123 2HB SER 123 26.010 -28.041 -1.639 868 HG SER 123 HG SER 123 27.117 -29.396 -3.124 869 H SER 124 H SER 124 22.019 -29.398 -0.377 870 HA SER 124 HA SER 124 21.275 -26.776 -0.162 871 HB2 SER 124 1HB SER 124 19.869 -27.476 1.775 872 HB3 SER 124 2HB SER 124 19.749 -28.577 0.403 873 HG SER 124 HG SER 124 20.145 -29.981 1.952 874 H ILE 125 H ILE 125 22.998 -28.641 2.339 875 HA ILE 125 HA ILE 125 23.311 -26.838 4.320 876 HB ILE 125 HB ILE 125 25.423 -28.683 3.209 877 HG12 ILE 125 1HG1 ILE 125 23.753 -28.955 5.710 878 HG13 ILE 125 2HG1 ILE 125 23.262 -29.619 4.155 879 HG21 ILE 125 1HG2 ILE 125 25.436 -27.198 5.833 880 HG22 ILE 125 2HG2 ILE 125 26.616 -28.401 5.316 881 HG23 ILE 125 3HG2 ILE 125 26.485 -26.867 4.455 882 HD11 ILE 125 3HD1 ILE 125 24.268 -31.452 4.997 883 HD12 ILE 125 1HD1 ILE 125 25.698 -30.683 4.309 884 HD13 ILE 125 2HD1 ILE 125 25.351 -30.521 6.031 Start of MODEL 2 1 H1 GLY 1 H GLY 1 27.670 38.800 15.334 2 HA2 GLY 1 1HA GLY 1 26.579 41.408 15.618 3 HA3 GLY 1 2HA GLY 1 26.026 40.675 14.120 4 H SER 2 H SER 2 24.087 41.287 15.781 5 HA SER 2 HA SER 2 23.011 38.721 16.525 6 HB2 SER 2 1HB SER 2 23.297 40.823 18.684 7 HB3 SER 2 2HB SER 2 22.600 39.212 18.857 8 HG SER 2 HG SER 2 24.803 38.511 18.101 9 H SER 3 H SER 3 20.753 39.089 17.579 10 HA SER 3 HA SER 3 19.376 41.507 17.091 11 HB2 SER 3 1HB SER 3 19.570 41.075 14.759 12 HB3 SER 3 2HB SER 3 19.175 39.369 14.969 13 HG SER 3 HG SER 3 17.384 41.487 15.559 14 H GLY 4 H GLY 4 17.298 41.471 17.915 15 HA2 GLY 4 1HA GLY 4 16.704 39.399 19.758 16 HA3 GLY 4 2HA GLY 4 15.646 40.736 19.333 17 H SER 5 H SER 5 14.925 37.974 19.818 18 HA SER 5 HA SER 5 13.153 37.589 17.649 19 HB2 SER 5 1HB SER 5 14.035 35.475 16.764 20 HB3 SER 5 2HB SER 5 15.189 36.786 16.520 21 HG SER 5 HG SER 5 15.360 34.539 18.131 22 H SER 6 H SER 6 11.463 37.115 18.900 23 HA SER 6 HA SER 6 11.618 35.721 21.355 24 HB2 SER 6 1HB SER 6 9.239 36.297 19.574 25 HB3 SER 6 2HB SER 6 9.130 35.670 21.219 26 HG SER 6 HG SER 6 9.755 37.572 22.007 27 H GLY 7 H GLY 7 10.388 33.697 21.828 28 HA2 GLY 7 1HA GLY 7 11.275 31.625 20.023 29 HA3 GLY 7 2HA GLY 7 10.498 31.392 21.581 30 H PHE 8 H PHE 8 9.532 32.967 18.531 31 HA PHE 8 HA PHE 8 7.338 31.066 18.262 32 HB2 PHE 8 1HB PHE 8 6.484 32.989 19.622 33 HB3 PHE 8 2HB PHE 8 6.840 34.048 18.261 34 HD1 PHE 8 1HD PHE 8 4.874 31.042 19.205 35 HD2 PHE 8 2HD PHE 8 5.265 34.378 16.590 36 HE1 PHE 8 1HE PHE 8 2.661 30.548 18.249 37 HE2 PHE 8 2HE PHE 8 3.052 33.890 15.631 38 HZ PHE 8 HZ PHE 8 1.747 31.974 16.460 39 H LYS 9 H LYS 9 7.557 30.317 16.268 40 HA LYS 9 HA LYS 9 8.643 32.042 14.175 41 HB2 LYS 9 1HB LYS 9 8.947 30.014 12.886 42 HB3 LYS 9 2HB LYS 9 9.606 29.784 14.501 43 HG2 LYS 9 1HG LYS 9 7.817 28.404 15.149 44 HG3 LYS 9 2HG LYS 9 6.841 28.882 13.758 45 HD2 LYS 9 1HD LYS 9 7.656 26.720 13.264 46 HD3 LYS 9 2HD LYS 9 8.639 27.833 12.311 47 HE2 LYS 9 1HE LYS 9 10.102 26.219 13.286 48 HE3 LYS 9 2HE LYS 9 10.353 27.749 14.125 49 HZ1 LYS 9 3HZ LYS 9 9.070 25.290 15.097 50 HZ2 LYS 9 1HZ LYS 9 8.602 26.778 15.751 51 HZ3 LYS 9 2HZ LYS 9 10.213 26.277 15.859 52 H VAL 10 H VAL 10 7.652 31.895 11.987 53 HA VAL 10 HA VAL 10 4.718 31.651 12.148 54 HB VAL 10 HB VAL 10 6.244 33.716 10.555 55 HG11 VAL 10 1HG1 VAL 10 3.444 32.821 10.585 56 HG12 VAL 10 2HG1 VAL 10 3.678 34.569 10.640 57 HG13 VAL 10 3HG1 VAL 10 4.366 33.627 9.317 58 HG21 VAL 10 3HG2 VAL 10 5.120 35.315 12.143 59 HG22 VAL 10 1HG2 VAL 10 4.706 33.917 13.135 60 HG23 VAL 10 2HG2 VAL 10 6.398 34.324 12.848 61 H ARG 11 H ARG 11 3.723 30.569 10.534 62 HA ARG 11 HA ARG 11 5.446 29.393 8.472 63 HB2 ARG 11 1HB ARG 11 2.709 28.571 9.459 64 HB3 ARG 11 2HB ARG 11 3.604 27.751 8.187 65 HG2 ARG 11 1HG ARG 11 4.157 26.432 9.951 66 HG3 ARG 11 2HG ARG 11 5.458 27.620 10.062 67 HD2 ARG 11 1HD ARG 11 3.984 28.902 11.660 68 HD3 ARG 11 2HD ARG 11 2.922 27.495 11.679 69 HE ARG 11 HE ARG 11 5.568 26.709 12.262 70 HH11 ARG 11 1HH1 ARG 11 2.866 28.404 13.657 71 HH12 ARG 11 2HH1 ARG 11 3.297 28.016 15.290 72 HH21 ARG 11 1HH2 ARG 11 6.146 26.191 14.407 73 HH22 ARG 11 2HH2 ARG 11 5.164 26.757 15.715 74 H VAL 12 H VAL 12 5.230 29.908 6.388 75 HA VAL 12 HA VAL 12 2.735 30.870 5.305 76 HB VAL 12 HB VAL 12 3.807 32.959 4.370 77 HG11 VAL 12 1HG1 VAL 12 3.707 33.199 7.338 78 HG12 VAL 12 2HG1 VAL 12 3.001 34.237 6.098 79 HG13 VAL 12 3HG1 VAL 12 2.261 32.680 6.473 80 HG21 VAL 12 3HG2 VAL 12 5.960 33.349 4.746 81 HG22 VAL 12 1HG2 VAL 12 5.639 33.433 6.479 82 HG23 VAL 12 2HG2 VAL 12 6.064 31.892 5.734 83 H GLY 13 H GLY 13 3.000 31.417 2.924 84 HA2 GLY 13 1HA GLY 13 3.515 30.588 0.841 85 HA3 GLY 13 2HA GLY 13 5.178 30.806 1.364 86 H GLU 14 H GLU 14 5.376 28.926 -0.177 87 HA GLU 14 HA GLU 14 4.979 26.411 1.307 88 HB2 GLU 14 1HB GLU 14 4.363 25.271 -0.610 89 HB3 GLU 14 2HB GLU 14 3.608 26.837 -0.871 90 HG2 GLU 14 1HG GLU 14 5.782 27.414 -2.137 91 HG3 GLU 14 2HG GLU 14 6.027 25.669 -2.179 92 HA PRO 15 HA PRO 15 9.309 25.735 1.037 93 HB2 PRO 15 1HB PRO 15 9.394 23.023 0.952 94 HB3 PRO 15 2HB PRO 15 8.983 23.926 2.415 95 HG2 PRO 15 1HG PRO 15 7.172 22.585 0.445 96 HG3 PRO 15 2HG PRO 15 7.088 22.592 2.216 97 HD2 PRO 15 1HD PRO 15 5.531 24.186 0.678 98 HD3 PRO 15 2HD PRO 15 6.102 24.674 2.287 99 H GLY 16 H GLY 16 11.007 24.655 -0.284 100 HA2 GLY 16 1HA GLY 16 10.512 25.077 -3.058 101 HA3 GLY 16 2HA GLY 16 11.995 24.452 -2.353 102 H GLN 17 H GLN 17 12.100 22.167 -1.857 103 HA GLN 17 HA GLN 17 11.503 20.483 -3.889 104 HB2 GLN 17 1HB GLN 17 11.674 18.612 -2.272 105 HB3 GLN 17 2HB GLN 17 12.950 19.806 -2.075 106 HG2 GLN 17 1HG GLN 17 11.743 20.781 -0.185 107 HG3 GLN 17 2HG GLN 17 10.476 19.570 -0.378 108 HE21 GLN 17 1HE2 GLN 17 10.663 17.755 0.734 109 HE22 GLN 17 2HE2 GLN 17 12.098 17.189 1.511 110 H ALA 18 H ALA 18 9.760 19.535 -4.732 111 HA ALA 18 HA ALA 18 7.181 19.986 -3.454 112 HB1 ALA 18 3HB ALA 18 6.615 20.378 -5.567 113 HB2 ALA 18 1HB ALA 18 8.124 19.690 -6.168 114 HB3 ALA 18 2HB ALA 18 6.741 18.642 -5.847 115 H GLY 19 H GLY 19 5.990 18.449 -2.494 116 HA2 GLY 19 1HA GLY 19 5.834 15.763 -3.123 117 HA3 GLY 19 2HA GLY 19 7.137 15.897 -1.952 118 H ASN 20 H ASN 20 3.940 17.441 -2.285 119 HA ASN 20 HA ASN 20 3.493 17.138 0.561 120 HB2 ASN 20 1HB ASN 20 1.254 18.261 -0.086 121 HB3 ASN 20 2HB ASN 20 2.732 19.209 -0.223 122 HD21 ASN 20 1HD2 ASN 20 0.537 17.160 -2.083 123 HD22 ASN 20 2HD2 ASN 20 0.749 17.993 -3.583 124 HA PRO 21 HA PRO 21 1.456 13.217 -0.050 125 HB2 PRO 21 1HB PRO 21 0.847 12.822 2.566 126 HB3 PRO 21 2HB PRO 21 2.466 12.560 1.906 127 HG2 PRO 21 1HG PRO 21 1.392 14.917 3.406 128 HG3 PRO 21 2HG PRO 21 2.955 14.099 3.579 129 HD2 PRO 21 1HD PRO 21 2.667 16.415 2.207 130 HD3 PRO 21 2HD PRO 21 3.867 15.185 1.762 131 H ALA 22 H ALA 22 0.118 16.010 1.598 132 HA ALA 22 HA ALA 22 -2.475 15.195 2.084 133 HB1 ALA 22 3HB ALA 22 -3.051 17.655 1.641 134 HB2 ALA 22 1HB ALA 22 -1.884 17.294 2.914 135 HB3 ALA 22 2HB ALA 22 -1.326 17.864 1.340 136 H LEU 23 H LEU 23 -1.156 16.597 -0.908 137 HA LEU 23 HA LEU 23 -3.631 16.371 -2.325 138 HB2 LEU 23 1HB LEU 23 -0.841 16.746 -3.403 139 HB3 LEU 23 2HB LEU 23 -2.344 17.020 -4.282 140 HG LEU 23 HG LEU 23 -1.377 18.610 -1.906 141 HD11 LEU 23 1HD1 LEU 23 -0.218 19.826 -3.348 142 HD12 LEU 23 2HD1 LEU 23 -1.695 20.164 -4.249 143 HD13 LEU 23 3HD1 LEU 23 -0.711 18.761 -4.665 144 HD21 LEU 23 3HD2 LEU 23 -3.304 20.103 -3.024 145 HD22 LEU 23 1HD2 LEU 23 -3.602 18.962 -1.713 146 HD23 LEU 23 2HD2 LEU 23 -3.933 18.494 -3.381 147 H VAL 24 H VAL 24 -0.663 14.467 -2.140 148 HA VAL 24 HA VAL 24 -0.986 12.694 -4.204 149 HB VAL 24 HB VAL 24 0.078 12.229 -1.425 150 HG11 VAL 24 1HG1 VAL 24 1.154 10.174 -2.580 151 HG12 VAL 24 2HG1 VAL 24 -0.505 10.057 -1.989 152 HG13 VAL 24 3HG1 VAL 24 -0.196 10.313 -3.707 153 HG21 VAL 24 3HG2 VAL 24 2.148 12.682 -2.287 154 HG22 VAL 24 1HG2 VAL 24 1.711 12.145 -3.909 155 HG23 VAL 24 2HG2 VAL 24 1.161 13.714 -3.321 156 H SER 25 H SER 25 -2.084 10.792 -4.557 157 HA SER 25 HA SER 25 -3.931 9.815 -2.526 158 HB2 SER 25 1HB SER 25 -4.854 10.695 -5.272 159 HB3 SER 25 2HB SER 25 -5.849 9.858 -4.080 160 HG SER 25 HG SER 25 -5.594 11.646 -2.703 161 H ALA 26 H ALA 26 -4.720 7.693 -2.937 162 HA ALA 26 HA ALA 26 -3.413 6.264 -5.147 163 HB1 ALA 26 3HB ALA 26 -3.571 5.037 -2.417 164 HB2 ALA 26 1HB ALA 26 -2.557 4.579 -3.786 165 HB3 ALA 26 2HB ALA 26 -2.209 6.055 -2.885 166 H TYR 27 H TYR 27 -4.613 4.681 -6.088 167 HA TYR 27 HA TYR 27 -6.907 3.518 -4.829 168 HB2 TYR 27 1HB TYR 27 -8.627 4.429 -6.221 169 HB3 TYR 27 2HB TYR 27 -7.741 5.786 -5.533 170 HD1 TYR 27 1HD TYR 27 -6.274 7.155 -6.941 171 HD2 TYR 27 2HD TYR 27 -8.570 3.974 -8.587 172 HE1 TYR 27 1HE TYR 27 -5.892 8.055 -9.198 173 HE2 TYR 27 2HE TYR 27 -8.193 4.864 -10.849 174 HH TYR 27 HH TYR 27 -6.676 7.964 -11.374 175 H GLY 28 H GLY 28 -8.107 2.073 -6.391 176 HA2 GLY 28 1HA GLY 28 -7.586 1.288 -8.866 177 HA3 GLY 28 2HA GLY 28 -6.127 0.728 -8.062 178 H THR 29 H THR 29 -6.483 -1.443 -8.356 179 HA THR 29 HA THR 29 -8.856 -2.558 -7.007 180 HB THR 29 HB THR 29 -7.254 -3.872 -9.209 181 HG1 THR 29 1HG THR 29 -8.710 -1.903 -9.640 182 HG21 THR 29 3HG2 THR 29 -9.756 -5.015 -9.112 183 HG22 THR 29 1HG2 THR 29 -9.372 -4.763 -7.410 184 HG23 THR 29 2HG2 THR 29 -8.284 -5.705 -8.430 185 H GLY 30 H GLY 30 -5.551 -2.183 -6.782 186 HA2 GLY 30 1HA GLY 30 -4.908 -4.757 -5.655 187 HA3 GLY 30 2HA GLY 30 -3.865 -3.344 -5.696 188 H LEU 31 H LEU 31 -5.763 -1.580 -4.413 189 HA LEU 31 HA LEU 31 -5.154 -2.251 -1.688 190 HB2 LEU 31 1HB LEU 31 -6.794 0.022 -2.798 191 HB3 LEU 31 2HB LEU 31 -6.191 -0.112 -1.147 192 HG LEU 31 HG LEU 31 -4.375 0.039 -3.543 193 HD11 LEU 31 1HD1 LEU 31 -6.049 2.043 -2.948 194 HD12 LEU 31 2HD1 LEU 31 -4.409 2.297 -3.545 195 HD13 LEU 31 3HD1 LEU 31 -4.745 2.406 -1.817 196 HD21 LEU 31 3HD2 LEU 31 -3.113 1.111 -1.355 197 HD22 LEU 31 1HD2 LEU 31 -2.897 -0.529 -1.966 198 HD23 LEU 31 2HD2 LEU 31 -4.038 -0.220 -0.657 199 H GLU 32 H GLU 32 -7.926 -2.458 -3.775 200 HA GLU 32 HA GLU 32 -10.029 -2.539 -1.998 201 HB2 GLU 32 1HB GLU 32 -9.658 -4.308 -4.422 202 HB3 GLU 32 2HB GLU 32 -11.187 -3.957 -3.628 203 HG2 GLU 32 1HG GLU 32 -9.548 -1.687 -4.626 204 HG3 GLU 32 2HG GLU 32 -10.437 -2.671 -5.787 205 H GLY 33 H GLY 33 -7.792 -5.146 -2.868 206 HA2 GLY 33 1HA GLY 33 -7.887 -6.391 -0.366 207 HA3 GLY 33 2HA GLY 33 -9.064 -7.190 -1.398 208 H GLY 34 H GLY 34 -7.114 -8.742 -0.469 209 HA2 GLY 34 1HA GLY 34 -4.986 -8.837 -2.482 210 HA3 GLY 34 2HA GLY 34 -5.030 -9.751 -0.981 211 H THR 35 H THR 35 -5.647 -9.797 -4.315 212 HA THR 35 HA THR 35 -7.273 -12.227 -4.141 213 HB THR 35 HB THR 35 -7.116 -11.860 -6.779 214 HG1 THR 35 1HG THR 35 -7.109 -9.174 -5.918 215 HG21 THR 35 3HG2 THR 35 -9.110 -11.769 -5.134 216 HG22 THR 35 1HG2 THR 35 -9.263 -10.955 -6.690 217 HG23 THR 35 2HG2 THR 35 -8.914 -10.020 -5.236 218 H THR 36 H THR 36 -6.067 -13.999 -3.860 219 HA THR 36 HA THR 36 -3.402 -14.242 -4.894 220 HB THR 36 HB THR 36 -4.913 -16.634 -3.945 221 HG1 THR 36 1HG THR 36 -4.432 -14.307 -2.471 222 HG21 THR 36 3HG2 THR 36 -2.258 -15.824 -2.904 223 HG22 THR 36 1HG2 THR 36 -2.345 -16.289 -4.602 224 HG23 THR 36 2HG2 THR 36 -2.860 -17.420 -3.350 225 H GLY 37 H GLY 37 -3.024 -14.582 -6.985 226 HA2 GLY 37 1HA GLY 37 -3.048 -16.367 -8.690 227 HA3 GLY 37 2HA GLY 37 -4.779 -16.485 -8.411 228 H ILE 38 H ILE 38 -4.868 -13.466 -8.201 229 HA ILE 38 HA ILE 38 -4.887 -12.965 -11.101 230 HB ILE 38 HB ILE 38 -6.432 -11.460 -8.991 231 HG12 ILE 38 1HG1 ILE 38 -7.541 -13.531 -10.884 232 HG13 ILE 38 2HG1 ILE 38 -7.030 -13.926 -9.246 233 HG21 ILE 38 1HG2 ILE 38 -6.138 -10.127 -10.933 234 HG22 ILE 38 2HG2 ILE 38 -6.509 -11.482 -11.999 235 HG23 ILE 38 3HG2 ILE 38 -7.778 -10.771 -11.002 236 HD11 ILE 38 3HD1 ILE 38 -8.807 -12.896 -8.297 237 HD12 ILE 38 1HD1 ILE 38 -8.928 -11.681 -9.570 238 HD13 ILE 38 2HD1 ILE 38 -9.533 -13.314 -9.849 239 H GLN 39 H GLN 39 -4.398 -10.766 -11.809 240 HA GLN 39 HA GLN 39 -2.283 -9.574 -10.151 241 HB2 GLN 39 1HB GLN 39 -1.302 -10.197 -12.177 242 HB3 GLN 39 2HB GLN 39 -2.714 -9.730 -13.115 243 HG2 GLN 39 1HG GLN 39 -2.224 -7.387 -12.734 244 HG3 GLN 39 2HG GLN 39 -0.843 -7.824 -11.728 245 HE21 GLN 39 1HE2 GLN 39 0.851 -9.121 -12.797 246 HE22 GLN 39 2HE2 GLN 39 1.212 -8.783 -14.452 247 H SER 40 H SER 40 -2.526 -7.585 -9.359 248 HA SER 40 HA SER 40 -4.686 -5.906 -10.455 249 HB2 SER 40 1HB SER 40 -3.818 -6.074 -7.559 250 HB3 SER 40 2HB SER 40 -5.120 -5.072 -8.201 251 HG SER 40 HG SER 40 -6.383 -6.739 -8.105 252 H GLU 41 H GLU 41 -4.399 -3.564 -10.009 253 HA GLU 41 HA GLU 41 -1.688 -2.666 -9.512 254 HB2 GLU 41 1HB GLU 41 -1.224 -1.757 -11.595 255 HB3 GLU 41 2HB GLU 41 -2.000 -3.277 -12.019 256 HG2 GLU 41 1HG GLU 41 -4.164 -1.909 -12.143 257 HG3 GLU 41 2HG GLU 41 -3.105 -0.500 -12.170 258 H PHE 42 H PHE 42 -1.628 -0.661 -8.648 259 HA PHE 42 HA PHE 42 -4.124 0.904 -8.682 260 HB2 PHE 42 1HB PHE 42 -3.761 1.548 -6.393 261 HB3 PHE 42 2HB PHE 42 -3.674 -0.209 -6.484 262 HD1 PHE 42 1HD PHE 42 -1.746 2.878 -6.030 263 HD2 PHE 42 2HD PHE 42 -1.634 -1.377 -6.040 264 HE1 PHE 42 1HE PHE 42 0.464 2.937 -4.950 265 HE2 PHE 42 2HE PHE 42 0.576 -1.325 -4.959 266 HZ PHE 42 HZ PHE 42 1.627 0.834 -4.412 267 H PHE 43 H PHE 43 -3.961 3.015 -9.178 268 HA PHE 43 HA PHE 43 -1.316 4.017 -9.900 269 HB2 PHE 43 1HB PHE 43 -4.093 5.062 -10.479 270 HB3 PHE 43 2HB PHE 43 -2.612 5.860 -10.997 271 HD1 PHE 43 1HD PHE 43 -0.927 4.191 -12.255 272 HD2 PHE 43 2HD PHE 43 -5.154 3.749 -12.021 273 HE1 PHE 43 1HE PHE 43 -0.891 2.807 -14.289 274 HE2 PHE 43 2HE PHE 43 -5.125 2.364 -14.054 275 HZ PHE 43 HZ PHE 43 -2.992 1.890 -15.190 276 H ILE 44 H ILE 44 -0.672 6.192 -9.324 277 HA ILE 44 HA ILE 44 -1.836 7.098 -6.773 278 HB ILE 44 HB ILE 44 1.082 7.255 -7.529 279 HG12 ILE 44 1HG1 ILE 44 -0.089 5.496 -5.386 280 HG13 ILE 44 2HG1 ILE 44 0.077 4.929 -7.044 281 HG21 ILE 44 1HG2 ILE 44 -0.490 8.579 -5.549 282 HG22 ILE 44 2HG2 ILE 44 0.659 7.506 -4.753 283 HG23 ILE 44 3HG2 ILE 44 1.235 8.733 -5.882 284 HD11 ILE 44 3HD1 ILE 44 2.000 4.152 -6.052 285 HD12 ILE 44 1HD1 ILE 44 2.545 5.665 -6.776 286 HD13 ILE 44 2HD1 ILE 44 2.192 5.590 -5.050 287 H ASN 45 H ASN 45 -2.984 8.850 -7.360 288 HA ASN 45 HA ASN 45 -2.330 10.609 -9.456 289 HB2 ASN 45 1HB ASN 45 -4.565 10.237 -8.092 290 HB3 ASN 45 2HB ASN 45 -3.935 11.566 -7.123 291 HD21 ASN 45 1HD2 ASN 45 -5.622 10.702 -9.893 292 HD22 ASN 45 2HD2 ASN 45 -5.677 12.254 -10.652 293 H THR 46 H THR 46 -0.142 11.176 -9.192 294 HA THR 46 HA THR 46 0.383 13.059 -6.984 295 HB THR 46 HB THR 46 1.806 11.033 -6.911 296 HG1 THR 46 1HG THR 46 3.870 12.354 -7.089 297 HG21 THR 46 3HG2 THR 46 3.690 11.428 -8.884 298 HG22 THR 46 1HG2 THR 46 2.167 11.712 -9.725 299 HG23 THR 46 2HG2 THR 46 2.439 10.184 -8.887 300 H THR 47 H THR 47 -0.877 13.724 -9.502 301 HA THR 47 HA THR 47 1.130 15.061 -11.100 302 HB THR 47 HB THR 47 -0.756 15.849 -12.465 303 HG1 THR 47 1HG THR 47 -2.405 16.110 -11.014 304 HG21 THR 47 3HG2 THR 47 -0.064 13.103 -11.969 305 HG22 THR 47 1HG2 THR 47 -0.481 13.889 -13.491 306 HG23 THR 47 2HG2 THR 47 -1.752 13.224 -12.466 307 H ARG 48 H ARG 48 -0.740 15.783 -8.355 308 HA ARG 48 HA ARG 48 -0.601 18.670 -8.805 309 HB2 ARG 48 1HB ARG 48 -2.077 16.926 -6.862 310 HB3 ARG 48 2HB ARG 48 -1.836 18.632 -6.509 311 HG2 ARG 48 1HG ARG 48 -3.079 17.667 -9.067 312 HG3 ARG 48 2HG ARG 48 -4.017 18.007 -7.611 313 HD2 ARG 48 1HD ARG 48 -3.460 20.288 -7.656 314 HD3 ARG 48 2HD ARG 48 -2.137 20.028 -8.791 315 HE ARG 48 HE ARG 48 -4.912 20.394 -9.423 316 HH11 ARG 48 1HH1 ARG 48 -1.900 19.016 -10.496 317 HH12 ARG 48 2HH1 ARG 48 -2.335 19.045 -12.173 318 HH21 ARG 48 1HH2 ARG 48 -5.495 20.438 -11.627 319 HH22 ARG 48 2HH2 ARG 48 -4.379 19.855 -12.816 320 H ALA 49 H ALA 49 0.781 16.123 -6.867 321 HA ALA 49 HA ALA 49 2.066 17.876 -4.991 322 HB1 ALA 49 3HB ALA 49 2.235 14.939 -5.562 323 HB2 ALA 49 1HB ALA 49 3.361 15.721 -4.452 324 HB3 ALA 49 2HB ALA 49 1.628 15.760 -4.124 325 H GLY 50 H GLY 50 3.212 15.861 -7.703 326 HA2 GLY 50 1HA GLY 50 4.784 16.879 -9.279 327 HA3 GLY 50 2HA GLY 50 5.537 17.672 -7.904 328 HA PRO 51 HA PRO 51 7.300 13.299 -8.893 329 HB2 PRO 51 1HB PRO 51 9.224 13.902 -10.712 330 HB3 PRO 51 2HB PRO 51 7.584 13.429 -11.170 331 HG2 PRO 51 1HG PRO 51 8.787 16.165 -10.996 332 HG3 PRO 51 2HG PRO 51 7.727 15.486 -12.245 333 HD2 PRO 51 1HD PRO 51 6.812 17.121 -10.291 334 HD3 PRO 51 2HD PRO 51 5.823 15.825 -10.993 335 H GLY 52 H GLY 52 8.780 12.727 -7.427 336 HA2 GLY 52 1HA GLY 52 11.260 14.120 -7.110 337 HA3 GLY 52 2HA GLY 52 10.157 14.437 -5.779 338 H THR 53 H THR 53 10.596 13.226 -4.075 339 HA THR 53 HA THR 53 12.119 10.809 -4.278 340 HB THR 53 HB THR 53 11.757 10.651 -1.811 341 HG1 THR 53 1HG THR 53 10.461 13.170 -2.078 342 HG21 THR 53 3HG2 THR 53 12.567 13.463 -2.193 343 HG22 THR 53 1HG2 THR 53 13.427 12.277 -3.173 344 HG23 THR 53 2HG2 THR 53 13.423 12.132 -1.416 345 H LEU 54 H LEU 54 11.398 8.795 -4.504 346 HA LEU 54 HA LEU 54 8.526 8.291 -4.095 347 HB2 LEU 54 1HB LEU 54 9.729 8.025 -6.405 348 HB3 LEU 54 2HB LEU 54 10.277 6.498 -5.717 349 HG LEU 54 HG LEU 54 7.376 7.276 -5.969 350 HD11 LEU 54 1HD1 LEU 54 7.228 6.144 -7.983 351 HD12 LEU 54 2HD1 LEU 54 8.759 5.303 -7.741 352 HD13 LEU 54 3HD1 LEU 54 8.751 7.020 -8.143 353 HD21 LEU 54 3HD2 LEU 54 7.883 5.609 -4.247 354 HD22 LEU 54 1HD2 LEU 54 8.716 4.624 -5.450 355 HD23 LEU 54 2HD2 LEU 54 6.980 4.905 -5.589 356 H SER 55 H SER 55 8.150 7.282 -2.240 357 HA SER 55 HA SER 55 10.019 5.164 -1.396 358 HB2 SER 55 1HB SER 55 8.401 7.050 0.333 359 HB3 SER 55 2HB SER 55 9.339 5.688 0.944 360 HG SER 55 HG SER 55 10.613 7.557 -0.702 361 H VAL 56 H VAL 56 9.162 3.209 -1.521 362 HA VAL 56 HA VAL 56 6.369 2.807 -0.748 363 HB VAL 56 HB VAL 56 6.247 3.005 -3.157 364 HG11 VAL 56 1HG1 VAL 56 7.718 2.141 -4.626 365 HG12 VAL 56 2HG1 VAL 56 8.784 2.070 -3.222 366 HG13 VAL 56 3HG1 VAL 56 7.892 0.634 -3.727 367 HG21 VAL 56 3HG2 VAL 56 5.466 0.648 -3.701 368 HG22 VAL 56 1HG2 VAL 56 5.987 0.213 -2.072 369 HG23 VAL 56 2HG2 VAL 56 4.723 1.422 -2.301 370 H THR 57 H THR 57 5.970 0.882 0.248 371 HA THR 57 HA THR 57 7.951 -1.244 0.170 372 HB THR 57 HB THR 57 7.195 0.077 2.784 373 HG1 THR 57 1HG THR 57 9.547 0.446 2.795 374 HG21 THR 57 3HG2 THR 57 9.046 -1.523 3.601 375 HG22 THR 57 1HG2 THR 57 8.736 -2.409 2.108 376 HG23 THR 57 2HG2 THR 57 7.444 -2.191 3.289 377 H ILE 58 H ILE 58 7.168 -3.251 0.902 378 HA ILE 58 HA ILE 58 4.345 -3.364 1.681 379 HB ILE 58 HB ILE 58 5.534 -5.008 -0.556 380 HG12 ILE 58 1HG1 ILE 58 3.208 -3.132 -0.823 381 HG13 ILE 58 2HG1 ILE 58 4.853 -2.509 -0.909 382 HG21 ILE 58 1HG2 ILE 58 3.999 -6.385 0.593 383 HG22 ILE 58 2HG2 ILE 58 2.847 -5.065 0.790 384 HG23 ILE 58 3HG2 ILE 58 3.128 -5.757 -0.807 385 HD11 ILE 58 3HD1 ILE 58 4.503 -4.826 -2.597 386 HD12 ILE 58 1HD1 ILE 58 3.356 -3.546 -2.989 387 HD13 ILE 58 2HD1 ILE 58 5.088 -3.211 -2.997 388 H GLU 59 H GLU 59 3.788 -5.091 2.972 389 HA GLU 59 HA GLU 59 5.946 -6.964 3.677 390 HB2 GLU 59 1HB GLU 59 4.197 -5.332 5.495 391 HB3 GLU 59 2HB GLU 59 4.893 -6.850 6.043 392 HG2 GLU 59 1HG GLU 59 7.141 -5.918 5.392 393 HG3 GLU 59 2HG GLU 59 6.337 -4.365 5.177 394 H GLY 60 H GLY 60 5.137 -8.935 4.800 395 HA2 GLY 60 1HA GLY 60 2.557 -9.799 5.025 396 HA3 GLY 60 2HA GLY 60 2.927 -10.025 3.322 397 HA PRO 61 HA PRO 61 4.324 -13.712 5.908 398 HB2 PRO 61 1HB PRO 61 2.657 -15.538 4.784 399 HB3 PRO 61 2HB PRO 61 2.218 -14.581 6.204 400 HG2 PRO 61 1HG PRO 61 1.494 -14.151 3.331 401 HG3 PRO 61 2HG PRO 61 0.474 -14.011 4.775 402 HD2 PRO 61 1HD PRO 61 1.545 -11.856 3.535 403 HD3 PRO 61 2HD PRO 61 1.269 -11.909 5.288 404 H SER 62 H SER 62 3.489 -13.323 2.498 405 HA SER 62 HA SER 62 5.854 -14.939 1.807 406 HB2 SER 62 1HB SER 62 3.115 -14.899 0.574 407 HB3 SER 62 2HB SER 62 4.518 -15.351 -0.394 408 HG SER 62 HG SER 62 4.003 -16.554 2.107 409 H LYS 63 H LYS 63 7.368 -13.521 1.223 410 HA LYS 63 HA LYS 63 7.143 -10.939 0.404 411 HB2 LYS 63 1HB LYS 63 9.159 -13.066 -0.180 412 HB3 LYS 63 2HB LYS 63 9.292 -11.525 -1.016 413 HG2 LYS 63 1HG LYS 63 10.662 -11.287 0.849 414 HG3 LYS 63 2HG LYS 63 9.170 -10.461 1.305 415 HD2 LYS 63 1HD LYS 63 8.458 -12.337 2.616 416 HD3 LYS 63 2HD LYS 63 9.800 -13.320 2.027 417 HE2 LYS 63 1HE LYS 63 10.398 -10.749 3.409 418 HE3 LYS 63 2HE LYS 63 9.900 -12.135 4.377 419 HZ1 LYS 63 3HZ LYS 63 12.422 -11.598 3.269 420 HZ2 LYS 63 1HZ LYS 63 11.825 -13.016 2.563 421 HZ3 LYS 63 2HZ LYS 63 11.957 -12.900 4.245 422 H VAL 64 H VAL 64 6.212 -9.942 -1.249 423 HA VAL 64 HA VAL 64 5.528 -11.496 -3.639 424 HB VAL 64 HB VAL 64 3.931 -9.753 -4.164 425 HG11 VAL 64 1HG1 VAL 64 2.852 -11.267 -2.829 426 HG12 VAL 64 2HG1 VAL 64 3.910 -10.971 -1.448 427 HG13 VAL 64 3HG1 VAL 64 2.652 -9.806 -1.862 428 HG21 VAL 64 3HG2 VAL 64 4.618 -7.689 -3.560 429 HG22 VAL 64 1HG2 VAL 64 3.702 -8.040 -2.095 430 HG23 VAL 64 2HG2 VAL 64 5.450 -8.271 -2.119 431 H LYS 65 H LYS 65 6.637 -11.239 -5.455 432 HA LYS 65 HA LYS 65 8.618 -9.135 -5.657 433 HB2 LYS 65 1HB LYS 65 8.777 -11.664 -6.398 434 HB3 LYS 65 2HB LYS 65 8.057 -11.051 -7.881 435 HG2 LYS 65 1HG LYS 65 10.500 -9.777 -6.711 436 HG3 LYS 65 2HG LYS 65 10.612 -11.213 -7.731 437 HD2 LYS 65 1HD LYS 65 9.715 -10.093 -9.592 438 HD3 LYS 65 2HD LYS 65 9.108 -8.762 -8.604 439 HE2 LYS 65 1HE LYS 65 11.504 -8.214 -8.066 440 HE3 LYS 65 2HE LYS 65 11.973 -9.395 -9.288 441 HZ1 LYS 65 3HZ LYS 65 10.954 -8.120 -10.975 442 HZ2 LYS 65 1HZ LYS 65 11.866 -7.031 -10.056 443 HZ3 LYS 65 2HZ LYS 65 10.187 -7.102 -9.864 444 H MET 66 H MET 66 7.700 -7.197 -6.100 445 HA MET 66 HA MET 66 6.048 -7.037 -8.535 446 HB2 MET 66 1HB MET 66 4.983 -5.026 -7.509 447 HB3 MET 66 2HB MET 66 4.648 -6.524 -6.651 448 HG2 MET 66 1HG MET 66 5.128 -5.201 -4.881 449 HG3 MET 66 2HG MET 66 6.756 -5.765 -5.249 450 HE1 MET 66 3HE MET 66 8.487 -4.727 -5.817 451 HE2 MET 66 1HE MET 66 8.498 -3.483 -7.067 452 HE3 MET 66 2HE MET 66 8.757 -3.039 -5.380 453 H ASP 67 H ASP 67 6.027 -4.576 -9.267 454 HA ASP 67 HA ASP 67 8.716 -3.438 -9.060 455 HB2 ASP 67 1HB ASP 67 8.866 -3.149 -11.492 456 HB3 ASP 67 2HB ASP 67 8.744 -4.854 -11.064 457 H CYS 68 H CYS 68 8.662 -1.311 -10.558 458 HA CYS 68 HA CYS 68 6.152 0.105 -9.958 459 HB2 CYS 68 1HB CYS 68 8.967 0.849 -9.285 460 HB3 CYS 68 2HB CYS 68 7.826 2.131 -9.671 461 HG CYS 68 HG CYS 68 7.624 2.227 -7.033 462 H GLN 69 H GLN 69 5.489 -0.135 -12.118 463 HA GLN 69 HA GLN 69 7.094 0.643 -14.327 464 HB2 GLN 69 1HB GLN 69 5.049 -0.890 -14.336 465 HB3 GLN 69 2HB GLN 69 4.082 0.578 -14.300 466 HG2 GLN 69 1HG GLN 69 4.310 -0.265 -16.562 467 HG3 GLN 69 2HG GLN 69 5.087 1.308 -16.392 468 HE21 GLN 69 1HE2 GLN 69 6.369 0.918 -18.208 469 HE22 GLN 69 2HE2 GLN 69 7.720 -0.158 -18.156 470 H GLU 70 H GLU 70 6.923 2.490 -15.650 471 HA GLU 70 HA GLU 70 6.202 4.896 -14.170 472 HB2 GLU 70 1HB GLU 70 8.409 4.461 -15.515 473 HB3 GLU 70 2HB GLU 70 7.431 4.925 -16.901 474 HG2 GLU 70 1HG GLU 70 7.650 6.646 -14.455 475 HG3 GLU 70 2HG GLU 70 8.805 6.741 -15.784 476 H THR 71 H THR 71 4.655 6.338 -14.782 477 HA THR 71 HA THR 71 3.164 5.829 -17.254 478 HB THR 71 HB THR 71 1.012 6.061 -16.108 479 HG1 THR 71 1HG THR 71 2.692 6.409 -13.874 480 HG21 THR 71 3HG2 THR 71 2.687 3.833 -16.056 481 HG22 THR 71 1HG2 THR 71 0.938 3.846 -15.832 482 HG23 THR 71 2HG2 THR 71 2.007 3.923 -14.432 483 HA PRO 72 HA PRO 72 3.222 10.203 -17.676 484 HB2 PRO 72 1HB PRO 72 0.986 10.580 -19.169 485 HB3 PRO 72 2HB PRO 72 2.469 9.873 -19.822 486 HG2 PRO 72 1HG PRO 72 -0.023 8.509 -18.876 487 HG3 PRO 72 2HG PRO 72 0.959 8.174 -20.314 488 HD2 PRO 72 1HD PRO 72 1.135 6.696 -18.052 489 HD3 PRO 72 2HD PRO 72 2.526 6.978 -19.120 490 H GLU 73 H GLU 73 0.961 8.597 -15.817 491 HA GLU 73 HA GLU 73 -0.395 11.090 -15.038 492 HB2 GLU 73 1HB GLU 73 -1.635 8.877 -15.779 493 HB3 GLU 73 2HB GLU 73 -1.331 8.409 -14.112 494 HG2 GLU 73 1HG GLU 73 -2.726 10.015 -13.257 495 HG3 GLU 73 2HG GLU 73 -2.564 11.060 -14.666 496 H GLY 74 H GLY 74 1.345 8.277 -13.806 497 HA2 GLY 74 1HA GLY 74 2.480 9.729 -11.657 498 HA3 GLY 74 2HA GLY 74 1.135 8.762 -11.071 499 H TYR 75 H TYR 75 1.867 6.991 -10.117 500 HA TYR 75 HA TYR 75 3.987 5.459 -11.466 501 HB2 TYR 75 1HB TYR 75 3.716 5.715 -8.468 502 HB3 TYR 75 2HB TYR 75 5.014 4.927 -9.359 503 HD1 TYR 75 1HD TYR 75 5.662 6.898 -11.421 504 HD2 TYR 75 2HD TYR 75 4.704 7.473 -7.315 505 HE1 TYR 75 1HE TYR 75 6.939 8.999 -11.423 506 HE2 TYR 75 2HE TYR 75 5.978 9.576 -7.307 507 HH TYR 75 HH TYR 75 7.575 10.769 -10.248 508 H LYS 76 H LYS 76 3.252 3.542 -12.061 509 HA LYS 76 HA LYS 76 0.948 2.387 -10.678 510 HB2 LYS 76 1HB LYS 76 0.950 2.632 -13.173 511 HB3 LYS 76 2HB LYS 76 2.264 1.466 -13.238 512 HG2 LYS 76 1HG LYS 76 0.556 0.006 -11.844 513 HG3 LYS 76 2HG LYS 76 -0.613 1.058 -12.646 514 HD2 LYS 76 1HD LYS 76 1.537 -0.204 -14.279 515 HD3 LYS 76 2HD LYS 76 0.177 -1.199 -13.753 516 HE2 LYS 76 1HE LYS 76 -0.652 -0.429 -15.736 517 HE3 LYS 76 2HE LYS 76 -1.219 0.848 -14.662 518 HZ1 LYS 76 3HZ LYS 76 0.621 1.001 -16.834 519 HZ2 LYS 76 1HZ LYS 76 1.291 1.635 -15.416 520 HZ3 LYS 76 2HZ LYS 76 -0.170 2.247 -16.008 521 H VAL 77 H VAL 77 1.030 0.532 -9.531 522 HA VAL 77 HA VAL 77 3.584 -0.938 -9.483 523 HB VAL 77 HB VAL 77 1.830 -0.298 -7.106 524 HG11 VAL 77 1HG1 VAL 77 3.627 -1.414 -5.802 525 HG12 VAL 77 2HG1 VAL 77 2.736 -2.510 -6.860 526 HG13 VAL 77 3HG1 VAL 77 4.343 -1.949 -7.322 527 HG21 VAL 77 3HG2 VAL 77 3.054 1.548 -6.922 528 HG22 VAL 77 1HG2 VAL 77 4.482 0.536 -6.702 529 HG23 VAL 77 2HG2 VAL 77 4.032 1.086 -8.316 530 H MET 78 H MET 78 3.255 -2.904 -10.274 531 HA MET 78 HA MET 78 0.650 -4.194 -9.854 532 HB2 MET 78 1HB MET 78 2.849 -4.872 -11.816 533 HB3 MET 78 2HB MET 78 1.294 -5.685 -11.702 534 HG2 MET 78 1HG MET 78 0.143 -3.680 -12.368 535 HG3 MET 78 2HG MET 78 1.653 -2.771 -12.352 536 HE1 MET 78 3HE MET 78 3.848 -3.850 -14.284 537 HE2 MET 78 1HE MET 78 3.068 -3.078 -15.665 538 HE3 MET 78 2HE MET 78 2.977 -2.331 -14.070 539 H TYR 79 H TYR 79 0.465 -5.871 -8.518 540 HA TYR 79 HA TYR 79 2.749 -7.587 -7.973 541 HB2 TYR 79 1HB TYR 79 2.823 -7.255 -5.649 542 HB3 TYR 79 2HB TYR 79 2.711 -5.627 -6.309 543 HD1 TYR 79 1HD TYR 79 0.579 -8.364 -4.942 544 HD2 TYR 79 2HD TYR 79 1.078 -4.178 -5.512 545 HE1 TYR 79 1HE TYR 79 -1.404 -7.944 -3.549 546 HE2 TYR 79 2HE TYR 79 -0.903 -3.746 -4.120 547 HH TYR 79 HH TYR 79 -2.107 -5.233 -2.120 548 H THR 80 H THR 80 2.181 -9.652 -7.484 549 HA THR 80 HA THR 80 -0.679 -10.209 -7.056 550 HB THR 80 HB THR 80 1.194 -11.751 -8.862 551 HG1 THR 80 1HG THR 80 0.286 -9.781 -9.728 552 HG21 THR 80 3HG2 THR 80 -0.157 -13.505 -8.630 553 HG22 THR 80 1HG2 THR 80 -1.528 -12.525 -9.149 554 HG23 THR 80 2HG2 THR 80 -1.109 -12.619 -7.438 555 HA PRO 81 HA PRO 81 1.108 -12.316 -3.542 556 HB2 PRO 81 1HB PRO 81 -1.266 -13.055 -2.453 557 HB3 PRO 81 2HB PRO 81 -0.613 -11.418 -2.313 558 HG2 PRO 81 1HG PRO 81 -2.684 -12.476 -4.198 559 HG3 PRO 81 2HG PRO 81 -2.669 -10.951 -3.292 560 HD2 PRO 81 1HD PRO 81 -2.004 -11.096 -5.913 561 HD3 PRO 81 2HD PRO 81 -1.267 -9.921 -4.804 562 H MET 82 H MET 82 1.592 -14.419 -3.102 563 HA MET 82 HA MET 82 0.464 -16.427 -4.918 564 HB2 MET 82 1HB MET 82 3.011 -15.942 -4.637 565 HB3 MET 82 2HB MET 82 2.855 -16.894 -3.167 566 HG2 MET 82 1HG MET 82 1.729 -18.629 -4.756 567 HG3 MET 82 2HG MET 82 2.588 -17.737 -6.010 568 HE1 MET 82 3HE MET 82 2.368 -20.084 -3.421 569 HE2 MET 82 1HE MET 82 3.708 -21.144 -3.860 570 HE3 MET 82 2HE MET 82 3.868 -20.041 -2.493 571 H ALA 83 H ALA 83 0.693 -15.536 -1.581 572 HA ALA 83 HA ALA 83 -0.952 -17.869 -0.883 573 HB1 ALA 83 3HB ALA 83 1.596 -16.993 0.374 574 HB2 ALA 83 1HB ALA 83 0.332 -17.658 1.409 575 HB3 ALA 83 2HB ALA 83 0.980 -18.619 0.079 576 HA PRO 84 HA PRO 84 -3.622 -14.907 0.974 577 HB2 PRO 84 1HB PRO 84 -4.887 -16.502 2.771 578 HB3 PRO 84 2HB PRO 84 -5.197 -16.579 1.033 579 HG2 PRO 84 1HG PRO 84 -3.462 -18.335 2.726 580 HG3 PRO 84 2HG PRO 84 -4.588 -18.787 1.433 581 HD2 PRO 84 1HD PRO 84 -1.913 -18.631 1.045 582 HD3 PRO 84 2HD PRO 84 -3.087 -18.258 -0.233 583 H GLY 85 H GLY 85 -4.167 -13.911 3.055 584 HA2 GLY 85 1HA GLY 85 -3.385 -14.257 5.544 585 HA3 GLY 85 2HA GLY 85 -1.828 -13.894 4.814 586 H ASN 86 H ASN 86 -1.479 -11.984 5.897 587 HA ASN 86 HA ASN 86 -3.264 -9.771 5.132 588 HB2 ASN 86 1HB ASN 86 -2.716 -8.725 7.350 589 HB3 ASN 86 2HB ASN 86 -3.695 -10.185 7.457 590 HD21 ASN 86 1HD2 ASN 86 -1.657 -8.752 9.229 591 HD22 ASN 86 2HD2 ASN 86 -0.622 -10.029 9.762 592 H TYR 87 H TYR 87 -2.261 -8.225 4.036 593 HA TYR 87 HA TYR 87 0.664 -7.991 4.304 594 HB2 TYR 87 1HB TYR 87 -1.124 -7.560 1.911 595 HB3 TYR 87 2HB TYR 87 0.549 -7.013 1.964 596 HD1 TYR 87 1HD TYR 87 -1.402 -10.134 2.647 597 HD2 TYR 87 2HD TYR 87 2.123 -8.399 1.013 598 HE1 TYR 87 1HE TYR 87 -0.659 -12.358 1.902 599 HE2 TYR 87 2HE TYR 87 2.875 -10.617 0.263 600 HH TYR 87 HH TYR 87 0.839 -13.483 0.673 601 H LEU 88 H LEU 88 1.569 -5.850 4.032 602 HA LEU 88 HA LEU 88 -0.317 -3.680 4.658 603 HB2 LEU 88 1HB LEU 88 1.193 -4.673 6.567 604 HB3 LEU 88 2HB LEU 88 2.431 -3.671 5.813 605 HG LEU 88 HG LEU 88 0.709 -1.755 6.098 606 HD11 LEU 88 1HD1 LEU 88 -0.786 -3.874 7.148 607 HD12 LEU 88 2HD1 LEU 88 -1.176 -2.155 7.193 608 HD13 LEU 88 3HD1 LEU 88 -0.299 -2.896 8.532 609 HD21 LEU 88 3HD2 LEU 88 2.667 -1.541 7.309 610 HD22 LEU 88 1HD2 LEU 88 2.396 -3.033 8.210 611 HD23 LEU 88 2HD2 LEU 88 1.447 -1.593 8.582 612 H ILE 89 H ILE 89 -0.088 -1.886 3.471 613 HA ILE 89 HA ILE 89 2.337 -1.640 1.812 614 HB ILE 89 HB ILE 89 -0.446 -0.690 1.123 615 HG12 ILE 89 1HG1 ILE 89 1.136 -2.932 -0.141 616 HG13 ILE 89 2HG1 ILE 89 -0.093 -3.187 1.093 617 HG21 ILE 89 1HG2 ILE 89 1.376 -0.857 -1.083 618 HG22 ILE 89 2HG2 ILE 89 0.470 0.532 -0.487 619 HG23 ILE 89 3HG2 ILE 89 2.057 0.160 0.186 620 HD11 ILE 89 3HD1 ILE 89 -1.149 -1.564 -1.016 621 HD12 ILE 89 1HD1 ILE 89 -0.444 -3.040 -1.675 622 HD13 ILE 89 2HD1 ILE 89 -1.691 -3.137 -0.431 623 H SER 90 H SER 90 3.578 -0.018 2.454 624 HA SER 90 HA SER 90 2.350 2.287 3.789 625 HB2 SER 90 1HB SER 90 5.183 1.243 3.733 626 HB3 SER 90 2HB SER 90 4.758 2.812 4.416 627 HG SER 90 HG SER 90 4.615 0.444 5.579 628 H VAL 91 H VAL 91 2.920 4.425 3.201 629 HA VAL 91 HA VAL 91 4.415 4.867 0.759 630 HB VAL 91 HB VAL 91 1.492 5.618 0.910 631 HG11 VAL 91 1HG1 VAL 91 3.431 7.040 -0.327 632 HG12 VAL 91 2HG1 VAL 91 2.976 5.918 -1.611 633 HG13 VAL 91 3HG1 VAL 91 1.758 6.961 -0.877 634 HG21 VAL 91 3HG2 VAL 91 1.253 4.107 -1.027 635 HG22 VAL 91 1HG2 VAL 91 2.940 3.629 -0.835 636 HG23 VAL 91 2HG2 VAL 91 1.769 3.260 0.431 637 H LYS 92 H LYS 92 5.629 6.595 1.109 638 HA LYS 92 HA LYS 92 4.584 8.720 2.864 639 HB2 LYS 92 1HB LYS 92 7.347 7.566 2.601 640 HB3 LYS 92 2HB LYS 92 7.104 9.189 3.234 641 HG2 LYS 92 1HG LYS 92 6.050 8.433 5.142 642 HG3 LYS 92 2HG LYS 92 5.598 6.893 4.407 643 HD2 LYS 92 1HD LYS 92 8.464 7.648 4.921 644 HD3 LYS 92 2HD LYS 92 7.468 6.846 6.139 645 HE2 LYS 92 1HE LYS 92 7.739 5.732 3.367 646 HE3 LYS 92 2HE LYS 92 8.946 5.396 4.608 647 HZ1 LYS 92 3HZ LYS 92 6.114 4.952 5.234 648 HZ2 LYS 92 1HZ LYS 92 7.484 4.156 5.826 649 HZ3 LYS 92 2HZ LYS 92 6.917 3.819 4.268 650 H TYR 93 H TYR 93 5.388 10.892 2.411 651 HA TYR 93 HA TYR 93 6.562 11.387 -0.185 652 HB2 TYR 93 1HB TYR 93 3.673 11.821 0.382 653 HB3 TYR 93 2HB TYR 93 4.510 13.057 -0.551 654 HD1 TYR 93 1HD TYR 93 3.447 9.534 -0.500 655 HD2 TYR 93 2HD TYR 93 5.229 12.635 -2.804 656 HE1 TYR 93 1HE TYR 93 3.180 8.171 -2.530 657 HE2 TYR 93 2HE TYR 93 4.966 11.282 -4.840 658 HH TYR 93 HH TYR 93 3.579 8.015 -4.708 659 H GLY 94 H GLY 94 7.993 12.950 0.127 660 HA2 GLY 94 1HA GLY 94 9.034 14.815 0.968 661 HA3 GLY 94 2HA GLY 94 7.419 15.476 1.175 662 H GLY 95 H GLY 95 9.588 13.093 2.710 663 HA2 GLY 95 1HA GLY 95 10.363 13.448 4.971 664 HA3 GLY 95 2HA GLY 95 8.852 14.280 5.307 665 HA PRO 96 HA PRO 96 8.702 9.762 6.664 666 HB2 PRO 96 1HB PRO 96 8.478 10.231 9.328 667 HB3 PRO 96 2HB PRO 96 10.035 10.037 8.515 668 HG2 PRO 96 1HG PRO 96 8.621 12.548 9.323 669 HG3 PRO 96 2HG PRO 96 10.338 12.133 9.474 670 HD2 PRO 96 1HD PRO 96 9.391 13.716 7.492 671 HD3 PRO 96 2HD PRO 96 10.783 12.638 7.270 672 H ASN 97 H ASN 97 6.827 12.501 6.579 673 HA ASN 97 HA ASN 97 4.564 11.577 8.082 674 HB2 ASN 97 1HB ASN 97 4.456 13.699 5.951 675 HB3 ASN 97 2HB ASN 97 3.491 13.563 7.417 676 HD21 ASN 97 1HD2 ASN 97 5.341 15.657 6.245 677 HD22 ASN 97 2HD2 ASN 97 6.383 16.072 7.559 678 H HIS 98 H HIS 98 3.324 9.952 7.443 679 HA HIS 98 HA HIS 98 3.292 8.973 4.769 680 HB2 HIS 98 1HB HIS 98 1.355 7.555 5.689 681 HB3 HIS 98 2HB HIS 98 2.941 7.339 6.423 682 HD2 HIS 98 2HD HIS 98 -0.072 9.757 7.350 683 HE1 HIS 98 1HE HIS 98 1.420 7.885 10.853 684 HE2 HIS 98 2HE HIS 98 -0.321 9.439 9.905 685 H ILE 99 H ILE 99 1.250 8.647 3.529 686 HA ILE 99 HA ILE 99 -0.090 11.188 3.232 687 HB ILE 99 HB ILE 99 -1.189 10.153 1.288 688 HG12 ILE 99 1HG1 ILE 99 0.485 7.698 1.755 689 HG13 ILE 99 2HG1 ILE 99 -1.139 7.825 2.420 690 HG21 ILE 99 1HG2 ILE 99 0.670 11.031 0.400 691 HG22 ILE 99 2HG2 ILE 99 1.701 10.362 1.663 692 HG23 ILE 99 3HG2 ILE 99 1.227 9.361 0.291 693 HD11 ILE 99 3HD1 ILE 99 -1.172 6.621 0.331 694 HD12 ILE 99 1HD1 ILE 99 -2.019 8.158 0.157 695 HD13 ILE 99 2HD1 ILE 99 -0.388 7.972 -0.489 696 H VAL 100 H VAL 100 -2.506 11.182 2.843 697 HA VAL 100 HA VAL 100 -3.834 10.368 5.189 698 HB VAL 100 HB VAL 100 -4.824 11.416 2.551 699 HG11 VAL 100 1HG1 VAL 100 -7.040 11.669 3.872 700 HG12 VAL 100 2HG1 VAL 100 -6.659 10.120 3.117 701 HG13 VAL 100 3HG1 VAL 100 -6.410 10.343 4.849 702 HG21 VAL 100 3HG2 VAL 100 -5.572 13.279 4.149 703 HG22 VAL 100 1HG2 VAL 100 -4.508 12.510 5.327 704 HG23 VAL 100 2HG2 VAL 100 -3.848 13.127 3.812 705 H GLY 101 H GLY 101 -5.241 8.706 5.623 706 HA2 GLY 101 1HA GLY 101 -6.576 6.829 5.101 707 HA3 GLY 101 2HA GLY 101 -5.826 6.767 3.512 708 H SER 102 H SER 102 -3.143 6.759 4.198 709 HA SER 102 HA SER 102 -2.770 4.024 4.860 710 HB2 SER 102 1HB SER 102 -1.000 6.325 4.195 711 HB3 SER 102 2HB SER 102 -0.267 4.949 5.019 712 HG SER 102 HG SER 102 -0.124 4.458 2.900 713 HA PRO 103 HA PRO 103 -0.592 3.065 5.563 714 HB2 PRO 103 1HB PRO 103 -0.619 0.890 7.189 715 HB3 PRO 103 2HB PRO 103 0.615 2.151 7.292 716 HG2 PRO 103 1HG PRO 103 -1.833 1.756 8.968 717 HG3 PRO 103 2HG PRO 103 -0.191 2.194 9.472 718 HD2 PRO 103 1HD PRO 103 -2.173 4.021 9.222 719 HD3 PRO 103 2HD PRO 103 -0.471 4.410 8.902 720 H PHE 104 H PHE 104 -1.374 1.352 4.313 721 HA PHE 104 HA PHE 104 -4.265 0.957 4.494 722 HB2 PHE 104 1HB PHE 104 -2.331 0.283 2.266 723 HB3 PHE 104 2HB PHE 104 -4.079 0.088 2.192 724 HD1 PHE 104 2HD PHE 104 -5.367 2.357 2.925 725 HD2 PHE 104 1HD PHE 104 -1.482 2.116 1.203 726 HE1 PHE 104 2HE PHE 104 -5.590 4.667 2.108 727 HE2 PHE 104 1HE PHE 104 -1.698 4.426 0.384 728 HZ PHE 104 HZ PHE 104 -3.754 5.704 0.835 729 H LYS 105 H LYS 105 -5.145 -0.893 5.148 730 HA LYS 105 HA LYS 105 -3.379 -3.225 5.483 731 HB2 LYS 105 1HB LYS 105 -5.755 -2.235 7.027 732 HB3 LYS 105 2HB LYS 105 -5.304 -3.934 7.089 733 HG2 LYS 105 1HG LYS 105 -2.957 -3.047 7.703 734 HG3 LYS 105 2HG LYS 105 -3.806 -1.547 8.083 735 HD2 LYS 105 1HD LYS 105 -3.846 -2.609 10.124 736 HD3 LYS 105 2HD LYS 105 -5.385 -3.135 9.438 737 HE2 LYS 105 1HE LYS 105 -4.055 -5.152 8.552 738 HE3 LYS 105 2HE LYS 105 -2.819 -4.666 9.711 739 HZ1 LYS 105 3HZ LYS 105 -4.286 -5.013 11.500 740 HZ2 LYS 105 1HZ LYS 105 -4.471 -6.366 10.502 741 HZ3 LYS 105 2HZ LYS 105 -5.637 -5.141 10.490 742 H ALA 106 H ALA 106 -3.616 -4.509 3.756 743 HA ALA 106 HA ALA 106 -6.318 -4.981 2.702 744 HB1 ALA 106 3HB ALA 106 -4.217 -4.262 1.281 745 HB2 ALA 106 1HB ALA 106 -3.895 -5.996 1.308 746 HB3 ALA 106 2HB ALA 106 -5.413 -5.391 0.644 747 H LYS 107 H LYS 107 -7.223 -6.982 2.674 748 HA LYS 107 HA LYS 107 -5.745 -9.104 4.080 749 HB2 LYS 107 1HB LYS 107 -7.778 -8.364 5.226 750 HB3 LYS 107 2HB LYS 107 -8.727 -8.695 3.783 751 HG2 LYS 107 1HG LYS 107 -8.305 -11.051 3.980 752 HG3 LYS 107 2HG LYS 107 -7.196 -10.778 5.327 753 HD2 LYS 107 1HD LYS 107 -9.246 -11.480 6.284 754 HD3 LYS 107 2HD LYS 107 -9.145 -9.738 6.556 755 HE2 LYS 107 1HE LYS 107 -11.308 -9.942 5.808 756 HE3 LYS 107 2HE LYS 107 -10.460 -9.612 4.298 757 HZ1 LYS 107 3HZ LYS 107 -12.004 -11.857 4.979 758 HZ2 LYS 107 1HZ LYS 107 -10.415 -12.368 4.703 759 HZ3 LYS 107 2HZ LYS 107 -11.245 -11.507 3.508 760 H VAL 108 H VAL 108 -5.083 -10.766 2.903 761 HA VAL 108 HA VAL 108 -6.146 -11.156 0.222 762 HB VAL 108 HB VAL 108 -3.915 -12.673 1.578 763 HG11 VAL 108 1HG1 VAL 108 -4.558 -12.320 -1.348 764 HG12 VAL 108 2HG1 VAL 108 -3.258 -13.297 -0.662 765 HG13 VAL 108 3HG1 VAL 108 -4.941 -13.753 -0.394 766 HG21 VAL 108 3HG2 VAL 108 -3.136 -10.717 -0.427 767 HG22 VAL 108 1HG2 VAL 108 -3.912 -9.980 0.976 768 HG23 VAL 108 2HG2 VAL 108 -2.488 -11.000 1.188 769 H THR 109 H THR 109 -7.467 -12.762 -0.374 770 HA THR 109 HA THR 109 -7.900 -14.998 1.487 771 HB THR 109 HB THR 109 -10.321 -14.942 0.964 772 HG1 THR 109 1HG THR 109 -10.046 -12.312 0.012 773 HG21 THR 109 3HG2 THR 109 -9.762 -12.221 2.013 774 HG22 THR 109 1HG2 THR 109 -9.056 -13.587 2.876 775 HG23 THR 109 2HG2 THR 109 -10.803 -13.490 2.657 776 H GLY 110 H GLY 110 -8.222 -16.983 0.562 777 HA2 GLY 110 1HA GLY 110 -9.137 -18.021 -1.607 778 HA3 GLY 110 2HA GLY 110 -7.850 -17.089 -2.357 779 H GLN 111 H GLN 111 -8.659 -20.082 -1.288 780 HA GLN 111 HA GLN 111 -6.723 -21.230 0.152 781 HB2 GLN 111 1HB GLN 111 -6.973 -23.260 -1.151 782 HB3 GLN 111 2HB GLN 111 -8.535 -22.471 -0.977 783 HG2 GLN 111 1HG GLN 111 -8.064 -21.439 -3.266 784 HG3 GLN 111 2HG GLN 111 -6.787 -22.646 -3.402 785 HE21 GLN 111 1HE2 GLN 111 -10.213 -22.098 -3.247 786 HE22 GLN 111 2HE2 GLN 111 -10.695 -23.672 -3.772 787 H ARG 112 H ARG 112 -4.639 -22.059 -0.128 788 HA ARG 112 HA ARG 112 -2.841 -20.453 -1.541 789 HB2 ARG 112 1HB ARG 112 -2.403 -23.280 -0.559 790 HB3 ARG 112 2HB ARG 112 -1.148 -22.114 -0.955 791 HG2 ARG 112 1HG ARG 112 -1.721 -20.740 0.895 792 HG3 ARG 112 2HG ARG 112 -3.193 -21.664 1.201 793 HD2 ARG 112 1HD ARG 112 -0.396 -22.774 1.399 794 HD3 ARG 112 2HD ARG 112 -1.339 -22.188 2.769 795 HE ARG 112 HE ARG 112 -2.967 -24.032 1.652 796 HH11 ARG 112 1HH1 ARG 112 0.363 -24.093 2.664 797 HH12 ARG 112 2HH1 ARG 112 0.347 -25.779 3.062 798 HH21 ARG 112 1HH2 ARG 112 -3.001 -26.252 2.173 799 HH22 ARG 112 2HH2 ARG 112 -1.567 -27.007 2.781 800 H LEU 113 H LEU 113 -2.169 -20.436 -3.587 801 HA LEU 113 HA LEU 113 -3.335 -22.168 -5.521 802 HB2 LEU 113 1HB LEU 113 -0.950 -20.409 -5.997 803 HB3 LEU 113 2HB LEU 113 -2.198 -20.899 -7.141 804 HG LEU 113 HG LEU 113 -2.473 -18.909 -4.892 805 HD11 LEU 113 1HD1 LEU 113 -2.726 -17.279 -6.588 806 HD12 LEU 113 2HD1 LEU 113 -2.821 -18.504 -7.852 807 HD13 LEU 113 3HD1 LEU 113 -1.297 -18.222 -7.011 808 HD21 LEU 113 3HD2 LEU 113 -4.705 -18.968 -6.675 809 HD22 LEU 113 1HD2 LEU 113 -4.672 -19.197 -4.927 810 HD23 LEU 113 2HD2 LEU 113 -4.455 -20.579 -6.001 811 H VAL 114 H VAL 114 -2.764 -24.256 -5.543 812 HA VAL 114 HA VAL 114 -0.198 -25.226 -4.817 813 HB VAL 114 HB VAL 114 -2.468 -26.556 -6.297 814 HG11 VAL 114 1HG1 VAL 114 -1.050 -28.615 -5.321 815 HG12 VAL 114 2HG1 VAL 114 -0.840 -27.982 -6.955 816 HG13 VAL 114 3HG1 VAL 114 0.261 -27.489 -5.668 817 HG21 VAL 114 3HG2 VAL 114 -1.809 -26.109 -3.485 818 HG22 VAL 114 1HG2 VAL 114 -3.349 -26.522 -4.238 819 HG23 VAL 114 2HG2 VAL 114 -2.179 -27.789 -3.871 820 H SER 115 H SER 115 -1.831 -25.334 -7.991 821 HA SER 115 HA SER 115 0.746 -25.649 -9.302 822 HB2 SER 115 1HB SER 115 -0.674 -25.887 -11.374 823 HB3 SER 115 2HB SER 115 -0.995 -27.085 -10.120 824 HG SER 115 HG SER 115 -2.570 -24.952 -11.002 825 HA PRO 116 HA PRO 116 1.199 -21.389 -10.326 826 HB2 PRO 116 1HB PRO 116 2.882 -21.650 -12.440 827 HB3 PRO 116 2HB PRO 116 3.397 -21.890 -10.767 828 HG2 PRO 116 1HG PRO 116 2.656 -23.927 -12.831 829 HG3 PRO 116 2HG PRO 116 4.001 -23.943 -11.676 830 HD2 PRO 116 1HD PRO 116 1.718 -25.343 -11.274 831 HD3 PRO 116 2HD PRO 116 2.665 -24.656 -9.938 832 H GLY 117 H GLY 117 -0.124 -23.726 -12.488 833 HA2 GLY 117 1HA GLY 117 -1.933 -23.340 -13.933 834 HA3 GLY 117 2HA GLY 117 -1.593 -21.617 -13.863 835 H SER 118 H SER 118 -2.165 -22.514 -16.273 836 HA SER 118 HA SER 118 -0.402 -23.728 -17.923 837 HB2 SER 118 1HB SER 118 -2.625 -22.495 -18.466 838 HB3 SER 118 2HB SER 118 -1.589 -21.105 -18.790 839 HG SER 118 HG SER 118 -2.164 -22.864 -20.509 840 H ALA 119 H ALA 119 1.668 -23.498 -18.422 841 HA ALA 119 HA ALA 119 2.904 -20.838 -18.123 842 HB1 ALA 119 3HB ALA 119 3.666 -23.412 -16.971 843 HB2 ALA 119 1HB ALA 119 4.989 -22.575 -17.785 844 HB3 ALA 119 2HB ALA 119 4.105 -21.774 -16.485 845 H ASN 120 H ASN 120 4.404 -20.214 -19.659 846 HA ASN 120 HA ASN 120 5.118 -22.046 -21.797 847 HB2 ASN 120 1HB ASN 120 2.933 -21.079 -22.489 848 HB3 ASN 120 2HB ASN 120 3.646 -19.471 -22.394 849 HD21 ASN 120 1HD2 ASN 120 4.621 -22.605 -23.751 850 HD22 ASN 120 2HD2 ASN 120 5.028 -21.991 -25.314 851 H GLU 121 H GLU 121 6.608 -20.950 -23.395 852 HA GLU 121 HA GLU 121 8.186 -18.845 -22.071 853 HB2 GLU 121 1HB GLU 121 9.271 -21.075 -21.880 854 HB3 GLU 121 2HB GLU 121 9.301 -21.179 -23.635 855 HG2 GLU 121 1HG GLU 121 11.435 -20.451 -22.472 856 HG3 GLU 121 2HG GLU 121 10.880 -19.473 -23.830 857 H THR 122 H THR 122 8.132 -17.065 -23.257 858 HA THR 122 HA THR 122 7.632 -17.220 -26.121 859 HB THR 122 HB THR 122 7.434 -14.755 -26.009 860 HG1 THR 122 1HG THR 122 7.777 -15.088 -23.199 861 HG21 THR 122 3HG2 THR 122 5.284 -15.022 -25.470 862 HG22 THR 122 1HG2 THR 122 5.684 -15.364 -23.788 863 HG23 THR 122 2HG2 THR 122 5.684 -16.667 -24.976 864 H SER 123 H SER 123 9.551 -17.923 -27.017 865 HA SER 123 HA SER 123 12.027 -16.539 -26.401 866 HB2 SER 123 1HB SER 123 11.282 -18.951 -28.010 867 HB3 SER 123 2HB SER 123 12.819 -18.149 -28.335 868 HG SER 123 HG SER 123 12.073 -19.707 -26.216 869 H SER 124 H SER 124 12.989 -15.021 -27.622 870 HA SER 124 HA SER 124 11.603 -14.205 -30.088 871 HB2 SER 124 1HB SER 124 12.514 -11.965 -29.699 872 HB3 SER 124 2HB SER 124 11.611 -12.515 -28.287 873 HG SER 124 HG SER 124 13.743 -11.533 -27.898 874 H ILE 125 H ILE 125 12.648 -14.284 -31.973 875 HA ILE 125 HA ILE 125 14.911 -15.682 -32.477 876 HB ILE 125 HB ILE 125 14.011 -13.229 -33.993 877 HG12 ILE 125 1HG1 ILE 125 13.435 -16.141 -34.563 878 HG13 ILE 125 2HG1 ILE 125 12.330 -15.086 -33.689 879 HG21 ILE 125 1HG2 ILE 125 15.949 -15.419 -34.678 880 HG22 ILE 125 2HG2 ILE 125 15.162 -14.436 -35.911 881 HG23 ILE 125 3HG2 ILE 125 16.206 -13.675 -34.710 882 HD11 ILE 125 3HD1 ILE 125 13.218 -14.851 -36.549 883 HD12 ILE 125 1HD1 ILE 125 11.599 -15.191 -35.939 884 HD13 ILE 125 2HD1 ILE 125 12.316 -13.597 -35.699 Start of MODEL 3 1 H1 GLY 1 H GLY 1 18.222 57.666 10.498 2 HA2 GLY 1 1HA GLY 1 15.992 55.761 10.643 3 HA3 GLY 1 2HA GLY 1 15.903 57.403 10.021 4 H SER 2 H SER 2 14.707 56.015 8.345 5 HA SER 2 HA SER 2 16.328 55.891 6.018 6 HB2 SER 2 1HB SER 2 15.970 53.449 5.550 7 HB3 SER 2 2HB SER 2 17.080 53.771 6.882 8 HG SER 2 HG SER 2 15.042 52.216 6.989 9 H SER 3 H SER 3 15.002 54.809 4.161 10 HA SER 3 HA SER 3 12.145 55.405 4.556 11 HB2 SER 3 1HB SER 3 13.648 57.133 3.238 12 HB3 SER 3 2HB SER 3 13.440 55.980 1.920 13 HG SER 3 HG SER 3 11.518 56.755 1.654 14 H GLY 4 H GLY 4 10.680 54.179 3.355 15 HA2 GLY 4 1HA GLY 4 11.860 51.815 2.028 16 HA3 GLY 4 2HA GLY 4 10.416 51.736 3.026 17 H SER 5 H SER 5 11.517 51.836 -0.086 18 HA SER 5 HA SER 5 8.925 52.839 -1.067 19 HB2 SER 5 1HB SER 5 11.695 53.228 -2.181 20 HB3 SER 5 2HB SER 5 10.271 53.359 -3.213 21 HG SER 5 HG SER 5 9.513 55.014 -1.870 22 H SER 6 H SER 6 7.743 51.200 -1.775 23 HA SER 6 HA SER 6 8.962 48.724 -2.626 24 HB2 SER 6 1HB SER 6 6.801 48.955 -1.259 25 HB3 SER 6 2HB SER 6 6.024 49.390 -2.782 26 HG SER 6 HG SER 6 6.028 47.364 -3.315 27 H GLY 7 H GLY 7 9.032 47.889 -4.669 28 HA2 GLY 7 1HA GLY 7 8.018 49.617 -6.840 29 HA3 GLY 7 2HA GLY 7 9.625 48.908 -6.901 30 H PHE 8 H PHE 8 6.623 48.608 -8.106 31 HA PHE 8 HA PHE 8 5.888 45.956 -7.927 32 HB2 PHE 8 1HB PHE 8 4.638 47.821 -9.091 33 HB3 PHE 8 2HB PHE 8 5.712 47.582 -10.465 34 HD1 PHE 8 1HD PHE 8 3.708 45.396 -8.193 35 HD2 PHE 8 2HD PHE 8 4.779 46.405 -12.187 36 HE1 PHE 8 1HE PHE 8 2.226 43.622 -9.036 37 HE2 PHE 8 2HE PHE 8 3.298 44.634 -13.036 38 HZ PHE 8 HZ PHE 8 2.019 43.240 -11.460 39 H LYS 9 H LYS 9 7.466 44.431 -7.981 40 HA LYS 9 HA LYS 9 8.599 43.819 -10.576 41 HB2 LYS 9 1HB LYS 9 10.401 44.219 -8.181 42 HB3 LYS 9 2HB LYS 9 10.901 43.675 -9.777 43 HG2 LYS 9 1HG LYS 9 10.409 45.799 -10.739 44 HG3 LYS 9 2HG LYS 9 9.636 46.353 -9.252 45 HD2 LYS 9 1HD LYS 9 12.463 45.443 -9.105 46 HD3 LYS 9 2HD LYS 9 12.132 47.005 -9.859 47 HE2 LYS 9 1HE LYS 9 12.390 47.665 -7.687 48 HE3 LYS 9 2HE LYS 9 10.657 47.345 -7.700 49 HZ1 LYS 9 3HZ LYS 9 12.390 45.103 -7.032 50 HZ2 LYS 9 1HZ LYS 9 10.886 45.539 -6.391 51 HZ3 LYS 9 2HZ LYS 9 12.286 46.339 -5.882 52 H VAL 10 H VAL 10 9.125 41.657 -10.828 53 HA VAL 10 HA VAL 10 8.021 39.889 -8.801 54 HB VAL 10 HB VAL 10 8.377 38.105 -10.503 55 HG11 VAL 10 1HG1 VAL 10 6.403 38.580 -11.485 56 HG12 VAL 10 2HG1 VAL 10 6.400 39.933 -10.353 57 HG13 VAL 10 3HG1 VAL 10 6.930 40.176 -12.017 58 HG21 VAL 10 3HG2 VAL 10 8.779 39.851 -12.757 59 HG22 VAL 10 1HG2 VAL 10 10.125 39.976 -11.625 60 HG23 VAL 10 2HG2 VAL 10 9.673 38.406 -12.287 61 H ARG 11 H ARG 11 9.145 38.388 -7.646 62 HA ARG 11 HA ARG 11 12.077 38.572 -7.796 63 HB2 ARG 11 1HB ARG 11 10.790 39.179 -5.651 64 HB3 ARG 11 2HB ARG 11 10.522 37.449 -5.478 65 HG2 ARG 11 1HG ARG 11 13.134 37.354 -5.793 66 HG3 ARG 11 2HG ARG 11 13.029 39.018 -5.214 67 HD2 ARG 11 1HD ARG 11 11.702 36.735 -3.781 68 HD3 ARG 11 2HD ARG 11 13.377 37.191 -3.469 69 HE ARG 11 HE ARG 11 11.986 39.519 -3.203 70 HH11 ARG 11 1HH1 ARG 11 11.760 36.352 -1.776 71 HH12 ARG 11 2HH1 ARG 11 11.126 36.932 -0.272 72 HH21 ARG 11 1HH2 ARG 11 11.152 40.295 -1.228 73 HH22 ARG 11 2HH2 ARG 11 10.779 39.175 0.039 74 H VAL 12 H VAL 12 13.246 36.843 -8.347 75 HA VAL 12 HA VAL 12 11.893 34.414 -9.113 76 HB VAL 12 HB VAL 12 14.841 35.076 -9.166 77 HG11 VAL 12 1HG1 VAL 12 14.762 32.759 -9.262 78 HG12 VAL 12 2HG1 VAL 12 13.246 32.748 -10.166 79 HG13 VAL 12 3HG1 VAL 12 14.746 33.221 -10.964 80 HG21 VAL 12 3HG2 VAL 12 14.598 35.874 -11.308 81 HG22 VAL 12 1HG2 VAL 12 13.106 34.977 -11.589 82 HG23 VAL 12 2HG2 VAL 12 13.089 36.422 -10.578 83 H GLY 13 H GLY 13 11.383 32.940 -7.630 84 HA2 GLY 13 1HA GLY 13 13.409 31.759 -5.987 85 HA3 GLY 13 2HA GLY 13 12.284 32.727 -5.046 86 H GLU 14 H GLU 14 12.710 29.886 -4.862 87 HA GLU 14 HA GLU 14 10.440 28.619 -6.120 88 HB2 GLU 14 1HB GLU 14 11.251 26.596 -5.253 89 HB3 GLU 14 2HB GLU 14 12.701 27.524 -5.612 90 HG2 GLU 14 1HG GLU 14 12.897 28.142 -3.262 91 HG3 GLU 14 2HG GLU 14 11.437 27.224 -2.897 92 HA PRO 15 HA PRO 15 7.468 29.252 -2.950 93 HB2 PRO 15 1HB PRO 15 5.995 26.984 -3.187 94 HB3 PRO 15 2HB PRO 15 5.939 28.294 -4.372 95 HG2 PRO 15 1HG PRO 15 7.453 25.713 -4.471 96 HG3 PRO 15 2HG PRO 15 6.534 26.521 -5.754 97 HD2 PRO 15 1HD PRO 15 9.233 26.659 -5.587 98 HD3 PRO 15 2HD PRO 15 8.247 27.987 -6.231 99 H GLY 16 H GLY 16 7.368 28.956 -0.797 100 HA2 GLY 16 1HA GLY 16 9.170 27.579 0.695 101 HA3 GLY 16 2HA GLY 16 7.547 27.934 1.267 102 H GLN 17 H GLN 17 5.834 26.359 0.496 103 HA GLN 17 HA GLN 17 6.599 23.745 1.294 104 HB2 GLN 17 1HB GLN 17 4.044 24.811 0.090 105 HB3 GLN 17 2HB GLN 17 4.239 23.155 0.648 106 HG2 GLN 17 1HG GLN 17 4.387 25.660 2.304 107 HG3 GLN 17 2HG GLN 17 3.132 24.422 2.344 108 HE21 GLN 17 1HE2 GLN 17 6.278 25.340 3.385 109 HE22 GLN 17 2HE2 GLN 17 6.563 23.996 4.433 110 H ALA 18 H ALA 18 7.717 22.385 0.072 111 HA ALA 18 HA ALA 18 7.038 22.193 -2.789 112 HB1 ALA 18 3HB ALA 18 9.643 21.337 -2.661 113 HB2 ALA 18 1HB ALA 18 9.105 22.928 -3.201 114 HB3 ALA 18 2HB ALA 18 9.618 22.690 -1.530 115 H GLY 19 H GLY 19 5.563 20.500 -2.021 116 HA2 GLY 19 1HA GLY 19 5.664 18.071 -2.592 117 HA3 GLY 19 2HA GLY 19 7.001 17.980 -1.455 118 H ASN 20 H ASN 20 3.681 17.641 -1.856 119 HA ASN 20 HA ASN 20 3.322 17.465 1.059 120 HB2 ASN 20 1HB ASN 20 2.205 19.494 0.047 121 HB3 ASN 20 2HB ASN 20 1.174 18.387 -0.854 122 HD21 ASN 20 1HD2 ASN 20 -0.624 19.318 0.209 123 HD22 ASN 20 2HD2 ASN 20 -1.023 18.870 1.829 124 HA PRO 21 HA PRO 21 2.231 13.309 -0.141 125 HB2 PRO 21 1HB PRO 21 1.778 12.415 2.382 126 HB3 PRO 21 2HB PRO 21 3.401 12.629 1.716 127 HG2 PRO 21 1HG PRO 21 1.841 14.436 3.522 128 HG3 PRO 21 2HG PRO 21 3.554 13.983 3.600 129 HD2 PRO 21 1HD PRO 21 2.717 16.343 2.571 130 HD3 PRO 21 2HD PRO 21 4.158 15.498 1.972 131 H ALA 22 H ALA 22 0.332 15.256 2.134 132 HA ALA 22 HA ALA 22 -1.999 13.795 2.249 133 HB1 ALA 22 3HB ALA 22 -1.723 15.725 3.629 134 HB2 ALA 22 1HB ALA 22 -1.628 16.784 2.222 135 HB3 ALA 22 2HB ALA 22 -3.147 15.981 2.622 136 H LEU 23 H LEU 23 -1.023 16.149 -0.219 137 HA LEU 23 HA LEU 23 -3.383 16.151 -1.713 138 HB2 LEU 23 1HB LEU 23 -0.531 16.777 -2.281 139 HB3 LEU 23 2HB LEU 23 -1.641 16.625 -3.642 140 HG LEU 23 HG LEU 23 -2.104 18.509 -1.338 141 HD11 LEU 23 1HD1 LEU 23 0.003 19.063 -2.470 142 HD12 LEU 23 2HD1 LEU 23 -1.242 20.280 -2.750 143 HD13 LEU 23 3HD1 LEU 23 -0.850 19.113 -4.013 144 HD21 LEU 23 3HD2 LEU 23 -3.871 19.334 -2.527 145 HD22 LEU 23 1HD2 LEU 23 -3.925 17.648 -3.044 146 HD23 LEU 23 2HD2 LEU 23 -3.187 18.866 -4.084 147 H VAL 24 H VAL 24 -0.501 14.100 -1.984 148 HA VAL 24 HA VAL 24 -1.115 12.673 -4.260 149 HB VAL 24 HB VAL 24 0.189 11.631 -1.742 150 HG11 VAL 24 1HG1 VAL 24 0.313 10.514 -4.541 151 HG12 VAL 24 2HG1 VAL 24 1.121 9.871 -3.110 152 HG13 VAL 24 3HG1 VAL 24 -0.639 9.834 -3.222 153 HG21 VAL 24 3HG2 VAL 24 1.199 13.086 -4.153 154 HG22 VAL 24 1HG2 VAL 24 1.541 13.374 -2.447 155 HG23 VAL 24 2HG2 VAL 24 2.257 11.987 -3.268 156 H SER 25 H SER 25 -2.461 11.040 -4.796 157 HA SER 25 HA SER 25 -4.184 9.945 -2.671 158 HB2 SER 25 1HB SER 25 -5.103 10.394 -5.509 159 HB3 SER 25 2HB SER 25 -6.087 10.056 -4.085 160 HG SER 25 HG SER 25 -5.287 12.424 -5.054 161 H ALA 26 H ALA 26 -4.558 7.780 -2.686 162 HA ALA 26 HA ALA 26 -3.264 6.226 -4.832 163 HB1 ALA 26 3HB ALA 26 -1.946 5.466 -3.193 164 HB2 ALA 26 1HB ALA 26 -3.018 6.067 -1.927 165 HB3 ALA 26 2HB ALA 26 -3.346 4.514 -2.698 166 H TYR 27 H TYR 27 -4.488 4.798 -5.893 167 HA TYR 27 HA TYR 27 -6.759 3.516 -4.691 168 HB2 TYR 27 1HB TYR 27 -8.362 4.386 -6.449 169 HB3 TYR 27 2HB TYR 27 -7.904 5.539 -5.201 170 HD1 TYR 27 1HD TYR 27 -6.377 7.398 -5.729 171 HD2 TYR 27 2HD TYR 27 -7.743 4.725 -8.744 172 HE1 TYR 27 1HE TYR 27 -5.662 8.994 -7.459 173 HE2 TYR 27 2HE TYR 27 -7.031 6.312 -10.482 174 HH TYR 27 HH TYR 27 -6.678 9.008 -10.478 175 H GLY 28 H GLY 28 -7.795 1.970 -6.171 176 HA2 GLY 28 1HA GLY 28 -7.272 1.294 -8.706 177 HA3 GLY 28 2HA GLY 28 -5.790 0.784 -7.911 178 H THR 29 H THR 29 -6.739 -1.266 -8.972 179 HA THR 29 HA THR 29 -8.901 -2.541 -7.578 180 HB THR 29 HB THR 29 -7.826 -4.608 -8.866 181 HG1 THR 29 1HG THR 29 -6.987 -3.504 -10.912 182 HG21 THR 29 3HG2 THR 29 -9.256 -4.115 -10.730 183 HG22 THR 29 1HG2 THR 29 -9.225 -2.391 -10.361 184 HG23 THR 29 2HG2 THR 29 -10.037 -3.512 -9.268 185 H GLY 30 H GLY 30 -5.373 -2.756 -7.536 186 HA2 GLY 30 1HA GLY 30 -5.079 -5.011 -5.922 187 HA3 GLY 30 2HA GLY 30 -3.931 -3.684 -6.011 188 H LEU 31 H LEU 31 -5.847 -1.703 -5.047 189 HA LEU 31 HA LEU 31 -5.401 -2.065 -2.246 190 HB2 LEU 31 1HB LEU 31 -6.848 0.038 -3.836 191 HB3 LEU 31 2HB LEU 31 -6.714 0.087 -2.079 192 HG LEU 31 HG LEU 31 -4.448 0.247 -4.065 193 HD11 LEU 31 1HD1 LEU 31 -4.680 2.405 -2.179 194 HD12 LEU 31 2HD1 LEU 31 -6.177 2.212 -3.091 195 HD13 LEU 31 3HD1 LEU 31 -4.652 2.452 -3.942 196 HD21 LEU 31 3HD2 LEU 31 -3.558 -0.916 -2.234 197 HD22 LEU 31 1HD2 LEU 31 -4.482 0.034 -1.069 198 HD23 LEU 31 2HD2 LEU 31 -3.137 0.772 -1.939 199 H GLU 32 H GLU 32 -8.130 -2.418 -4.409 200 HA GLU 32 HA GLU 32 -10.285 -2.385 -2.730 201 HB2 GLU 32 1HB GLU 32 -9.697 -4.251 -5.027 202 HB3 GLU 32 2HB GLU 32 -11.260 -4.179 -4.224 203 HG2 GLU 32 1HG GLU 32 -9.899 -1.961 -5.732 204 HG3 GLU 32 2HG GLU 32 -11.328 -2.865 -6.229 205 H GLY 33 H GLY 33 -7.936 -4.992 -3.146 206 HA2 GLY 33 1HA GLY 33 -8.225 -5.968 -0.533 207 HA3 GLY 33 2HA GLY 33 -9.248 -6.933 -1.587 208 H GLY 34 H GLY 34 -7.748 -8.641 -0.758 209 HA2 GLY 34 1HA GLY 34 -5.210 -8.658 -2.262 210 HA3 GLY 34 2HA GLY 34 -5.508 -9.573 -0.791 211 H THR 35 H THR 35 -5.585 -9.599 -4.187 212 HA THR 35 HA THR 35 -7.222 -12.026 -4.286 213 HB THR 35 HB THR 35 -6.654 -11.656 -6.861 214 HG1 THR 35 1HG THR 35 -6.623 -9.319 -7.199 215 HG21 THR 35 3HG2 THR 35 -8.775 -10.730 -7.108 216 HG22 THR 35 1HG2 THR 35 -8.640 -9.777 -5.631 217 HG23 THR 35 2HG2 THR 35 -8.878 -11.522 -5.535 218 H THR 36 H THR 36 -6.153 -13.860 -3.954 219 HA THR 36 HA THR 36 -3.331 -14.093 -4.521 220 HB THR 36 HB THR 36 -4.977 -16.474 -3.796 221 HG1 THR 36 1HG THR 36 -4.742 -14.137 -2.293 222 HG21 THR 36 3HG2 THR 36 -2.573 -15.794 -2.271 223 HG22 THR 36 1HG2 THR 36 -2.289 -15.983 -4.000 224 HG23 THR 36 2HG2 THR 36 -3.014 -17.299 -3.076 225 H GLY 37 H GLY 37 -2.589 -14.548 -6.483 226 HA2 GLY 37 1HA GLY 37 -2.354 -16.215 -8.221 227 HA3 GLY 37 2HA GLY 37 -4.087 -16.489 -8.122 228 H ILE 38 H ILE 38 -4.576 -13.548 -7.976 229 HA ILE 38 HA ILE 38 -4.409 -13.061 -10.859 230 HB ILE 38 HB ILE 38 -6.014 -11.469 -8.869 231 HG12 ILE 38 1HG1 ILE 38 -6.975 -13.825 -10.503 232 HG13 ILE 38 2HG1 ILE 38 -6.599 -13.902 -8.785 233 HG21 ILE 38 1HG2 ILE 38 -6.413 -11.884 -11.826 234 HG22 ILE 38 2HG2 ILE 38 -7.277 -10.761 -10.778 235 HG23 ILE 38 3HG2 ILE 38 -5.567 -10.507 -11.121 236 HD11 ILE 38 3HD1 ILE 38 -9.056 -13.490 -9.737 237 HD12 ILE 38 1HD1 ILE 38 -8.501 -12.853 -8.189 238 HD13 ILE 38 2HD1 ILE 38 -8.511 -11.818 -9.617 239 H GLN 39 H GLN 39 -3.813 -10.979 -11.669 240 HA GLN 39 HA GLN 39 -1.831 -9.647 -9.962 241 HB2 GLN 39 1HB GLN 39 -0.742 -10.345 -11.903 242 HB3 GLN 39 2HB GLN 39 -2.118 -9.965 -12.929 243 HG2 GLN 39 1HG GLN 39 -1.698 -7.591 -12.653 244 HG3 GLN 39 2HG GLN 39 -0.352 -7.942 -11.570 245 HE21 GLN 39 1HE2 GLN 39 1.471 -9.102 -12.462 246 HE22 GLN 39 2HE2 GLN 39 1.870 -8.903 -14.131 247 H SER 40 H SER 40 -2.430 -7.807 -9.052 248 HA SER 40 HA SER 40 -4.518 -6.195 -10.350 249 HB2 SER 40 1HB SER 40 -3.644 -6.474 -7.482 250 HB3 SER 40 2HB SER 40 -4.597 -5.089 -8.016 251 HG SER 40 HG SER 40 -6.287 -6.320 -7.980 252 H GLU 41 H GLU 41 -4.313 -3.851 -10.245 253 HA GLU 41 HA GLU 41 -1.601 -2.826 -9.898 254 HB2 GLU 41 1HB GLU 41 -1.733 -1.644 -12.095 255 HB3 GLU 41 2HB GLU 41 -1.601 -3.392 -12.229 256 HG2 GLU 41 1HG GLU 41 -4.000 -3.549 -12.637 257 HG3 GLU 41 2HG GLU 41 -4.141 -1.798 -12.494 258 H PHE 42 H PHE 42 -1.599 -0.898 -8.935 259 HA PHE 42 HA PHE 42 -4.070 0.703 -9.013 260 HB2 PHE 42 1HB PHE 42 -3.908 1.203 -6.716 261 HB3 PHE 42 2HB PHE 42 -3.577 -0.524 -6.814 262 HD1 PHE 42 1HD PHE 42 -1.978 2.797 -6.496 263 HD2 PHE 42 2HD PHE 42 -1.553 -1.413 -6.036 264 HE1 PHE 42 1HE PHE 42 0.151 3.144 -5.313 265 HE2 PHE 42 2HE PHE 42 0.576 -1.072 -4.851 266 HZ PHE 42 HZ PHE 42 1.430 1.209 -4.488 267 H PHE 43 H PHE 43 -3.856 2.889 -9.249 268 HA PHE 43 HA PHE 43 -1.141 3.849 -9.833 269 HB2 PHE 43 1HB PHE 43 -3.723 5.175 -10.656 270 HB3 PHE 43 2HB PHE 43 -2.109 5.460 -11.298 271 HD1 PHE 43 2HD PHE 43 -4.662 2.771 -10.967 272 HD2 PHE 43 1HD PHE 43 -1.464 4.411 -13.247 273 HE1 PHE 43 2HE PHE 43 -5.081 1.116 -12.738 274 HE2 PHE 43 1HE PHE 43 -1.879 2.759 -15.023 275 HZ PHE 43 HZ PHE 43 -3.688 1.107 -14.769 276 H ILE 44 H ILE 44 -0.786 6.214 -9.385 277 HA ILE 44 HA ILE 44 -2.181 7.081 -6.945 278 HB ILE 44 HB ILE 44 0.802 7.301 -7.354 279 HG12 ILE 44 1HG1 ILE 44 -0.553 5.544 -5.323 280 HG13 ILE 44 2HG1 ILE 44 -0.211 4.954 -6.946 281 HG21 ILE 44 1HG2 ILE 44 -0.922 7.879 -4.948 282 HG22 ILE 44 2HG2 ILE 44 0.833 8.019 -5.025 283 HG23 ILE 44 3HG2 ILE 44 -0.179 9.085 -5.999 284 HD11 ILE 44 3HD1 ILE 44 1.567 5.341 -4.679 285 HD12 ILE 44 1HD1 ILE 44 1.744 4.315 -6.101 286 HD13 ILE 44 2HD1 ILE 44 2.190 6.020 -6.183 287 H ASN 45 H ASN 45 -2.886 9.112 -7.035 288 HA ASN 45 HA ASN 45 -2.259 10.740 -9.332 289 HB2 ASN 45 1HB ASN 45 -4.560 10.634 -8.497 290 HB3 ASN 45 2HB ASN 45 -4.040 11.292 -6.948 291 HD21 ASN 45 1HD2 ASN 45 -5.238 12.004 -9.984 292 HD22 ASN 45 2HD2 ASN 45 -4.993 13.714 -9.968 293 H THR 46 H THR 46 -0.412 11.841 -9.353 294 HA THR 46 HA THR 46 0.308 13.388 -6.953 295 HB THR 46 HB THR 46 2.685 13.018 -7.419 296 HG1 THR 46 1HG THR 46 2.775 12.584 -9.579 297 HG21 THR 46 3HG2 THR 46 2.639 11.215 -6.104 298 HG22 THR 46 1HG2 THR 46 1.961 10.219 -7.392 299 HG23 THR 46 2HG2 THR 46 0.894 11.162 -6.352 300 H THR 47 H THR 47 -1.208 14.301 -9.176 301 HA THR 47 HA THR 47 0.632 15.900 -10.776 302 HB THR 47 HB THR 47 -1.712 16.745 -11.683 303 HG1 THR 47 1HG THR 47 -2.695 15.318 -9.941 304 HG21 THR 47 3HG2 THR 47 -1.708 14.720 -13.229 305 HG22 THR 47 1HG2 THR 47 -0.352 14.126 -12.272 306 HG23 THR 47 2HG2 THR 47 -0.214 15.653 -13.144 307 H ARG 48 H ARG 48 -1.095 16.165 -7.894 308 HA ARG 48 HA ARG 48 -1.119 19.104 -8.057 309 HB2 ARG 48 1HB ARG 48 -2.676 17.230 -6.270 310 HB3 ARG 48 2HB ARG 48 -2.686 18.981 -6.110 311 HG2 ARG 48 1HG ARG 48 -3.480 19.036 -8.528 312 HG3 ARG 48 2HG ARG 48 -3.779 17.306 -8.342 313 HD2 ARG 48 1HD ARG 48 -5.199 17.836 -6.363 314 HD3 ARG 48 2HD ARG 48 -4.993 19.548 -6.734 315 HE ARG 48 HE ARG 48 -5.959 18.159 -9.000 316 HH11 ARG 48 1HH1 ARG 48 -6.960 19.349 -5.885 317 HH12 ARG 48 2HH1 ARG 48 -8.618 19.542 -6.346 318 HH21 ARG 48 1HH2 ARG 48 -8.140 18.409 -9.619 319 HH22 ARG 48 2HH2 ARG 48 -9.289 19.006 -8.470 320 H ALA 49 H ALA 49 0.030 16.339 -6.254 321 HA ALA 49 HA ALA 49 0.924 17.500 -3.915 322 HB1 ALA 49 3HB ALA 49 1.317 15.296 -3.751 323 HB2 ALA 49 1HB ALA 49 1.628 15.119 -5.478 324 HB3 ALA 49 2HB ALA 49 2.902 15.705 -4.408 325 H GLY 50 H GLY 50 2.679 17.220 -7.005 326 HA2 GLY 50 1HA GLY 50 3.879 19.339 -7.626 327 HA3 GLY 50 2HA GLY 50 4.547 19.278 -6.002 328 HA PRO 51 HA PRO 51 7.992 17.047 -7.542 329 HB2 PRO 51 1HB PRO 51 8.702 15.636 -5.334 330 HB3 PRO 51 2HB PRO 51 8.962 17.378 -5.486 331 HG2 PRO 51 1HG PRO 51 6.773 15.907 -4.070 332 HG3 PRO 51 2HG PRO 51 7.693 17.326 -3.538 333 HD2 PRO 51 1HD PRO 51 5.200 17.511 -4.578 334 HD3 PRO 51 2HD PRO 51 6.424 18.778 -4.801 335 H GLY 52 H GLY 52 8.896 14.789 -7.713 336 HA2 GLY 52 1HA GLY 52 6.677 12.848 -7.921 337 HA3 GLY 52 2HA GLY 52 8.001 12.937 -9.074 338 H THR 53 H THR 53 7.276 12.288 -5.665 339 HA THR 53 HA THR 53 9.774 10.801 -5.398 340 HB THR 53 HB THR 53 7.663 11.373 -3.309 341 HG1 THR 53 1HG THR 53 8.612 13.305 -3.849 342 HG21 THR 53 3HG2 THR 53 10.515 10.450 -2.958 343 HG22 THR 53 1HG2 THR 53 9.112 9.385 -2.887 344 HG23 THR 53 2HG2 THR 53 9.305 10.672 -1.696 345 H LEU 54 H LEU 54 9.847 8.691 -5.762 346 HA LEU 54 HA LEU 54 7.347 7.157 -5.741 347 HB2 LEU 54 1HB LEU 54 8.506 6.980 -7.806 348 HB3 LEU 54 2HB LEU 54 10.036 6.659 -6.993 349 HG LEU 54 HG LEU 54 9.004 4.487 -6.197 350 HD11 LEU 54 1HD1 LEU 54 6.693 4.863 -6.489 351 HD12 LEU 54 2HD1 LEU 54 7.148 3.673 -7.707 352 HD13 LEU 54 3HD1 LEU 54 6.907 5.358 -8.168 353 HD21 LEU 54 3HD2 LEU 54 9.828 3.382 -8.022 354 HD22 LEU 54 1HD2 LEU 54 10.520 4.981 -8.294 355 HD23 LEU 54 2HD2 LEU 54 9.073 4.487 -9.173 356 H SER 55 H SER 55 6.943 5.690 -4.218 357 HA SER 55 HA SER 55 9.127 4.425 -2.769 358 HB2 SER 55 1HB SER 55 8.196 4.994 -0.568 359 HB3 SER 55 2HB SER 55 8.649 6.450 -1.454 360 HG SER 55 HG SER 55 6.022 5.381 -1.348 361 H VAL 56 H VAL 56 8.689 2.355 -2.310 362 HA VAL 56 HA VAL 56 5.891 1.474 -2.225 363 HB VAL 56 HB VAL 56 8.013 -0.013 -3.773 364 HG11 VAL 56 1HG1 VAL 56 6.401 -1.558 -4.316 365 HG12 VAL 56 2HG1 VAL 56 5.910 -1.130 -2.676 366 HG13 VAL 56 3HG1 VAL 56 5.074 -0.425 -4.061 367 HG21 VAL 56 3HG2 VAL 56 6.118 0.812 -5.588 368 HG22 VAL 56 1HG2 VAL 56 6.317 2.224 -4.550 369 HG23 VAL 56 2HG2 VAL 56 7.715 1.525 -5.368 370 H THR 57 H THR 57 5.503 0.250 -0.506 371 HA THR 57 HA THR 57 7.580 -1.512 0.541 372 HB THR 57 HB THR 57 6.130 0.374 2.399 373 HG1 THR 57 1HG THR 57 8.012 1.602 2.415 374 HG21 THR 57 3HG2 THR 57 7.359 -1.976 2.957 375 HG22 THR 57 1HG2 THR 57 7.243 -0.630 4.089 376 HG23 THR 57 2HG2 THR 57 8.707 -0.852 3.130 377 H ILE 58 H ILE 58 6.676 -3.443 0.741 378 HA ILE 58 HA ILE 58 3.878 -3.603 1.651 379 HB ILE 58 HB ILE 58 5.203 -5.447 -0.340 380 HG12 ILE 58 1HG1 ILE 58 2.962 -3.473 -0.809 381 HG13 ILE 58 2HG1 ILE 58 4.650 -3.134 -1.179 382 HG21 ILE 58 1HG2 ILE 58 3.625 -6.693 0.910 383 HG22 ILE 58 2HG2 ILE 58 2.446 -5.384 0.860 384 HG23 ILE 58 3HG2 ILE 58 2.834 -6.277 -0.610 385 HD11 ILE 58 3HD1 ILE 58 3.698 -3.793 -3.204 386 HD12 ILE 58 1HD1 ILE 58 4.575 -5.215 -2.638 387 HD13 ILE 58 2HD1 ILE 58 2.822 -5.130 -2.460 388 H GLU 59 H GLU 59 3.455 -4.977 3.286 389 HA GLU 59 HA GLU 59 5.606 -6.803 4.134 390 HB2 GLU 59 1HB GLU 59 4.061 -4.796 5.707 391 HB3 GLU 59 2HB GLU 59 4.499 -6.304 6.496 392 HG2 GLU 59 1HG GLU 59 6.874 -5.845 5.801 393 HG3 GLU 59 2HG GLU 59 6.334 -4.237 5.323 394 H GLY 60 H GLY 60 4.963 -8.752 5.120 395 HA2 GLY 60 1HA GLY 60 2.387 -9.529 5.790 396 HA3 GLY 60 2HA GLY 60 2.568 -9.868 4.075 397 HA PRO 61 HA PRO 61 4.140 -13.468 6.630 398 HB2 PRO 61 1HB PRO 61 2.505 -15.330 5.521 399 HB3 PRO 61 2HB PRO 61 2.049 -14.371 6.934 400 HG2 PRO 61 1HG PRO 61 1.315 -13.975 4.059 401 HG3 PRO 61 2HG PRO 61 0.294 -13.844 5.503 402 HD2 PRO 61 1HD PRO 61 1.326 -11.679 4.247 403 HD3 PRO 61 2HD PRO 61 1.052 -11.724 6.000 404 H SER 62 H SER 62 3.218 -13.231 3.214 405 HA SER 62 HA SER 62 5.596 -14.833 2.533 406 HB2 SER 62 1HB SER 62 2.956 -14.555 1.089 407 HB3 SER 62 2HB SER 62 4.380 -15.303 0.366 408 HG SER 62 HG SER 62 2.989 -16.145 2.691 409 H LYS 63 H LYS 63 6.607 -14.274 0.438 410 HA LYS 63 HA LYS 63 6.955 -11.407 0.262 411 HB2 LYS 63 1HB LYS 63 8.858 -13.053 0.191 412 HB3 LYS 63 2HB LYS 63 8.285 -13.556 -1.394 413 HG2 LYS 63 1HG LYS 63 9.907 -12.049 -1.967 414 HG3 LYS 63 2HG LYS 63 8.478 -11.013 -1.951 415 HD2 LYS 63 1HD LYS 63 9.132 -10.623 0.543 416 HD3 LYS 63 2HD LYS 63 10.721 -11.186 0.019 417 HE2 LYS 63 1HE LYS 63 10.641 -8.780 -0.115 418 HE3 LYS 63 2HE LYS 63 10.712 -9.452 -1.743 419 HZ1 LYS 63 3HZ LYS 63 8.493 -8.941 -2.132 420 HZ2 LYS 63 1HZ LYS 63 9.056 -7.586 -1.289 421 HZ3 LYS 63 2HZ LYS 63 8.131 -8.755 -0.490 422 H VAL 64 H VAL 64 6.592 -10.134 -1.555 423 HA VAL 64 HA VAL 64 4.948 -11.357 -3.673 424 HB VAL 64 HB VAL 64 3.546 -9.407 -3.775 425 HG11 VAL 64 1HG1 VAL 64 3.876 -10.812 -1.188 426 HG12 VAL 64 2HG1 VAL 64 2.813 -9.403 -1.214 427 HG13 VAL 64 3HG1 VAL 64 2.498 -10.767 -2.287 428 HG21 VAL 64 3HG2 VAL 64 5.453 -8.290 -1.742 429 HG22 VAL 64 1HG2 VAL 64 4.970 -7.608 -3.295 430 HG23 VAL 64 2HG2 VAL 64 3.828 -7.637 -1.951 431 H LYS 65 H LYS 65 5.141 -10.470 -5.751 432 HA LYS 65 HA LYS 65 7.712 -9.215 -6.252 433 HB2 LYS 65 1HB LYS 65 7.410 -9.820 -8.528 434 HB3 LYS 65 2HB LYS 65 6.826 -11.180 -7.578 435 HG2 LYS 65 1HG LYS 65 4.507 -10.121 -7.850 436 HG3 LYS 65 2HG LYS 65 5.252 -9.159 -9.130 437 HD2 LYS 65 1HD LYS 65 4.320 -11.035 -10.211 438 HD3 LYS 65 2HD LYS 65 6.051 -11.362 -10.114 439 HE2 LYS 65 1HE LYS 65 5.730 -12.834 -8.251 440 HE3 LYS 65 2HE LYS 65 4.030 -12.384 -8.126 441 HZ1 LYS 65 3HZ LYS 65 5.005 -13.534 -10.643 442 HZ2 LYS 65 1HZ LYS 65 3.469 -13.630 -9.940 443 HZ3 LYS 65 2HZ LYS 65 4.739 -14.567 -9.330 444 H MET 66 H MET 66 7.994 -7.119 -6.639 445 HA MET 66 HA MET 66 5.619 -5.489 -7.257 446 HB2 MET 66 1HB MET 66 8.076 -4.894 -5.628 447 HB3 MET 66 2HB MET 66 7.085 -3.599 -6.288 448 HG2 MET 66 1HG MET 66 5.276 -4.121 -4.948 449 HG3 MET 66 2HG MET 66 5.834 -5.768 -4.664 450 HE1 MET 66 3HE MET 66 8.949 -5.152 -2.431 451 HE2 MET 66 1HE MET 66 7.626 -6.317 -2.374 452 HE3 MET 66 2HE MET 66 8.398 -5.935 -3.913 453 H ASP 67 H ASP 67 5.627 -4.251 -9.042 454 HA ASP 67 HA ASP 67 8.158 -3.982 -10.524 455 HB2 ASP 67 1HB ASP 67 6.506 -5.680 -11.478 456 HB3 ASP 67 2HB ASP 67 5.471 -4.305 -11.854 457 H CYS 68 H CYS 68 8.668 -1.895 -10.236 458 HA CYS 68 HA CYS 68 6.692 0.173 -10.060 459 HB2 CYS 68 1HB CYS 68 8.617 1.699 -9.928 460 HB3 CYS 68 2HB CYS 68 8.794 0.343 -8.821 461 HG CYS 68 HG CYS 68 10.236 0.036 -11.862 462 H GLN 69 H GLN 69 6.257 1.817 -11.530 463 HA GLN 69 HA GLN 69 7.441 1.631 -14.194 464 HB2 GLN 69 1HB GLN 69 4.601 1.075 -13.507 465 HB3 GLN 69 2HB GLN 69 4.912 1.998 -14.972 466 HG2 GLN 69 1HG GLN 69 6.385 -0.550 -14.495 467 HG3 GLN 69 2HG GLN 69 4.717 -0.593 -15.062 468 HE21 GLN 69 1HE2 GLN 69 6.683 -1.651 -16.600 469 HE22 GLN 69 2HE2 GLN 69 6.946 -0.666 -17.994 470 H GLU 70 H GLU 70 7.595 3.559 -15.244 471 HA GLU 70 HA GLU 70 6.872 5.924 -13.697 472 HB2 GLU 70 1HB GLU 70 9.187 5.545 -14.689 473 HB3 GLU 70 2HB GLU 70 8.458 5.848 -16.260 474 HG2 GLU 70 1HG GLU 70 8.137 8.072 -15.842 475 HG3 GLU 70 2HG GLU 70 8.054 7.845 -14.096 476 H THR 71 H THR 71 4.882 6.666 -14.041 477 HA THR 71 HA THR 71 3.822 6.651 -16.787 478 HB THR 71 HB THR 71 1.589 7.013 -15.690 479 HG1 THR 71 1HG THR 71 1.444 6.726 -13.476 480 HG21 THR 71 3HG2 THR 71 3.250 4.570 -15.419 481 HG22 THR 71 1HG2 THR 71 1.750 4.825 -16.310 482 HG23 THR 71 2HG2 THR 71 1.709 4.598 -14.562 483 HA PRO 72 HA PRO 72 3.952 11.036 -17.020 484 HB2 PRO 72 1HB PRO 72 1.791 11.524 -18.589 485 HB3 PRO 72 2HB PRO 72 3.286 10.812 -19.208 486 HG2 PRO 72 1HG PRO 72 0.729 9.466 -18.428 487 HG3 PRO 72 2HG PRO 72 1.765 9.170 -19.836 488 HD2 PRO 72 1HD PRO 72 1.813 7.594 -17.635 489 HD3 PRO 72 2HD PRO 72 3.254 7.890 -18.629 490 H GLU 73 H GLU 73 1.499 9.394 -15.403 491 HA GLU 73 HA GLU 73 0.225 11.896 -14.524 492 HB2 GLU 73 1HB GLU 73 -0.741 9.097 -14.818 493 HB3 GLU 73 2HB GLU 73 -1.407 10.048 -13.497 494 HG2 GLU 73 1HG GLU 73 -2.245 11.692 -15.005 495 HG3 GLU 73 2HG GLU 73 -1.399 10.954 -16.363 496 H GLY 74 H GLY 74 1.631 8.859 -13.361 497 HA2 GLY 74 1HA GLY 74 2.654 10.148 -11.014 498 HA3 GLY 74 2HA GLY 74 1.300 9.088 -10.651 499 H TYR 75 H TYR 75 1.672 6.969 -10.396 500 HA TYR 75 HA TYR 75 3.912 5.652 -11.631 501 HB2 TYR 75 1HB TYR 75 3.871 5.866 -8.615 502 HB3 TYR 75 2HB TYR 75 5.055 5.006 -9.593 503 HD1 TYR 75 1HD TYR 75 6.673 6.276 -10.976 504 HD2 TYR 75 2HD TYR 75 4.024 8.225 -8.277 505 HE1 TYR 75 1HE TYR 75 8.065 8.301 -11.081 506 HE2 TYR 75 2HE TYR 75 5.408 10.255 -8.375 507 HH TYR 75 HH TYR 75 8.309 10.467 -9.149 508 H LYS 76 H LYS 76 3.161 3.734 -12.203 509 HA LYS 76 HA LYS 76 0.853 2.606 -10.846 510 HB2 LYS 76 1HB LYS 76 0.829 2.615 -13.269 511 HB3 LYS 76 2HB LYS 76 2.358 1.747 -13.323 512 HG2 LYS 76 1HG LYS 76 1.398 -0.255 -12.704 513 HG3 LYS 76 2HG LYS 76 0.011 0.526 -11.941 514 HD2 LYS 76 1HD LYS 76 -0.873 -0.370 -13.905 515 HD3 LYS 76 2HD LYS 76 -0.581 1.321 -14.317 516 HE2 LYS 76 1HE LYS 76 1.575 -0.666 -14.832 517 HE3 LYS 76 2HE LYS 76 0.181 -0.640 -15.911 518 HZ1 LYS 76 3HZ LYS 76 1.109 1.060 -16.953 519 HZ2 LYS 76 1HZ LYS 76 2.391 1.103 -15.850 520 HZ3 LYS 76 2HZ LYS 76 0.986 1.995 -15.549 521 H VAL 77 H VAL 77 0.892 0.929 -9.479 522 HA VAL 77 HA VAL 77 3.372 -0.645 -9.265 523 HB VAL 77 HB VAL 77 1.702 0.169 -6.889 524 HG11 VAL 77 1HG1 VAL 77 2.920 -1.835 -6.474 525 HG12 VAL 77 2HG1 VAL 77 4.387 -1.163 -7.191 526 HG13 VAL 77 3HG1 VAL 77 3.777 -0.524 -5.664 527 HG21 VAL 77 3HG2 VAL 77 2.638 2.190 -7.753 528 HG22 VAL 77 1HG2 VAL 77 3.604 1.706 -6.359 529 HG23 VAL 77 2HG2 VAL 77 4.209 1.426 -7.992 530 H MET 78 H MET 78 3.089 -2.785 -9.291 531 HA MET 78 HA MET 78 0.408 -3.850 -8.703 532 HB2 MET 78 1HB MET 78 2.197 -5.018 -10.822 533 HB3 MET 78 2HB MET 78 0.484 -5.313 -10.557 534 HG2 MET 78 1HG MET 78 0.379 -3.937 -12.363 535 HG3 MET 78 2HG MET 78 0.290 -2.748 -11.066 536 HE1 MET 78 3HE MET 78 2.288 -4.499 -13.711 537 HE2 MET 78 1HE MET 78 3.748 -3.537 -13.942 538 HE3 MET 78 2HE MET 78 3.632 -4.649 -12.578 539 H TYR 79 H TYR 79 0.322 -5.886 -7.737 540 HA TYR 79 HA TYR 79 2.819 -7.239 -7.094 541 HB2 TYR 79 1HB TYR 79 2.504 -7.187 -4.719 542 HB3 TYR 79 2HB TYR 79 2.420 -5.527 -5.296 543 HD1 TYR 79 2HD TYR 79 0.262 -4.343 -5.357 544 HD2 TYR 79 1HD TYR 79 0.594 -8.264 -3.739 545 HE1 TYR 79 2HE TYR 79 -1.922 -4.068 -4.259 546 HE2 TYR 79 1HE TYR 79 -1.590 -8.001 -2.638 547 HH TYR 79 HH TYR 79 -3.360 -4.941 -2.776 548 H THR 80 H THR 80 2.572 -9.382 -7.112 549 HA THR 80 HA THR 80 -0.166 -10.462 -6.932 550 HB THR 80 HB THR 80 2.117 -11.527 -8.607 551 HG1 THR 80 1HG THR 80 0.741 -9.537 -9.218 552 HG21 THR 80 3HG2 THR 80 0.542 -13.147 -9.449 553 HG22 THR 80 1HG2 THR 80 -0.756 -12.448 -8.482 554 HG23 THR 80 2HG2 THR 80 0.591 -13.266 -7.690 555 HA PRO 81 HA PRO 81 1.955 -12.403 -3.414 556 HB2 PRO 81 1HB PRO 81 -0.341 -12.968 -2.079 557 HB3 PRO 81 2HB PRO 81 0.434 -11.381 -2.028 558 HG2 PRO 81 1HG PRO 81 -1.887 -12.303 -3.678 559 HG3 PRO 81 2HG PRO 81 -1.675 -10.778 -2.799 560 HD2 PRO 81 1HD PRO 81 -1.293 -10.985 -5.472 561 HD3 PRO 81 2HD PRO 81 -0.368 -9.857 -4.459 562 H MET 82 H MET 82 2.169 -14.554 -2.794 563 HA MET 82 HA MET 82 0.844 -16.484 -4.569 564 HB2 MET 82 1HB MET 82 3.352 -16.346 -4.573 565 HB3 MET 82 2HB MET 82 3.330 -16.902 -2.905 566 HG2 MET 82 1HG MET 82 3.794 -18.761 -4.325 567 HG3 MET 82 2HG MET 82 2.177 -18.958 -3.654 568 HE1 MET 82 3HE MET 82 4.436 -18.575 -6.527 569 HE2 MET 82 1HE MET 82 3.696 -20.162 -6.736 570 HE3 MET 82 2HE MET 82 3.437 -18.903 -7.944 571 H ALA 83 H ALA 83 1.070 -15.454 -1.314 572 HA ALA 83 HA ALA 83 -0.591 -17.735 -0.487 573 HB1 ALA 83 3HB ALA 83 0.705 -18.289 1.267 574 HB2 ALA 83 1HB ALA 83 1.978 -17.515 0.323 575 HB3 ALA 83 2HB ALA 83 1.155 -16.617 1.599 576 HA PRO 84 HA PRO 84 -3.347 -14.626 0.975 577 HB2 PRO 84 1HB PRO 84 -4.771 -16.121 2.737 578 HB3 PRO 84 2HB PRO 84 -4.952 -16.270 0.985 579 HG2 PRO 84 1HG PRO 84 -3.380 -17.974 2.879 580 HG3 PRO 84 2HG PRO 84 -4.415 -18.467 1.526 581 HD2 PRO 84 1HD PRO 84 -1.715 -18.368 1.335 582 HD3 PRO 84 2HD PRO 84 -2.783 -18.034 -0.043 583 H GLY 85 H GLY 85 -4.294 -13.914 3.214 584 HA2 GLY 85 1HA GLY 85 -3.635 -14.031 5.664 585 HA3 GLY 85 2HA GLY 85 -2.007 -13.737 5.072 586 H ASN 86 H ASN 86 -1.953 -11.858 6.420 587 HA ASN 86 HA ASN 86 -3.589 -9.621 5.428 588 HB2 ASN 86 1HB ASN 86 -2.860 -8.523 7.620 589 HB3 ASN 86 2HB ASN 86 -4.000 -9.860 7.743 590 HD21 ASN 86 1HD2 ASN 86 -0.923 -8.672 8.589 591 HD22 ASN 86 2HD2 ASN 86 -0.381 -10.048 9.482 592 H TYR 87 H TYR 87 -2.603 -8.163 4.209 593 HA TYR 87 HA TYR 87 0.324 -7.896 4.427 594 HB2 TYR 87 1HB TYR 87 -1.507 -7.655 2.045 595 HB3 TYR 87 2HB TYR 87 0.133 -7.017 2.032 596 HD1 TYR 87 1HD TYR 87 -1.608 -10.196 2.971 597 HD2 TYR 87 2HD TYR 87 1.743 -8.366 1.092 598 HE1 TYR 87 1HE TYR 87 -0.757 -12.416 2.339 599 HE2 TYR 87 2HE TYR 87 2.602 -10.581 0.455 600 HH TYR 87 HH TYR 87 0.837 -13.292 0.399 601 H LEU 88 H LEU 88 1.220 -5.779 4.085 602 HA LEU 88 HA LEU 88 -0.663 -3.558 4.462 603 HB2 LEU 88 1HB LEU 88 0.559 -4.466 6.589 604 HB3 LEU 88 2HB LEU 88 1.933 -3.575 5.937 605 HG LEU 88 HG LEU 88 0.123 -1.621 5.863 606 HD11 LEU 88 1HD1 LEU 88 -1.516 -3.395 6.875 607 HD12 LEU 88 2HD1 LEU 88 -1.542 -1.723 7.437 608 HD13 LEU 88 3HD1 LEU 88 -0.721 -2.960 8.388 609 HD21 LEU 88 3HD2 LEU 88 2.050 -1.128 6.999 610 HD22 LEU 88 1HD2 LEU 88 1.958 -2.571 8.008 611 HD23 LEU 88 2HD2 LEU 88 0.903 -1.196 8.338 612 H ILE 89 H ILE 89 -0.303 -1.936 3.099 613 HA ILE 89 HA ILE 89 2.315 -1.803 1.756 614 HB ILE 89 HB ILE 89 -0.256 -0.652 0.689 615 HG12 ILE 89 1HG1 ILE 89 0.925 -3.220 -0.312 616 HG13 ILE 89 2HG1 ILE 89 -0.151 -3.239 1.081 617 HG21 ILE 89 1HG2 ILE 89 1.768 0.295 -0.246 618 HG22 ILE 89 2HG2 ILE 89 2.385 -1.317 -0.603 619 HG23 ILE 89 3HG2 ILE 89 0.962 -0.711 -1.449 620 HD11 ILE 89 3HD1 ILE 89 -1.179 -3.666 -1.197 621 HD12 ILE 89 1HD1 ILE 89 -1.965 -2.464 -0.174 622 HD13 ILE 89 2HD1 ILE 89 -0.932 -1.948 -1.507 623 H SER 90 H SER 90 3.529 -0.238 2.589 624 HA SER 90 HA SER 90 2.246 2.209 3.570 625 HB2 SER 90 1HB SER 90 4.831 0.828 4.154 626 HB3 SER 90 2HB SER 90 4.744 2.576 4.374 627 HG SER 90 HG SER 90 2.727 2.006 5.614 628 H VAL 91 H VAL 91 2.833 4.243 2.849 629 HA VAL 91 HA VAL 91 4.684 4.389 0.575 630 HB VAL 91 HB VAL 91 1.864 5.458 0.620 631 HG11 VAL 91 1HG1 VAL 91 4.084 6.085 -1.323 632 HG12 VAL 91 2HG1 VAL 91 2.389 6.529 -1.533 633 HG13 VAL 91 3HG1 VAL 91 3.323 7.212 -0.202 634 HG21 VAL 91 3HG2 VAL 91 2.674 4.131 -1.789 635 HG22 VAL 91 1HG2 VAL 91 3.002 3.100 -0.396 636 HG23 VAL 91 2HG2 VAL 91 1.374 3.718 -0.672 637 H LYS 92 H LYS 92 6.160 5.896 0.938 638 HA LYS 92 HA LYS 92 5.513 8.094 2.782 639 HB2 LYS 92 1HB LYS 92 8.016 6.593 2.167 640 HB3 LYS 92 2HB LYS 92 8.158 8.275 2.659 641 HG2 LYS 92 1HG LYS 92 7.047 7.819 4.738 642 HG3 LYS 92 2HG LYS 92 6.706 6.161 4.236 643 HD2 LYS 92 1HD LYS 92 9.203 5.833 4.052 644 HD3 LYS 92 2HD LYS 92 9.384 7.398 4.848 645 HE2 LYS 92 1HE LYS 92 9.514 5.915 6.621 646 HE3 LYS 92 2HE LYS 92 7.816 6.389 6.645 647 HZ1 LYS 92 3HZ LYS 92 8.391 4.092 4.994 648 HZ2 LYS 92 1HZ LYS 92 7.157 4.331 6.126 649 HZ3 LYS 92 2HZ LYS 92 8.695 3.851 6.641 650 H TYR 93 H TYR 93 5.923 10.215 2.228 651 HA TYR 93 HA TYR 93 6.995 10.777 -0.432 652 HB2 TYR 93 1HB TYR 93 4.198 11.249 0.453 653 HB3 TYR 93 2HB TYR 93 4.963 12.525 -0.486 654 HD1 TYR 93 1HD TYR 93 4.571 8.806 -0.585 655 HD2 TYR 93 2HD TYR 93 4.699 12.452 -2.774 656 HE1 TYR 93 1HE TYR 93 4.069 7.574 -2.654 657 HE2 TYR 93 2HE TYR 93 4.197 11.230 -4.849 658 HH TYR 93 HH TYR 93 3.226 9.162 -5.579 659 H GLY 94 H GLY 94 8.077 12.693 -0.583 660 HA2 GLY 94 1HA GLY 94 9.401 14.370 0.314 661 HA3 GLY 94 2HA GLY 94 7.827 15.032 0.732 662 H GLY 95 H GLY 95 9.633 12.242 2.015 663 HA2 GLY 95 1HA GLY 95 10.843 12.487 4.140 664 HA3 GLY 95 2HA GLY 95 9.554 13.564 4.657 665 HA PRO 96 HA PRO 96 8.741 9.253 6.254 666 HB2 PRO 96 1HB PRO 96 8.453 9.987 8.852 667 HB3 PRO 96 2HB PRO 96 10.016 9.571 8.139 668 HG2 PRO 96 1HG PRO 96 8.825 12.270 8.648 669 HG3 PRO 96 2HG PRO 96 10.484 11.710 8.923 670 HD2 PRO 96 1HD PRO 96 9.784 13.184 6.763 671 HD3 PRO 96 2HD PRO 96 11.070 11.962 6.708 672 H ASN 97 H ASN 97 7.167 12.192 5.935 673 HA ASN 97 HA ASN 97 4.759 11.601 7.359 674 HB2 ASN 97 1HB ASN 97 3.931 13.491 5.674 675 HB3 ASN 97 2HB ASN 97 4.926 13.870 7.077 676 HD21 ASN 97 1HD2 ASN 97 7.265 13.975 6.714 677 HD22 ASN 97 2HD2 ASN 97 7.836 14.584 5.201 678 H HIS 98 H HIS 98 3.768 9.749 6.749 679 HA HIS 98 HA HIS 98 3.611 8.756 4.125 680 HB2 HIS 98 1HB HIS 98 1.483 8.156 6.148 681 HB3 HIS 98 2HB HIS 98 2.247 7.078 4.983 682 HD2 HIS 98 2HD HIS 98 5.371 7.911 6.120 683 HE1 HIS 98 1HE HIS 98 3.922 5.926 9.578 684 HE2 HIS 98 2HE HIS 98 5.953 6.836 8.399 685 H ILE 99 H ILE 99 1.496 8.386 2.960 686 HA ILE 99 HA ILE 99 0.208 10.964 2.596 687 HB ILE 99 HB ILE 99 -0.798 10.002 0.605 688 HG12 ILE 99 1HG1 ILE 99 0.658 7.422 1.079 689 HG13 ILE 99 2HG1 ILE 99 -0.939 7.669 1.776 690 HG21 ILE 99 1HG2 ILE 99 2.074 10.006 1.106 691 HG22 ILE 99 2HG2 ILE 99 1.603 8.996 -0.260 692 HG23 ILE 99 3HG2 ILE 99 1.154 10.701 -0.228 693 HD11 ILE 99 3HD1 ILE 99 -1.966 7.752 -0.297 694 HD12 ILE 99 1HD1 ILE 99 -0.460 8.116 -1.139 695 HD13 ILE 99 2HD1 ILE 99 -0.743 6.497 -0.498 696 H VAL 100 H VAL 100 -2.189 10.991 2.206 697 HA VAL 100 HA VAL 100 -3.577 10.234 4.500 698 HB VAL 100 HB VAL 100 -4.520 11.054 1.766 699 HG11 VAL 100 1HG1 VAL 100 -6.242 10.402 4.155 700 HG12 VAL 100 2HG1 VAL 100 -6.800 11.197 2.682 701 HG13 VAL 100 3HG1 VAL 100 -6.208 9.537 2.619 702 HG21 VAL 100 3HG2 VAL 100 -4.467 12.366 4.477 703 HG22 VAL 100 1HG2 VAL 100 -3.572 12.834 3.031 704 HG23 VAL 100 2HG2 VAL 100 -5.323 13.035 3.088 705 H GLY 101 H GLY 101 -4.833 8.518 5.061 706 HA2 GLY 101 1HA GLY 101 -6.118 6.570 4.636 707 HA3 GLY 101 2HA GLY 101 -5.333 6.426 3.070 708 H SER 102 H SER 102 -2.734 6.354 3.528 709 HA SER 102 HA SER 102 -2.235 3.774 4.436 710 HB2 SER 102 1HB SER 102 -0.413 6.143 4.025 711 HB3 SER 102 2HB SER 102 0.200 4.567 4.526 712 HG SER 102 HG SER 102 -0.408 5.388 2.077 713 HA PRO 103 HA PRO 103 -0.227 2.775 5.283 714 HB2 PRO 103 1HB PRO 103 -0.429 0.675 6.992 715 HB3 PRO 103 2HB PRO 103 0.859 1.881 7.100 716 HG2 PRO 103 1HG PRO 103 -1.677 1.671 8.677 717 HG3 PRO 103 2HG PRO 103 -0.039 2.054 9.238 718 HD2 PRO 103 1HD PRO 103 -1.919 3.958 8.824 719 HD3 PRO 103 2HD PRO 103 -0.187 4.254 8.567 720 H PHE 104 H PHE 104 -1.117 1.306 3.905 721 HA PHE 104 HA PHE 104 -3.995 1.003 3.986 722 HB2 PHE 104 1HB PHE 104 -1.901 0.195 1.966 723 HB3 PHE 104 2HB PHE 104 -3.611 -0.178 1.777 724 HD1 PHE 104 2HD PHE 104 -5.198 1.936 2.096 725 HD2 PHE 104 1HD PHE 104 -1.103 2.081 0.944 726 HE1 PHE 104 2HE PHE 104 -5.567 4.144 1.075 727 HE2 PHE 104 1HE PHE 104 -1.465 4.290 -0.077 728 HZ PHE 104 HZ PHE 104 -3.699 5.324 -0.014 729 H LYS 105 H LYS 105 -4.927 -0.602 5.050 730 HA LYS 105 HA LYS 105 -3.434 -3.094 5.477 731 HB2 LYS 105 1HB LYS 105 -5.881 -1.996 6.874 732 HB3 LYS 105 2HB LYS 105 -5.127 -3.542 7.243 733 HG2 LYS 105 1HG LYS 105 -3.230 -2.538 8.149 734 HG3 LYS 105 2HG LYS 105 -3.569 -0.987 7.378 735 HD2 LYS 105 1HD LYS 105 -5.418 -0.589 8.848 736 HD3 LYS 105 2HD LYS 105 -5.304 -2.219 9.514 737 HE2 LYS 105 1HE LYS 105 -3.143 -1.702 10.481 738 HE3 LYS 105 2HE LYS 105 -3.168 -0.101 9.743 739 HZ1 LYS 105 3HZ LYS 105 -4.342 -0.972 12.181 740 HZ2 LYS 105 1HZ LYS 105 -5.510 -0.283 11.169 741 HZ3 LYS 105 2HZ LYS 105 -4.133 0.602 11.596 742 H ALA 106 H ALA 106 -3.802 -4.462 3.835 743 HA ALA 106 HA ALA 106 -6.582 -4.833 2.933 744 HB1 ALA 106 3HB ALA 106 -5.775 -5.527 0.828 745 HB2 ALA 106 1HB ALA 106 -4.836 -4.095 1.255 746 HB3 ALA 106 2HB ALA 106 -4.126 -5.701 1.431 747 H LYS 107 H LYS 107 -7.374 -6.949 2.621 748 HA LYS 107 HA LYS 107 -5.916 -9.005 4.148 749 HB2 LYS 107 1HB LYS 107 -7.957 -8.399 5.278 750 HB3 LYS 107 2HB LYS 107 -8.886 -8.579 3.795 751 HG2 LYS 107 1HG LYS 107 -8.834 -10.880 3.881 752 HG3 LYS 107 2HG LYS 107 -7.384 -10.915 4.887 753 HD2 LYS 107 1HD LYS 107 -9.970 -9.783 5.907 754 HD3 LYS 107 2HD LYS 107 -9.634 -11.514 5.978 755 HE2 LYS 107 1HE LYS 107 -7.790 -11.201 7.406 756 HE3 LYS 107 2HE LYS 107 -7.723 -9.471 7.074 757 HZ1 LYS 107 3HZ LYS 107 -8.849 -10.507 9.246 758 HZ2 LYS 107 1HZ LYS 107 -10.202 -10.443 8.231 759 HZ3 LYS 107 2HZ LYS 107 -9.329 -9.034 8.566 760 H VAL 108 H VAL 108 -5.173 -10.651 2.997 761 HA VAL 108 HA VAL 108 -6.199 -11.100 0.301 762 HB VAL 108 HB VAL 108 -3.876 -12.525 1.584 763 HG11 VAL 108 1HG1 VAL 108 -4.427 -13.629 -0.383 764 HG12 VAL 108 2HG1 VAL 108 -4.869 -12.136 -1.214 765 HG13 VAL 108 3HG1 VAL 108 -3.172 -12.504 -0.901 766 HG21 VAL 108 3HG2 VAL 108 -3.689 -9.994 1.672 767 HG22 VAL 108 1HG2 VAL 108 -2.389 -10.851 0.843 768 HG23 VAL 108 2HG2 VAL 108 -3.645 -10.037 -0.090 769 H THR 109 H THR 109 -7.493 -12.738 -0.217 770 HA THR 109 HA THR 109 -7.723 -14.998 1.660 771 HB THR 109 HB THR 109 -10.128 -15.138 1.142 772 HG1 THR 109 1HG THR 109 -11.068 -13.756 -0.224 773 HG21 THR 109 3HG2 THR 109 -10.829 -13.052 2.347 774 HG22 THR 109 1HG2 THR 109 -9.157 -12.502 2.243 775 HG23 THR 109 2HG2 THR 109 -9.549 -13.965 3.147 776 H GLY 110 H GLY 110 -8.390 -17.017 0.720 777 HA2 GLY 110 1HA GLY 110 -9.051 -18.053 -1.502 778 HA3 GLY 110 2HA GLY 110 -7.651 -17.198 -2.132 779 H GLN 111 H GLN 111 -8.508 -20.146 -1.663 780 HA GLN 111 HA GLN 111 -6.947 -21.453 0.149 781 HB2 GLN 111 1HB GLN 111 -7.880 -22.142 -2.598 782 HB3 GLN 111 2HB GLN 111 -6.705 -23.202 -1.831 783 HG2 GLN 111 1HG GLN 111 -8.186 -23.628 -0.002 784 HG3 GLN 111 2HG GLN 111 -9.329 -22.421 -0.589 785 HE21 GLN 111 1HE2 GLN 111 -10.836 -24.232 -0.434 786 HE22 GLN 111 2HE2 GLN 111 -10.963 -25.324 -1.767 787 H ARG 112 H ARG 112 -4.868 -21.249 0.619 788 HA ARG 112 HA ARG 112 -2.904 -19.932 -0.658 789 HB2 ARG 112 1HB ARG 112 -1.267 -21.351 0.487 790 HB3 ARG 112 2HB ARG 112 -2.612 -20.949 1.547 791 HG2 ARG 112 1HG ARG 112 -3.569 -23.233 0.728 792 HG3 ARG 112 2HG ARG 112 -1.885 -23.562 0.315 793 HD2 ARG 112 1HD ARG 112 -1.394 -22.760 2.728 794 HD3 ARG 112 2HD ARG 112 -3.112 -23.051 2.998 795 HE ARG 112 HE ARG 112 -2.000 -25.321 1.792 796 HH11 ARG 112 1HH1 ARG 112 -1.868 -23.568 4.797 797 HH12 ARG 112 2HH1 ARG 112 -1.491 -24.967 5.747 798 HH21 ARG 112 1HH2 ARG 112 -1.504 -27.170 3.032 799 HH22 ARG 112 2HH2 ARG 112 -1.283 -27.015 4.742 800 H LEU 113 H LEU 113 -1.473 -20.222 -2.307 801 HA LEU 113 HA LEU 113 -2.109 -22.320 -4.212 802 HB2 LEU 113 1HB LEU 113 -0.043 -20.154 -4.503 803 HB3 LEU 113 2HB LEU 113 -0.812 -21.094 -5.780 804 HG LEU 113 HG LEU 113 -2.376 -19.209 -4.040 805 HD11 LEU 113 1HD1 LEU 113 -0.368 -18.163 -5.300 806 HD12 LEU 113 2HD1 LEU 113 -1.959 -17.416 -5.437 807 HD13 LEU 113 3HD1 LEU 113 -1.350 -18.437 -6.740 808 HD21 LEU 113 3HD2 LEU 113 -3.680 -20.809 -5.293 809 HD22 LEU 113 1HD2 LEU 113 -2.821 -20.395 -6.777 810 HD23 LEU 113 2HD2 LEU 113 -3.872 -19.207 -6.006 811 H VAL 114 H VAL 114 -1.098 -24.205 -4.159 812 HA VAL 114 HA VAL 114 1.594 -24.348 -2.989 813 HB VAL 114 HB VAL 114 1.114 -26.860 -2.993 814 HG11 VAL 114 1HG1 VAL 114 -0.790 -26.196 -1.083 815 HG12 VAL 114 2HG1 VAL 114 0.953 -26.319 -0.839 816 HG13 VAL 114 3HG1 VAL 114 0.223 -24.759 -1.218 817 HG21 VAL 114 3HG2 VAL 114 -0.837 -26.596 -4.583 818 HG22 VAL 114 1HG2 VAL 114 -1.123 -27.608 -3.167 819 HG23 VAL 114 2HG2 VAL 114 -1.749 -25.959 -3.214 820 H SER 115 H SER 115 3.259 -25.469 -4.038 821 HA SER 115 HA SER 115 2.790 -26.164 -6.854 822 HB2 SER 115 1HB SER 115 3.743 -23.953 -6.931 823 HB3 SER 115 2HB SER 115 5.003 -24.401 -5.782 824 HG SER 115 HG SER 115 4.812 -25.913 -8.110 825 HA PRO 116 HA PRO 116 4.994 -29.586 -4.702 826 HB2 PRO 116 1HB PRO 116 3.675 -31.552 -6.030 827 HB3 PRO 116 2HB PRO 116 3.036 -30.780 -4.574 828 HG2 PRO 116 1HG PRO 116 2.372 -30.251 -7.445 829 HG3 PRO 116 2HG PRO 116 1.285 -30.374 -6.049 830 HD2 PRO 116 1HD PRO 116 2.062 -27.996 -7.084 831 HD3 PRO 116 2HD PRO 116 1.726 -28.221 -5.356 832 H GLY 117 H GLY 117 4.297 -28.987 -8.105 833 HA2 GLY 117 1HA GLY 117 6.220 -28.826 -9.606 834 HA3 GLY 117 2HA GLY 117 6.906 -30.206 -8.763 835 H SER 118 H SER 118 6.962 -31.874 -10.111 836 HA SER 118 HA SER 118 4.638 -32.337 -11.859 837 HB2 SER 118 1HB SER 118 7.569 -32.778 -12.226 838 HB3 SER 118 2HB SER 118 6.452 -33.880 -13.031 839 HG SER 118 HG SER 118 5.839 -31.199 -13.269 840 H ALA 119 H ALA 119 3.643 -34.309 -11.882 841 HA ALA 119 HA ALA 119 4.751 -36.498 -10.310 842 HB1 ALA 119 3HB ALA 119 3.432 -36.230 -8.549 843 HB2 ALA 119 1HB ALA 119 2.755 -34.771 -9.272 844 HB3 ALA 119 2HB ALA 119 2.011 -36.339 -9.587 845 H ASN 120 H ASN 120 4.724 -38.122 -11.719 846 HA ASN 120 HA ASN 120 2.220 -38.900 -12.951 847 HB2 ASN 120 1HB ASN 120 3.200 -37.346 -14.603 848 HB3 ASN 120 2HB ASN 120 4.659 -38.331 -14.651 849 HD21 ASN 120 1HD2 ASN 120 4.357 -40.609 -15.291 850 HD22 ASN 120 2HD2 ASN 120 3.179 -40.961 -16.505 851 H GLU 121 H GLU 121 2.023 -41.025 -12.739 852 HA GLU 121 HA GLU 121 4.468 -42.669 -12.698 853 HB2 GLU 121 1HB GLU 121 3.128 -42.270 -10.472 854 HB3 GLU 121 2HB GLU 121 2.039 -43.473 -11.147 855 HG2 GLU 121 1HG GLU 121 3.568 -44.592 -9.717 856 HG3 GLU 121 2HG GLU 121 3.982 -45.008 -11.379 857 H THR 122 H THR 122 4.200 -44.878 -13.395 858 HA THR 122 HA THR 122 1.892 -45.249 -15.193 859 HB THR 122 HB THR 122 3.904 -44.831 -16.511 860 HG1 THR 122 1HG THR 122 2.968 -47.520 -16.512 861 HG21 THR 122 3HG2 THR 122 5.699 -45.457 -15.135 862 HG22 THR 122 1HG2 THR 122 5.703 -46.656 -16.427 863 HG23 THR 122 2HG2 THR 122 5.033 -47.064 -14.847 864 H SER 123 H SER 123 1.225 -47.440 -15.563 865 HA SER 123 HA SER 123 1.530 -49.078 -13.183 866 HB2 SER 123 1HB SER 123 -0.720 -48.888 -13.886 867 HB3 SER 123 2HB SER 123 -0.305 -49.194 -15.573 868 HG SER 123 HG SER 123 -0.254 -51.040 -13.421 869 H SER 124 H SER 124 2.129 -49.302 -16.662 870 HA SER 124 HA SER 124 2.871 -51.914 -16.952 871 HB2 SER 124 1HB SER 124 3.803 -49.383 -18.240 872 HB3 SER 124 2HB SER 124 4.672 -50.877 -18.593 873 HG SER 124 HG SER 124 2.980 -51.634 -19.643 874 H ILE 125 H ILE 125 5.231 -52.660 -17.367 875 HA ILE 125 HA ILE 125 6.561 -52.666 -14.865 876 HB ILE 125 HB ILE 125 7.320 -53.717 -17.578 877 HG12 ILE 125 1HG1 ILE 125 7.268 -55.862 -16.021 878 HG13 ILE 125 2HG1 ILE 125 6.245 -54.833 -15.024 879 HG21 ILE 125 1HG2 ILE 125 9.039 -53.250 -15.260 880 HG22 ILE 125 2HG2 ILE 125 9.079 -54.907 -15.861 881 HG23 ILE 125 3HG2 ILE 125 9.463 -53.568 -16.942 882 HD11 ILE 125 3HD1 ILE 125 4.512 -55.289 -16.309 883 HD12 ILE 125 1HD1 ILE 125 5.359 -54.650 -17.718 884 HD13 ILE 125 2HD1 ILE 125 5.528 -56.352 -17.284 Start of MODEL 4 1 H1 GLY 1 H GLY 1 2.749 51.208 -31.057 2 HA2 GLY 1 1HA GLY 1 4.107 51.250 -28.565 3 HA3 GLY 1 2HA GLY 1 3.744 52.648 -29.567 4 H SER 2 H SER 2 3.658 52.842 -26.831 5 HA SER 2 HA SER 2 1.042 53.846 -26.411 6 HB2 SER 2 1HB SER 2 0.302 52.362 -24.623 7 HB3 SER 2 2HB SER 2 0.563 51.432 -26.098 8 HG SER 2 HG SER 2 2.404 50.595 -25.255 9 H SER 3 H SER 3 1.167 55.466 -24.991 10 HA SER 3 HA SER 3 3.583 56.271 -23.856 11 HB2 SER 3 1HB SER 3 1.431 57.636 -24.313 12 HB3 SER 3 2HB SER 3 0.924 57.098 -22.712 13 HG SER 3 HG SER 3 2.207 59.179 -23.011 14 H GLY 4 H GLY 4 3.663 56.831 -21.374 15 HA2 GLY 4 1HA GLY 4 3.765 54.298 -20.021 16 HA3 GLY 4 2HA GLY 4 4.240 55.855 -19.359 17 H SER 5 H SER 5 1.384 53.919 -20.195 18 HA SER 5 HA SER 5 0.115 54.815 -17.727 19 HB2 SER 5 1HB SER 5 -0.680 56.406 -19.423 20 HB3 SER 5 2HB SER 5 -1.223 55.066 -20.434 21 HG SER 5 HG SER 5 -2.737 54.538 -18.872 22 H SER 6 H SER 6 -0.398 53.006 -16.707 23 HA SER 6 HA SER 6 -0.514 50.465 -17.849 24 HB2 SER 6 1HB SER 6 -1.775 51.459 -15.282 25 HB3 SER 6 2HB SER 6 -1.576 49.761 -15.715 26 HG SER 6 HG SER 6 0.174 50.265 -14.492 27 H GLY 7 H GLY 7 -2.377 49.001 -17.979 28 HA2 GLY 7 1HA GLY 7 -4.996 50.219 -18.279 29 HA3 GLY 7 2HA GLY 7 -4.272 49.627 -19.767 30 H PHE 8 H PHE 8 -3.406 47.302 -19.566 31 HA PHE 8 HA PHE 8 -5.513 45.563 -19.211 32 HB2 PHE 8 1HB PHE 8 -3.632 43.788 -18.979 33 HB3 PHE 8 2HB PHE 8 -3.743 44.714 -20.472 34 HD1 PHE 8 2HD PHE 8 -2.114 46.462 -20.975 35 HD2 PHE 8 1HD PHE 8 -1.788 44.058 -17.478 36 HE1 PHE 8 2HE PHE 8 0.222 47.183 -20.701 37 HE2 PHE 8 1HE PHE 8 0.548 44.776 -17.197 38 HZ PHE 8 HZ PHE 8 1.557 46.340 -18.811 39 H LYS 9 H LYS 9 -6.241 44.235 -17.592 40 HA LYS 9 HA LYS 9 -5.440 44.996 -14.890 41 HB2 LYS 9 1HB LYS 9 -7.772 45.064 -15.120 42 HB3 LYS 9 2HB LYS 9 -7.817 43.571 -16.049 43 HG2 LYS 9 1HG LYS 9 -8.699 43.050 -13.934 44 HG3 LYS 9 2HG LYS 9 -7.063 42.387 -13.951 45 HD2 LYS 9 1HD LYS 9 -6.241 44.088 -12.560 46 HD3 LYS 9 2HD LYS 9 -7.645 45.119 -12.846 47 HE2 LYS 9 1HE LYS 9 -8.909 43.053 -11.768 48 HE3 LYS 9 2HE LYS 9 -7.329 42.784 -11.033 49 HZ1 LYS 9 3HZ LYS 9 -7.638 44.472 -9.643 50 HZ2 LYS 9 1HZ LYS 9 -9.259 44.488 -10.128 51 HZ3 LYS 9 2HZ LYS 9 -8.143 45.518 -10.873 52 H VAL 10 H VAL 10 -4.087 43.798 -13.739 53 HA VAL 10 HA VAL 10 -3.418 41.109 -14.648 54 HB VAL 10 HB VAL 10 -2.149 42.806 -12.493 55 HG11 VAL 10 1HG1 VAL 10 -0.624 40.594 -13.658 56 HG12 VAL 10 2HG1 VAL 10 -0.777 41.107 -11.977 57 HG13 VAL 10 3HG1 VAL 10 -2.021 40.090 -12.706 58 HG21 VAL 10 3HG2 VAL 10 -0.747 42.131 -15.015 59 HG22 VAL 10 1HG2 VAL 10 -2.029 43.339 -15.101 60 HG23 VAL 10 2HG2 VAL 10 -0.657 43.585 -14.021 61 H ARG 11 H ARG 11 -4.037 39.297 -13.651 62 HA ARG 11 HA ARG 11 -5.878 39.458 -11.447 63 HB2 ARG 11 1HB ARG 11 -6.038 37.832 -13.386 64 HB3 ARG 11 2HB ARG 11 -4.698 36.958 -12.655 65 HG2 ARG 11 1HG ARG 11 -6.027 36.573 -10.650 66 HG3 ARG 11 2HG ARG 11 -7.367 37.474 -11.360 67 HD2 ARG 11 1HD ARG 11 -8.012 35.358 -11.908 68 HD3 ARG 11 2HD ARG 11 -7.023 35.731 -13.319 69 HE ARG 11 HE ARG 11 -5.365 34.581 -11.396 70 HH11 ARG 11 1HH1 ARG 11 -8.077 33.697 -13.392 71 HH12 ARG 11 2HH1 ARG 11 -7.630 32.026 -13.486 72 HH21 ARG 11 1HH2 ARG 11 -4.766 32.383 -11.513 73 HH22 ARG 11 2HH2 ARG 11 -5.747 31.280 -12.416 74 H VAL 12 H VAL 12 -5.605 38.688 -9.368 75 HA VAL 12 HA VAL 12 -2.937 38.810 -8.332 76 HB VAL 12 HB VAL 12 -5.547 38.134 -6.970 77 HG11 VAL 12 1HG1 VAL 12 -2.911 37.706 -6.065 78 HG12 VAL 12 2HG1 VAL 12 -3.537 39.102 -5.186 79 HG13 VAL 12 3HG1 VAL 12 -4.411 37.570 -5.149 80 HG21 VAL 12 3HG2 VAL 12 -4.967 40.497 -7.993 81 HG22 VAL 12 1HG2 VAL 12 -5.764 40.345 -6.427 82 HG23 VAL 12 2HG2 VAL 12 -4.029 40.652 -6.507 83 H GLY 13 H GLY 13 -1.892 37.042 -9.352 84 HA2 GLY 13 1HA GLY 13 -2.770 34.381 -9.282 85 HA3 GLY 13 2HA GLY 13 -1.098 34.892 -9.456 86 H GLU 14 H GLU 14 -1.733 32.585 -8.094 87 HA GLU 14 HA GLU 14 -1.890 33.077 -5.270 88 HB2 GLU 14 1HB GLU 14 -1.329 30.600 -6.896 89 HB3 GLU 14 2HB GLU 14 -1.340 30.601 -5.138 90 HG2 GLU 14 1HG GLU 14 -3.668 31.445 -6.845 91 HG3 GLU 14 2HG GLU 14 -3.456 29.828 -6.175 92 HA PRO 15 HA PRO 15 2.351 33.602 -4.273 93 HB2 PRO 15 1HB PRO 15 2.490 32.366 -1.860 94 HB3 PRO 15 2HB PRO 15 1.680 33.919 -2.099 95 HG2 PRO 15 1HG PRO 15 0.500 31.173 -1.925 96 HG3 PRO 15 2HG PRO 15 -0.069 32.684 -1.191 97 HD2 PRO 15 1HD PRO 15 -1.162 31.658 -3.446 98 HD3 PRO 15 2HD PRO 15 -1.063 33.404 -3.142 99 H GLY 16 H GLY 16 1.227 30.300 -3.493 100 HA2 GLY 16 1HA GLY 16 2.761 28.866 -5.231 101 HA3 GLY 16 2HA GLY 16 3.848 29.183 -3.887 102 H GLN 17 H GLN 17 3.477 26.635 -4.316 103 HA GLN 17 HA GLN 17 1.310 25.736 -2.548 104 HB2 GLN 17 1HB GLN 17 1.575 23.548 -3.534 105 HB3 GLN 17 2HB GLN 17 1.421 24.740 -4.817 106 HG2 GLN 17 1HG GLN 17 3.774 24.670 -5.251 107 HG3 GLN 17 2HG GLN 17 4.044 23.632 -3.852 108 HE21 GLN 17 1HE2 GLN 17 2.714 23.810 -7.075 109 HE22 GLN 17 2HE2 GLN 17 2.675 22.107 -7.365 110 H ALA 18 H ALA 18 1.860 23.800 -1.173 111 HA ALA 18 HA ALA 18 4.627 23.901 -0.185 112 HB1 ALA 18 3HB ALA 18 2.533 25.082 1.152 113 HB2 ALA 18 1HB ALA 18 2.676 23.510 1.939 114 HB3 ALA 18 2HB ALA 18 4.070 24.589 1.863 115 H GLY 19 H GLY 19 5.499 21.940 -0.110 116 HA2 GLY 19 1HA GLY 19 4.482 19.592 -0.913 117 HA3 GLY 19 2HA GLY 19 5.684 19.674 0.366 118 H ASN 20 H ASN 20 2.729 18.469 -0.415 119 HA ASN 20 HA ASN 20 2.103 17.981 2.394 120 HB2 ASN 20 1HB ASN 20 0.676 19.842 1.965 121 HB3 ASN 20 2HB ASN 20 0.194 19.199 0.398 122 HD21 ASN 20 1HD2 ASN 20 -1.983 19.403 1.035 123 HD22 ASN 20 2HD2 ASN 20 -2.713 18.253 2.098 124 HA PRO 21 HA PRO 21 1.691 13.933 0.601 125 HB2 PRO 21 1HB PRO 21 1.012 12.664 2.904 126 HB3 PRO 21 2HB PRO 21 2.669 13.154 2.529 127 HG2 PRO 21 1HG PRO 21 0.638 14.510 4.262 128 HG3 PRO 21 2HG PRO 21 2.368 14.255 4.556 129 HD2 PRO 21 1HD PRO 21 1.371 16.616 3.683 130 HD3 PRO 21 2HD PRO 21 2.984 16.034 3.225 131 H ALA 22 H ALA 22 -0.762 15.510 2.567 132 HA ALA 22 HA ALA 22 -2.877 13.727 2.223 133 HB1 ALA 22 3HB ALA 22 -3.612 16.571 2.184 134 HB2 ALA 22 1HB ALA 22 -4.117 15.278 3.274 135 HB3 ALA 22 2HB ALA 22 -2.567 16.085 3.520 136 H LEU 23 H LEU 23 -1.603 16.201 0.086 137 HA LEU 23 HA LEU 23 -3.741 16.313 -1.736 138 HB2 LEU 23 1HB LEU 23 -0.800 16.862 -2.008 139 HB3 LEU 23 2HB LEU 23 -1.920 17.066 -3.354 140 HG LEU 23 HG LEU 23 -2.234 18.512 -0.731 141 HD11 LEU 23 1HD1 LEU 23 -0.137 18.868 -2.513 142 HD12 LEU 23 2HD1 LEU 23 -0.689 20.008 -1.286 143 HD13 LEU 23 3HD1 LEU 23 -1.297 20.128 -2.937 144 HD21 LEU 23 3HD2 LEU 23 -3.751 19.898 -1.896 145 HD22 LEU 23 1HD2 LEU 23 -4.183 18.241 -2.319 146 HD23 LEU 23 2HD2 LEU 23 -3.274 19.233 -3.460 147 H VAL 24 H VAL 24 -1.078 14.080 -1.375 148 HA VAL 24 HA VAL 24 -1.396 12.824 -3.925 149 HB VAL 24 HB VAL 24 0.027 11.930 -1.418 150 HG11 VAL 24 1HG1 VAL 24 0.164 10.660 -4.149 151 HG12 VAL 24 2HG1 VAL 24 0.995 10.134 -2.683 152 HG13 VAL 24 3HG1 VAL 24 -0.762 10.013 -2.795 153 HG21 VAL 24 3HG2 VAL 24 0.715 13.617 -3.681 154 HG22 VAL 24 1HG2 VAL 24 1.534 13.412 -2.133 155 HG23 VAL 24 2HG2 VAL 24 1.857 12.292 -3.457 156 H SER 25 H SER 25 -2.751 11.253 -4.518 157 HA SER 25 HA SER 25 -4.275 9.865 -2.412 158 HB2 SER 25 1HB SER 25 -5.184 11.150 -4.952 159 HB3 SER 25 2HB SER 25 -6.030 9.708 -4.390 160 HG SER 25 HG SER 25 -7.059 11.403 -3.450 161 H ALA 26 H ALA 26 -5.027 7.718 -2.958 162 HA ALA 26 HA ALA 26 -3.605 6.418 -5.167 163 HB1 ALA 26 3HB ALA 26 -2.962 4.550 -3.666 164 HB2 ALA 26 1HB ALA 26 -2.159 6.072 -3.281 165 HB3 ALA 26 2HB ALA 26 -3.509 5.513 -2.294 166 H TYR 27 H TYR 27 -4.853 5.034 -6.257 167 HA TYR 27 HA TYR 27 -7.037 3.643 -4.947 168 HB2 TYR 27 1HB TYR 27 -8.716 4.421 -6.585 169 HB3 TYR 27 2HB TYR 27 -8.110 5.734 -5.583 170 HD1 TYR 27 1HD TYR 27 -6.723 7.489 -6.534 171 HD2 TYR 27 2HD TYR 27 -8.196 4.317 -8.956 172 HE1 TYR 27 1HE TYR 27 -6.145 8.770 -8.552 173 HE2 TYR 27 2HE TYR 27 -7.621 5.588 -10.981 174 HH TYR 27 HH TYR 27 -7.068 7.669 -11.753 175 H GLY 28 H GLY 28 -8.025 2.004 -6.342 176 HA2 GLY 28 1HA GLY 28 -7.361 1.299 -8.890 177 HA3 GLY 28 2HA GLY 28 -6.016 0.695 -7.932 178 H THR 29 H THR 29 -6.460 -1.461 -8.355 179 HA THR 29 HA THR 29 -8.989 -2.488 -7.245 180 HB THR 29 HB THR 29 -7.197 -3.967 -9.169 181 HG1 THR 29 1HG THR 29 -8.803 -3.285 -10.750 182 HG21 THR 29 3HG2 THR 29 -8.975 -5.464 -9.431 183 HG22 THR 29 1HG2 THR 29 -10.146 -4.341 -8.742 184 HG23 THR 29 2HG2 THR 29 -8.964 -5.132 -7.699 185 H GLY 30 H GLY 30 -5.565 -2.501 -6.963 186 HA2 GLY 30 1HA GLY 30 -5.246 -4.989 -5.626 187 HA3 GLY 30 2HA GLY 30 -4.110 -3.648 -5.601 188 H LEU 31 H LEU 31 -6.074 -1.762 -4.535 189 HA LEU 31 HA LEU 31 -5.672 -2.327 -1.756 190 HB2 LEU 31 1HB LEU 31 -7.375 -0.138 -2.918 191 HB3 LEU 31 2HB LEU 31 -6.588 -0.177 -1.341 192 HG LEU 31 HG LEU 31 -5.014 -0.140 -3.902 193 HD11 LEU 31 1HD1 LEU 31 -5.578 2.329 -2.314 194 HD12 LEU 31 2HD1 LEU 31 -6.687 1.812 -3.584 195 HD13 LEU 31 3HD1 LEU 31 -5.005 2.170 -3.975 196 HD21 LEU 31 3HD2 LEU 31 -4.085 1.101 -1.386 197 HD22 LEU 31 1HD2 LEU 31 -3.195 0.178 -2.596 198 HD23 LEU 31 2HD2 LEU 31 -4.192 -0.660 -1.407 199 H GLU 32 H GLU 32 -8.338 -2.555 -4.002 200 HA GLU 32 HA GLU 32 -10.531 -2.635 -2.358 201 HB2 GLU 32 1HB GLU 32 -9.966 -4.408 -4.740 202 HB3 GLU 32 2HB GLU 32 -11.549 -4.174 -4.013 203 HG2 GLU 32 1HG GLU 32 -9.978 -1.835 -5.004 204 HG3 GLU 32 2HG GLU 32 -10.908 -2.832 -6.121 205 H GLY 33 H GLY 33 -8.039 -5.057 -2.764 206 HA2 GLY 33 1HA GLY 33 -8.385 -6.290 -0.325 207 HA3 GLY 33 2HA GLY 33 -9.434 -7.163 -1.432 208 H GLY 34 H GLY 34 -7.743 -8.801 -0.487 209 HA2 GLY 34 1HA GLY 34 -5.348 -8.816 -2.203 210 HA3 GLY 34 2HA GLY 34 -5.525 -9.712 -0.701 211 H THR 35 H THR 35 -5.809 -9.809 -4.078 212 HA THR 35 HA THR 35 -7.395 -12.274 -4.024 213 HB THR 35 HB THR 35 -6.439 -11.039 -6.574 214 HG1 THR 35 1HG THR 35 -8.816 -10.140 -5.328 215 HG21 THR 35 3HG2 THR 35 -7.644 -12.963 -7.010 216 HG22 THR 35 1HG2 THR 35 -8.904 -11.735 -7.106 217 HG23 THR 35 2HG2 THR 35 -8.737 -12.714 -5.649 218 H THR 36 H THR 36 -6.153 -13.997 -3.597 219 HA THR 36 HA THR 36 -3.410 -14.181 -4.392 220 HB THR 36 HB THR 36 -4.936 -16.617 -3.595 221 HG1 THR 36 1HG THR 36 -4.694 -14.278 -2.086 222 HG21 THR 36 3HG2 THR 36 -2.923 -17.155 -2.422 223 HG22 THR 36 1HG2 THR 36 -2.301 -15.517 -2.622 224 HG23 THR 36 2HG2 THR 36 -2.461 -16.577 -4.023 225 H GLY 37 H GLY 37 -2.912 -14.400 -6.486 226 HA2 GLY 37 1HA GLY 37 -2.703 -16.225 -8.171 227 HA3 GLY 37 2HA GLY 37 -4.450 -16.376 -8.057 228 H ILE 38 H ILE 38 -4.646 -13.374 -7.853 229 HA ILE 38 HA ILE 38 -4.354 -12.843 -10.733 230 HB ILE 38 HB ILE 38 -6.181 -11.360 -8.853 231 HG12 ILE 38 1HG1 ILE 38 -6.791 -13.782 -10.561 232 HG13 ILE 38 2HG1 ILE 38 -6.834 -13.705 -8.803 233 HG21 ILE 38 1HG2 ILE 38 -7.236 -11.372 -11.410 234 HG22 ILE 38 2HG2 ILE 38 -6.370 -10.044 -10.639 235 HG23 ILE 38 3HG2 ILE 38 -5.501 -11.184 -11.665 236 HD11 ILE 38 3HD1 ILE 38 -8.526 -11.674 -9.875 237 HD12 ILE 38 1HD1 ILE 38 -8.923 -13.225 -10.614 238 HD13 ILE 38 2HD1 ILE 38 -8.942 -13.053 -8.858 239 H GLN 39 H GLN 39 -3.637 -10.790 -11.426 240 HA GLN 39 HA GLN 39 -1.884 -9.469 -9.487 241 HB2 GLN 39 1HB GLN 39 -0.689 -10.143 -11.419 242 HB3 GLN 39 2HB GLN 39 -1.937 -9.533 -12.498 243 HG2 GLN 39 1HG GLN 39 -1.368 -7.259 -11.938 244 HG3 GLN 39 2HG GLN 39 -0.195 -7.816 -10.746 245 HE21 GLN 39 1HE2 GLN 39 -0.966 -7.832 -14.182 246 HE22 GLN 39 2HE2 GLN 39 0.666 -7.962 -14.734 247 H SER 40 H SER 40 -2.356 -7.532 -8.692 248 HA SER 40 HA SER 40 -4.501 -5.984 -9.984 249 HB2 SER 40 1HB SER 40 -3.569 -5.710 -7.123 250 HB3 SER 40 2HB SER 40 -5.048 -5.074 -7.842 251 HG SER 40 HG SER 40 -4.395 -7.803 -7.419 252 H GLU 41 H GLU 41 -4.334 -3.602 -9.751 253 HA GLU 41 HA GLU 41 -1.628 -2.561 -9.466 254 HB2 GLU 41 1HB GLU 41 -1.934 -1.298 -11.665 255 HB3 GLU 41 2HB GLU 41 -1.541 -3.008 -11.774 256 HG2 GLU 41 1HG GLU 41 -4.369 -2.022 -11.897 257 HG3 GLU 41 2HG GLU 41 -3.342 -2.107 -13.327 258 H PHE 42 H PHE 42 -1.569 -0.507 -8.713 259 HA PHE 42 HA PHE 42 -4.063 1.042 -8.697 260 HB2 PHE 42 1HB PHE 42 -3.927 1.524 -6.386 261 HB3 PHE 42 2HB PHE 42 -3.653 -0.211 -6.508 262 HD1 PHE 42 1HD PHE 42 -2.063 3.046 -5.905 263 HD2 PHE 42 2HD PHE 42 -1.563 -1.181 -5.902 264 HE1 PHE 42 1HE PHE 42 0.052 3.300 -4.674 265 HE2 PHE 42 2HE PHE 42 0.552 -0.934 -4.670 266 HZ PHE 42 HZ PHE 42 1.362 1.309 -4.054 267 H PHE 43 H PHE 43 -3.736 2.995 -9.510 268 HA PHE 43 HA PHE 43 -1.036 4.002 -9.824 269 HB2 PHE 43 1HB PHE 43 -3.660 5.214 -10.717 270 HB3 PHE 43 2HB PHE 43 -2.053 5.729 -11.218 271 HD1 PHE 43 1HD PHE 43 -0.746 4.396 -12.771 272 HD2 PHE 43 2HD PHE 43 -4.671 3.225 -11.613 273 HE1 PHE 43 1HE PHE 43 -0.826 2.815 -14.654 274 HE2 PHE 43 2HE PHE 43 -4.757 1.642 -13.494 275 HZ PHE 43 HZ PHE 43 -2.832 1.434 -15.017 276 H ILE 44 H ILE 44 -0.167 5.753 -8.823 277 HA ILE 44 HA ILE 44 -1.690 6.843 -6.565 278 HB ILE 44 HB ILE 44 1.281 6.894 -7.106 279 HG12 ILE 44 1HG1 ILE 44 -0.183 5.451 -4.898 280 HG13 ILE 44 2HG1 ILE 44 0.163 4.692 -6.448 281 HG21 ILE 44 1HG2 ILE 44 1.033 7.542 -4.501 282 HG22 ILE 44 2HG2 ILE 44 1.171 8.727 -5.799 283 HG23 ILE 44 3HG2 ILE 44 -0.415 8.305 -5.156 284 HD11 ILE 44 3HD1 ILE 44 2.040 5.523 -4.286 285 HD12 ILE 44 1HD1 ILE 44 1.916 3.984 -5.139 286 HD13 ILE 44 2HD1 ILE 44 2.607 5.390 -5.951 287 H ASN 45 H ASN 45 -2.633 8.739 -6.884 288 HA ASN 45 HA ASN 45 -1.813 10.498 -9.009 289 HB2 ASN 45 1HB ASN 45 -4.214 10.079 -8.222 290 HB3 ASN 45 2HB ASN 45 -3.834 11.135 -6.864 291 HD21 ASN 45 1HD2 ASN 45 -4.196 10.945 -10.331 292 HD22 ASN 45 2HD2 ASN 45 -4.396 12.640 -10.598 293 H THR 46 H THR 46 -0.140 11.820 -8.801 294 HA THR 46 HA THR 46 0.185 13.294 -6.279 295 HB THR 46 HB THR 46 1.859 11.555 -6.195 296 HG1 THR 46 1HG THR 46 3.184 13.924 -7.047 297 HG21 THR 46 3HG2 THR 46 3.583 11.347 -7.941 298 HG22 THR 46 1HG2 THR 46 2.731 12.545 -8.913 299 HG23 THR 46 2HG2 THR 46 1.972 10.992 -8.562 300 H THR 47 H THR 47 -0.981 14.002 -8.883 301 HA THR 47 HA THR 47 0.912 15.770 -10.157 302 HB THR 47 HB THR 47 -1.199 16.535 -11.417 303 HG1 THR 47 1HG THR 47 -2.727 15.712 -9.922 304 HG21 THR 47 3HG2 THR 47 -0.024 13.776 -11.523 305 HG22 THR 47 1HG2 THR 47 0.249 15.141 -12.604 306 HG23 THR 47 2HG2 THR 47 -1.283 14.269 -12.655 307 H ARG 48 H ARG 48 -0.996 15.951 -7.418 308 HA ARG 48 HA ARG 48 -1.350 18.856 -7.619 309 HB2 ARG 48 1HB ARG 48 -2.538 16.761 -5.813 310 HB3 ARG 48 2HB ARG 48 -2.653 18.475 -5.436 311 HG2 ARG 48 1HG ARG 48 -3.539 17.468 -8.104 312 HG3 ARG 48 2HG ARG 48 -4.587 17.303 -6.694 313 HD2 ARG 48 1HD ARG 48 -3.344 19.951 -7.251 314 HD3 ARG 48 2HD ARG 48 -4.698 19.429 -8.252 315 HE ARG 48 HE ARG 48 -4.788 20.235 -5.489 316 HH11 ARG 48 1HH1 ARG 48 -6.376 18.447 -8.019 317 HH12 ARG 48 2HH1 ARG 48 -7.941 18.544 -7.284 318 HH21 ARG 48 1HH2 ARG 48 -6.844 20.369 -4.511 319 HH22 ARG 48 2HH2 ARG 48 -8.207 19.638 -5.289 320 H ALA 49 H ALA 49 0.375 16.373 -5.886 321 HA ALA 49 HA ALA 49 1.397 18.216 -3.895 322 HB1 ALA 49 3HB ALA 49 0.942 15.966 -3.181 323 HB2 ALA 49 1HB ALA 49 2.000 15.312 -4.431 324 HB3 ALA 49 2HB ALA 49 2.681 16.248 -3.100 325 H GLY 50 H GLY 50 2.713 16.306 -6.599 326 HA2 GLY 50 1HA GLY 50 4.276 17.745 -8.006 327 HA3 GLY 50 2HA GLY 50 5.134 17.989 -6.492 328 HA PRO 51 HA PRO 51 6.291 13.925 -8.808 329 HB2 PRO 51 1HB PRO 51 8.267 14.797 -10.454 330 HB3 PRO 51 2HB PRO 51 6.575 14.692 -10.956 331 HG2 PRO 51 1HG PRO 51 8.134 17.077 -10.038 332 HG3 PRO 51 2HG PRO 51 6.986 16.940 -11.383 333 HD2 PRO 51 1HD PRO 51 6.310 18.020 -8.993 334 HD3 PRO 51 2HD PRO 51 5.151 17.127 -10.000 335 H GLY 52 H GLY 52 7.241 13.189 -6.946 336 HA2 GLY 52 1HA GLY 52 9.925 14.261 -6.327 337 HA3 GLY 52 2HA GLY 52 8.828 13.626 -5.110 338 H THR 53 H THR 53 10.588 12.236 -4.476 339 HA THR 53 HA THR 53 11.666 10.291 -6.250 340 HB THR 53 HB THR 53 11.584 10.190 -3.229 341 HG1 THR 53 1HG THR 53 13.587 11.266 -4.952 342 HG21 THR 53 3HG2 THR 53 13.235 8.770 -5.308 343 HG22 THR 53 1HG2 THR 53 12.228 8.064 -4.045 344 HG23 THR 53 2HG2 THR 53 13.730 8.886 -3.619 345 H LEU 54 H LEU 54 11.204 8.105 -6.449 346 HA LEU 54 HA LEU 54 8.461 7.380 -5.799 347 HB2 LEU 54 1HB LEU 54 9.783 7.037 -8.055 348 HB3 LEU 54 2HB LEU 54 10.311 5.558 -7.255 349 HG LEU 54 HG LEU 54 7.418 6.291 -7.682 350 HD11 LEU 54 1HD1 LEU 54 9.002 4.305 -9.286 351 HD12 LEU 54 2HD1 LEU 54 8.776 5.977 -9.799 352 HD13 LEU 54 3HD1 LEU 54 7.379 4.921 -9.595 353 HD21 LEU 54 3HD2 LEU 54 7.931 3.505 -7.469 354 HD22 LEU 54 1HD2 LEU 54 6.989 4.539 -6.394 355 HD23 LEU 54 2HD2 LEU 54 8.717 4.318 -6.115 356 H SER 55 H SER 55 8.111 6.489 -3.877 357 HA SER 55 HA SER 55 9.965 4.396 -2.956 358 HB2 SER 55 1HB SER 55 10.379 6.371 -1.600 359 HB3 SER 55 2HB SER 55 8.656 6.539 -1.264 360 HG SER 55 HG SER 55 10.094 4.204 -0.582 361 H VAL 56 H VAL 56 8.952 2.515 -2.869 362 HA VAL 56 HA VAL 56 6.224 2.400 -1.812 363 HB VAL 56 HB VAL 56 5.801 2.393 -4.157 364 HG11 VAL 56 1HG1 VAL 56 7.010 1.292 -5.774 365 HG12 VAL 56 2HG1 VAL 56 8.277 1.674 -4.607 366 HG13 VAL 56 3HG1 VAL 56 7.582 0.053 -4.658 367 HG21 VAL 56 3HG2 VAL 56 5.802 -0.534 -3.513 368 HG22 VAL 56 1HG2 VAL 56 4.766 0.588 -2.630 369 HG23 VAL 56 2HG2 VAL 56 4.593 0.416 -4.377 370 H THR 57 H THR 57 5.866 0.698 -0.503 371 HA THR 57 HA THR 57 7.589 -1.644 -0.627 372 HB THR 57 HB THR 57 7.324 -0.081 1.947 373 HG1 THR 57 1HG THR 57 9.752 0.029 1.457 374 HG21 THR 57 3HG2 THR 57 9.481 -1.940 1.911 375 HG22 THR 57 1HG2 THR 57 8.017 -2.780 1.402 376 HG23 THR 57 2HG2 THR 57 8.054 -1.932 2.947 377 H ILE 58 H ILE 58 6.639 -3.487 0.153 378 HA ILE 58 HA ILE 58 3.981 -3.204 1.387 379 HB ILE 58 HB ILE 58 4.748 -5.117 -0.818 380 HG12 ILE 58 1HG1 ILE 58 2.605 -2.984 -0.716 381 HG13 ILE 58 2HG1 ILE 58 4.171 -2.788 -1.496 382 HG21 ILE 58 1HG2 ILE 58 3.348 -6.154 0.964 383 HG22 ILE 58 2HG2 ILE 58 2.113 -4.941 0.631 384 HG23 ILE 58 3HG2 ILE 58 2.573 -6.097 -0.619 385 HD11 ILE 58 3HD1 ILE 58 2.792 -5.163 -2.408 386 HD12 ILE 58 1HD1 ILE 58 1.850 -3.695 -2.669 387 HD13 ILE 58 2HD1 ILE 58 3.481 -3.826 -3.329 388 H GLU 59 H GLU 59 3.491 -4.620 3.002 389 HA GLU 59 HA GLU 59 5.594 -6.549 3.736 390 HB2 GLU 59 1HB GLU 59 5.182 -4.520 5.252 391 HB3 GLU 59 2HB GLU 59 3.665 -5.299 5.679 392 HG2 GLU 59 1HG GLU 59 5.246 -5.849 7.354 393 HG3 GLU 59 2HG GLU 59 4.977 -7.298 6.386 394 H GLY 60 H GLY 60 4.934 -8.533 4.706 395 HA2 GLY 60 1HA GLY 60 2.318 -9.365 5.151 396 HA3 GLY 60 2HA GLY 60 2.671 -9.704 3.463 397 HA PRO 61 HA PRO 61 4.155 -13.178 6.293 398 HB2 PRO 61 1HB PRO 61 2.473 -15.095 5.361 399 HB3 PRO 61 2HB PRO 61 2.065 -14.034 6.714 400 HG2 PRO 61 1HG PRO 61 1.258 -13.832 3.838 401 HG3 PRO 61 2HG PRO 61 0.277 -13.588 5.295 402 HD2 PRO 61 1HD PRO 61 1.295 -11.528 3.864 403 HD3 PRO 61 2HD PRO 61 1.068 -11.448 5.623 404 H SER 62 H SER 62 3.446 -12.791 2.902 405 HA SER 62 HA SER 62 5.752 -14.492 2.266 406 HB2 SER 62 1HB SER 62 2.964 -14.733 1.213 407 HB3 SER 62 2HB SER 62 4.309 -15.079 0.126 408 HG SER 62 HG SER 62 3.460 -16.440 2.410 409 H LYS 63 H LYS 63 7.165 -13.011 1.567 410 HA LYS 63 HA LYS 63 6.782 -10.541 0.517 411 HB2 LYS 63 1HB LYS 63 8.893 -12.541 -0.310 412 HB3 LYS 63 2HB LYS 63 8.958 -10.820 -0.663 413 HG2 LYS 63 1HG LYS 63 8.803 -11.929 2.127 414 HG3 LYS 63 2HG LYS 63 10.320 -11.571 1.299 415 HD2 LYS 63 1HD LYS 63 9.700 -9.242 1.092 416 HD3 LYS 63 2HD LYS 63 8.115 -9.571 1.795 417 HE2 LYS 63 1HE LYS 63 9.290 -10.343 3.864 418 HE3 LYS 63 2HE LYS 63 10.799 -9.778 3.151 419 HZ1 LYS 63 3HZ LYS 63 8.442 -8.158 3.925 420 HZ2 LYS 63 1HZ LYS 63 9.688 -7.553 2.952 421 HZ3 LYS 63 2HZ LYS 63 10.018 -8.057 4.533 422 H VAL 64 H VAL 64 6.897 -9.678 -1.665 423 HA VAL 64 HA VAL 64 5.944 -11.494 -3.762 424 HB VAL 64 HB VAL 64 4.372 -9.589 -4.481 425 HG11 VAL 64 1HG1 VAL 64 2.668 -10.374 -2.662 426 HG12 VAL 64 2HG1 VAL 64 3.287 -11.521 -3.852 427 HG13 VAL 64 3HG1 VAL 64 3.957 -11.492 -2.220 428 HG21 VAL 64 3HG2 VAL 64 5.514 -8.276 -2.371 429 HG22 VAL 64 1HG2 VAL 64 3.986 -7.840 -3.136 430 HG23 VAL 64 2HG2 VAL 64 3.992 -8.837 -1.681 431 H LYS 65 H LYS 65 6.352 -10.794 -5.895 432 HA LYS 65 HA LYS 65 8.596 -8.938 -6.083 433 HB2 LYS 65 1HB LYS 65 8.458 -9.843 -8.561 434 HB3 LYS 65 2HB LYS 65 9.183 -10.806 -7.280 435 HG2 LYS 65 1HG LYS 65 7.229 -12.145 -7.071 436 HG3 LYS 65 2HG LYS 65 6.309 -11.071 -8.127 437 HD2 LYS 65 1HD LYS 65 8.797 -12.332 -9.178 438 HD3 LYS 65 2HD LYS 65 7.340 -13.319 -9.034 439 HE2 LYS 65 1HE LYS 65 6.165 -11.411 -10.282 440 HE3 LYS 65 2HE LYS 65 7.788 -10.853 -10.688 441 HZ1 LYS 65 3HZ LYS 65 6.375 -13.263 -11.576 442 HZ2 LYS 65 1HZ LYS 65 8.060 -13.327 -11.438 443 HZ3 LYS 65 2HZ LYS 65 7.338 -12.191 -12.462 444 H MET 66 H MET 66 7.883 -6.878 -6.157 445 HA MET 66 HA MET 66 5.543 -6.159 -7.700 446 HB2 MET 66 1HB MET 66 7.507 -4.471 -6.141 447 HB3 MET 66 2HB MET 66 6.055 -3.853 -6.918 448 HG2 MET 66 1HG MET 66 5.280 -4.122 -4.801 449 HG3 MET 66 2HG MET 66 4.888 -5.705 -5.468 450 HE1 MET 66 3HE MET 66 7.814 -4.199 -2.587 451 HE2 MET 66 1HE MET 66 8.898 -4.959 -3.753 452 HE3 MET 66 2HE MET 66 7.752 -3.729 -4.287 453 H ASP 67 H ASP 67 5.641 -4.367 -9.282 454 HA ASP 67 HA ASP 67 8.121 -4.489 -10.872 455 HB2 ASP 67 1HB ASP 67 5.256 -4.317 -11.823 456 HB3 ASP 67 2HB ASP 67 6.658 -4.132 -12.872 457 H CYS 68 H CYS 68 9.119 -2.620 -10.345 458 HA CYS 68 HA CYS 68 7.678 -0.163 -9.972 459 HB2 CYS 68 1HB CYS 68 9.915 0.838 -9.681 460 HB3 CYS 68 2HB CYS 68 9.700 -0.595 -8.682 461 HG CYS 68 HG CYS 68 11.950 0.018 -11.040 462 H GLN 69 H GLN 69 7.181 1.315 -11.455 463 HA GLN 69 HA GLN 69 8.776 1.683 -13.828 464 HB2 GLN 69 1HB GLN 69 7.403 -0.162 -14.576 465 HB3 GLN 69 2HB GLN 69 5.944 0.650 -14.024 466 HG2 GLN 69 1HG GLN 69 6.434 2.463 -15.676 467 HG3 GLN 69 2HG GLN 69 7.729 1.446 -16.307 468 HE21 GLN 69 1HE2 GLN 69 5.020 2.451 -17.311 469 HE22 GLN 69 2HE2 GLN 69 4.284 1.034 -17.970 470 H GLU 70 H GLU 70 8.922 3.808 -14.036 471 HA GLU 70 HA GLU 70 7.201 5.620 -12.706 472 HB2 GLU 70 1HB GLU 70 8.523 7.351 -13.654 473 HB3 GLU 70 2HB GLU 70 9.619 6.016 -13.322 474 HG2 GLU 70 1HG GLU 70 8.392 6.335 -16.028 475 HG3 GLU 70 2HG GLU 70 9.806 7.279 -15.561 476 H THR 71 H THR 71 5.637 7.012 -13.496 477 HA THR 71 HA THR 71 4.734 6.577 -16.259 478 HB THR 71 HB THR 71 2.346 6.786 -15.307 479 HG1 THR 71 1HG THR 71 3.417 7.181 -13.101 480 HG21 THR 71 3HG2 THR 71 3.757 4.671 -16.125 481 HG22 THR 71 1HG2 THR 71 2.118 4.526 -15.491 482 HG23 THR 71 2HG2 THR 71 3.500 4.191 -14.447 483 HA PRO 72 HA PRO 72 4.325 10.942 -16.507 484 HB2 PRO 72 1HB PRO 72 2.215 11.189 -18.198 485 HB3 PRO 72 2HB PRO 72 3.813 10.652 -18.728 486 HG2 PRO 72 1HG PRO 72 1.383 9.024 -18.092 487 HG3 PRO 72 2HG PRO 72 2.524 8.851 -19.438 488 HD2 PRO 72 1HD PRO 72 2.624 7.283 -17.232 489 HD3 PRO 72 2HD PRO 72 4.077 7.743 -18.144 490 H GLU 73 H GLU 73 1.937 9.021 -15.078 491 HA GLU 73 HA GLU 73 0.336 11.353 -14.285 492 HB2 GLU 73 1HB GLU 73 -0.864 9.420 -15.285 493 HB3 GLU 73 2HB GLU 73 -0.303 8.417 -13.955 494 HG2 GLU 73 1HG GLU 73 -1.490 9.927 -12.386 495 HG3 GLU 73 2HG GLU 73 -2.142 10.791 -13.778 496 H GLY 74 H GLY 74 2.209 8.647 -13.023 497 HA2 GLY 74 1HA GLY 74 3.040 10.007 -10.720 498 HA3 GLY 74 2HA GLY 74 1.646 9.028 -10.290 499 H TYR 75 H TYR 75 1.982 6.968 -9.750 500 HA TYR 75 HA TYR 75 4.326 5.560 -10.761 501 HB2 TYR 75 1HB TYR 75 3.793 5.564 -7.799 502 HB3 TYR 75 2HB TYR 75 5.231 5.016 -8.653 503 HD1 TYR 75 1HD TYR 75 6.272 7.030 -10.191 504 HD2 TYR 75 2HD TYR 75 4.061 7.497 -6.586 505 HE1 TYR 75 1HE TYR 75 7.324 9.225 -9.837 506 HE2 TYR 75 2HE TYR 75 5.106 9.693 -6.222 507 HH TYR 75 HH TYR 75 7.416 11.039 -8.562 508 H LYS 76 H LYS 76 3.412 3.837 -11.663 509 HA LYS 76 HA LYS 76 1.095 2.583 -10.398 510 HB2 LYS 76 1HB LYS 76 0.909 3.028 -12.776 511 HB3 LYS 76 2HB LYS 76 2.395 2.142 -13.092 512 HG2 LYS 76 1HG LYS 76 1.117 0.155 -11.997 513 HG3 LYS 76 2HG LYS 76 -0.314 1.111 -12.391 514 HD2 LYS 76 1HD LYS 76 0.857 1.274 -14.745 515 HD3 LYS 76 2HD LYS 76 1.660 -0.200 -14.199 516 HE2 LYS 76 1HE LYS 76 -0.350 -1.377 -14.047 517 HE3 LYS 76 2HE LYS 76 -1.318 0.096 -14.023 518 HZ1 LYS 76 3HZ LYS 76 -0.875 0.454 -16.319 519 HZ2 LYS 76 1HZ LYS 76 -1.393 -1.148 -16.153 520 HZ3 LYS 76 2HZ LYS 76 0.249 -0.809 -16.375 521 H VAL 77 H VAL 77 1.326 0.884 -9.115 522 HA VAL 77 HA VAL 77 3.734 -0.790 -9.415 523 HB VAL 77 HB VAL 77 2.180 -0.140 -6.910 524 HG11 VAL 77 1HG1 VAL 77 2.947 -2.524 -7.060 525 HG12 VAL 77 2HG1 VAL 77 4.602 -1.916 -7.136 526 HG13 VAL 77 3HG1 VAL 77 3.614 -1.611 -5.707 527 HG21 VAL 77 3HG2 VAL 77 4.420 1.078 -8.174 528 HG22 VAL 77 1HG2 VAL 77 3.648 1.504 -6.646 529 HG23 VAL 77 2HG2 VAL 77 4.964 0.330 -6.672 530 H MET 78 H MET 78 3.521 -3.015 -9.304 531 HA MET 78 HA MET 78 0.776 -4.068 -9.192 532 HB2 MET 78 1HB MET 78 2.905 -4.994 -11.126 533 HB3 MET 78 2HB MET 78 1.249 -5.576 -11.030 534 HG2 MET 78 1HG MET 78 0.378 -3.568 -11.875 535 HG3 MET 78 2HG MET 78 1.895 -2.709 -11.616 536 HE1 MET 78 3HE MET 78 3.869 -3.162 -14.706 537 HE2 MET 78 1HE MET 78 2.980 -1.905 -13.845 538 HE3 MET 78 2HE MET 78 4.014 -3.021 -12.953 539 H TYR 79 H TYR 79 0.524 -5.718 -7.830 540 HA TYR 79 HA TYR 79 2.835 -7.388 -7.152 541 HB2 TYR 79 1HB TYR 79 2.571 -7.144 -4.826 542 HB3 TYR 79 2HB TYR 79 2.453 -5.504 -5.454 543 HD1 TYR 79 1HD TYR 79 0.605 -8.285 -3.937 544 HD2 TYR 79 2HD TYR 79 0.362 -4.288 -5.374 545 HE1 TYR 79 1HE TYR 79 -1.568 -8.021 -2.816 546 HE2 TYR 79 2HE TYR 79 -1.811 -4.012 -4.256 547 HH TYR 79 HH TYR 79 -3.700 -5.596 -3.490 548 H THR 80 H THR 80 2.369 -9.504 -6.849 549 HA THR 80 HA THR 80 -0.470 -10.283 -6.766 550 HB THR 80 HB THR 80 1.582 -11.885 -8.276 551 HG1 THR 80 1HG THR 80 1.198 -10.711 -10.056 552 HG21 THR 80 3HG2 THR 80 -1.279 -11.797 -9.021 553 HG22 THR 80 1HG2 THR 80 -0.893 -12.570 -7.484 554 HG23 THR 80 2HG2 THR 80 -0.161 -13.160 -8.977 555 HA PRO 81 HA PRO 81 1.377 -12.333 -3.176 556 HB2 PRO 81 1HB PRO 81 -0.998 -12.751 -1.930 557 HB3 PRO 81 2HB PRO 81 -0.140 -11.207 -1.868 558 HG2 PRO 81 1HG PRO 81 -2.440 -12.028 -3.600 559 HG3 PRO 81 2HG PRO 81 -2.180 -10.503 -2.734 560 HD2 PRO 81 1HD PRO 81 -1.702 -10.773 -5.385 561 HD3 PRO 81 2HD PRO 81 -0.758 -9.681 -4.351 562 H MET 82 H MET 82 1.679 -14.467 -2.788 563 HA MET 82 HA MET 82 0.150 -16.349 -4.438 564 HB2 MET 82 1HB MET 82 2.872 -16.454 -3.168 565 HB3 MET 82 2HB MET 82 2.069 -17.924 -3.704 566 HG2 MET 82 1HG MET 82 2.277 -17.405 -5.911 567 HG3 MET 82 2HG MET 82 2.268 -15.668 -5.618 568 HE1 MET 82 3HE MET 82 3.846 -14.521 -6.380 569 HE2 MET 82 1HE MET 82 4.968 -14.295 -5.038 570 HE3 MET 82 2HE MET 82 5.560 -14.877 -6.594 571 H ALA 83 H ALA 83 1.012 -15.600 -1.129 572 HA ALA 83 HA ALA 83 -0.706 -17.815 -0.216 573 HB1 ALA 83 3HB ALA 83 0.567 -17.417 1.998 574 HB2 ALA 83 1HB ALA 83 1.376 -18.280 0.690 575 HB3 ALA 83 2HB ALA 83 1.742 -16.579 0.984 576 HA PRO 84 HA PRO 84 -3.539 -14.824 1.342 577 HB2 PRO 84 1HB PRO 84 -4.783 -16.354 3.207 578 HB3 PRO 84 2HB PRO 84 -5.052 -16.549 1.471 579 HG2 PRO 84 1HG PRO 84 -3.290 -18.129 3.304 580 HG3 PRO 84 2HG PRO 84 -4.370 -18.703 2.020 581 HD2 PRO 84 1HD PRO 84 -1.694 -18.468 1.678 582 HD3 PRO 84 2HD PRO 84 -2.851 -18.218 0.355 583 H GLY 85 H GLY 85 -4.245 -13.827 3.423 584 HA2 GLY 85 1HA GLY 85 -3.548 -13.901 5.905 585 HA3 GLY 85 2HA GLY 85 -1.939 -13.651 5.244 586 H ASN 86 H ASN 86 -1.757 -11.697 6.419 587 HA ASN 86 HA ASN 86 -3.476 -9.509 5.461 588 HB2 ASN 86 1HB ASN 86 -2.480 -8.288 7.488 589 HB3 ASN 86 2HB ASN 86 -3.631 -9.581 7.811 590 HD21 ASN 86 1HD2 ASN 86 -3.066 -10.913 9.358 591 HD22 ASN 86 2HD2 ASN 86 -1.451 -11.292 9.843 592 H TYR 87 H TYR 87 -2.635 -7.911 4.272 593 HA TYR 87 HA TYR 87 0.299 -7.737 4.062 594 HB2 TYR 87 1HB TYR 87 -1.798 -7.666 1.909 595 HB3 TYR 87 2HB TYR 87 -0.229 -6.907 1.665 596 HD1 TYR 87 1HD TYR 87 -1.503 -10.158 3.019 597 HD2 TYR 87 2HD TYR 87 1.282 -8.175 0.486 598 HE1 TYR 87 1HE TYR 87 -0.560 -12.333 2.363 599 HE2 TYR 87 2HE TYR 87 2.232 -10.345 -0.178 600 HH TYR 87 HH TYR 87 0.883 -13.392 1.044 601 H LEU 88 H LEU 88 1.189 -5.671 3.729 602 HA LEU 88 HA LEU 88 -0.650 -3.420 4.195 603 HB2 LEU 88 1HB LEU 88 0.893 -4.276 6.142 604 HB3 LEU 88 2HB LEU 88 2.128 -3.365 5.276 605 HG LEU 88 HG LEU 88 0.333 -1.437 5.435 606 HD11 LEU 88 1HD1 LEU 88 -1.479 -2.489 6.443 607 HD12 LEU 88 2HD1 LEU 88 -0.697 -1.648 7.781 608 HD13 LEU 88 3HD1 LEU 88 -0.458 -3.382 7.571 609 HD21 LEU 88 3HD2 LEU 88 1.902 -0.550 6.734 610 HD22 LEU 88 1HD2 LEU 88 2.664 -2.140 6.804 611 HD23 LEU 88 2HD2 LEU 88 1.515 -1.657 8.052 612 H ILE 89 H ILE 89 -0.306 -1.603 3.013 613 HA ILE 89 HA ILE 89 2.012 -1.614 1.191 614 HB ILE 89 HB ILE 89 -0.710 -0.471 0.562 615 HG12 ILE 89 1HG1 ILE 89 0.462 -2.946 -0.682 616 HG13 ILE 89 2HG1 ILE 89 -0.498 -3.040 0.791 617 HG21 ILE 89 1HG2 ILE 89 1.757 0.080 -0.544 618 HG22 ILE 89 2HG2 ILE 89 1.065 -1.110 -1.646 619 HG23 ILE 89 3HG2 ILE 89 0.189 0.379 -1.294 620 HD11 ILE 89 3HD1 ILE 89 -2.424 -2.694 -0.296 621 HD12 ILE 89 1HD1 ILE 89 -1.717 -1.507 -1.392 622 HD13 ILE 89 2HD1 ILE 89 -1.503 -3.230 -1.701 623 H SER 90 H SER 90 3.372 -0.035 1.682 624 HA SER 90 HA SER 90 2.434 2.322 3.107 625 HB2 SER 90 1HB SER 90 4.804 2.841 3.410 626 HB3 SER 90 2HB SER 90 4.488 1.166 3.863 627 HG SER 90 HG SER 90 5.727 2.152 1.521 628 H VAL 91 H VAL 91 2.486 4.393 2.337 629 HA VAL 91 HA VAL 91 3.392 4.808 -0.427 630 HB VAL 91 HB VAL 91 0.771 5.857 0.647 631 HG11 VAL 91 1HG1 VAL 91 0.428 6.385 -1.808 632 HG12 VAL 91 2HG1 VAL 91 1.606 7.381 -0.951 633 HG13 VAL 91 3HG1 VAL 91 2.153 6.084 -2.015 634 HG21 VAL 91 3HG2 VAL 91 0.129 4.249 -1.451 635 HG22 VAL 91 1HG2 VAL 91 1.468 3.360 -0.724 636 HG23 VAL 91 2HG2 VAL 91 0.051 3.766 0.244 637 H LYS 92 H LYS 92 4.648 6.539 -0.631 638 HA LYS 92 HA LYS 92 4.280 8.828 1.144 639 HB2 LYS 92 1HB LYS 92 6.890 7.338 0.826 640 HB3 LYS 92 2HB LYS 92 6.746 8.930 1.558 641 HG2 LYS 92 1HG LYS 92 5.515 8.090 3.385 642 HG3 LYS 92 2HG LYS 92 5.246 6.540 2.584 643 HD2 LYS 92 1HD LYS 92 8.046 7.429 3.091 644 HD3 LYS 92 2HD LYS 92 7.093 6.808 4.441 645 HE2 LYS 92 1HE LYS 92 6.808 4.711 3.407 646 HE3 LYS 92 2HE LYS 92 7.345 5.321 1.842 647 HZ1 LYS 92 3HZ LYS 92 9.560 5.696 2.922 648 HZ2 LYS 92 1HZ LYS 92 9.117 4.074 2.737 649 HZ3 LYS 92 2HZ LYS 92 8.994 4.816 4.251 650 H TYR 93 H TYR 93 5.231 10.778 0.360 651 HA TYR 93 HA TYR 93 5.947 10.678 -2.498 652 HB2 TYR 93 1HB TYR 93 4.601 12.487 -2.977 653 HB3 TYR 93 2HB TYR 93 3.654 11.712 -1.712 654 HD1 TYR 93 2HD TYR 93 3.720 12.638 0.610 655 HD2 TYR 93 1HD TYR 93 5.498 14.665 -2.682 656 HE1 TYR 93 2HE TYR 93 3.759 14.720 1.920 657 HE2 TYR 93 1HE TYR 93 5.543 16.752 -1.381 658 HH TYR 93 HH TYR 93 4.639 16.819 2.015 659 H GLY 94 H GLY 94 7.998 11.221 -2.801 660 HA2 GLY 94 1HA GLY 94 10.121 11.996 -2.211 661 HA3 GLY 94 2HA GLY 94 9.273 13.519 -2.434 662 H GLY 95 H GLY 95 9.282 11.028 0.123 663 HA2 GLY 95 1HA GLY 95 10.715 12.308 2.062 664 HA3 GLY 95 2HA GLY 95 9.120 13.037 2.172 665 HA PRO 96 HA PRO 96 9.452 8.925 4.539 666 HB2 PRO 96 1HB PRO 96 9.520 9.936 7.058 667 HB3 PRO 96 2HB PRO 96 10.978 9.605 6.116 668 HG2 PRO 96 1HG PRO 96 9.559 12.203 6.560 669 HG3 PRO 96 2HG PRO 96 11.299 11.861 6.580 670 HD2 PRO 96 1HD PRO 96 10.058 12.978 4.448 671 HD3 PRO 96 2HD PRO 96 11.461 11.903 4.281 672 H ASN 97 H ASN 97 7.673 11.917 4.944 673 HA ASN 97 HA ASN 97 5.585 11.015 6.567 674 HB2 ASN 97 1HB ASN 97 5.131 13.002 4.358 675 HB3 ASN 97 2HB ASN 97 4.451 12.979 5.983 676 HD21 ASN 97 1HD2 ASN 97 5.968 13.362 7.765 677 HD22 ASN 97 2HD2 ASN 97 7.269 14.470 7.511 678 H HIS 98 H HIS 98 3.574 10.139 6.142 679 HA HIS 98 HA HIS 98 3.354 8.757 3.563 680 HB2 HIS 98 1HB HIS 98 1.663 7.340 4.750 681 HB3 HIS 98 2HB HIS 98 3.281 7.258 5.442 682 HD2 HIS 98 2HD HIS 98 3.540 8.382 8.010 683 HE1 HIS 98 1HE HIS 98 -0.621 8.976 8.589 684 HE2 HIS 98 2HE HIS 98 1.660 9.051 9.656 685 H ILE 99 H ILE 99 1.082 8.448 2.746 686 HA ILE 99 HA ILE 99 -0.278 11.039 2.798 687 HB ILE 99 HB ILE 99 -1.387 10.365 0.767 688 HG12 ILE 99 1HG1 ILE 99 0.096 7.771 0.670 689 HG13 ILE 99 2HG1 ILE 99 -1.380 7.865 1.625 690 HG21 ILE 99 1HG2 ILE 99 1.543 9.659 0.670 691 HG22 ILE 99 2HG2 ILE 99 0.541 10.096 -0.713 692 HG23 ILE 99 3HG2 ILE 99 0.861 11.281 0.553 693 HD11 ILE 99 3HD1 ILE 99 -1.161 7.371 -1.099 694 HD12 ILE 99 1HD1 ILE 99 -2.635 7.705 -0.189 695 HD13 ILE 99 2HD1 ILE 99 -1.768 9.023 -0.980 696 H VAL 100 H VAL 100 -2.705 10.965 2.602 697 HA VAL 100 HA VAL 100 -3.821 9.751 4.869 698 HB VAL 100 HB VAL 100 -5.100 10.989 2.438 699 HG11 VAL 100 1HG1 VAL 100 -6.428 9.853 4.893 700 HG12 VAL 100 2HG1 VAL 100 -7.213 10.975 3.780 701 HG13 VAL 100 3HG1 VAL 100 -6.692 9.387 3.213 702 HG21 VAL 100 3HG2 VAL 100 -4.722 11.896 5.289 703 HG22 VAL 100 1HG2 VAL 100 -3.953 12.558 3.846 704 HG23 VAL 100 2HG2 VAL 100 -5.689 12.757 4.091 705 H GLY 101 H GLY 101 -4.985 7.911 5.197 706 HA2 GLY 101 1HA GLY 101 -6.290 6.050 4.477 707 HA3 GLY 101 2HA GLY 101 -5.573 6.204 2.881 708 H SER 102 H SER 102 -2.884 6.286 3.498 709 HA SER 102 HA SER 102 -2.389 3.506 4.028 710 HB2 SER 102 1HB SER 102 -0.895 4.186 2.436 711 HB3 SER 102 2HB SER 102 -0.803 5.829 3.072 712 HG SER 102 HG SER 102 0.807 5.262 4.319 713 HA PRO 103 HA PRO 103 -0.339 2.415 4.526 714 HB2 PRO 103 1HB PRO 103 -0.348 0.308 6.238 715 HB3 PRO 103 2HB PRO 103 0.994 1.452 6.130 716 HG2 PRO 103 1HG PRO 103 -1.245 1.341 8.113 717 HG3 PRO 103 2HG PRO 103 0.480 1.642 8.390 718 HD2 PRO 103 1HD PRO 103 -1.351 3.635 8.306 719 HD3 PRO 103 2HD PRO 103 0.324 3.854 7.761 720 H PHE 104 H PHE 104 -1.387 0.637 3.534 721 HA PHE 104 HA PHE 104 -4.272 0.611 3.976 722 HB2 PHE 104 1HB PHE 104 -2.503 -0.287 1.714 723 HB3 PHE 104 2HB PHE 104 -4.189 -0.785 1.804 724 HD1 PHE 104 2HD PHE 104 -5.909 1.162 2.137 725 HD2 PHE 104 1HD PHE 104 -1.969 1.654 0.604 726 HE1 PHE 104 2HE PHE 104 -6.590 3.274 1.074 727 HE2 PHE 104 1HE PHE 104 -2.643 3.767 -0.461 728 HZ PHE 104 HZ PHE 104 -4.956 4.579 -0.228 729 H LYS 105 H LYS 105 -5.114 -0.889 5.248 730 HA LYS 105 HA LYS 105 -3.660 -3.376 5.723 731 HB2 LYS 105 1HB LYS 105 -5.940 -1.993 7.112 732 HB3 LYS 105 2HB LYS 105 -5.562 -3.677 7.449 733 HG2 LYS 105 1HG LYS 105 -3.529 -3.163 8.424 734 HG3 LYS 105 2HG LYS 105 -3.428 -1.593 7.624 735 HD2 LYS 105 1HD LYS 105 -3.967 -1.001 9.795 736 HD3 LYS 105 2HD LYS 105 -5.552 -1.041 9.019 737 HE2 LYS 105 1HE LYS 105 -5.513 -3.546 9.815 738 HE3 LYS 105 2HE LYS 105 -4.341 -2.931 10.981 739 HZ1 LYS 105 3HZ LYS 105 -5.915 -1.491 11.902 740 HZ2 LYS 105 1HZ LYS 105 -6.760 -2.939 11.675 741 HZ3 LYS 105 2HZ LYS 105 -6.981 -1.654 10.598 742 H ALA 106 H ALA 106 -4.104 -4.291 3.635 743 HA ALA 106 HA ALA 106 -6.884 -4.967 3.057 744 HB1 ALA 106 3HB ALA 106 -6.213 -5.496 0.896 745 HB2 ALA 106 1HB ALA 106 -5.155 -4.151 1.327 746 HB3 ALA 106 2HB ALA 106 -4.546 -5.806 1.383 747 H LYS 107 H LYS 107 -7.401 -7.213 2.416 748 HA LYS 107 HA LYS 107 -5.890 -9.162 4.032 749 HB2 LYS 107 1HB LYS 107 -8.055 -8.692 5.050 750 HB3 LYS 107 2HB LYS 107 -8.869 -9.038 3.530 751 HG2 LYS 107 1HG LYS 107 -9.193 -11.010 4.621 752 HG3 LYS 107 2HG LYS 107 -7.674 -11.364 3.794 753 HD2 LYS 107 1HD LYS 107 -6.476 -10.636 5.868 754 HD3 LYS 107 2HD LYS 107 -8.045 -10.526 6.668 755 HE2 LYS 107 1HE LYS 107 -8.413 -12.841 6.496 756 HE3 LYS 107 2HE LYS 107 -7.133 -13.040 5.299 757 HZ1 LYS 107 3HZ LYS 107 -6.579 -12.152 8.067 758 HZ2 LYS 107 1HZ LYS 107 -5.487 -12.753 6.923 759 HZ3 LYS 107 2HZ LYS 107 -6.618 -13.787 7.637 760 H VAL 108 H VAL 108 -5.245 -10.993 3.057 761 HA VAL 108 HA VAL 108 -6.057 -11.386 0.256 762 HB VAL 108 HB VAL 108 -3.661 -12.708 1.477 763 HG11 VAL 108 1HG1 VAL 108 -3.133 -11.899 -1.120 764 HG12 VAL 108 2HG1 VAL 108 -3.591 -13.521 -0.597 765 HG13 VAL 108 3HG1 VAL 108 -4.825 -12.392 -1.157 766 HG21 VAL 108 3HG2 VAL 108 -2.294 -10.788 0.706 767 HG22 VAL 108 1HG2 VAL 108 -3.783 -9.892 0.405 768 HG23 VAL 108 2HG2 VAL 108 -3.366 -10.384 2.047 769 H THR 109 H THR 109 -7.534 -12.917 -0.006 770 HA THR 109 HA THR 109 -7.442 -15.283 1.750 771 HB THR 109 HB THR 109 -9.867 -15.582 1.124 772 HG1 THR 109 1HG THR 109 -10.907 -13.698 0.296 773 HG21 THR 109 3HG2 THR 109 -9.121 -13.045 2.583 774 HG22 THR 109 1HG2 THR 109 -9.223 -14.657 3.287 775 HG23 THR 109 2HG2 THR 109 -10.679 -13.864 2.686 776 H GLY 110 H GLY 110 -8.009 -17.336 0.801 777 HA2 GLY 110 1HA GLY 110 -8.615 -18.458 -1.360 778 HA3 GLY 110 2HA GLY 110 -7.387 -17.433 -2.087 779 H GLN 111 H GLN 111 -7.934 -20.484 -1.231 780 HA GLN 111 HA GLN 111 -5.870 -21.394 0.331 781 HB2 GLN 111 1HB GLN 111 -7.337 -22.573 -1.993 782 HB3 GLN 111 2HB GLN 111 -5.956 -23.435 -1.327 783 HG2 GLN 111 1HG GLN 111 -7.712 -24.365 -0.175 784 HG3 GLN 111 2HG GLN 111 -7.159 -23.116 0.940 785 HE21 GLN 111 1HE2 GLN 111 -8.927 -22.462 1.961 786 HE22 GLN 111 2HE2 GLN 111 -10.385 -21.929 1.204 787 H ARG 112 H ARG 112 -3.727 -21.381 0.192 788 HA ARG 112 HA ARG 112 -2.162 -20.016 -1.480 789 HB2 ARG 112 1HB ARG 112 -0.309 -21.342 -0.833 790 HB3 ARG 112 2HB ARG 112 -1.441 -21.410 0.511 791 HG2 ARG 112 1HG ARG 112 -2.227 -23.601 -0.297 792 HG3 ARG 112 2HG ARG 112 -1.017 -23.534 -1.580 793 HD2 ARG 112 1HD ARG 112 0.750 -23.390 0.132 794 HD3 ARG 112 2HD ARG 112 -0.479 -23.528 1.388 795 HE ARG 112 HE ARG 112 -0.883 -25.724 -0.158 796 HH11 ARG 112 1HH1 ARG 112 1.882 -24.382 1.477 797 HH12 ARG 112 2HH1 ARG 112 2.631 -25.920 1.751 798 HH21 ARG 112 1HH2 ARG 112 0.093 -27.756 0.197 799 HH22 ARG 112 2HH2 ARG 112 1.613 -27.839 1.021 800 H LEU 113 H LEU 113 -1.100 -20.262 -3.435 801 HA LEU 113 HA LEU 113 -2.316 -22.213 -5.248 802 HB2 LEU 113 1HB LEU 113 -0.738 -19.699 -5.753 803 HB3 LEU 113 2HB LEU 113 -1.270 -20.793 -7.027 804 HG LEU 113 HG LEU 113 -3.291 -19.614 -5.170 805 HD11 LEU 113 1HD1 LEU 113 -3.460 -17.612 -6.379 806 HD12 LEU 113 2HD1 LEU 113 -2.382 -18.187 -7.651 807 HD13 LEU 113 3HD1 LEU 113 -1.736 -17.802 -6.056 808 HD21 LEU 113 3HD2 LEU 113 -3.233 -20.654 -7.985 809 HD22 LEU 113 1HD2 LEU 113 -4.568 -19.668 -7.386 810 HD23 LEU 113 2HD2 LEU 113 -4.198 -21.212 -6.617 811 H VAL 114 H VAL 114 -1.237 -24.064 -5.419 812 HA VAL 114 HA VAL 114 1.700 -23.948 -5.651 813 HB VAL 114 HB VAL 114 1.113 -24.981 -3.530 814 HG11 VAL 114 1HG1 VAL 114 -1.084 -25.970 -4.893 815 HG12 VAL 114 2HG1 VAL 114 -0.103 -27.400 -4.569 816 HG13 VAL 114 3HG1 VAL 114 -0.614 -26.359 -3.239 817 HG21 VAL 114 3HG2 VAL 114 2.600 -26.705 -3.689 818 HG22 VAL 114 1HG2 VAL 114 1.874 -27.341 -5.165 819 HG23 VAL 114 2HG2 VAL 114 2.913 -25.918 -5.236 820 H SER 115 H SER 115 2.651 -25.143 -7.249 821 HA SER 115 HA SER 115 0.838 -26.223 -9.273 822 HB2 SER 115 1HB SER 115 2.632 -24.518 -9.843 823 HB3 SER 115 2HB SER 115 3.817 -25.788 -9.538 824 HG SER 115 HG SER 115 3.250 -25.675 -11.747 825 HA PRO 116 HA PRO 116 1.791 -30.406 -8.282 826 HB2 PRO 116 1HB PRO 116 1.170 -31.553 -10.664 827 HB3 PRO 116 2HB PRO 116 -0.054 -30.961 -9.534 828 HG2 PRO 116 1HG PRO 116 1.052 -29.648 -11.986 829 HG3 PRO 116 2HG PRO 116 -0.629 -29.742 -11.429 830 HD2 PRO 116 1HD PRO 116 0.903 -27.538 -11.072 831 HD3 PRO 116 2HD PRO 116 -0.356 -28.022 -9.919 832 H GLY 117 H GLY 117 3.336 -28.701 -10.877 833 HA2 GLY 117 1HA GLY 117 5.410 -28.920 -11.835 834 HA3 GLY 117 2HA GLY 117 5.840 -29.897 -10.439 835 H SER 118 H SER 118 4.728 -29.922 -13.734 836 HA SER 118 HA SER 118 4.019 -32.536 -14.150 837 HB2 SER 118 1HB SER 118 4.276 -30.497 -15.806 838 HB3 SER 118 2HB SER 118 5.838 -31.242 -16.145 839 HG SER 118 HG SER 118 4.219 -32.029 -17.542 840 H ALA 119 H ALA 119 5.301 -34.269 -15.259 841 HA ALA 119 HA ALA 119 7.804 -34.670 -13.792 842 HB1 ALA 119 3HB ALA 119 6.509 -36.526 -13.405 843 HB2 ALA 119 1HB ALA 119 5.791 -36.496 -15.016 844 HB3 ALA 119 2HB ALA 119 7.448 -37.063 -14.799 845 H ASN 120 H ASN 120 9.739 -35.120 -14.784 846 HA ASN 120 HA ASN 120 9.801 -34.775 -17.710 847 HB2 ASN 120 1HB ASN 120 10.792 -32.842 -16.660 848 HB3 ASN 120 2HB ASN 120 11.793 -33.859 -15.627 849 HD21 ASN 120 1HD2 ASN 120 13.757 -34.389 -16.307 850 HD22 ASN 120 2HD2 ASN 120 14.369 -34.124 -17.900 851 H GLU 121 H GLU 121 11.564 -35.852 -18.830 852 HA GLU 121 HA GLU 121 12.512 -38.257 -17.415 853 HB2 GLU 121 1HB GLU 121 10.668 -38.643 -19.117 854 HB3 GLU 121 2HB GLU 121 11.822 -38.155 -20.349 855 HG2 GLU 121 1HG GLU 121 13.258 -39.997 -19.823 856 HG3 GLU 121 2HG GLU 121 12.261 -40.434 -18.436 857 H THR 122 H THR 122 14.608 -37.850 -17.053 858 HA THR 122 HA THR 122 16.219 -36.650 -19.191 859 HB THR 122 HB THR 122 16.883 -37.082 -16.272 860 HG1 THR 122 1HG THR 122 16.165 -35.101 -16.003 861 HG21 THR 122 3HG2 THR 122 18.962 -36.145 -16.621 862 HG22 THR 122 1HG2 THR 122 18.468 -35.341 -18.111 863 HG23 THR 122 2HG2 THR 122 18.762 -37.080 -18.102 864 H SER 123 H SER 123 17.751 -37.761 -20.252 865 HA SER 123 HA SER 123 19.020 -40.090 -19.190 866 HB2 SER 123 1HB SER 123 16.779 -40.990 -19.890 867 HB3 SER 123 2HB SER 123 17.176 -40.536 -21.547 868 HG SER 123 HG SER 123 17.709 -42.707 -21.153 869 H SER 124 H SER 124 21.005 -40.128 -20.002 870 HA SER 124 HA SER 124 21.585 -38.550 -22.386 871 HB2 SER 124 1HB SER 124 23.007 -38.098 -20.494 872 HB3 SER 124 2HB SER 124 23.378 -39.811 -20.301 873 HG SER 124 HG SER 124 24.014 -38.324 -22.629 874 H ILE 125 H ILE 125 21.621 -39.508 -24.298 875 HA ILE 125 HA ILE 125 21.342 -42.149 -24.889 876 HB ILE 125 HB ILE 125 22.298 -41.706 -27.094 877 HG12 ILE 125 1HG1 ILE 125 24.215 -40.321 -26.222 878 HG13 ILE 125 2HG1 ILE 125 23.412 -39.659 -27.642 879 HG21 ILE 125 1HG2 ILE 125 20.984 -39.350 -27.336 880 HG22 ILE 125 2HG2 ILE 125 20.197 -40.926 -27.268 881 HG23 ILE 125 3HG2 ILE 125 20.330 -39.944 -25.810 882 HD11 ILE 125 3HD1 ILE 125 23.313 -38.711 -24.810 883 HD12 ILE 125 1HD1 ILE 125 23.730 -37.819 -26.272 884 HD13 ILE 125 2HD1 ILE 125 22.053 -38.272 -25.963 Start of MODEL 5 1 H1 GLY 1 H GLY 1 18.899 32.206 24.531 2 HA2 GLY 1 1HA GLY 1 20.231 30.423 26.209 3 HA3 GLY 1 2HA GLY 1 20.057 31.929 27.098 4 H SER 2 H SER 2 18.887 29.692 28.087 5 HA SER 2 HA SER 2 16.176 30.477 28.315 6 HB2 SER 2 1HB SER 2 16.182 29.316 26.058 7 HB3 SER 2 2HB SER 2 16.561 27.825 26.919 8 HG SER 2 HG SER 2 14.228 29.408 27.062 9 H SER 3 H SER 3 16.102 30.244 30.456 10 HA SER 3 HA SER 3 17.355 27.955 31.740 11 HB2 SER 3 1HB SER 3 16.268 30.576 32.652 12 HB3 SER 3 2HB SER 3 16.292 29.250 33.814 13 HG SER 3 HG SER 3 18.582 29.022 33.126 14 H GLY 4 H GLY 4 16.294 26.146 32.187 15 HA2 GLY 4 1HA GLY 4 14.591 24.727 32.821 16 HA3 GLY 4 2HA GLY 4 13.619 26.142 33.199 17 H SER 5 H SER 5 12.024 24.485 32.253 18 HA SER 5 HA SER 5 11.890 24.844 29.331 19 HB2 SER 5 1HB SER 5 12.038 22.463 30.450 20 HB3 SER 5 2HB SER 5 10.318 22.720 30.740 21 HG SER 5 HG SER 5 10.370 23.314 28.354 22 H SER 6 H SER 6 10.220 25.936 28.512 23 HA SER 6 HA SER 6 8.105 26.790 30.359 24 HB2 SER 6 1HB SER 6 9.367 27.996 27.940 25 HB3 SER 6 2HB SER 6 7.682 28.392 28.276 26 HG SER 6 HG SER 6 8.344 29.658 29.803 27 H GLY 7 H GLY 7 5.900 26.984 29.498 28 HA2 GLY 7 1HA GLY 7 5.310 24.721 27.703 29 HA3 GLY 7 2HA GLY 7 4.217 25.352 28.926 30 H PHE 8 H PHE 8 5.575 27.990 27.548 31 HA PHE 8 HA PHE 8 3.263 28.359 25.791 32 HB2 PHE 8 1HB PHE 8 5.114 30.230 27.225 33 HB3 PHE 8 2HB PHE 8 4.210 30.800 25.826 34 HD1 PHE 8 1HD PHE 8 2.752 28.260 27.980 35 HD2 PHE 8 2HD PHE 8 3.049 32.437 27.215 36 HE1 PHE 8 1HE PHE 8 0.792 28.658 29.413 37 HE2 PHE 8 2HE PHE 8 1.090 32.841 28.648 38 HZ PHE 8 HZ PHE 8 -0.041 30.951 29.749 39 H LYS 9 H LYS 9 3.438 28.519 23.640 40 HA LYS 9 HA LYS 9 6.092 28.216 22.462 41 HB2 LYS 9 1HB LYS 9 3.294 27.780 21.458 42 HB3 LYS 9 2HB LYS 9 4.641 27.899 20.334 43 HG2 LYS 9 1HG LYS 9 5.744 26.051 21.650 44 HG3 LYS 9 2HG LYS 9 4.200 25.845 22.481 45 HD2 LYS 9 1HD LYS 9 4.209 25.891 19.505 46 HD3 LYS 9 2HD LYS 9 4.809 24.446 20.322 47 HE2 LYS 9 1HE LYS 9 2.588 23.920 20.131 48 HE3 LYS 9 2HE LYS 9 2.591 24.708 21.708 49 HZ1 LYS 9 3HZ LYS 9 0.984 25.368 19.640 50 HZ2 LYS 9 1HZ LYS 9 2.214 26.523 19.508 51 HZ3 LYS 9 2HZ LYS 9 1.343 26.377 20.950 52 H VAL 10 H VAL 10 6.645 29.444 20.515 53 HA VAL 10 HA VAL 10 5.683 32.215 20.725 54 HB VAL 10 HB VAL 10 8.195 31.348 19.312 55 HG11 VAL 10 1HG1 VAL 10 6.843 33.825 19.705 56 HG12 VAL 10 2HG1 VAL 10 8.394 33.884 20.544 57 HG13 VAL 10 3HG1 VAL 10 8.335 33.507 18.822 58 HG21 VAL 10 3HG2 VAL 10 8.398 30.517 21.566 59 HG22 VAL 10 1HG2 VAL 10 9.410 31.951 21.387 60 HG23 VAL 10 2HG2 VAL 10 7.862 32.064 22.224 61 H ARG 11 H ARG 11 4.846 33.272 18.996 62 HA ARG 11 HA ARG 11 3.714 31.811 16.890 63 HB2 ARG 11 1HB ARG 11 3.018 33.924 15.984 64 HB3 ARG 11 2HB ARG 11 2.899 34.015 17.736 65 HG2 ARG 11 1HG ARG 11 5.353 34.993 16.341 66 HG3 ARG 11 2HG ARG 11 3.905 35.998 16.423 67 HD2 ARG 11 1HD ARG 11 4.006 35.390 18.971 68 HD3 ARG 11 2HD ARG 11 5.702 35.067 18.614 69 HE ARG 11 HE ARG 11 5.275 37.530 17.553 70 HH11 ARG 11 1HH1 ARG 11 4.757 36.121 20.694 71 HH12 ARG 11 2HH1 ARG 11 5.002 37.609 21.546 72 HH21 ARG 11 1HH2 ARG 11 5.599 39.496 18.663 73 HH22 ARG 11 2HH2 ARG 11 5.480 39.528 20.390 74 H VAL 12 H VAL 12 4.191 31.724 14.676 75 HA VAL 12 HA VAL 12 6.774 32.740 13.778 76 HB VAL 12 HB VAL 12 6.052 29.812 13.792 77 HG11 VAL 12 1HG1 VAL 12 6.878 29.964 11.656 78 HG12 VAL 12 2HG1 VAL 12 7.920 31.336 12.039 79 HG13 VAL 12 3HG1 VAL 12 8.368 29.713 12.565 80 HG21 VAL 12 3HG2 VAL 12 8.360 31.400 14.902 81 HG22 VAL 12 1HG2 VAL 12 7.148 30.486 15.800 82 HG23 VAL 12 2HG2 VAL 12 8.337 29.639 14.811 83 H GLY 13 H GLY 13 6.684 33.452 11.737 84 HA2 GLY 13 1HA GLY 13 4.356 32.628 10.113 85 HA3 GLY 13 2HA GLY 13 5.046 34.244 10.077 86 H GLU 14 H GLU 14 4.700 31.769 8.166 87 HA GLU 14 HA GLU 14 7.425 31.938 7.054 88 HB2 GLU 14 1HB GLU 14 5.463 29.646 7.015 89 HB3 GLU 14 2HB GLU 14 6.884 29.708 5.982 90 HG2 GLU 14 1HG GLU 14 8.351 29.591 7.819 91 HG3 GLU 14 2HG GLU 14 7.058 29.923 8.970 92 HA PRO 15 HA PRO 15 5.771 33.624 3.356 93 HB2 PRO 15 1HB PRO 15 7.442 32.568 1.495 94 HB3 PRO 15 2HB PRO 15 7.938 33.835 2.623 95 HG2 PRO 15 1HG PRO 15 8.412 30.883 2.764 96 HG3 PRO 15 2HG PRO 15 9.532 32.213 3.108 97 HD2 PRO 15 1HD PRO 15 8.252 30.843 5.062 98 HD3 PRO 15 2HD PRO 15 8.667 32.563 5.216 99 H GLY 16 H GLY 16 6.447 30.135 3.230 100 HA2 GLY 16 1HA GLY 16 4.107 29.028 2.744 101 HA3 GLY 16 2HA GLY 16 4.381 29.793 1.186 102 H GLN 17 H GLN 17 4.241 26.915 2.166 103 HA GLN 17 HA GLN 17 6.853 26.016 1.149 104 HB2 GLN 17 1HB GLN 17 4.828 24.468 2.774 105 HB3 GLN 17 2HB GLN 17 6.410 23.890 2.269 106 HG2 GLN 17 1HG GLN 17 6.087 26.328 3.982 107 HG3 GLN 17 2HG GLN 17 6.158 24.704 4.664 108 HE21 GLN 17 1HE2 GLN 17 8.065 25.329 5.766 109 HE22 GLN 17 2HE2 GLN 17 9.583 25.392 4.943 110 H ALA 18 H ALA 18 6.859 24.104 -0.231 111 HA ALA 18 HA ALA 18 4.398 23.874 -1.838 112 HB1 ALA 18 3HB ALA 18 5.551 24.015 -3.806 113 HB2 ALA 18 1HB ALA 18 6.545 25.067 -2.798 114 HB3 ALA 18 2HB ALA 18 7.048 23.404 -3.103 115 H GLY 19 H GLY 19 3.957 21.832 -2.777 116 HA2 GLY 19 1HA GLY 19 4.141 19.527 -3.038 117 HA3 GLY 19 2HA GLY 19 5.643 19.571 -2.126 118 H ASN 20 H ASN 20 2.235 19.090 -2.001 119 HA ASN 20 HA ASN 20 2.398 18.621 0.903 120 HB2 ASN 20 1HB ASN 20 0.732 20.352 -0.115 121 HB3 ASN 20 2HB ASN 20 -0.199 18.928 -0.573 122 HD21 ASN 20 1HD2 ASN 20 -1.892 19.453 0.786 123 HD22 ASN 20 2HD2 ASN 20 -1.781 19.309 2.504 124 HA PRO 21 HA PRO 21 2.027 14.324 -0.194 125 HB2 PRO 21 1HB PRO 21 1.931 13.389 2.353 126 HB3 PRO 21 2HB PRO 21 3.431 13.914 1.578 127 HG2 PRO 21 1HG PRO 21 1.666 15.396 3.489 128 HG3 PRO 21 2HG PRO 21 3.436 15.295 3.449 129 HD2 PRO 21 1HD PRO 21 2.076 17.428 2.482 130 HD3 PRO 21 2HD PRO 21 3.614 16.880 1.785 131 H ALA 22 H ALA 22 0.037 15.571 2.497 132 HA ALA 22 HA ALA 22 -1.954 13.785 2.687 133 HB1 ALA 22 3HB ALA 22 -3.068 16.472 2.448 134 HB2 ALA 22 1HB ALA 22 -3.044 15.370 3.825 135 HB3 ALA 22 2HB ALA 22 -1.643 16.386 3.483 136 H LEU 23 H LEU 23 -1.870 16.347 0.213 137 HA LEU 23 HA LEU 23 -4.219 15.837 -1.105 138 HB2 LEU 23 1HB LEU 23 -1.542 16.782 -2.039 139 HB3 LEU 23 2HB LEU 23 -2.831 16.505 -3.209 140 HG LEU 23 HG LEU 23 -3.283 18.295 -0.850 141 HD11 LEU 23 1HD1 LEU 23 -1.798 19.776 -1.561 142 HD12 LEU 23 2HD1 LEU 23 -2.670 19.881 -3.090 143 HD13 LEU 23 3HD1 LEU 23 -1.346 18.730 -2.907 144 HD21 LEU 23 3HD2 LEU 23 -5.164 17.535 -2.295 145 HD22 LEU 23 1HD2 LEU 23 -4.385 18.346 -3.654 146 HD23 LEU 23 2HD2 LEU 23 -4.940 19.285 -2.268 147 H VAL 24 H VAL 24 -1.093 14.229 -1.600 148 HA VAL 24 HA VAL 24 -1.621 12.626 -3.746 149 HB VAL 24 HB VAL 24 -0.144 11.788 -1.246 150 HG11 VAL 24 1HG1 VAL 24 -0.615 9.848 -2.556 151 HG12 VAL 24 2HG1 VAL 24 -0.141 10.669 -4.044 152 HG13 VAL 24 3HG1 VAL 24 1.073 10.278 -2.825 153 HG21 VAL 24 3HG2 VAL 24 0.683 13.313 -3.697 154 HG22 VAL 24 1HG2 VAL 24 0.906 13.740 -2.000 155 HG23 VAL 24 2HG2 VAL 24 1.854 12.435 -2.712 156 H SER 25 H SER 25 -2.545 10.618 -4.105 157 HA SER 25 HA SER 25 -4.015 9.358 -1.914 158 HB2 SER 25 1HB SER 25 -5.329 10.098 -4.540 159 HB3 SER 25 2HB SER 25 -6.089 9.258 -3.188 160 HG SER 25 HG SER 25 -5.649 11.175 -1.933 161 H ALA 26 H ALA 26 -4.982 7.233 -2.646 162 HA ALA 26 HA ALA 26 -3.653 5.999 -4.918 163 HB1 ALA 26 3HB ALA 26 -2.810 4.118 -3.498 164 HB2 ALA 26 1HB ALA 26 -1.976 5.654 -3.262 165 HB3 ALA 26 2HB ALA 26 -3.169 5.107 -2.083 166 H TYR 27 H TYR 27 -4.892 4.474 -5.847 167 HA TYR 27 HA TYR 27 -6.796 2.912 -4.386 168 HB2 TYR 27 1HB TYR 27 -8.779 3.752 -5.693 169 HB3 TYR 27 2HB TYR 27 -8.155 4.877 -4.491 170 HD1 TYR 27 2HD TYR 27 -7.772 4.065 -8.119 171 HD2 TYR 27 1HD TYR 27 -7.834 7.078 -5.116 172 HE1 TYR 27 2HE TYR 27 -7.562 5.794 -9.857 173 HE2 TYR 27 1HE TYR 27 -7.625 8.815 -6.845 174 HH TYR 27 HH TYR 27 -7.251 7.965 -10.266 175 H GLY 28 H GLY 28 -7.989 1.410 -5.807 176 HA2 GLY 28 1HA GLY 28 -7.810 1.037 -8.480 177 HA3 GLY 28 2HA GLY 28 -6.244 0.475 -7.914 178 H THR 29 H THR 29 -6.493 -1.669 -8.380 179 HA THR 29 HA THR 29 -8.759 -3.068 -7.134 180 HB THR 29 HB THR 29 -6.874 -4.235 -9.178 181 HG1 THR 29 1HG THR 29 -8.237 -2.244 -9.770 182 HG21 THR 29 3HG2 THR 29 -9.422 -5.317 -9.432 183 HG22 THR 29 1HG2 THR 29 -9.176 -5.181 -7.692 184 HG23 THR 29 2HG2 THR 29 -8.025 -6.084 -8.678 185 H GLY 30 H GLY 30 -5.439 -2.494 -6.803 186 HA2 GLY 30 1HA GLY 30 -4.870 -5.021 -5.471 187 HA3 GLY 30 2HA GLY 30 -3.733 -3.711 -5.754 188 H LEU 31 H LEU 31 -6.084 -1.971 -4.615 189 HA LEU 31 HA LEU 31 -5.181 -2.237 -1.838 190 HB2 LEU 31 1HB LEU 31 -6.490 0.030 -3.326 191 HB3 LEU 31 2HB LEU 31 -6.186 0.049 -1.590 192 HG LEU 31 HG LEU 31 -3.988 -0.274 -3.620 193 HD11 LEU 31 1HD1 LEU 31 -5.089 2.256 -2.411 194 HD12 LEU 31 2HD1 LEU 31 -5.046 1.821 -4.119 195 HD13 LEU 31 3HD1 LEU 31 -3.544 2.138 -3.253 196 HD21 LEU 31 3HD2 LEU 31 -3.637 0.942 -0.938 197 HD22 LEU 31 1HD2 LEU 31 -2.537 -0.063 -1.882 198 HD23 LEU 31 2HD2 LEU 31 -3.886 -0.803 -1.020 199 H GLU 32 H GLU 32 -7.957 -2.547 -3.867 200 HA GLU 32 HA GLU 32 -9.957 -2.290 -1.870 201 HB2 GLU 32 1HB GLU 32 -11.479 -3.142 -3.490 202 HB3 GLU 32 2HB GLU 32 -10.320 -2.145 -4.358 203 HG2 GLU 32 1HG GLU 32 -9.289 -3.967 -5.343 204 HG3 GLU 32 2HG GLU 32 -9.900 -5.093 -4.132 205 H GLY 33 H GLY 33 -7.588 -4.593 -2.290 206 HA2 GLY 33 1HA GLY 33 -8.071 -6.194 -0.198 207 HA3 GLY 33 2HA GLY 33 -9.157 -6.871 -1.403 208 H GLY 34 H GLY 34 -7.530 -8.682 -0.656 209 HA2 GLY 34 1HA GLY 34 -5.184 -8.612 -2.444 210 HA3 GLY 34 2HA GLY 34 -5.311 -9.600 -0.996 211 H THR 35 H THR 35 -5.696 -9.503 -4.348 212 HA THR 35 HA THR 35 -7.416 -11.869 -4.411 213 HB THR 35 HB THR 35 -6.965 -11.444 -7.008 214 HG1 THR 35 1HG THR 35 -6.928 -9.063 -7.227 215 HG21 THR 35 3HG2 THR 35 -8.827 -9.513 -5.697 216 HG22 THR 35 1HG2 THR 35 -9.101 -11.243 -5.491 217 HG23 THR 35 2HG2 THR 35 -9.082 -10.540 -7.108 218 H THR 36 H THR 36 -6.345 -13.715 -4.085 219 HA THR 36 HA THR 36 -3.596 -14.055 -4.864 220 HB THR 36 HB THR 36 -5.284 -16.385 -4.073 221 HG1 THR 36 1HG THR 36 -4.805 -14.098 -2.526 222 HG21 THR 36 3HG2 THR 36 -3.240 -16.894 -2.739 223 HG22 THR 36 1HG2 THR 36 -2.495 -15.443 -3.407 224 HG23 THR 36 2HG2 THR 36 -2.943 -16.774 -4.473 225 H GLY 37 H GLY 37 -3.037 -14.428 -6.906 226 HA2 GLY 37 1HA GLY 37 -2.962 -16.115 -8.664 227 HA3 GLY 37 2HA GLY 37 -4.700 -16.299 -8.473 228 H ILE 38 H ILE 38 -4.790 -13.242 -8.205 229 HA ILE 38 HA ILE 38 -4.709 -12.706 -11.101 230 HB ILE 38 HB ILE 38 -6.464 -11.375 -9.036 231 HG12 ILE 38 1HG1 ILE 38 -7.064 -13.531 -11.069 232 HG13 ILE 38 2HG1 ILE 38 -7.178 -13.663 -9.318 233 HG21 ILE 38 1HG2 ILE 38 -6.739 -11.237 -12.023 234 HG22 ILE 38 2HG2 ILE 38 -7.490 -10.214 -10.799 235 HG23 ILE 38 3HG2 ILE 38 -5.760 -10.084 -11.117 236 HD11 ILE 38 3HD1 ILE 38 -9.102 -12.357 -9.229 237 HD12 ILE 38 1HD1 ILE 38 -8.839 -11.695 -10.842 238 HD13 ILE 38 2HD1 ILE 38 -9.335 -13.377 -10.648 239 H GLN 39 H GLN 39 -3.852 -10.784 -11.847 240 HA GLN 39 HA GLN 39 -2.009 -9.469 -10.022 241 HB2 GLN 39 1HB GLN 39 -0.970 -10.014 -12.049 242 HB3 GLN 39 2HB GLN 39 -2.352 -9.495 -13.005 243 HG2 GLN 39 1HG GLN 39 -1.869 -7.176 -12.486 244 HG3 GLN 39 2HG GLN 39 -0.519 -7.670 -11.466 245 HE21 GLN 39 1HE2 GLN 39 0.957 -9.313 -12.748 246 HE22 GLN 39 2HE2 GLN 39 1.461 -8.735 -14.296 247 H SER 40 H SER 40 -2.584 -7.705 -8.957 248 HA SER 40 HA SER 40 -4.748 -6.036 -10.030 249 HB2 SER 40 1HB SER 40 -3.589 -6.147 -7.234 250 HB3 SER 40 2HB SER 40 -4.952 -5.150 -7.740 251 HG SER 40 HG SER 40 -5.862 -7.299 -8.439 252 H GLU 41 H GLU 41 -4.564 -3.713 -9.881 253 HA GLU 41 HA GLU 41 -1.879 -2.622 -9.583 254 HB2 GLU 41 1HB GLU 41 -1.898 -1.527 -11.755 255 HB3 GLU 41 2HB GLU 41 -2.025 -3.269 -11.954 256 HG2 GLU 41 1HG GLU 41 -3.577 -2.494 -13.460 257 HG3 GLU 41 2HG GLU 41 -4.573 -2.828 -12.044 258 H PHE 42 H PHE 42 -1.889 -0.623 -8.736 259 HA PHE 42 HA PHE 42 -4.443 0.844 -8.701 260 HB2 PHE 42 1HB PHE 42 -3.953 1.582 -6.424 261 HB3 PHE 42 2HB PHE 42 -3.998 -0.177 -6.503 262 HD1 PHE 42 1HD PHE 42 -1.686 2.722 -6.470 263 HD2 PHE 42 2HD PHE 42 -2.187 -1.447 -5.772 264 HE1 PHE 42 1HE PHE 42 0.554 2.626 -5.457 265 HE2 PHE 42 2HE PHE 42 0.052 -1.549 -4.757 266 HZ PHE 42 HZ PHE 42 1.426 0.489 -4.598 267 H PHE 43 H PHE 43 -4.358 2.917 -9.314 268 HA PHE 43 HA PHE 43 -1.774 4.008 -10.090 269 HB2 PHE 43 1HB PHE 43 -4.624 4.646 -10.728 270 HB3 PHE 43 2HB PHE 43 -3.409 5.904 -10.933 271 HD1 PHE 43 1HD PHE 43 -1.239 5.086 -12.236 272 HD2 PHE 43 2HD PHE 43 -5.101 3.321 -12.533 273 HE1 PHE 43 1HE PHE 43 -0.640 4.151 -14.432 274 HE2 PHE 43 2HE PHE 43 -4.507 2.382 -14.728 275 HZ PHE 43 HZ PHE 43 -2.274 2.796 -15.681 276 H ILE 44 H ILE 44 -0.800 5.737 -9.172 277 HA ILE 44 HA ILE 44 -1.970 6.732 -6.679 278 HB ILE 44 HB ILE 44 0.843 7.085 -7.720 279 HG12 ILE 44 1HG1 ILE 44 -0.083 5.237 -5.520 280 HG13 ILE 44 2HG1 ILE 44 0.109 4.708 -7.188 281 HG21 ILE 44 1HG2 ILE 44 0.442 8.829 -6.211 282 HG22 ILE 44 2HG2 ILE 44 -0.508 7.801 -5.139 283 HG23 ILE 44 3HG2 ILE 44 1.240 7.588 -5.245 284 HD11 ILE 44 3HD1 ILE 44 2.246 4.325 -6.801 285 HD12 ILE 44 1HD1 ILE 44 2.487 6.033 -6.439 286 HD13 ILE 44 2HD1 ILE 44 2.065 4.908 -5.147 287 H ASN 45 H ASN 45 -2.784 8.715 -6.519 288 HA ASN 45 HA ASN 45 -2.653 10.495 -8.801 289 HB2 ASN 45 1HB ASN 45 -4.793 10.144 -7.640 290 HB3 ASN 45 2HB ASN 45 -4.098 10.797 -6.159 291 HD21 ASN 45 1HD2 ASN 45 -4.214 12.912 -5.816 292 HD22 ASN 45 2HD2 ASN 45 -4.718 14.087 -6.978 293 H THR 46 H THR 46 -0.404 11.024 -8.686 294 HA THR 46 HA THR 46 0.242 12.929 -6.530 295 HB THR 46 HB THR 46 1.692 10.984 -6.388 296 HG1 THR 46 1HG THR 46 3.289 12.305 -5.977 297 HG21 THR 46 3HG2 THR 46 1.797 11.329 -9.295 298 HG22 THR 46 1HG2 THR 46 2.039 9.882 -8.317 299 HG23 THR 46 2HG2 THR 46 3.365 11.021 -8.552 300 H THR 47 H THR 47 -1.030 13.270 -9.256 301 HA THR 47 HA THR 47 0.943 14.785 -10.740 302 HB THR 47 HB THR 47 -0.879 15.227 -12.334 303 HG1 THR 47 1HG THR 47 -2.514 15.111 -10.513 304 HG21 THR 47 3HG2 THR 47 -0.832 12.324 -11.509 305 HG22 THR 47 1HG2 THR 47 0.436 13.115 -12.444 306 HG23 THR 47 2HG2 THR 47 -1.190 12.966 -13.111 307 H ARG 48 H ARG 48 -1.267 15.374 -8.235 308 HA ARG 48 HA ARG 48 -1.443 18.234 -8.855 309 HB2 ARG 48 1HB ARG 48 -2.941 16.438 -6.963 310 HB3 ARG 48 2HB ARG 48 -3.004 18.188 -6.804 311 HG2 ARG 48 1HG ARG 48 -3.649 18.083 -9.342 312 HG3 ARG 48 2HG ARG 48 -4.121 16.434 -8.930 313 HD2 ARG 48 1HD ARG 48 -5.454 17.427 -7.028 314 HD3 ARG 48 2HD ARG 48 -5.149 19.005 -7.753 315 HE ARG 48 HE ARG 48 -6.193 17.428 -9.761 316 HH11 ARG 48 1HH1 ARG 48 -7.212 18.580 -6.638 317 HH12 ARG 48 2HH1 ARG 48 -8.895 18.601 -7.050 318 HH21 ARG 48 1HH2 ARG 48 -8.405 17.451 -10.316 319 HH22 ARG 48 2HH2 ARG 48 -9.572 17.958 -9.142 320 H ALA 49 H ALA 49 -0.060 15.961 -6.603 321 HA ALA 49 HA ALA 49 0.709 17.898 -4.644 322 HB1 ALA 49 3HB ALA 49 2.259 15.407 -4.767 323 HB2 ALA 49 1HB ALA 49 1.383 16.138 -3.422 324 HB3 ALA 49 2HB ALA 49 0.514 15.194 -4.633 325 H GLY 50 H GLY 50 2.489 16.110 -7.165 326 HA2 GLY 50 1HA GLY 50 4.019 17.713 -8.441 327 HA3 GLY 50 2HA GLY 50 4.694 18.043 -6.852 328 HA PRO 51 HA PRO 51 6.647 14.256 -9.027 329 HB2 PRO 51 1HB PRO 51 8.880 15.428 -10.032 330 HB3 PRO 51 2HB PRO 51 7.378 15.277 -10.951 331 HG2 PRO 51 1HG PRO 51 8.450 17.634 -9.449 332 HG3 PRO 51 2HG PRO 51 7.681 17.580 -11.046 333 HD2 PRO 51 1HD PRO 51 6.351 18.338 -8.813 334 HD3 PRO 51 2HD PRO 51 5.556 17.496 -10.159 335 H GLY 52 H GLY 52 8.488 13.150 -8.231 336 HA2 GLY 52 1HA GLY 52 10.629 13.959 -6.826 337 HA3 GLY 52 2HA GLY 52 9.351 14.097 -5.628 338 H THR 53 H THR 53 11.306 12.455 -4.962 339 HA THR 53 HA THR 53 11.035 9.783 -5.887 340 HB THR 53 HB THR 53 12.361 9.174 -3.868 341 HG1 THR 53 1HG THR 53 11.447 10.968 -2.583 342 HG21 THR 53 3HG2 THR 53 13.523 9.820 -5.896 343 HG22 THR 53 1HG2 THR 53 14.385 10.451 -4.493 344 HG23 THR 53 2HG2 THR 53 13.381 11.525 -5.467 345 H LEU 54 H LEU 54 9.352 8.499 -5.552 346 HA LEU 54 HA LEU 54 7.594 8.973 -3.271 347 HB2 LEU 54 1HB LEU 54 6.885 8.576 -5.746 348 HB3 LEU 54 2HB LEU 54 7.132 6.876 -5.352 349 HG LEU 54 HG LEU 54 5.516 7.497 -3.339 350 HD11 LEU 54 1HD1 LEU 54 4.605 9.376 -5.510 351 HD12 LEU 54 2HD1 LEU 54 5.420 9.885 -4.032 352 HD13 LEU 54 3HD1 LEU 54 3.844 9.099 -3.943 353 HD21 LEU 54 3HD2 LEU 54 4.313 7.115 -6.060 354 HD22 LEU 54 1HD2 LEU 54 3.800 6.440 -4.514 355 HD23 LEU 54 2HD2 LEU 54 5.269 5.848 -5.290 356 H SER 55 H SER 55 7.222 7.514 -1.655 357 HA SER 55 HA SER 55 9.125 5.283 -1.492 358 HB2 SER 55 1HB SER 55 8.999 7.126 0.306 359 HB3 SER 55 2HB SER 55 7.496 6.352 0.808 360 HG SER 55 HG SER 55 9.813 4.800 0.479 361 H VAL 56 H VAL 56 8.431 3.260 -1.654 362 HA VAL 56 HA VAL 56 5.668 2.613 -0.928 363 HB VAL 56 HB VAL 56 5.370 2.849 -3.241 364 HG11 VAL 56 1HG1 VAL 56 7.678 3.118 -3.904 365 HG12 VAL 56 2HG1 VAL 56 7.992 1.406 -3.614 366 HG13 VAL 56 3HG1 VAL 56 6.911 1.896 -4.918 367 HG21 VAL 56 3HG2 VAL 56 4.611 0.665 -2.275 368 HG22 VAL 56 1HG2 VAL 56 4.875 0.648 -4.019 369 HG23 VAL 56 2HG2 VAL 56 6.072 -0.066 -2.939 370 H THR 57 H THR 57 5.901 1.150 0.630 371 HA THR 57 HA THR 57 7.792 -1.066 0.187 372 HB THR 57 HB THR 57 7.142 0.116 2.891 373 HG1 THR 57 1HG THR 57 9.362 0.897 2.717 374 HG21 THR 57 3HG2 THR 57 8.287 -1.589 3.775 375 HG22 THR 57 1HG2 THR 57 9.600 -1.403 2.613 376 HG23 THR 57 2HG2 THR 57 8.180 -2.363 2.194 377 H ILE 58 H ILE 58 6.818 -2.973 0.095 378 HA ILE 58 HA ILE 58 4.146 -3.252 1.289 379 HB ILE 58 HB ILE 58 5.467 -4.884 -0.883 380 HG12 ILE 58 1HG1 ILE 58 3.248 -2.833 -0.917 381 HG13 ILE 58 2HG1 ILE 58 4.807 -2.733 -1.728 382 HG21 ILE 58 1HG2 ILE 58 2.806 -5.157 0.487 383 HG22 ILE 58 2HG2 ILE 58 3.133 -5.852 -1.100 384 HG23 ILE 58 3HG2 ILE 58 4.072 -6.370 0.300 385 HD11 ILE 58 3HD1 ILE 58 2.350 -4.166 -2.503 386 HD12 ILE 58 1HD1 ILE 58 3.558 -3.353 -3.498 387 HD13 ILE 58 2HD1 ILE 58 3.882 -4.965 -2.858 388 H GLU 59 H GLU 59 3.690 -4.848 2.735 389 HA GLU 59 HA GLU 59 5.871 -6.681 3.469 390 HB2 GLU 59 1HB GLU 59 5.508 -4.646 5.030 391 HB3 GLU 59 2HB GLU 59 4.049 -5.486 5.538 392 HG2 GLU 59 1HG GLU 59 5.623 -6.124 7.111 393 HG3 GLU 59 2HG GLU 59 5.589 -7.483 5.989 394 H GLY 60 H GLY 60 5.187 -8.645 4.525 395 HA2 GLY 60 1HA GLY 60 2.607 -9.456 5.057 396 HA3 GLY 60 2HA GLY 60 2.834 -9.740 3.337 397 HA PRO 61 HA PRO 61 4.415 -13.358 5.913 398 HB2 PRO 61 1HB PRO 61 2.655 -15.203 4.980 399 HB3 PRO 61 2HB PRO 61 2.334 -14.201 6.400 400 HG2 PRO 61 1HG PRO 61 1.388 -13.850 3.582 401 HG3 PRO 61 2HG PRO 61 0.485 -13.661 5.097 402 HD2 PRO 61 1HD PRO 61 1.467 -11.551 3.712 403 HD3 PRO 61 2HD PRO 61 1.329 -11.551 5.482 404 H SER 62 H SER 62 3.328 -13.046 2.570 405 HA SER 62 HA SER 62 5.616 -14.710 1.744 406 HB2 SER 62 1HB SER 62 2.866 -14.559 0.489 407 HB3 SER 62 2HB SER 62 4.246 -15.379 -0.242 408 HG SER 62 HG SER 62 2.848 -16.031 2.122 409 H LYS 63 H LYS 63 7.090 -13.562 0.706 410 HA LYS 63 HA LYS 63 6.920 -10.921 -0.033 411 HB2 LYS 63 1HB LYS 63 8.908 -11.299 -1.405 412 HB3 LYS 63 2HB LYS 63 9.036 -12.147 0.130 413 HG2 LYS 63 1HG LYS 63 8.725 -14.234 -0.858 414 HG3 LYS 63 2HG LYS 63 8.047 -13.537 -2.332 415 HD2 LYS 63 1HD LYS 63 10.157 -14.050 -3.061 416 HD3 LYS 63 2HD LYS 63 10.422 -12.403 -2.483 417 HE2 LYS 63 1HE LYS 63 10.934 -13.662 -0.218 418 HE3 LYS 63 2HE LYS 63 11.285 -15.000 -1.311 419 HZ1 LYS 63 3HZ LYS 63 13.314 -13.964 -1.136 420 HZ2 LYS 63 1HZ LYS 63 12.653 -12.408 -1.055 421 HZ3 LYS 63 2HZ LYS 63 12.699 -13.231 -2.531 422 H VAL 64 H VAL 64 6.968 -9.937 -2.200 423 HA VAL 64 HA VAL 64 5.577 -11.424 -4.290 424 HB VAL 64 HB VAL 64 3.960 -9.565 -4.639 425 HG11 VAL 64 1HG1 VAL 64 3.896 -11.115 -2.064 426 HG12 VAL 64 2HG1 VAL 64 2.536 -10.136 -2.617 427 HG13 VAL 64 3HG1 VAL 64 3.101 -11.494 -3.591 428 HG21 VAL 64 3HG2 VAL 64 5.509 -8.403 -2.478 429 HG22 VAL 64 1HG2 VAL 64 4.394 -7.635 -3.609 430 HG23 VAL 64 2HG2 VAL 64 3.778 -8.390 -2.139 431 H LYS 65 H LYS 65 5.845 -10.573 -6.369 432 HA LYS 65 HA LYS 65 8.197 -8.916 -6.672 433 HB2 LYS 65 1HB LYS 65 6.463 -10.484 -8.560 434 HB3 LYS 65 2HB LYS 65 7.643 -9.333 -9.173 435 HG2 LYS 65 1HG LYS 65 8.841 -11.287 -9.214 436 HG3 LYS 65 2HG LYS 65 9.298 -10.634 -7.639 437 HD2 LYS 65 1HD LYS 65 7.596 -12.048 -6.574 438 HD3 LYS 65 2HD LYS 65 7.167 -12.711 -8.153 439 HE2 LYS 65 1HE LYS 65 9.255 -13.782 -8.380 440 HE3 LYS 65 2HE LYS 65 9.962 -12.856 -7.057 441 HZ1 LYS 65 3HZ LYS 65 8.563 -14.023 -5.503 442 HZ2 LYS 65 1HZ LYS 65 9.428 -15.147 -6.426 443 HZ3 LYS 65 2HZ LYS 65 7.794 -14.862 -6.754 444 H MET 66 H MET 66 8.194 -6.794 -7.007 445 HA MET 66 HA MET 66 5.655 -5.505 -7.750 446 HB2 MET 66 1HB MET 66 8.046 -4.424 -6.253 447 HB3 MET 66 2HB MET 66 6.675 -3.445 -6.755 448 HG2 MET 66 1HG MET 66 5.249 -4.413 -5.232 449 HG3 MET 66 2HG MET 66 6.216 -5.880 -5.102 450 HE1 MET 66 3HE MET 66 9.159 -4.959 -2.950 451 HE2 MET 66 1HE MET 66 7.875 -6.146 -2.715 452 HE3 MET 66 2HE MET 66 8.552 -5.888 -4.322 453 H ASP 67 H ASP 67 5.508 -4.667 -9.716 454 HA ASP 67 HA ASP 67 7.730 -4.615 -11.499 455 HB2 ASP 67 1HB ASP 67 4.951 -3.457 -11.802 456 HB3 ASP 67 2HB ASP 67 6.129 -3.617 -13.102 457 H CYS 68 H CYS 68 5.786 -2.074 -9.950 458 HA CYS 68 HA CYS 68 6.116 0.180 -9.758 459 HB2 CYS 68 1HB CYS 68 8.795 -1.034 -9.150 460 HB3 CYS 68 2HB CYS 68 8.574 0.710 -9.094 461 HG CYS 68 HG CYS 68 7.225 0.844 -6.862 462 H GLN 69 H GLN 69 6.002 -0.539 -12.410 463 HA GLN 69 HA GLN 69 8.229 0.464 -13.892 464 HB2 GLN 69 1HB GLN 69 6.819 -1.175 -14.930 465 HB3 GLN 69 2HB GLN 69 5.388 -0.184 -14.678 466 HG2 GLN 69 1HG GLN 69 6.086 -0.113 -16.993 467 HG3 GLN 69 2HG GLN 69 6.254 1.473 -16.243 468 HE21 GLN 69 1HE2 GLN 69 7.696 1.955 -17.994 469 HE22 GLN 69 2HE2 GLN 69 9.343 1.440 -17.923 470 H GLU 70 H GLU 70 8.520 2.432 -14.862 471 HA GLU 70 HA GLU 70 7.269 4.676 -13.646 472 HB2 GLU 70 1HB GLU 70 9.569 4.827 -14.367 473 HB3 GLU 70 2HB GLU 70 9.116 4.462 -16.026 474 HG2 GLU 70 1HG GLU 70 9.605 6.841 -15.668 475 HG3 GLU 70 2HG GLU 70 7.958 6.558 -16.226 476 H THR 71 H THR 71 5.760 6.092 -14.423 477 HA THR 71 HA THR 71 4.534 5.472 -17.024 478 HB THR 71 HB THR 71 2.301 6.029 -15.988 479 HG1 THR 71 1HG THR 71 2.141 6.143 -13.808 480 HG21 THR 71 3HG2 THR 71 3.162 3.697 -16.454 481 HG22 THR 71 1HG2 THR 71 1.908 3.815 -15.220 482 HG23 THR 71 2HG2 THR 71 3.594 3.607 -14.746 483 HA PRO 72 HA PRO 72 4.712 9.786 -17.832 484 HB2 PRO 72 1HB PRO 72 2.535 10.105 -19.423 485 HB3 PRO 72 2HB PRO 72 4.008 9.291 -19.963 486 HG2 PRO 72 1HG PRO 72 1.441 8.106 -18.981 487 HG3 PRO 72 2HG PRO 72 2.450 7.609 -20.351 488 HD2 PRO 72 1HD PRO 72 2.506 6.334 -17.963 489 HD3 PRO 72 2HD PRO 72 3.936 6.470 -19.006 490 H GLU 73 H GLU 73 1.891 8.405 -16.355 491 HA GLU 73 HA GLU 73 0.779 11.017 -15.692 492 HB2 GLU 73 1HB GLU 73 -0.795 9.297 -16.361 493 HB3 GLU 73 2HB GLU 73 -0.193 8.215 -15.113 494 HG2 GLU 73 1HG GLU 73 -1.150 9.476 -13.394 495 HG3 GLU 73 2HG GLU 73 -1.393 10.875 -14.439 496 H GLY 74 H GLY 74 2.454 8.328 -14.189 497 HA2 GLY 74 1HA GLY 74 3.448 9.880 -12.067 498 HA3 GLY 74 2HA GLY 74 2.039 8.999 -11.495 499 H TYR 75 H TYR 75 2.342 7.002 -10.749 500 HA TYR 75 HA TYR 75 4.591 5.414 -11.716 501 HB2 TYR 75 1HB TYR 75 4.154 6.010 -8.782 502 HB3 TYR 75 2HB TYR 75 5.348 4.895 -9.435 503 HD1 TYR 75 1HD TYR 75 7.265 5.779 -10.757 504 HD2 TYR 75 2HD TYR 75 4.558 8.355 -8.722 505 HE1 TYR 75 1HE TYR 75 8.891 7.615 -10.931 506 HE2 TYR 75 2HE TYR 75 6.176 10.199 -8.892 507 HH TYR 75 HH TYR 75 8.871 10.100 -10.917 508 H LYS 76 H LYS 76 3.685 3.580 -12.346 509 HA LYS 76 HA LYS 76 1.276 2.598 -11.040 510 HB2 LYS 76 1HB LYS 76 1.560 2.684 -13.556 511 HB3 LYS 76 2HB LYS 76 2.725 1.377 -13.389 512 HG2 LYS 76 1HG LYS 76 1.025 -0.072 -12.468 513 HG3 LYS 76 2HG LYS 76 -0.152 1.243 -12.509 514 HD2 LYS 76 1HD LYS 76 0.204 1.348 -14.995 515 HD3 LYS 76 2HD LYS 76 1.159 -0.129 -14.851 516 HE2 LYS 76 1HE LYS 76 -1.582 -0.055 -13.680 517 HE3 LYS 76 2HE LYS 76 -1.404 -0.223 -15.426 518 HZ1 LYS 76 3HZ LYS 76 -0.681 -2.091 -13.296 519 HZ2 LYS 76 1HZ LYS 76 0.291 -2.067 -14.680 520 HZ3 LYS 76 2HZ LYS 76 -1.363 -2.395 -14.814 521 H VAL 77 H VAL 77 1.222 0.961 -9.634 522 HA VAL 77 HA VAL 77 3.662 -0.664 -9.308 523 HB VAL 77 HB VAL 77 1.713 0.159 -7.149 524 HG11 VAL 77 1HG1 VAL 77 2.537 -1.964 -6.559 525 HG12 VAL 77 2HG1 VAL 77 4.164 -1.581 -7.126 526 HG13 VAL 77 3HG1 VAL 77 3.534 -0.816 -5.667 527 HG21 VAL 77 3HG2 VAL 77 3.223 1.741 -6.425 528 HG22 VAL 77 1HG2 VAL 77 4.590 0.950 -7.209 529 HG23 VAL 77 2HG2 VAL 77 3.423 1.854 -8.174 530 H MET 78 H MET 78 3.442 -2.810 -9.441 531 HA MET 78 HA MET 78 0.727 -3.941 -9.289 532 HB2 MET 78 1HB MET 78 2.905 -4.447 -11.295 533 HB3 MET 78 2HB MET 78 1.675 -5.663 -10.978 534 HG2 MET 78 1HG MET 78 -0.063 -4.197 -11.692 535 HG3 MET 78 2HG MET 78 1.056 -2.840 -11.801 536 HE1 MET 78 3HE MET 78 3.174 -3.044 -12.966 537 HE2 MET 78 1HE MET 78 3.606 -4.245 -14.184 538 HE3 MET 78 2HE MET 78 2.771 -2.766 -14.661 539 H TYR 79 H TYR 79 0.486 -5.850 -8.203 540 HA TYR 79 HA TYR 79 2.760 -7.428 -7.402 541 HB2 TYR 79 1HB TYR 79 2.834 -6.969 -5.149 542 HB3 TYR 79 2HB TYR 79 2.425 -5.374 -5.772 543 HD1 TYR 79 1HD TYR 79 0.894 -8.459 -4.358 544 HD2 TYR 79 2HD TYR 79 0.510 -4.272 -5.014 545 HE1 TYR 79 1HE TYR 79 -1.113 -8.426 -2.937 546 HE2 TYR 79 2HE TYR 79 -1.498 -4.228 -3.594 547 HH TYR 79 HH TYR 79 -2.497 -5.563 -1.776 548 H THR 80 H THR 80 2.168 -9.493 -7.269 549 HA THR 80 HA THR 80 -0.689 -10.099 -6.857 550 HB THR 80 HB THR 80 1.250 -11.695 -8.541 551 HG1 THR 80 1HG THR 80 0.395 -10.685 -10.272 552 HG21 THR 80 3HG2 THR 80 -1.204 -12.456 -9.335 553 HG22 THR 80 1HG2 THR 80 -1.541 -12.089 -7.644 554 HG23 THR 80 2HG2 THR 80 -0.304 -13.277 -8.059 555 HA PRO 81 HA PRO 81 1.027 -12.230 -3.308 556 HB2 PRO 81 1HB PRO 81 -1.377 -12.917 -2.252 557 HB3 PRO 81 2HB PRO 81 -0.686 -11.298 -2.094 558 HG2 PRO 81 1HG PRO 81 -2.760 -12.293 -4.009 559 HG3 PRO 81 2HG PRO 81 -2.719 -10.775 -3.094 560 HD2 PRO 81 1HD PRO 81 -2.026 -10.920 -5.708 561 HD3 PRO 81 2HD PRO 81 -1.274 -9.771 -4.583 562 H MET 82 H MET 82 1.573 -14.319 -3.019 563 HA MET 82 HA MET 82 0.420 -16.290 -4.835 564 HB2 MET 82 1HB MET 82 2.965 -15.864 -4.373 565 HB3 MET 82 2HB MET 82 2.682 -16.878 -2.964 566 HG2 MET 82 1HG MET 82 1.622 -18.505 -4.701 567 HG3 MET 82 2HG MET 82 2.580 -17.581 -5.856 568 HE1 MET 82 3HE MET 82 4.808 -17.133 -5.791 569 HE2 MET 82 1HE MET 82 6.068 -17.832 -4.774 570 HE3 MET 82 2HE MET 82 5.495 -18.707 -6.194 571 H ALA 83 H ALA 83 0.597 -15.513 -1.444 572 HA ALA 83 HA ALA 83 -1.207 -17.768 -0.886 573 HB1 ALA 83 3HB ALA 83 -0.096 -18.318 1.124 574 HB2 ALA 83 1HB ALA 83 1.162 -18.183 -0.105 575 HB3 ALA 83 2HB ALA 83 0.913 -16.874 1.051 576 HA PRO 84 HA PRO 84 -3.808 -14.761 0.990 577 HB2 PRO 84 1HB PRO 84 -5.149 -16.333 2.751 578 HB3 PRO 84 2HB PRO 84 -5.435 -16.383 1.008 579 HG2 PRO 84 1HG PRO 84 -3.781 -18.208 2.709 580 HG3 PRO 84 2HG PRO 84 -4.901 -18.613 1.395 581 HD2 PRO 84 1HD PRO 84 -2.216 -18.537 1.049 582 HD3 PRO 84 2HD PRO 84 -3.358 -18.114 -0.243 583 H GLY 85 H GLY 85 -4.049 -13.505 2.851 584 HA2 GLY 85 1HA GLY 85 -3.429 -13.965 5.437 585 HA3 GLY 85 2HA GLY 85 -1.848 -13.690 4.721 586 H ASN 86 H ASN 86 -1.641 -11.845 6.099 587 HA ASN 86 HA ASN 86 -3.253 -9.538 5.224 588 HB2 ASN 86 1HB ASN 86 -2.526 -8.525 7.443 589 HB3 ASN 86 2HB ASN 86 -3.667 -9.863 7.538 590 HD21 ASN 86 1HD2 ASN 86 -0.347 -8.890 7.995 591 HD22 ASN 86 2HD2 ASN 86 0.106 -10.215 9.007 592 H TYR 87 H TYR 87 -2.227 -8.011 4.120 593 HA TYR 87 HA TYR 87 0.714 -7.921 4.261 594 HB2 TYR 87 1HB TYR 87 -1.172 -7.286 1.991 595 HB3 TYR 87 2HB TYR 87 0.530 -6.837 1.974 596 HD1 TYR 87 1HD TYR 87 -1.406 -9.920 2.855 597 HD2 TYR 87 2HD TYR 87 1.816 -8.216 0.660 598 HE1 TYR 87 1HE TYR 87 -0.835 -12.146 1.979 599 HE2 TYR 87 2HE TYR 87 2.396 -10.437 -0.224 600 HH TYR 87 HH TYR 87 0.367 -13.240 0.373 601 H LEU 88 H LEU 88 1.744 -5.874 4.201 602 HA LEU 88 HA LEU 88 0.015 -3.647 5.061 603 HB2 LEU 88 1HB LEU 88 1.772 -4.796 6.659 604 HB3 LEU 88 2HB LEU 88 2.898 -3.749 5.797 605 HG LEU 88 HG LEU 88 1.217 -1.865 6.462 606 HD11 LEU 88 1HD1 LEU 88 0.389 -2.514 8.852 607 HD12 LEU 88 2HD1 LEU 88 0.428 -4.153 8.204 608 HD13 LEU 88 3HD1 LEU 88 -0.575 -2.925 7.433 609 HD21 LEU 88 3HD2 LEU 88 3.432 -1.789 7.256 610 HD22 LEU 88 1HD2 LEU 88 3.203 -3.211 8.273 611 HD23 LEU 88 2HD2 LEU 88 2.415 -1.690 8.694 612 H ILE 89 H ILE 89 -0.107 -2.104 3.583 613 HA ILE 89 HA ILE 89 2.191 -1.668 1.797 614 HB ILE 89 HB ILE 89 -0.655 -0.779 1.334 615 HG12 ILE 89 1HG1 ILE 89 0.795 -3.209 0.259 616 HG13 ILE 89 2HG1 ILE 89 -0.541 -3.228 1.405 617 HG21 ILE 89 1HG2 ILE 89 0.509 -0.949 -1.098 618 HG22 ILE 89 2HG2 ILE 89 0.441 0.526 -0.135 619 HG23 ILE 89 3HG2 ILE 89 1.890 -0.479 -0.109 620 HD11 ILE 89 3HD1 ILE 89 -0.576 -3.081 -1.478 621 HD12 ILE 89 1HD1 ILE 89 -1.873 -3.466 -0.348 622 HD13 ILE 89 2HD1 ILE 89 -1.516 -1.784 -0.741 623 H SER 90 H SER 90 3.389 0.043 2.261 624 HA SER 90 HA SER 90 2.098 2.367 3.533 625 HB2 SER 90 1HB SER 90 4.927 1.328 3.780 626 HB3 SER 90 2HB SER 90 4.411 2.900 4.390 627 HG SER 90 HG SER 90 3.924 1.779 6.107 628 H VAL 91 H VAL 91 2.017 4.174 2.383 629 HA VAL 91 HA VAL 91 4.003 4.588 0.248 630 HB VAL 91 HB VAL 91 1.045 5.180 0.073 631 HG11 VAL 91 1HG1 VAL 91 2.684 5.440 -2.337 632 HG12 VAL 91 2HG1 VAL 91 1.407 6.485 -1.713 633 HG13 VAL 91 3HG1 VAL 91 3.049 6.627 -1.085 634 HG21 VAL 91 3HG2 VAL 91 2.737 3.263 -1.528 635 HG22 VAL 91 1HG2 VAL 91 1.656 2.803 -0.213 636 HG23 VAL 91 2HG2 VAL 91 0.999 3.520 -1.684 637 H LYS 92 H LYS 92 5.232 6.160 1.115 638 HA LYS 92 HA LYS 92 3.856 8.591 2.055 639 HB2 LYS 92 1HB LYS 92 5.843 8.992 3.501 640 HB3 LYS 92 2HB LYS 92 4.938 7.549 3.938 641 HG2 LYS 92 1HG LYS 92 6.585 6.169 2.760 642 HG3 LYS 92 2HG LYS 92 7.501 7.624 2.356 643 HD2 LYS 92 1HD LYS 92 7.388 7.992 4.970 644 HD3 LYS 92 2HD LYS 92 7.174 6.240 4.973 645 HE2 LYS 92 1HE LYS 92 9.232 6.304 3.348 646 HE3 LYS 92 2HE LYS 92 9.515 7.873 4.102 647 HZ1 LYS 92 3HZ LYS 92 9.707 6.869 6.217 648 HZ2 LYS 92 1HZ LYS 92 10.664 5.945 5.171 649 HZ3 LYS 92 2HZ LYS 92 9.147 5.375 5.655 650 H TYR 93 H TYR 93 4.676 10.575 1.410 651 HA TYR 93 HA TYR 93 6.891 10.532 -0.519 652 HB2 TYR 93 1HB TYR 93 5.046 10.607 -1.971 653 HB3 TYR 93 2HB TYR 93 4.135 11.672 -0.907 654 HD1 TYR 93 1HD TYR 93 7.398 11.705 -2.744 655 HD2 TYR 93 2HD TYR 93 3.905 13.852 -1.607 656 HE1 TYR 93 1HE TYR 93 8.181 13.648 -4.031 657 HE2 TYR 93 2HE TYR 93 4.678 15.801 -2.892 658 HH TYR 93 HH TYR 93 7.790 15.756 -4.605 659 H GLY 94 H GLY 94 8.199 12.333 -0.535 660 HA2 GLY 94 1HA GLY 94 9.041 14.386 0.120 661 HA3 GLY 94 2HA GLY 94 7.490 14.740 0.867 662 H GLY 95 H GLY 95 9.586 11.970 1.528 663 HA2 GLY 95 1HA GLY 95 11.151 11.943 3.386 664 HA3 GLY 95 2HA GLY 95 10.116 13.107 4.200 665 HA PRO 96 HA PRO 96 9.160 8.957 5.976 666 HB2 PRO 96 1HB PRO 96 8.994 9.847 8.535 667 HB3 PRO 96 2HB PRO 96 10.520 9.374 7.780 668 HG2 PRO 96 1HG PRO 96 9.372 12.110 8.180 669 HG3 PRO 96 2HG PRO 96 11.038 11.551 8.413 670 HD2 PRO 96 1HD PRO 96 10.252 12.901 6.202 671 HD3 PRO 96 2HD PRO 96 11.526 11.666 6.164 672 H ASN 97 H ASN 97 7.709 12.128 6.290 673 HA ASN 97 HA ASN 97 5.323 11.439 7.572 674 HB2 ASN 97 1HB ASN 97 5.571 13.560 5.437 675 HB3 ASN 97 2HB ASN 97 4.459 13.528 6.803 676 HD21 ASN 97 1HD2 ASN 97 5.239 13.981 8.875 677 HD22 ASN 97 2HD2 ASN 97 6.736 14.807 9.119 678 H HIS 98 H HIS 98 3.998 9.867 6.941 679 HA HIS 98 HA HIS 98 3.721 9.113 4.179 680 HB2 HIS 98 1HB HIS 98 1.814 7.660 5.307 681 HB3 HIS 98 2HB HIS 98 3.514 7.241 5.497 682 HD2 HIS 98 2HD HIS 98 1.105 9.569 7.633 683 HE1 HIS 98 1HE HIS 98 3.393 7.094 10.209 684 HE2 HIS 98 2HE HIS 98 1.577 8.833 10.067 685 H ILE 99 H ILE 99 1.609 8.954 3.106 686 HA ILE 99 HA ILE 99 0.194 11.454 3.310 687 HB ILE 99 HB ILE 99 -1.005 10.779 1.342 688 HG12 ILE 99 1HG1 ILE 99 0.314 8.071 1.491 689 HG13 ILE 99 2HG1 ILE 99 -1.282 8.375 2.170 690 HG21 ILE 99 1HG2 ILE 99 1.882 9.924 1.176 691 HG22 ILE 99 2HG2 ILE 99 0.855 10.330 -0.198 692 HG23 ILE 99 3HG2 ILE 99 1.264 11.566 0.992 693 HD11 ILE 99 3HD1 ILE 99 -1.416 7.386 -0.048 694 HD12 ILE 99 1HD1 ILE 99 -2.106 9.008 -0.027 695 HD13 ILE 99 2HD1 ILE 99 -0.503 8.740 -0.713 696 H VAL 100 H VAL 100 -2.329 11.208 2.939 697 HA VAL 100 HA VAL 100 -3.373 10.191 5.382 698 HB VAL 100 HB VAL 100 -4.247 12.177 4.015 699 HG11 VAL 100 1HG1 VAL 100 -6.049 10.212 2.684 700 HG12 VAL 100 2HG1 VAL 100 -5.627 11.858 2.209 701 HG13 VAL 100 3HG1 VAL 100 -4.472 10.547 1.970 702 HG21 VAL 100 3HG2 VAL 100 -6.566 10.484 4.712 703 HG22 VAL 100 1HG2 VAL 100 -5.356 10.720 5.974 704 HG23 VAL 100 2HG2 VAL 100 -6.149 12.114 5.241 705 H GLY 101 H GLY 101 -4.990 8.570 5.663 706 HA2 GLY 101 1HA GLY 101 -6.162 6.631 5.126 707 HA3 GLY 101 2HA GLY 101 -5.531 6.733 3.489 708 H SER 102 H SER 102 -2.761 6.902 4.254 709 HA SER 102 HA SER 102 -2.273 4.083 4.618 710 HB2 SER 102 1HB SER 102 -0.498 6.457 4.070 711 HB3 SER 102 2HB SER 102 0.169 4.862 4.414 712 HG SER 102 HG SER 102 -0.527 5.694 2.100 713 HA PRO 103 HA PRO 103 -0.166 3.029 5.101 714 HB2 PRO 103 1HB PRO 103 -0.140 0.827 6.689 715 HB3 PRO 103 2HB PRO 103 1.162 2.023 6.682 716 HG2 PRO 103 1HG PRO 103 -1.120 1.718 8.595 717 HG3 PRO 103 2HG PRO 103 0.586 2.063 8.935 718 HD2 PRO 103 1HD PRO 103 -1.315 3.992 8.915 719 HD3 PRO 103 2HD PRO 103 0.364 4.301 8.428 720 H PHE 104 H PHE 104 -1.189 1.467 3.865 721 HA PHE 104 HA PHE 104 -4.056 1.253 4.267 722 HB2 PHE 104 1HB PHE 104 -2.302 0.280 2.002 723 HB3 PHE 104 2HB PHE 104 -4.062 0.228 2.019 724 HD1 PHE 104 2HD PHE 104 -5.150 2.615 2.617 725 HD2 PHE 104 1HD PHE 104 -1.334 1.990 0.837 726 HE1 PHE 104 2HE PHE 104 -5.225 4.883 1.668 727 HE2 PHE 104 1HE PHE 104 -1.403 4.258 -0.114 728 HZ PHE 104 HZ PHE 104 -3.350 5.708 0.299 729 H LYS 105 H LYS 105 -5.103 -0.494 4.983 730 HA LYS 105 HA LYS 105 -3.518 -2.909 5.530 731 HB2 LYS 105 1HB LYS 105 -6.087 -1.909 6.772 732 HB3 LYS 105 2HB LYS 105 -5.338 -3.453 7.155 733 HG2 LYS 105 1HG LYS 105 -3.749 -0.946 7.435 734 HG3 LYS 105 2HG LYS 105 -4.933 -1.375 8.672 735 HD2 LYS 105 1HD LYS 105 -3.026 -3.472 7.772 736 HD3 LYS 105 2HD LYS 105 -2.413 -2.182 8.810 737 HE2 LYS 105 1HE LYS 105 -3.144 -4.116 10.117 738 HE3 LYS 105 2HE LYS 105 -4.118 -2.691 10.472 739 HZ1 LYS 105 3HZ LYS 105 -5.395 -4.795 10.184 740 HZ2 LYS 105 1HZ LYS 105 -4.947 -4.793 8.552 741 HZ3 LYS 105 2HZ LYS 105 -5.892 -3.534 9.171 742 H ALA 106 H ALA 106 -3.732 -4.368 3.961 743 HA ALA 106 HA ALA 106 -6.405 -4.790 2.795 744 HB1 ALA 106 3HB ALA 106 -5.426 -5.425 0.774 745 HB2 ALA 106 1HB ALA 106 -4.449 -4.057 1.307 746 HB3 ALA 106 2HB ALA 106 -3.851 -5.703 1.516 747 H LYS 107 H LYS 107 -6.929 -7.022 2.186 748 HA LYS 107 HA LYS 107 -5.577 -9.031 3.856 749 HB2 LYS 107 1HB LYS 107 -7.688 -8.245 4.932 750 HB3 LYS 107 2HB LYS 107 -8.573 -8.801 3.518 751 HG2 LYS 107 1HG LYS 107 -8.283 -11.016 4.035 752 HG3 LYS 107 2HG LYS 107 -6.814 -10.718 4.967 753 HD2 LYS 107 1HD LYS 107 -8.679 -11.340 6.421 754 HD3 LYS 107 2HD LYS 107 -8.142 -9.689 6.741 755 HE2 LYS 107 1HE LYS 107 -10.466 -9.520 6.716 756 HE3 LYS 107 2HE LYS 107 -9.991 -8.987 5.104 757 HZ1 LYS 107 3HZ LYS 107 -11.249 -11.529 5.911 758 HZ2 LYS 107 1HZ LYS 107 -10.368 -11.428 4.470 759 HZ3 LYS 107 2HZ LYS 107 -11.723 -10.444 4.703 760 H VAL 108 H VAL 108 -4.939 -10.733 2.718 761 HA VAL 108 HA VAL 108 -6.054 -11.145 0.042 762 HB VAL 108 HB VAL 108 -3.699 -12.646 1.136 763 HG11 VAL 108 1HG1 VAL 108 -5.030 -12.375 -1.396 764 HG12 VAL 108 2HG1 VAL 108 -3.340 -11.888 -1.534 765 HG13 VAL 108 3HG1 VAL 108 -3.750 -13.489 -0.919 766 HG21 VAL 108 3HG2 VAL 108 -2.771 -10.622 1.560 767 HG22 VAL 108 1HG2 VAL 108 -2.473 -10.662 -0.178 768 HG23 VAL 108 2HG2 VAL 108 -3.855 -9.771 0.460 769 H THR 109 H THR 109 -7.262 -12.862 -0.480 770 HA THR 109 HA THR 109 -7.303 -15.191 1.294 771 HB THR 109 HB THR 109 -9.783 -15.273 1.208 772 HG1 THR 109 1HG THR 109 -9.862 -13.781 -0.672 773 HG21 THR 109 3HG2 THR 109 -8.403 -14.170 3.076 774 HG22 THR 109 1HG2 THR 109 -10.128 -13.812 3.006 775 HG23 THR 109 2HG2 THR 109 -8.958 -12.641 2.396 776 H GLY 110 H GLY 110 -8.493 -17.045 0.306 777 HA2 GLY 110 1HA GLY 110 -9.492 -17.890 -1.803 778 HA3 GLY 110 2HA GLY 110 -8.258 -16.960 -2.640 779 H GLN 111 H GLN 111 -8.835 -19.822 -2.782 780 HA GLN 111 HA GLN 111 -7.284 -21.550 -1.419 781 HB2 GLN 111 1HB GLN 111 -7.204 -22.950 -3.342 782 HB3 GLN 111 2HB GLN 111 -8.716 -22.057 -3.430 783 HG2 GLN 111 1HG GLN 111 -7.372 -20.411 -4.907 784 HG3 GLN 111 2HG GLN 111 -6.247 -21.757 -5.080 785 HE21 GLN 111 1HE2 GLN 111 -8.630 -20.265 -6.606 786 HE22 GLN 111 2HE2 GLN 111 -9.350 -21.581 -7.463 787 H ARG 112 H ARG 112 -5.179 -21.988 -1.098 788 HA ARG 112 HA ARG 112 -3.217 -20.071 -1.722 789 HB2 ARG 112 1HB ARG 112 -3.204 -21.725 0.202 790 HB3 ARG 112 2HB ARG 112 -2.679 -22.938 -0.957 791 HG2 ARG 112 1HG ARG 112 -0.678 -21.640 -1.436 792 HG3 ARG 112 2HG ARG 112 -1.211 -20.391 -0.308 793 HD2 ARG 112 1HD ARG 112 0.439 -21.842 0.734 794 HD3 ARG 112 2HD ARG 112 -1.129 -22.016 1.522 795 HE ARG 112 HE ARG 112 -0.768 -23.957 -0.527 796 HH11 ARG 112 1HH1 ARG 112 0.111 -23.169 2.748 797 HH12 ARG 112 2HH1 ARG 112 0.369 -24.818 3.214 798 HH21 ARG 112 1HH2 ARG 112 -0.432 -26.131 0.074 799 HH22 ARG 112 2HH2 ARG 112 0.060 -26.502 1.692 800 H LEU 113 H LEU 113 -1.441 -20.153 -3.128 801 HA LEU 113 HA LEU 113 -1.705 -22.068 -5.352 802 HB2 LEU 113 1HB LEU 113 -0.610 -19.294 -5.666 803 HB3 LEU 113 2HB LEU 113 -1.174 -20.403 -6.915 804 HG LEU 113 HG LEU 113 -2.931 -18.982 -4.914 805 HD11 LEU 113 1HD1 LEU 113 -2.222 -18.410 -7.773 806 HD12 LEU 113 2HD1 LEU 113 -2.180 -17.325 -6.384 807 HD13 LEU 113 3HD1 LEU 113 -3.728 -17.839 -7.054 808 HD21 LEU 113 3HD2 LEU 113 -4.226 -20.035 -7.263 809 HD22 LEU 113 1HD2 LEU 113 -4.596 -20.303 -5.559 810 HD23 LEU 113 2HD2 LEU 113 -3.402 -21.316 -6.371 811 H VAL 114 H VAL 114 -0.141 -23.496 -4.703 812 HA VAL 114 HA VAL 114 2.545 -22.454 -4.155 813 HB VAL 114 HB VAL 114 3.042 -24.852 -3.526 814 HG11 VAL 114 1HG1 VAL 114 2.587 -23.106 -1.869 815 HG12 VAL 114 2HG1 VAL 114 0.861 -23.459 -1.975 816 HG13 VAL 114 3HG1 VAL 114 1.974 -24.675 -1.346 817 HG21 VAL 114 3HG2 VAL 114 1.457 -26.475 -3.520 818 HG22 VAL 114 1HG2 VAL 114 0.144 -25.344 -3.195 819 HG23 VAL 114 2HG2 VAL 114 0.795 -25.493 -4.827 820 H SER 115 H SER 115 4.174 -22.666 -5.558 821 HA SER 115 HA SER 115 3.695 -24.273 -7.980 822 HB2 SER 115 1HB SER 115 3.944 -21.747 -8.215 823 HB3 SER 115 2HB SER 115 5.631 -21.967 -7.753 824 HG SER 115 HG SER 115 5.721 -22.139 -9.897 825 HA PRO 116 HA PRO 116 7.157 -26.359 -5.734 826 HB2 PRO 116 1HB PRO 116 6.313 -28.872 -6.319 827 HB3 PRO 116 2HB PRO 116 5.721 -27.961 -4.926 828 HG2 PRO 116 1HG PRO 116 4.450 -28.361 -7.607 829 HG3 PRO 116 2HG PRO 116 3.708 -28.417 -5.997 830 HD2 PRO 116 1HD PRO 116 3.517 -26.254 -7.615 831 HD3 PRO 116 2HD PRO 116 3.565 -26.122 -5.845 832 H GLY 117 H GLY 117 5.682 -27.295 -8.844 833 HA2 GLY 117 1HA GLY 117 7.617 -26.743 -10.599 834 HA3 GLY 117 2HA GLY 117 8.260 -28.196 -9.848 835 H SER 118 H SER 118 6.544 -27.084 -12.417 836 HA SER 118 HA SER 118 5.441 -29.751 -12.929 837 HB2 SER 118 1HB SER 118 3.928 -27.152 -13.272 838 HB3 SER 118 2HB SER 118 3.391 -28.707 -13.907 839 HG SER 118 HG SER 118 3.042 -27.719 -11.467 840 H ALA 119 H ALA 119 4.809 -29.991 -15.273 841 HA ALA 119 HA ALA 119 6.669 -28.461 -16.975 842 HB1 ALA 119 3HB ALA 119 7.651 -30.388 -17.472 843 HB2 ALA 119 1HB ALA 119 6.455 -31.290 -16.541 844 HB3 ALA 119 2HB ALA 119 6.150 -30.909 -18.236 845 H ASN 120 H ASN 120 5.582 -27.147 -18.278 846 HA ASN 120 HA ASN 120 2.845 -27.752 -19.041 847 HB2 ASN 120 1HB ASN 120 3.449 -25.467 -18.324 848 HB3 ASN 120 2HB ASN 120 4.560 -25.342 -19.685 849 HD21 ASN 120 1HD2 ASN 120 3.533 -23.645 -20.654 850 HD22 ASN 120 2HD2 ASN 120 1.972 -23.773 -21.384 851 H GLU 121 H GLU 121 2.149 -28.266 -21.059 852 HA GLU 121 HA GLU 121 4.006 -29.421 -22.869 853 HB2 GLU 121 1HB GLU 121 1.623 -30.154 -22.542 854 HB3 GLU 121 2HB GLU 121 1.121 -28.714 -23.417 855 HG2 GLU 121 1HG GLU 121 1.106 -30.231 -25.109 856 HG3 GLU 121 2HG GLU 121 2.763 -29.644 -25.242 857 H THR 122 H THR 122 5.410 -28.129 -23.896 858 HA THR 122 HA THR 122 4.617 -25.525 -24.882 859 HB THR 122 HB THR 122 7.255 -26.909 -25.363 860 HG1 THR 122 1HG THR 122 7.727 -26.557 -23.335 861 HG21 THR 122 3HG2 THR 122 8.097 -24.604 -25.518 862 HG22 THR 122 1HG2 THR 122 6.461 -23.995 -25.271 863 HG23 THR 122 2HG2 THR 122 6.847 -24.922 -26.721 864 H SER 123 H SER 123 4.459 -24.905 -27.017 865 HA SER 123 HA SER 123 3.263 -26.433 -28.868 866 HB2 SER 123 1HB SER 123 3.487 -24.133 -29.366 867 HB3 SER 123 2HB SER 123 5.246 -24.199 -29.273 868 HG SER 123 HG SER 123 4.259 -24.160 -31.445 869 H SER 124 H SER 124 3.714 -28.111 -30.145 870 HA SER 124 HA SER 124 6.481 -29.084 -30.203 871 HB2 SER 124 1HB SER 124 4.686 -30.602 -29.342 872 HB3 SER 124 2HB SER 124 3.955 -30.576 -30.946 873 HG SER 124 HG SER 124 6.159 -31.297 -31.647 874 H ILE 125 H ILE 125 7.434 -29.795 -32.150 875 HA ILE 125 HA ILE 125 7.363 -28.180 -34.310 876 HB ILE 125 HB ILE 125 9.032 -29.948 -34.036 877 HG12 ILE 125 1HG1 ILE 125 7.733 -30.479 -36.689 878 HG13 ILE 125 2HG1 ILE 125 8.348 -28.873 -36.317 879 HG21 ILE 125 1HG2 ILE 125 7.649 -31.767 -33.300 880 HG22 ILE 125 2HG2 ILE 125 6.787 -31.791 -34.838 881 HG23 ILE 125 3HG2 ILE 125 8.487 -32.257 -34.772 882 HD11 ILE 125 3HD1 ILE 125 9.763 -31.253 -37.115 883 HD12 ILE 125 1HD1 ILE 125 10.307 -29.577 -37.069 884 HD13 ILE 125 2HD1 ILE 125 10.416 -30.579 -35.622 Start of MODEL 6 1 H1 GLY 1 H GLY 1 -15.664 50.614 18.867 2 HA2 GLY 1 1HA GLY 1 -17.121 49.641 20.652 3 HA3 GLY 1 2HA GLY 1 -18.441 50.501 19.873 4 H SER 2 H SER 2 -17.677 47.555 20.378 5 HA SER 2 HA SER 2 -18.940 46.505 18.083 6 HB2 SER 2 1HB SER 2 -17.049 45.200 17.156 7 HB3 SER 2 2HB SER 2 -16.800 46.938 16.990 8 HG SER 2 HG SER 2 -15.663 45.231 18.952 9 H SER 3 H SER 3 -19.569 44.386 18.374 10 HA SER 3 HA SER 3 -18.393 42.633 20.273 11 HB2 SER 3 1HB SER 3 -20.092 42.619 21.982 12 HB3 SER 3 2HB SER 3 -19.527 44.279 21.796 13 HG SER 3 HG SER 3 -21.693 44.457 21.773 14 H GLY 4 H GLY 4 -19.942 40.714 20.708 15 HA2 GLY 4 1HA GLY 4 -21.636 39.266 19.939 16 HA3 GLY 4 2HA GLY 4 -21.860 40.307 18.541 17 H SER 5 H SER 5 -21.257 37.320 19.046 18 HA SER 5 HA SER 5 -19.357 37.100 16.838 19 HB2 SER 5 1HB SER 5 -17.950 36.861 18.805 20 HB3 SER 5 2HB SER 5 -19.044 35.655 19.480 21 HG SER 5 HG SER 5 -17.848 35.275 16.956 22 H SER 6 H SER 6 -19.948 35.605 15.393 23 HA SER 6 HA SER 6 -21.893 33.555 16.219 24 HB2 SER 6 1HB SER 6 -21.951 35.181 13.665 25 HB3 SER 6 2HB SER 6 -23.019 33.824 14.025 26 HG SER 6 HG SER 6 -23.169 36.410 14.846 27 H GLY 7 H GLY 7 -21.811 31.576 15.088 28 HA2 GLY 7 1HA GLY 7 -19.190 30.786 14.305 29 HA3 GLY 7 2HA GLY 7 -20.637 29.793 14.228 30 H PHE 8 H PHE 8 -18.948 32.426 12.554 31 HA PHE 8 HA PHE 8 -20.289 31.657 10.063 32 HB2 PHE 8 1HB PHE 8 -18.879 34.130 10.993 33 HB3 PHE 8 2HB PHE 8 -19.004 33.805 9.267 34 HD1 PHE 8 2HD PHE 8 -21.393 33.279 8.384 35 HD2 PHE 8 1HD PHE 8 -20.580 35.253 12.066 36 HE1 PHE 8 2HE PHE 8 -23.661 34.233 8.369 37 HE2 PHE 8 1HE PHE 8 -22.847 36.210 12.058 38 HZ PHE 8 HZ PHE 8 -24.390 35.701 10.207 39 H LYS 9 H LYS 9 -18.739 32.063 8.077 40 HA LYS 9 HA LYS 9 -16.972 29.979 7.894 41 HB2 LYS 9 1HB LYS 9 -16.072 31.043 5.906 42 HB3 LYS 9 2HB LYS 9 -17.814 31.274 5.968 43 HG2 LYS 9 1HG LYS 9 -17.342 33.544 6.980 44 HG3 LYS 9 2HG LYS 9 -15.655 33.284 6.528 45 HD2 LYS 9 1HD LYS 9 -16.268 33.078 4.200 46 HD3 LYS 9 2HD LYS 9 -17.982 33.187 4.609 47 HE2 LYS 9 1HE LYS 9 -17.293 35.324 3.806 48 HE3 LYS 9 2HE LYS 9 -17.528 35.460 5.548 49 HZ1 LYS 9 3HZ LYS 9 -14.934 34.815 5.401 50 HZ2 LYS 9 1HZ LYS 9 -15.513 36.403 5.481 51 HZ3 LYS 9 2HZ LYS 9 -15.109 35.725 3.985 52 H VAL 10 H VAL 10 -14.605 29.980 7.644 53 HA VAL 10 HA VAL 10 -13.223 32.019 9.235 54 HB VAL 10 HB VAL 10 -12.919 29.046 9.686 55 HG11 VAL 10 1HG1 VAL 10 -11.500 31.397 10.932 56 HG12 VAL 10 2HG1 VAL 10 -11.388 29.733 11.508 57 HG13 VAL 10 3HG1 VAL 10 -10.789 30.154 9.903 58 HG21 VAL 10 3HG2 VAL 10 -14.921 29.751 10.743 59 HG22 VAL 10 1HG2 VAL 10 -13.693 29.672 12.007 60 HG23 VAL 10 2HG2 VAL 10 -14.169 31.232 11.337 61 H ARG 11 H ARG 11 -11.069 32.340 8.701 62 HA ARG 11 HA ARG 11 -10.275 31.200 6.126 63 HB2 ARG 11 1HB ARG 11 -8.835 33.058 5.863 64 HB3 ARG 11 2HB ARG 11 -10.323 33.703 6.543 65 HG2 ARG 11 1HG ARG 11 -9.358 34.163 8.575 66 HG3 ARG 11 2HG ARG 11 -8.100 32.942 8.374 67 HD2 ARG 11 1HD ARG 11 -7.259 34.428 6.452 68 HD3 ARG 11 2HD ARG 11 -8.283 35.678 7.158 69 HE ARG 11 HE ARG 11 -6.584 34.502 9.111 70 HH11 ARG 11 1HH1 ARG 11 -6.630 36.772 6.472 71 HH12 ARG 11 2HH1 ARG 11 -5.304 37.706 7.081 72 HH21 ARG 11 1HH2 ARG 11 -4.838 35.724 9.924 73 HH22 ARG 11 2HH2 ARG 11 -4.285 37.109 9.044 74 H VAL 12 H VAL 12 -8.307 30.184 5.791 75 HA VAL 12 HA VAL 12 -6.732 29.544 8.193 76 HB VAL 12 HB VAL 12 -7.666 27.614 6.070 77 HG11 VAL 12 1HG1 VAL 12 -6.272 25.931 7.083 78 HG12 VAL 12 2HG1 VAL 12 -5.264 27.297 6.599 79 HG13 VAL 12 3HG1 VAL 12 -5.701 27.079 8.294 80 HG21 VAL 12 3HG2 VAL 12 -8.653 26.412 7.928 81 HG22 VAL 12 1HG2 VAL 12 -7.990 27.583 9.069 82 HG23 VAL 12 2HG2 VAL 12 -9.231 28.078 7.918 83 H GLY 13 H GLY 13 -4.539 29.457 7.933 84 HA2 GLY 13 1HA GLY 13 -3.544 30.275 5.281 85 HA3 GLY 13 2HA GLY 13 -2.750 30.626 6.809 86 H GLU 14 H GLU 14 -1.547 29.424 4.505 87 HA GLU 14 HA GLU 14 -1.057 26.682 5.451 88 HB2 GLU 14 1HB GLU 14 -0.697 27.968 2.748 89 HB3 GLU 14 2HB GLU 14 0.001 26.405 3.149 90 HG2 GLU 14 1HG GLU 14 -2.932 27.071 3.245 91 HG3 GLU 14 2HG GLU 14 -2.120 26.214 1.936 92 HA PRO 15 HA PRO 15 3.044 27.640 6.683 93 HB2 PRO 15 1HB PRO 15 4.346 25.344 6.050 94 HB3 PRO 15 2HB PRO 15 3.213 25.464 7.401 95 HG2 PRO 15 1HG PRO 15 2.768 24.382 4.645 96 HG3 PRO 15 2HG PRO 15 2.235 23.726 6.204 97 HD2 PRO 15 1HD PRO 15 0.588 25.127 4.573 98 HD3 PRO 15 2HD PRO 15 0.444 25.171 6.342 99 H GLY 16 H GLY 16 5.188 28.077 5.936 100 HA2 GLY 16 1HA GLY 16 5.344 29.181 3.372 101 HA3 GLY 16 2HA GLY 16 6.721 28.840 4.409 102 H GLN 17 H GLN 17 7.810 26.847 4.208 103 HA GLN 17 HA GLN 17 8.466 25.932 1.785 104 HB2 GLN 17 1HB GLN 17 9.143 23.817 2.782 105 HB3 GLN 17 2HB GLN 17 9.513 25.149 3.869 106 HG2 GLN 17 1HG GLN 17 6.969 23.606 4.158 107 HG3 GLN 17 2HG GLN 17 8.482 22.994 4.826 108 HE21 GLN 17 1HE2 GLN 17 9.729 24.997 5.910 109 HE22 GLN 17 2HE2 GLN 17 8.778 25.812 7.100 110 H ALA 18 H ALA 18 7.792 24.439 0.274 111 HA ALA 18 HA ALA 18 4.955 23.733 0.416 112 HB1 ALA 18 3HB ALA 18 6.794 24.450 -1.719 113 HB2 ALA 18 1HB ALA 18 5.828 23.023 -2.098 114 HB3 ALA 18 2HB ALA 18 5.033 24.537 -1.663 115 H GLY 19 H GLY 19 4.553 21.601 -0.999 116 HA2 GLY 19 1HA GLY 19 5.345 19.360 -1.438 117 HA3 GLY 19 2HA GLY 19 6.424 19.525 -0.060 118 H ASN 20 H ASN 20 3.016 19.279 -0.978 119 HA ASN 20 HA ASN 20 2.367 18.396 1.741 120 HB2 ASN 20 1HB ASN 20 0.943 20.160 0.833 121 HB3 ASN 20 2HB ASN 20 0.562 19.159 -0.565 122 HD21 ASN 20 1HD2 ASN 20 -1.607 19.862 0.424 123 HD22 ASN 20 2HD2 ASN 20 -2.326 18.730 1.513 124 HA PRO 21 HA PRO 21 2.647 14.271 -0.071 125 HB2 PRO 21 1HB PRO 21 2.645 12.987 2.321 126 HB3 PRO 21 2HB PRO 21 4.091 13.737 1.634 127 HG2 PRO 21 1HG PRO 21 2.221 14.788 3.723 128 HG3 PRO 21 2HG PRO 21 3.993 14.840 3.679 129 HD2 PRO 21 1HD PRO 21 2.456 16.967 3.011 130 HD3 PRO 21 2HD PRO 21 4.029 16.651 2.253 131 H ALA 22 H ALA 22 0.333 15.576 2.199 132 HA ALA 22 HA ALA 22 -1.461 13.424 2.332 133 HB1 ALA 22 3HB ALA 22 -2.349 16.287 2.403 134 HB2 ALA 22 1HB ALA 22 -2.981 14.905 3.299 135 HB3 ALA 22 2HB ALA 22 -1.407 15.582 3.717 136 H LEU 23 H LEU 23 -1.273 16.157 0.080 137 HA LEU 23 HA LEU 23 -3.594 15.814 -1.349 138 HB2 LEU 23 1HB LEU 23 -0.863 16.760 -2.094 139 HB3 LEU 23 2HB LEU 23 -2.084 16.569 -3.351 140 HG LEU 23 HG LEU 23 -2.358 18.341 -0.923 141 HD11 LEU 23 1HD1 LEU 23 -0.845 19.544 -2.117 142 HD12 LEU 23 2HD1 LEU 23 -2.313 20.054 -2.950 143 HD13 LEU 23 3HD1 LEU 23 -1.292 18.798 -3.651 144 HD21 LEU 23 3HD2 LEU 23 -4.497 18.575 -1.469 145 HD22 LEU 23 1HD2 LEU 23 -4.299 17.271 -2.640 146 HD23 LEU 23 2HD2 LEU 23 -4.077 18.948 -3.141 147 H VAL 24 H VAL 24 -0.620 13.959 -1.542 148 HA VAL 24 HA VAL 24 -1.213 12.540 -3.912 149 HB VAL 24 HB VAL 24 0.521 11.715 -1.578 150 HG11 VAL 24 1HG1 VAL 24 -0.127 9.799 -2.941 151 HG12 VAL 24 2HG1 VAL 24 0.418 10.638 -4.395 152 HG13 VAL 24 3HG1 VAL 24 1.583 10.175 -3.153 153 HG21 VAL 24 3HG2 VAL 24 2.364 12.459 -3.116 154 HG22 VAL 24 1HG2 VAL 24 1.122 13.178 -4.141 155 HG23 VAL 24 2HG2 VAL 24 1.345 13.755 -2.490 156 H SER 25 H SER 25 -2.413 10.772 -4.299 157 HA SER 25 HA SER 25 -3.570 9.347 -1.997 158 HB2 SER 25 1HB SER 25 -5.148 10.986 -3.211 159 HB3 SER 25 2HB SER 25 -5.116 9.826 -4.539 160 HG SER 25 HG SER 25 -6.335 9.659 -2.067 161 H ALA 26 H ALA 26 -4.459 7.185 -2.611 162 HA ALA 26 HA ALA 26 -3.249 5.981 -4.973 163 HB1 ALA 26 3HB ALA 26 -2.055 4.294 -3.807 164 HB2 ALA 26 1HB ALA 26 -1.585 5.837 -3.094 165 HB3 ALA 26 2HB ALA 26 -2.733 4.791 -2.257 166 H TYR 27 H TYR 27 -4.465 4.380 -5.816 167 HA TYR 27 HA TYR 27 -6.316 2.859 -4.224 168 HB2 TYR 27 1HB TYR 27 -8.317 3.560 -5.562 169 HB3 TYR 27 2HB TYR 27 -7.692 4.810 -4.492 170 HD1 TYR 27 1HD TYR 27 -6.575 6.783 -5.402 171 HD2 TYR 27 2HD TYR 27 -8.188 3.794 -7.965 172 HE1 TYR 27 1HE TYR 27 -6.415 8.335 -7.303 173 HE2 TYR 27 2HE TYR 27 -8.031 5.338 -9.873 174 HH TYR 27 HH TYR 27 -7.002 8.691 -9.444 175 H GLY 28 H GLY 28 -7.429 1.198 -5.491 176 HA2 GLY 28 1HA GLY 28 -7.150 0.682 -8.179 177 HA3 GLY 28 2HA GLY 28 -5.677 0.065 -7.446 178 H THR 29 H THR 29 -6.543 -1.977 -8.370 179 HA THR 29 HA THR 29 -8.793 -3.150 -6.955 180 HB THR 29 HB THR 29 -7.029 -4.631 -8.887 181 HG1 THR 29 1HG THR 29 -7.871 -3.561 -10.531 182 HG21 THR 29 3HG2 THR 29 -8.596 -6.207 -8.725 183 HG22 THR 29 1HG2 THR 29 -9.862 -5.049 -9.129 184 HG23 THR 29 2HG2 THR 29 -9.361 -5.258 -7.451 185 H GLY 30 H GLY 30 -5.400 -2.994 -6.653 186 HA2 GLY 30 1HA GLY 30 -5.179 -5.509 -5.201 187 HA3 GLY 30 2HA GLY 30 -3.871 -4.391 -5.556 188 H LEU 31 H LEU 31 -5.604 -2.141 -4.522 189 HA LEU 31 HA LEU 31 -4.750 -2.378 -1.765 190 HB2 LEU 31 1HB LEU 31 -5.957 -0.149 -3.381 191 HB3 LEU 31 2HB LEU 31 -5.675 -0.013 -1.646 192 HG LEU 31 HG LEU 31 -3.501 -0.562 -3.661 193 HD11 LEU 31 1HD1 LEU 31 -2.888 1.839 -3.203 194 HD12 LEU 31 2HD1 LEU 31 -4.494 2.029 -2.501 195 HD13 LEU 31 3HD1 LEU 31 -4.321 1.590 -4.200 196 HD21 LEU 31 3HD2 LEU 31 -3.319 0.422 -0.819 197 HD22 LEU 31 1HD2 LEU 31 -1.995 -0.063 -1.879 198 HD23 LEU 31 2HD2 LEU 31 -3.139 -1.269 -1.289 199 H GLU 32 H GLU 32 -7.680 -2.597 -3.595 200 HA GLU 32 HA GLU 32 -9.457 -2.184 -1.384 201 HB2 GLU 32 1HB GLU 32 -11.193 -3.048 -2.949 202 HB3 GLU 32 2HB GLU 32 -10.263 -1.705 -3.598 203 HG2 GLU 32 1HG GLU 32 -8.957 -3.197 -4.956 204 HG3 GLU 32 2HG GLU 32 -9.738 -4.599 -4.227 205 H GLY 33 H GLY 33 -7.961 -4.953 -2.946 206 HA2 GLY 33 1HA GLY 33 -8.463 -6.591 -0.639 207 HA3 GLY 33 2HA GLY 33 -9.421 -7.071 -2.032 208 H GLY 34 H GLY 34 -7.667 -8.855 -0.953 209 HA2 GLY 34 1HA GLY 34 -5.313 -8.779 -2.723 210 HA3 GLY 34 2HA GLY 34 -5.450 -9.741 -1.259 211 H THR 35 H THR 35 -5.837 -9.679 -4.633 212 HA THR 35 HA THR 35 -7.425 -12.136 -4.667 213 HB THR 35 HB THR 35 -6.419 -10.780 -7.145 214 HG1 THR 35 1HG THR 35 -8.826 -10.026 -5.837 215 HG21 THR 35 3HG2 THR 35 -8.548 -12.691 -6.391 216 HG22 THR 35 1HG2 THR 35 -7.574 -12.601 -7.858 217 HG23 THR 35 2HG2 THR 35 -8.951 -11.519 -7.645 218 H THR 36 H THR 36 -6.189 -13.872 -4.243 219 HA THR 36 HA THR 36 -3.454 -14.088 -5.036 220 HB THR 36 HB THR 36 -5.084 -16.488 -4.295 221 HG1 THR 36 1HG THR 36 -4.580 -14.229 -2.711 222 HG21 THR 36 3HG2 THR 36 -2.961 -17.246 -4.404 223 HG22 THR 36 1HG2 THR 36 -2.812 -16.516 -2.807 224 HG23 THR 36 2HG2 THR 36 -2.269 -15.633 -4.233 225 H GLY 37 H GLY 37 -2.685 -14.659 -6.958 226 HA2 GLY 37 1HA GLY 37 -2.578 -16.301 -8.734 227 HA3 GLY 37 2HA GLY 37 -4.331 -16.415 -8.663 228 H ILE 38 H ILE 38 -4.497 -13.425 -8.431 229 HA ILE 38 HA ILE 38 -4.118 -12.859 -11.294 230 HB ILE 38 HB ILE 38 -5.960 -11.382 -9.422 231 HG12 ILE 38 1HG1 ILE 38 -6.499 -13.788 -11.166 232 HG13 ILE 38 2HG1 ILE 38 -6.746 -13.644 -9.429 233 HG21 ILE 38 1HG2 ILE 38 -6.773 -10.290 -11.263 234 HG22 ILE 38 2HG2 ILE 38 -5.091 -10.509 -11.743 235 HG23 ILE 38 3HG2 ILE 38 -6.333 -11.593 -12.367 236 HD11 ILE 38 3HD1 ILE 38 -8.599 -13.199 -11.484 237 HD12 ILE 38 1HD1 ILE 38 -8.816 -12.947 -9.753 238 HD13 ILE 38 2HD1 ILE 38 -8.251 -11.624 -10.773 239 H GLN 39 H GLN 39 -3.233 -10.900 -11.959 240 HA GLN 39 HA GLN 39 -1.415 -9.696 -10.050 241 HB2 GLN 39 1HB GLN 39 -0.414 -10.136 -12.137 242 HB3 GLN 39 2HB GLN 39 -1.776 -9.470 -13.027 243 HG2 GLN 39 1HG GLN 39 -1.168 -7.229 -12.052 244 HG3 GLN 39 2HG GLN 39 0.319 -7.981 -11.476 245 HE21 GLN 39 1HE2 GLN 39 1.973 -8.273 -12.856 246 HE22 GLN 39 2HE2 GLN 39 1.941 -7.842 -14.529 247 H SER 40 H SER 40 -2.085 -8.084 -8.808 248 HA SER 40 HA SER 40 -4.292 -6.391 -9.652 249 HB2 SER 40 1HB SER 40 -4.119 -5.454 -7.349 250 HB3 SER 40 2HB SER 40 -4.332 -7.205 -7.364 251 HG SER 40 HG SER 40 -2.696 -6.712 -5.930 252 H GLU 41 H GLU 41 -4.155 -4.039 -9.446 253 HA GLU 41 HA GLU 41 -1.508 -2.856 -9.570 254 HB2 GLU 41 1HB GLU 41 -2.053 -1.694 -11.733 255 HB3 GLU 41 2HB GLU 41 -1.746 -3.419 -11.873 256 HG2 GLU 41 1HG GLU 41 -4.445 -2.089 -11.849 257 HG3 GLU 41 2HG GLU 41 -3.621 -2.761 -13.255 258 H PHE 42 H PHE 42 -1.483 -0.820 -8.794 259 HA PHE 42 HA PHE 42 -4.011 0.650 -8.593 260 HB2 PHE 42 1HB PHE 42 -3.738 1.124 -6.278 261 HB3 PHE 42 2HB PHE 42 -3.517 -0.614 -6.451 262 HD1 PHE 42 2HD PHE 42 -1.341 -1.631 -6.142 263 HD2 PHE 42 1HD PHE 42 -1.896 2.565 -5.694 264 HE1 PHE 42 2HE PHE 42 0.841 -1.466 -5.017 265 HE2 PHE 42 1HE PHE 42 0.286 2.737 -4.570 266 HZ PHE 42 HZ PHE 42 1.657 0.720 -4.229 267 H PHE 43 H PHE 43 -3.821 2.747 -9.081 268 HA PHE 43 HA PHE 43 -1.177 3.775 -9.716 269 HB2 PHE 43 1HB PHE 43 -3.968 4.803 -10.227 270 HB3 PHE 43 2HB PHE 43 -2.527 5.741 -10.606 271 HD1 PHE 43 1HD PHE 43 -0.785 4.606 -12.139 272 HD2 PHE 43 2HD PHE 43 -4.831 3.333 -11.784 273 HE1 PHE 43 1HE PHE 43 -0.612 3.465 -14.312 274 HE2 PHE 43 2HE PHE 43 -4.664 2.189 -13.956 275 HZ PHE 43 HZ PHE 43 -2.553 2.253 -15.223 276 H ILE 44 H ILE 44 -0.568 5.977 -9.070 277 HA ILE 44 HA ILE 44 -1.621 6.684 -6.409 278 HB ILE 44 HB ILE 44 1.252 6.786 -7.335 279 HG12 ILE 44 1HG1 ILE 44 0.035 5.257 -5.030 280 HG13 ILE 44 2HG1 ILE 44 0.292 4.558 -6.625 281 HG21 ILE 44 1HG2 ILE 44 1.019 8.696 -6.017 282 HG22 ILE 44 2HG2 ILE 44 -0.106 7.909 -4.911 283 HG23 ILE 44 3HG2 ILE 44 1.603 7.475 -4.886 284 HD11 ILE 44 3HD1 ILE 44 2.187 3.865 -5.594 285 HD12 ILE 44 1HD1 ILE 44 2.752 5.419 -6.207 286 HD13 ILE 44 2HD1 ILE 44 2.252 5.265 -4.523 287 H ASN 45 H ASN 45 -2.793 8.471 -6.752 288 HA ASN 45 HA ASN 45 -2.343 10.359 -8.787 289 HB2 ASN 45 1HB ASN 45 -4.028 10.246 -6.330 290 HB3 ASN 45 2HB ASN 45 -3.787 11.817 -7.090 291 HD21 ASN 45 1HD2 ASN 45 -6.232 11.323 -7.162 292 HD22 ASN 45 2HD2 ASN 45 -6.797 10.633 -8.642 293 H THR 46 H THR 46 -0.213 11.052 -8.772 294 HA THR 46 HA THR 46 0.499 12.836 -6.537 295 HB THR 46 HB THR 46 1.915 10.860 -6.415 296 HG1 THR 46 1HG THR 46 3.542 12.881 -7.548 297 HG21 THR 46 3HG2 THR 46 1.895 9.986 -8.609 298 HG22 THR 46 1HG2 THR 46 3.560 10.492 -8.323 299 HG23 THR 46 2HG2 THR 46 2.488 11.495 -9.301 300 H THR 47 H THR 47 -0.862 13.543 -8.963 301 HA THR 47 HA THR 47 1.126 14.843 -10.639 302 HB THR 47 HB THR 47 -0.896 15.674 -11.903 303 HG1 THR 47 1HG THR 47 -2.309 13.803 -10.291 304 HG21 THR 47 3HG2 THR 47 -0.109 12.834 -11.558 305 HG22 THR 47 1HG2 THR 47 -0.033 13.863 -12.987 306 HG23 THR 47 2HG2 THR 47 -1.571 13.158 -12.489 307 H ARG 48 H ARG 48 -1.300 15.677 -8.238 308 HA ARG 48 HA ARG 48 -1.011 18.514 -8.623 309 HB2 ARG 48 1HB ARG 48 -2.524 16.754 -6.742 310 HB3 ARG 48 2HB ARG 48 -2.269 18.437 -6.300 311 HG2 ARG 48 1HG ARG 48 -3.199 18.934 -8.670 312 HG3 ARG 48 2HG ARG 48 -3.842 17.295 -8.563 313 HD2 ARG 48 1HD ARG 48 -5.168 17.821 -6.697 314 HD3 ARG 48 2HD ARG 48 -4.284 19.315 -6.388 315 HE ARG 48 HE ARG 48 -5.625 20.382 -7.905 316 HH11 ARG 48 1HH1 ARG 48 -5.951 16.940 -8.313 317 HH12 ARG 48 2HH1 ARG 48 -7.267 17.066 -9.433 318 HH21 ARG 48 1HH2 ARG 48 -7.357 20.561 -9.379 319 HH22 ARG 48 2HH2 ARG 48 -8.065 19.126 -10.039 320 H ALA 49 H ALA 49 0.350 16.068 -6.526 321 HA ALA 49 HA ALA 49 1.543 17.900 -4.681 322 HB1 ALA 49 3HB ALA 49 2.684 15.967 -3.780 323 HB2 ALA 49 1HB ALA 49 0.991 15.574 -4.084 324 HB3 ALA 49 2HB ALA 49 2.241 15.011 -5.194 325 H GLY 50 H GLY 50 3.002 15.717 -7.110 326 HA2 GLY 50 1HA GLY 50 4.587 17.497 -8.447 327 HA3 GLY 50 2HA GLY 50 5.512 17.109 -7.004 328 HA PRO 51 HA PRO 51 5.750 13.780 -10.473 329 HB2 PRO 51 1HB PRO 51 7.880 14.674 -11.898 330 HB3 PRO 51 2HB PRO 51 6.210 15.087 -12.305 331 HG2 PRO 51 1HG PRO 51 8.249 16.692 -10.812 332 HG3 PRO 51 2HG PRO 51 7.108 17.218 -12.063 333 HD2 PRO 51 1HD PRO 51 6.670 17.634 -9.424 334 HD3 PRO 51 2HD PRO 51 5.350 17.358 -10.579 335 H GLY 52 H GLY 52 7.582 15.209 -8.061 336 HA2 GLY 52 1HA GLY 52 10.080 14.086 -8.123 337 HA3 GLY 52 2HA GLY 52 9.162 14.318 -6.642 338 H THR 53 H THR 53 10.857 12.281 -6.616 339 HA THR 53 HA THR 53 9.575 9.839 -7.497 340 HB THR 53 HB THR 53 11.506 8.712 -6.383 341 HG1 THR 53 1HG THR 53 13.114 9.969 -5.480 342 HG21 THR 53 3HG2 THR 53 11.452 9.748 -8.786 343 HG22 THR 53 1HG2 THR 53 12.969 9.146 -8.118 344 HG23 THR 53 2HG2 THR 53 12.628 10.877 -8.112 345 H LEU 54 H LEU 54 8.277 8.583 -6.319 346 HA LEU 54 HA LEU 54 7.782 9.331 -3.535 347 HB2 LEU 54 1HB LEU 54 6.240 7.890 -5.637 348 HB3 LEU 54 2HB LEU 54 5.884 7.552 -3.944 349 HG LEU 54 HG LEU 54 5.627 10.133 -3.754 350 HD11 LEU 54 1HD1 LEU 54 5.270 11.364 -5.643 351 HD12 LEU 54 2HD1 LEU 54 4.777 9.966 -6.598 352 HD13 LEU 54 3HD1 LEU 54 6.483 10.234 -6.244 353 HD21 LEU 54 3HD2 LEU 54 3.582 8.470 -5.221 354 HD22 LEU 54 1HD2 LEU 54 3.270 9.943 -4.303 355 HD23 LEU 54 2HD2 LEU 54 3.826 8.489 -3.473 356 H SER 55 H SER 55 7.331 7.531 -1.988 357 HA SER 55 HA SER 55 9.078 5.215 -2.497 358 HB2 SER 55 1HB SER 55 8.815 6.740 0.106 359 HB3 SER 55 2HB SER 55 9.791 5.293 -0.142 360 HG SER 55 HG SER 55 11.300 6.610 -0.745 361 H VAL 56 H VAL 56 8.334 3.248 -1.863 362 HA VAL 56 HA VAL 56 5.894 3.109 -0.250 363 HB VAL 56 HB VAL 56 4.903 1.453 -1.807 364 HG11 VAL 56 1HG1 VAL 56 5.267 3.838 -3.513 365 HG12 VAL 56 2HG1 VAL 56 3.788 3.056 -2.952 366 HG13 VAL 56 3HG1 VAL 56 4.686 4.124 -1.873 367 HG21 VAL 56 3HG2 VAL 56 5.820 0.859 -3.813 368 HG22 VAL 56 1HG2 VAL 56 6.691 2.382 -3.991 369 HG23 VAL 56 2HG2 VAL 56 7.297 1.143 -2.892 370 H THR 57 H THR 57 5.637 1.205 0.903 371 HA THR 57 HA THR 57 7.676 -0.873 0.596 372 HB THR 57 HB THR 57 7.030 0.276 3.311 373 HG1 THR 57 1HG THR 57 9.066 0.938 1.457 374 HG21 THR 57 3HG2 THR 57 7.884 -1.801 3.748 375 HG22 THR 57 1HG2 THR 57 9.390 -0.893 3.623 376 HG23 THR 57 2HG2 THR 57 8.822 -1.851 2.256 377 H ILE 58 H ILE 58 6.528 -2.659 0.260 378 HA ILE 58 HA ILE 58 3.920 -2.986 1.523 379 HB ILE 58 HB ILE 58 5.214 -4.954 -0.347 380 HG12 ILE 58 1HG1 ILE 58 3.630 -2.479 -1.066 381 HG13 ILE 58 2HG1 ILE 58 5.316 -2.792 -1.460 382 HG21 ILE 58 1HG2 ILE 58 2.630 -5.060 -0.927 383 HG22 ILE 58 2HG2 ILE 58 3.326 -5.974 0.410 384 HG23 ILE 58 3HG2 ILE 58 2.493 -4.452 0.722 385 HD11 ILE 58 3HD1 ILE 58 2.844 -3.936 -2.651 386 HD12 ILE 58 1HD1 ILE 58 4.289 -3.300 -3.437 387 HD13 ILE 58 2HD1 ILE 58 4.329 -4.887 -2.668 388 H GLU 59 H GLU 59 3.353 -4.859 2.723 389 HA GLU 59 HA GLU 59 5.568 -6.486 3.733 390 HB2 GLU 59 1HB GLU 59 4.890 -4.414 5.219 391 HB3 GLU 59 2HB GLU 59 3.565 -5.465 5.701 392 HG2 GLU 59 1HG GLU 59 4.955 -6.972 6.744 393 HG3 GLU 59 2HG GLU 59 6.362 -6.489 5.798 394 H GLY 60 H GLY 60 4.811 -8.405 4.941 395 HA2 GLY 60 1HA GLY 60 2.297 -9.359 5.266 396 HA3 GLY 60 2HA GLY 60 2.582 -9.604 3.550 397 HA PRO 61 HA PRO 61 4.258 -13.176 6.152 398 HB2 PRO 61 1HB PRO 61 2.532 -15.074 5.265 399 HB3 PRO 61 2HB PRO 61 2.209 -14.069 6.682 400 HG2 PRO 61 1HG PRO 61 1.205 -13.768 3.878 401 HG3 PRO 61 2HG PRO 61 0.325 -13.589 5.407 402 HD2 PRO 61 1HD PRO 61 1.226 -11.466 3.988 403 HD3 PRO 61 2HD PRO 61 1.119 -11.454 5.760 404 H SER 62 H SER 62 3.035 -13.024 2.831 405 HA SER 62 HA SER 62 5.261 -14.754 1.983 406 HB2 SER 62 1HB SER 62 2.592 -14.183 0.682 407 HB3 SER 62 2HB SER 62 3.897 -15.056 -0.122 408 HG SER 62 HG SER 62 2.726 -15.816 2.350 409 H LYS 63 H LYS 63 6.767 -14.007 0.604 410 HA LYS 63 HA LYS 63 6.910 -11.192 0.115 411 HB2 LYS 63 1HB LYS 63 8.882 -12.689 0.567 412 HB3 LYS 63 2HB LYS 63 8.667 -13.359 -1.045 413 HG2 LYS 63 1HG LYS 63 9.219 -11.314 -2.079 414 HG3 LYS 63 2HG LYS 63 9.081 -10.424 -0.561 415 HD2 LYS 63 1HD LYS 63 11.050 -12.650 -0.712 416 HD3 LYS 63 2HD LYS 63 11.431 -11.142 -1.549 417 HE2 LYS 63 1HE LYS 63 10.548 -11.196 1.323 418 HE3 LYS 63 2HE LYS 63 12.238 -11.394 0.862 419 HZ1 LYS 63 3HZ LYS 63 11.919 -9.237 -0.415 420 HZ2 LYS 63 1HZ LYS 63 11.989 -9.127 1.272 421 HZ3 LYS 63 2HZ LYS 63 10.497 -9.037 0.480 422 H VAL 64 H VAL 64 6.539 -10.064 -1.724 423 HA VAL 64 HA VAL 64 5.451 -11.575 -4.009 424 HB VAL 64 HB VAL 64 4.213 -9.517 -4.599 425 HG11 VAL 64 1HG1 VAL 64 2.509 -10.348 -3.440 426 HG12 VAL 64 2HG1 VAL 64 3.664 -11.343 -2.551 427 HG13 VAL 64 3HG1 VAL 64 3.191 -9.763 -1.923 428 HG21 VAL 64 3HG2 VAL 64 5.617 -7.838 -3.608 429 HG22 VAL 64 1HG2 VAL 64 4.019 -7.737 -2.870 430 HG23 VAL 64 2HG2 VAL 64 5.347 -8.500 -1.996 431 H LYS 65 H LYS 65 5.841 -10.703 -6.142 432 HA LYS 65 HA LYS 65 8.481 -9.429 -6.318 433 HB2 LYS 65 1HB LYS 65 6.962 -11.307 -8.084 434 HB3 LYS 65 2HB LYS 65 8.177 -10.256 -8.797 435 HG2 LYS 65 1HG LYS 65 9.836 -11.172 -7.200 436 HG3 LYS 65 2HG LYS 65 8.605 -12.301 -6.630 437 HD2 LYS 65 1HD LYS 65 9.327 -12.127 -9.537 438 HD3 LYS 65 2HD LYS 65 10.275 -13.108 -8.417 439 HE2 LYS 65 1HE LYS 65 8.175 -14.278 -7.770 440 HE3 LYS 65 2HE LYS 65 7.333 -13.373 -9.027 441 HZ1 LYS 65 3HZ LYS 65 8.267 -14.597 -10.661 442 HZ2 LYS 65 1HZ LYS 65 8.377 -15.761 -9.439 443 HZ3 LYS 65 2HZ LYS 65 9.727 -14.823 -9.836 444 H MET 66 H MET 66 6.548 -7.648 -5.714 445 HA MET 66 HA MET 66 5.153 -6.501 -7.856 446 HB2 MET 66 1HB MET 66 4.943 -4.526 -6.456 447 HB3 MET 66 2HB MET 66 4.714 -5.975 -5.486 448 HG2 MET 66 1HG MET 66 6.043 -4.578 -4.176 449 HG3 MET 66 2HG MET 66 7.162 -5.757 -4.857 450 HE1 MET 66 3HE MET 66 5.931 -2.164 -4.691 451 HE2 MET 66 1HE MET 66 7.382 -2.384 -3.713 452 HE3 MET 66 2HE MET 66 7.412 -1.300 -5.104 453 H ASP 67 H ASP 67 5.586 -4.464 -8.949 454 HA ASP 67 HA ASP 67 8.429 -3.792 -9.205 455 HB2 ASP 67 1HB ASP 67 6.634 -4.129 -11.610 456 HB3 ASP 67 2HB ASP 67 8.375 -3.865 -11.593 457 H CYS 68 H CYS 68 8.830 -1.688 -10.113 458 HA CYS 68 HA CYS 68 6.533 0.130 -9.803 459 HB2 CYS 68 1HB CYS 68 9.409 0.384 -9.005 460 HB3 CYS 68 2HB CYS 68 8.487 1.835 -9.381 461 HG CYS 68 HG CYS 68 8.338 -0.156 -6.691 462 H GLN 69 H GLN 69 5.880 0.275 -11.913 463 HA GLN 69 HA GLN 69 7.866 1.033 -13.928 464 HB2 GLN 69 1HB GLN 69 5.085 -0.082 -14.070 465 HB3 GLN 69 2HB GLN 69 5.786 0.731 -15.463 466 HG2 GLN 69 1HG GLN 69 6.918 -1.681 -14.061 467 HG3 GLN 69 2HG GLN 69 6.075 -1.673 -15.610 468 HE21 GLN 69 1HE2 GLN 69 7.080 -0.623 -17.396 469 HE22 GLN 69 2HE2 GLN 69 8.798 -0.452 -17.457 470 H GLU 70 H GLU 70 8.114 3.094 -14.453 471 HA GLU 70 HA GLU 70 6.594 5.180 -13.364 472 HB2 GLU 70 1HB GLU 70 8.002 6.620 -14.493 473 HB3 GLU 70 2HB GLU 70 8.983 5.162 -14.432 474 HG2 GLU 70 1HG GLU 70 8.252 4.604 -16.714 475 HG3 GLU 70 2HG GLU 70 7.343 6.113 -16.769 476 H THR 71 H THR 71 5.105 6.617 -14.296 477 HA THR 71 HA THR 71 3.949 5.929 -16.881 478 HB THR 71 HB THR 71 1.629 5.976 -15.915 479 HG1 THR 71 1HG THR 71 1.360 6.066 -13.791 480 HG21 THR 71 3HG2 THR 71 1.588 3.684 -15.480 481 HG22 THR 71 1HG2 THR 71 3.176 3.703 -14.714 482 HG23 THR 71 2HG2 THR 71 3.038 3.882 -16.463 483 HA PRO 72 HA PRO 72 3.430 10.277 -17.234 484 HB2 PRO 72 1HB PRO 72 1.289 10.405 -18.898 485 HB3 PRO 72 2HB PRO 72 2.897 9.909 -19.438 486 HG2 PRO 72 1HG PRO 72 0.535 8.216 -18.721 487 HG3 PRO 72 2HG PRO 72 1.662 8.046 -20.079 488 HD2 PRO 72 1HD PRO 72 1.848 6.544 -17.834 489 HD3 PRO 72 2HD PRO 72 3.270 7.028 -18.779 490 H GLU 73 H GLU 73 1.000 8.295 -15.861 491 HA GLU 73 HA GLU 73 -0.713 10.540 -15.141 492 HB2 GLU 73 1HB GLU 73 -1.636 8.303 -15.855 493 HB3 GLU 73 2HB GLU 73 -1.017 7.643 -14.347 494 HG2 GLU 73 1HG GLU 73 -2.400 9.555 -13.257 495 HG3 GLU 73 2HG GLU 73 -3.259 9.556 -14.796 496 H GLY 74 H GLY 74 1.740 8.500 -13.771 497 HA2 GLY 74 1HA GLY 74 2.487 10.086 -11.699 498 HA3 GLY 74 2HA GLY 74 1.138 9.179 -11.033 499 H TYR 75 H TYR 75 1.339 6.944 -10.712 500 HA TYR 75 HA TYR 75 3.774 5.572 -11.378 501 HB2 TYR 75 1HB TYR 75 3.311 6.639 -8.629 502 HB3 TYR 75 2HB TYR 75 4.061 5.055 -8.795 503 HD1 TYR 75 1HD TYR 75 5.795 5.334 -11.093 504 HD2 TYR 75 2HD TYR 75 4.959 8.139 -8.005 505 HE1 TYR 75 1HE TYR 75 7.975 6.404 -11.483 506 HE2 TYR 75 2HE TYR 75 7.137 9.217 -8.386 507 HH TYR 75 HH TYR 75 9.555 7.808 -10.409 508 H LYS 76 H LYS 76 3.250 3.530 -11.759 509 HA LYS 76 HA LYS 76 0.887 2.411 -10.398 510 HB2 LYS 76 1HB LYS 76 0.470 2.671 -12.768 511 HB3 LYS 76 2HB LYS 76 1.973 1.846 -13.162 512 HG2 LYS 76 1HG LYS 76 0.869 -0.107 -11.783 513 HG3 LYS 76 2HG LYS 76 -0.618 0.733 -12.230 514 HD2 LYS 76 1HD LYS 76 1.449 0.121 -14.307 515 HD3 LYS 76 2HD LYS 76 0.322 -1.131 -13.781 516 HE2 LYS 76 1HE LYS 76 -1.557 0.357 -14.348 517 HE3 LYS 76 2HE LYS 76 -0.408 1.566 -14.919 518 HZ1 LYS 76 3HZ LYS 76 0.321 0.072 -16.628 519 HZ2 LYS 76 1HZ LYS 76 -1.363 0.206 -16.715 520 HZ3 LYS 76 2HZ LYS 76 -0.658 -1.174 -16.036 521 H VAL 77 H VAL 77 1.256 0.768 -9.071 522 HA VAL 77 HA VAL 77 3.757 -0.759 -9.392 523 HB VAL 77 HB VAL 77 2.190 -0.134 -6.889 524 HG11 VAL 77 1HG1 VAL 77 4.319 -2.155 -7.425 525 HG12 VAL 77 2HG1 VAL 77 4.250 -1.359 -5.851 526 HG13 VAL 77 3HG1 VAL 77 2.867 -2.287 -6.433 527 HG21 VAL 77 3HG2 VAL 77 3.512 1.699 -7.123 528 HG22 VAL 77 1HG2 VAL 77 4.688 0.633 -6.354 529 HG23 VAL 77 2HG2 VAL 77 4.706 0.850 -8.104 530 H MET 78 H MET 78 3.376 -2.681 -10.274 531 HA MET 78 HA MET 78 0.834 -4.034 -9.744 532 HB2 MET 78 1HB MET 78 2.990 -4.766 -11.731 533 HB3 MET 78 2HB MET 78 1.375 -5.454 -11.634 534 HG2 MET 78 1HG MET 78 0.373 -3.572 -12.509 535 HG3 MET 78 2HG MET 78 1.713 -2.522 -12.056 536 HE1 MET 78 3HE MET 78 3.911 -2.286 -14.894 537 HE2 MET 78 1HE MET 78 3.503 -1.926 -13.216 538 HE3 MET 78 2HE MET 78 4.445 -3.366 -13.604 539 H TYR 79 H TYR 79 0.685 -5.819 -8.526 540 HA TYR 79 HA TYR 79 3.024 -7.452 -7.989 541 HB2 TYR 79 1HB TYR 79 3.093 -7.165 -5.666 542 HB3 TYR 79 2HB TYR 79 2.886 -5.527 -6.274 543 HD1 TYR 79 1HD TYR 79 0.952 -8.421 -4.944 544 HD2 TYR 79 2HD TYR 79 1.143 -4.204 -5.474 545 HE1 TYR 79 1HE TYR 79 -1.046 -8.160 -3.535 546 HE2 TYR 79 2HE TYR 79 -0.855 -3.931 -4.065 547 HH TYR 79 HH TYR 79 -2.346 -6.690 -2.437 548 H THR 80 H THR 80 2.528 -9.545 -7.499 549 HA THR 80 HA THR 80 -0.335 -10.205 -7.252 550 HB THR 80 HB THR 80 1.680 -11.987 -8.614 551 HG1 THR 80 1HG THR 80 0.740 -11.142 -10.582 552 HG21 THR 80 3HG2 THR 80 -0.811 -12.546 -7.695 553 HG22 THR 80 1HG2 THR 80 -0.053 -13.363 -9.061 554 HG23 THR 80 2HG2 THR 80 -1.172 -12.029 -9.342 555 HA PRO 81 HA PRO 81 1.188 -12.033 -3.461 556 HB2 PRO 81 1HB PRO 81 -1.258 -12.768 -2.540 557 HB3 PRO 81 2HB PRO 81 -0.654 -11.110 -2.444 558 HG2 PRO 81 1HG PRO 81 -2.527 -12.331 -4.434 559 HG3 PRO 81 2HG PRO 81 -2.625 -10.755 -3.625 560 HD2 PRO 81 1HD PRO 81 -1.727 -11.037 -6.164 561 HD3 PRO 81 2HD PRO 81 -1.116 -9.780 -5.069 562 H MET 82 H MET 82 1.792 -14.071 -2.976 563 HA MET 82 HA MET 82 0.914 -16.206 -4.753 564 HB2 MET 82 1HB MET 82 3.373 -15.614 -3.971 565 HB3 MET 82 2HB MET 82 2.943 -16.636 -2.606 566 HG2 MET 82 1HG MET 82 2.687 -17.508 -5.471 567 HG3 MET 82 2HG MET 82 4.127 -17.780 -4.492 568 HE1 MET 82 3HE MET 82 4.341 -20.356 -4.096 569 HE2 MET 82 1HE MET 82 2.928 -21.383 -4.342 570 HE3 MET 82 2HE MET 82 3.417 -20.242 -5.595 571 H ALA 83 H ALA 83 0.762 -15.265 -1.384 572 HA ALA 83 HA ALA 83 -1.132 -17.460 -0.917 573 HB1 ALA 83 3HB ALA 83 1.444 -17.301 0.217 574 HB2 ALA 83 1HB ALA 83 0.292 -16.931 1.500 575 HB3 ALA 83 2HB ALA 83 0.154 -18.441 0.599 576 HA PRO 84 HA PRO 84 -3.722 -14.399 0.873 577 HB2 PRO 84 1HB PRO 84 -5.054 -15.865 2.730 578 HB3 PRO 84 2HB PRO 84 -5.347 -16.019 0.994 579 HG2 PRO 84 1HG PRO 84 -3.684 -17.738 2.794 580 HG3 PRO 84 2HG PRO 84 -4.809 -18.221 1.511 581 HD2 PRO 84 1HD PRO 84 -2.126 -18.163 1.150 582 HD3 PRO 84 2HD PRO 84 -3.273 -17.820 -0.160 583 H GLY 85 H GLY 85 -4.440 -13.522 3.072 584 HA2 GLY 85 1HA GLY 85 -3.649 -13.686 5.514 585 HA3 GLY 85 2HA GLY 85 -2.063 -13.413 4.808 586 H ASN 86 H ASN 86 -2.019 -11.546 6.249 587 HA ASN 86 HA ASN 86 -3.622 -9.287 5.256 588 HB2 ASN 86 1HB ASN 86 -2.888 -8.198 7.444 589 HB3 ASN 86 2HB ASN 86 -4.018 -9.542 7.578 590 HD21 ASN 86 1HD2 ASN 86 -3.123 -9.427 9.815 591 HD22 ASN 86 2HD2 ASN 86 -1.718 -10.373 10.156 592 H TYR 87 H TYR 87 -2.621 -7.866 4.008 593 HA TYR 87 HA TYR 87 0.311 -7.647 4.195 594 HB2 TYR 87 1HB TYR 87 -1.557 -7.236 1.859 595 HB3 TYR 87 2HB TYR 87 0.130 -6.737 1.835 596 HD1 TYR 87 1HD TYR 87 -2.016 -9.733 2.398 597 HD2 TYR 87 2HD TYR 87 1.766 -8.239 1.143 598 HE1 TYR 87 1HE TYR 87 -1.364 -11.996 1.688 599 HE2 TYR 87 2HE TYR 87 2.427 -10.498 0.428 600 HH TYR 87 HH TYR 87 0.222 -13.261 0.795 601 H LEU 88 H LEU 88 1.274 -5.608 4.160 602 HA LEU 88 HA LEU 88 -0.554 -3.351 4.660 603 HB2 LEU 88 1HB LEU 88 0.959 -4.374 6.561 604 HB3 LEU 88 2HB LEU 88 2.200 -3.386 5.792 605 HG LEU 88 HG LEU 88 0.396 -1.487 6.080 606 HD11 LEU 88 1HD1 LEU 88 -1.265 -3.171 6.975 607 HD12 LEU 88 2HD1 LEU 88 -1.024 -1.720 7.948 608 HD13 LEU 88 3HD1 LEU 88 -0.270 -3.240 8.430 609 HD21 LEU 88 3HD2 LEU 88 1.460 -0.866 8.161 610 HD22 LEU 88 1HD2 LEU 88 2.657 -1.551 7.061 611 HD23 LEU 88 2HD2 LEU 88 2.031 -2.518 8.397 612 H ILE 89 H ILE 89 -0.370 -1.700 3.301 613 HA ILE 89 HA ILE 89 2.149 -1.392 1.801 614 HB ILE 89 HB ILE 89 -0.617 -0.760 0.767 615 HG12 ILE 89 1HG1 ILE 89 1.180 -2.986 -0.181 616 HG13 ILE 89 2HG1 ILE 89 -0.006 -3.233 1.095 617 HG21 ILE 89 1HG2 ILE 89 0.680 -0.666 -1.425 618 HG22 ILE 89 2HG2 ILE 89 0.901 0.674 -0.302 619 HG23 ILE 89 3HG2 ILE 89 2.132 -0.582 -0.428 620 HD11 ILE 89 3HD1 ILE 89 -0.626 -3.823 -1.331 621 HD12 ILE 89 1HD1 ILE 89 -1.794 -2.949 -0.341 622 HD13 ILE 89 2HD1 ILE 89 -0.828 -2.084 -1.536 623 H SER 90 H SER 90 3.161 0.404 2.376 624 HA SER 90 HA SER 90 1.569 2.705 3.282 625 HB2 SER 90 1HB SER 90 3.314 1.684 4.828 626 HB3 SER 90 2HB SER 90 4.532 2.300 3.711 627 HG SER 90 HG SER 90 2.963 3.643 5.537 628 H VAL 91 H VAL 91 2.228 4.837 2.628 629 HA VAL 91 HA VAL 91 3.871 4.957 0.201 630 HB VAL 91 HB VAL 91 1.126 6.193 0.460 631 HG11 VAL 91 1HG1 VAL 91 1.818 7.695 -1.023 632 HG12 VAL 91 2HG1 VAL 91 3.393 6.910 -1.155 633 HG13 VAL 91 3HG1 VAL 91 2.055 6.381 -2.175 634 HG21 VAL 91 3HG2 VAL 91 0.914 4.720 -1.722 635 HG22 VAL 91 1HG2 VAL 91 2.181 3.784 -0.929 636 HG23 VAL 91 2HG2 VAL 91 0.634 4.036 -0.121 637 H LYS 92 H LYS 92 5.331 6.524 0.324 638 HA LYS 92 HA LYS 92 4.764 8.850 2.040 639 HB2 LYS 92 1HB LYS 92 7.509 7.657 1.689 640 HB3 LYS 92 2HB LYS 92 6.993 8.858 2.865 641 HG2 LYS 92 1HG LYS 92 5.479 7.062 3.820 642 HG3 LYS 92 2HG LYS 92 6.375 5.922 2.813 643 HD2 LYS 92 1HD LYS 92 7.570 5.787 4.767 644 HD3 LYS 92 2HD LYS 92 8.458 7.067 3.937 645 HE2 LYS 92 1HE LYS 92 8.147 7.897 6.098 646 HE3 LYS 92 2HE LYS 92 6.885 8.683 5.150 647 HZ1 LYS 92 3HZ LYS 92 5.643 6.458 5.988 648 HZ2 LYS 92 1HZ LYS 92 5.557 7.952 6.777 649 HZ3 LYS 92 2HZ LYS 92 6.652 6.778 7.308 650 H TYR 93 H TYR 93 5.225 10.819 1.210 651 HA TYR 93 HA TYR 93 6.305 10.876 -1.525 652 HB2 TYR 93 1HB TYR 93 4.125 11.787 -1.541 653 HB3 TYR 93 2HB TYR 93 4.400 12.689 -0.056 654 HD1 TYR 93 1HD TYR 93 5.735 12.458 -3.540 655 HD2 TYR 93 2HD TYR 93 4.816 14.955 -0.220 656 HE1 TYR 93 1HE TYR 93 6.354 14.436 -4.864 657 HE2 TYR 93 2HE TYR 93 5.430 16.940 -1.535 658 HH TYR 93 HH TYR 93 5.499 17.467 -4.150 659 H GLY 94 H GLY 94 8.445 11.225 -1.409 660 HA2 GLY 94 1HA GLY 94 10.464 12.078 -0.629 661 HA3 GLY 94 2HA GLY 94 9.664 13.580 -1.065 662 H GLY 95 H GLY 95 9.283 11.268 1.628 663 HA2 GLY 95 1HA GLY 95 10.423 12.858 3.615 664 HA3 GLY 95 2HA GLY 95 8.721 13.288 3.526 665 HA PRO 96 HA PRO 96 9.599 9.269 5.995 666 HB2 PRO 96 1HB PRO 96 9.744 10.281 8.510 667 HB3 PRO 96 2HB PRO 96 11.165 10.050 7.485 668 HG2 PRO 96 1HG PRO 96 9.602 12.546 8.021 669 HG3 PRO 96 2HG PRO 96 11.359 12.322 7.940 670 HD2 PRO 96 1HD PRO 96 9.926 13.353 5.888 671 HD3 PRO 96 2HD PRO 96 11.386 12.376 5.636 672 H ASN 97 H ASN 97 7.417 11.756 5.710 673 HA ASN 97 HA ASN 97 5.508 10.664 7.637 674 HB2 ASN 97 1HB ASN 97 5.454 13.147 5.914 675 HB3 ASN 97 2HB ASN 97 4.107 12.637 6.928 676 HD21 ASN 97 1HD2 ASN 97 7.245 14.048 6.835 677 HD22 ASN 97 2HD2 ASN 97 7.336 14.483 8.504 678 H HIS 98 H HIS 98 3.776 9.483 7.076 679 HA HIS 98 HA HIS 98 3.585 8.510 4.377 680 HB2 HIS 98 1HB HIS 98 1.552 7.275 5.391 681 HB3 HIS 98 2HB HIS 98 3.160 6.852 5.971 682 HD2 HIS 98 2HD HIS 98 3.740 7.737 8.610 683 HE1 HIS 98 1HE HIS 98 -0.289 8.696 9.530 684 HE2 HIS 98 2HE HIS 98 2.047 8.433 10.437 685 H ILE 99 H ILE 99 1.389 8.363 3.314 686 HA ILE 99 HA ILE 99 0.282 11.043 3.169 687 HB ILE 99 HB ILE 99 -0.879 10.300 1.187 688 HG12 ILE 99 1HG1 ILE 99 0.252 7.540 1.663 689 HG13 ILE 99 2HG1 ILE 99 -1.385 7.999 2.120 690 HG21 ILE 99 1HG2 ILE 99 0.947 10.222 -0.166 691 HG22 ILE 99 2HG2 ILE 99 1.748 10.654 1.344 692 HG23 ILE 99 3HG2 ILE 99 1.745 8.978 0.796 693 HD11 ILE 99 3HD1 ILE 99 -1.849 7.133 0.095 694 HD12 ILE 99 1HD1 ILE 99 -1.425 8.759 -0.438 695 HD13 ILE 99 2HD1 ILE 99 -0.236 7.460 -0.539 696 H VAL 100 H VAL 100 -2.235 10.961 2.612 697 HA VAL 100 HA VAL 100 -3.529 10.306 5.050 698 HB VAL 100 HB VAL 100 -4.607 11.204 2.382 699 HG11 VAL 100 1HG1 VAL 100 -6.367 9.931 3.356 700 HG12 VAL 100 2HG1 VAL 100 -6.087 10.645 4.945 701 HG13 VAL 100 3HG1 VAL 100 -6.737 11.632 3.636 702 HG21 VAL 100 3HG2 VAL 100 -4.169 12.576 5.029 703 HG22 VAL 100 1HG2 VAL 100 -3.370 12.915 3.493 704 HG23 VAL 100 2HG2 VAL 100 -5.083 13.284 3.697 705 H GLY 101 H GLY 101 -5.136 8.769 5.476 706 HA2 GLY 101 1HA GLY 101 -6.412 6.852 5.117 707 HA3 GLY 101 2HA GLY 101 -5.774 6.765 3.482 708 H SER 102 H SER 102 -3.080 6.654 3.884 709 HA SER 102 HA SER 102 -2.689 3.945 4.549 710 HB2 SER 102 1HB SER 102 -0.941 6.231 3.803 711 HB3 SER 102 2HB SER 102 -0.168 4.861 4.600 712 HG SER 102 HG SER 102 -0.156 4.095 2.631 713 HA PRO 103 HA PRO 103 -0.470 2.967 5.120 714 HB2 PRO 103 1HB PRO 103 -0.417 0.767 6.709 715 HB3 PRO 103 2HB PRO 103 0.824 2.024 6.767 716 HG2 PRO 103 1HG PRO 103 -1.534 1.606 8.563 717 HG3 PRO 103 2HG PRO 103 0.134 2.033 8.988 718 HD2 PRO 103 1HD PRO 103 -1.854 3.868 8.871 719 HD3 PRO 103 2HD PRO 103 -0.170 4.258 8.468 720 H PHE 104 H PHE 104 -1.390 1.447 3.788 721 HA PHE 104 HA PHE 104 -4.246 1.052 4.085 722 HB2 PHE 104 1HB PHE 104 -2.379 0.188 1.866 723 HB3 PHE 104 2HB PHE 104 -4.138 0.121 1.816 724 HD1 PHE 104 2HD PHE 104 -5.286 2.470 2.395 725 HD2 PHE 104 1HD PHE 104 -1.369 1.948 0.812 726 HE1 PHE 104 2HE PHE 104 -5.347 4.759 1.498 727 HE2 PHE 104 1HE PHE 104 -1.424 4.237 -0.088 728 HZ PHE 104 HZ PHE 104 -3.415 5.646 0.254 729 H LYS 105 H LYS 105 -5.190 -0.730 4.827 730 HA LYS 105 HA LYS 105 -3.520 -3.122 5.223 731 HB2 LYS 105 1HB LYS 105 -5.965 -2.154 6.710 732 HB3 LYS 105 2HB LYS 105 -5.232 -3.733 6.962 733 HG2 LYS 105 1HG LYS 105 -3.086 -2.485 7.496 734 HG3 LYS 105 2HG LYS 105 -4.081 -1.029 7.567 735 HD2 LYS 105 1HD LYS 105 -3.965 -1.781 9.787 736 HD3 LYS 105 2HD LYS 105 -5.546 -2.320 9.214 737 HE2 LYS 105 1HE LYS 105 -4.226 -4.493 8.577 738 HE3 LYS 105 2HE LYS 105 -3.084 -3.907 9.785 739 HZ1 LYS 105 3HZ LYS 105 -5.025 -3.754 11.333 740 HZ2 LYS 105 1HZ LYS 105 -4.594 -5.328 10.886 741 HZ3 LYS 105 2HZ LYS 105 -5.941 -4.587 10.181 742 H ALA 106 H ALA 106 -3.850 -4.150 3.274 743 HA ALA 106 HA ALA 106 -6.589 -4.657 2.396 744 HB1 ALA 106 3HB ALA 106 -5.661 -5.407 0.339 745 HB2 ALA 106 1HB ALA 106 -4.800 -3.936 0.791 746 HB3 ALA 106 2HB ALA 106 -4.043 -5.510 1.034 747 H LYS 107 H LYS 107 -7.479 -6.701 2.200 748 HA LYS 107 HA LYS 107 -6.071 -8.825 3.678 749 HB2 LYS 107 1HB LYS 107 -8.149 -8.003 4.747 750 HB3 LYS 107 2HB LYS 107 -9.050 -8.455 3.306 751 HG2 LYS 107 1HG LYS 107 -9.441 -10.255 4.667 752 HG3 LYS 107 2HG LYS 107 -8.035 -10.815 3.758 753 HD2 LYS 107 1HD LYS 107 -6.663 -9.805 5.697 754 HD3 LYS 107 2HD LYS 107 -8.187 -9.832 6.587 755 HE2 LYS 107 1HE LYS 107 -7.115 -12.265 5.188 756 HE3 LYS 107 2HE LYS 107 -6.634 -11.849 6.833 757 HZ1 LYS 107 3HZ LYS 107 -9.401 -11.684 6.739 758 HZ2 LYS 107 1HZ LYS 107 -8.464 -12.846 7.535 759 HZ3 LYS 107 2HZ LYS 107 -8.990 -13.124 5.952 760 H VAL 108 H VAL 108 -5.608 -10.667 2.654 761 HA VAL 108 HA VAL 108 -6.553 -10.987 -0.099 762 HB VAL 108 HB VAL 108 -4.383 -12.531 1.324 763 HG11 VAL 108 1HG1 VAL 108 -3.711 -13.229 -0.896 764 HG12 VAL 108 2HG1 VAL 108 -5.399 -13.662 -0.617 765 HG13 VAL 108 3HG1 VAL 108 -4.999 -12.264 -1.617 766 HG21 VAL 108 3HG2 VAL 108 -2.945 -10.872 0.949 767 HG22 VAL 108 1HG2 VAL 108 -3.483 -10.702 -0.722 768 HG23 VAL 108 2HG2 VAL 108 -4.332 -9.851 0.568 769 H THR 109 H THR 109 -7.682 -12.747 -0.802 770 HA THR 109 HA THR 109 -9.004 -14.326 1.244 771 HB THR 109 HB THR 109 -10.314 -15.239 -0.717 772 HG1 THR 109 1HG THR 109 -10.058 -13.688 -2.603 773 HG21 THR 109 3HG2 THR 109 -10.318 -12.234 -0.416 774 HG22 THR 109 1HG2 THR 109 -11.105 -13.362 0.687 775 HG23 THR 109 2HG2 THR 109 -11.654 -13.234 -0.984 776 H GLY 110 H GLY 110 -9.228 -16.664 1.041 777 HA2 GLY 110 1HA GLY 110 -6.952 -18.107 1.127 778 HA3 GLY 110 2HA GLY 110 -8.467 -18.801 0.570 779 H GLN 111 H GLN 111 -8.815 -19.112 -1.623 780 HA GLN 111 HA GLN 111 -7.961 -19.950 -3.611 781 HB2 GLN 111 1HB GLN 111 -7.188 -17.045 -3.883 782 HB3 GLN 111 2HB GLN 111 -7.619 -18.158 -5.174 783 HG2 GLN 111 1HG GLN 111 -9.495 -17.263 -2.999 784 HG3 GLN 111 2HG GLN 111 -9.401 -16.541 -4.605 785 HE21 GLN 111 1HE2 GLN 111 -11.779 -17.416 -3.947 786 HE22 GLN 111 2HE2 GLN 111 -12.167 -18.909 -4.725 787 H ARG 112 H ARG 112 -6.084 -20.518 -1.689 788 HA ARG 112 HA ARG 112 -3.518 -19.520 -2.044 789 HB2 ARG 112 1HB ARG 112 -4.302 -22.362 -1.368 790 HB3 ARG 112 2HB ARG 112 -2.727 -21.633 -1.082 791 HG2 ARG 112 1HG ARG 112 -4.111 -19.894 0.294 792 HG3 ARG 112 2HG ARG 112 -5.307 -21.192 0.337 793 HD2 ARG 112 1HD ARG 112 -3.972 -22.565 1.599 794 HD3 ARG 112 2HD ARG 112 -2.480 -21.838 1.005 795 HE ARG 112 HE ARG 112 -2.568 -20.345 2.734 796 HH11 ARG 112 1HH1 ARG 112 -5.700 -21.815 2.348 797 HH12 ARG 112 2HH1 ARG 112 -6.358 -21.098 3.781 798 HH21 ARG 112 1HH2 ARG 112 -3.422 -19.395 4.623 799 HH22 ARG 112 2HH2 ARG 112 -5.061 -19.721 5.074 800 H LEU 113 H LEU 113 -1.714 -20.262 -3.231 801 HA LEU 113 HA LEU 113 -2.437 -21.655 -5.723 802 HB2 LEU 113 1HB LEU 113 -0.407 -19.526 -5.128 803 HB3 LEU 113 2HB LEU 113 -0.311 -20.518 -6.582 804 HG LEU 113 HG LEU 113 -2.829 -19.023 -5.999 805 HD11 LEU 113 1HD1 LEU 113 -1.973 -16.999 -6.324 806 HD12 LEU 113 2HD1 LEU 113 -1.028 -17.546 -7.708 807 HD13 LEU 113 3HD1 LEU 113 -0.381 -17.717 -6.077 808 HD21 LEU 113 3HD2 LEU 113 -1.549 -19.310 -8.668 809 HD22 LEU 113 1HD2 LEU 113 -3.257 -19.300 -8.226 810 HD23 LEU 113 2HD2 LEU 113 -2.277 -20.736 -7.927 811 H VAL 114 H VAL 114 -2.028 -23.752 -5.076 812 HA VAL 114 HA VAL 114 0.765 -24.354 -4.349 813 HB VAL 114 HB VAL 114 -1.703 -25.975 -3.706 814 HG11 VAL 114 1HG1 VAL 114 0.527 -27.175 -4.137 815 HG12 VAL 114 2HG1 VAL 114 1.054 -26.441 -2.621 816 HG13 VAL 114 3HG1 VAL 114 -0.333 -27.532 -2.640 817 HG21 VAL 114 3HG2 VAL 114 -1.875 -24.334 -2.142 818 HG22 VAL 114 1HG2 VAL 114 -0.698 -25.355 -1.316 819 HG23 VAL 114 2HG2 VAL 114 -0.159 -23.934 -2.211 820 H SER 115 H SER 115 1.864 -25.888 -5.490 821 HA SER 115 HA SER 115 0.772 -26.602 -8.070 822 HB2 SER 115 1HB SER 115 3.221 -25.872 -7.471 823 HB3 SER 115 2HB SER 115 3.429 -27.579 -7.081 824 HG SER 115 HG SER 115 2.379 -26.670 -9.550 825 HA PRO 116 HA PRO 116 -0.635 -30.623 -6.940 826 HB2 PRO 116 1HB PRO 116 -0.693 -31.735 -9.416 827 HB3 PRO 116 2HB PRO 116 -1.886 -30.553 -8.866 828 HG2 PRO 116 1HG PRO 116 0.534 -30.145 -10.580 829 HG3 PRO 116 2HG PRO 116 -1.097 -29.477 -10.770 830 HD2 PRO 116 1HD PRO 116 0.946 -28.050 -9.712 831 HD3 PRO 116 2HD PRO 116 -0.740 -27.824 -9.204 832 H GLY 117 H GLY 117 2.084 -30.441 -9.238 833 HA2 GLY 117 1HA GLY 117 3.151 -32.918 -8.038 834 HA3 GLY 117 2HA GLY 117 3.503 -32.368 -9.669 835 H SER 118 H SER 118 3.919 -31.461 -6.261 836 HA SER 118 HA SER 118 6.179 -29.765 -6.943 837 HB2 SER 118 1HB SER 118 4.401 -29.243 -5.150 838 HB3 SER 118 2HB SER 118 5.259 -30.414 -4.148 839 HG SER 118 HG SER 118 7.181 -29.103 -4.621 840 H ALA 119 H ALA 119 7.959 -30.894 -7.463 841 HA ALA 119 HA ALA 119 9.162 -32.550 -5.404 842 HB1 ALA 119 3HB ALA 119 7.721 -33.828 -7.349 843 HB2 ALA 119 1HB ALA 119 9.360 -33.871 -7.999 844 HB3 ALA 119 2HB ALA 119 9.025 -34.545 -6.404 845 H ASN 120 H ASN 120 11.297 -32.216 -5.304 846 HA ASN 120 HA ASN 120 12.523 -30.509 -7.308 847 HB2 ASN 120 1HB ASN 120 12.752 -30.305 -4.724 848 HB3 ASN 120 2HB ASN 120 13.945 -31.589 -4.893 849 HD21 ASN 120 1HD2 ASN 120 14.378 -28.908 -3.984 850 HD22 ASN 120 2HD2 ASN 120 15.500 -28.178 -5.077 851 H GLU 121 H GLU 121 13.452 -31.384 -9.030 852 HA GLU 121 HA GLU 121 14.928 -33.912 -8.692 853 HB2 GLU 121 1HB GLU 121 12.795 -34.150 -9.992 854 HB3 GLU 121 2HB GLU 121 13.464 -33.051 -11.190 855 HG2 GLU 121 1HG GLU 121 13.682 -35.398 -11.847 856 HG3 GLU 121 2HG GLU 121 15.245 -34.599 -11.680 857 H THR 122 H THR 122 16.884 -32.816 -8.378 858 HA THR 122 HA THR 122 17.828 -31.015 -10.461 859 HB THR 122 HB THR 122 19.959 -31.119 -8.920 860 HG1 THR 122 1HG THR 122 17.999 -31.721 -6.974 861 HG21 THR 122 3HG2 THR 122 18.062 -29.692 -7.329 862 HG22 THR 122 1HG2 THR 122 17.649 -29.489 -9.031 863 HG23 THR 122 2HG2 THR 122 19.259 -29.056 -8.457 864 H SER 123 H SER 123 19.625 -31.392 -11.759 865 HA SER 123 HA SER 123 19.951 -33.915 -12.832 866 HB2 SER 123 1HB SER 123 20.729 -31.607 -13.724 867 HB3 SER 123 2HB SER 123 22.214 -31.931 -12.829 868 HG SER 123 HG SER 123 22.624 -32.808 -14.758 869 H SER 124 H SER 124 22.004 -35.208 -12.894 870 HA SER 124 HA SER 124 23.240 -35.353 -10.223 871 HB2 SER 124 1HB SER 124 21.478 -37.181 -10.949 872 HB3 SER 124 2HB SER 124 22.849 -37.838 -11.843 873 HG SER 124 HG SER 124 22.930 -37.202 -9.081 874 H ILE 125 H ILE 125 23.667 -36.910 -13.404 875 HA ILE 125 HA ILE 125 26.410 -35.883 -13.487 876 HB ILE 125 HB ILE 125 26.576 -38.139 -12.554 877 HG12 ILE 125 1HG1 ILE 125 27.495 -38.230 -15.426 878 HG13 ILE 125 2HG1 ILE 125 28.255 -37.189 -14.227 879 HG21 ILE 125 1HG2 ILE 125 25.081 -39.663 -13.172 880 HG22 ILE 125 2HG2 ILE 125 24.599 -38.707 -14.572 881 HG23 ILE 125 3HG2 ILE 125 25.963 -39.818 -14.691 882 HD11 ILE 125 3HD1 ILE 125 29.094 -39.664 -14.796 883 HD12 ILE 125 1HD1 ILE 125 29.310 -38.900 -13.222 884 HD13 ILE 125 2HD1 ILE 125 27.974 -40.022 -13.482 Start of MODEL 7 1 H1 GLY 1 H GLY 1 -35.662 35.534 11.220 2 HA2 GLY 1 1HA GLY 1 -37.054 35.359 8.772 3 HA3 GLY 1 2HA GLY 1 -35.682 36.440 8.576 4 H SER 2 H SER 2 -35.562 34.373 6.995 5 HA SER 2 HA SER 2 -33.257 32.942 7.885 6 HB2 SER 2 1HB SER 2 -35.000 31.598 8.997 7 HB3 SER 2 2HB SER 2 -35.796 31.349 7.443 8 HG SER 2 HG SER 2 -33.098 30.625 7.859 9 H SER 3 H SER 3 -32.140 31.974 6.198 10 HA SER 3 HA SER 3 -33.227 31.466 3.640 11 HB2 SER 3 1HB SER 3 -32.236 33.291 2.363 12 HB3 SER 3 2HB SER 3 -33.338 33.944 3.576 13 HG SER 3 HG SER 3 -30.594 33.662 4.141 14 H GLY 4 H GLY 4 -31.289 31.400 1.955 15 HA2 GLY 4 1HA GLY 4 -28.694 30.885 3.045 16 HA3 GLY 4 2HA GLY 4 -29.565 29.397 2.706 17 H SER 5 H SER 5 -27.139 30.772 1.498 18 HA SER 5 HA SER 5 -27.851 30.197 -1.256 19 HB2 SER 5 1HB SER 5 -28.297 32.664 -0.874 20 HB3 SER 5 2HB SER 5 -26.566 32.853 -0.601 21 HG SER 5 HG SER 5 -27.799 31.860 -2.958 22 H SER 6 H SER 6 -25.906 30.208 -2.680 23 HA SER 6 HA SER 6 -23.685 29.001 -1.248 24 HB2 SER 6 1HB SER 6 -22.952 28.182 -3.370 25 HB3 SER 6 2HB SER 6 -24.706 28.005 -3.345 26 HG SER 6 HG SER 6 -24.697 30.135 -4.441 27 H GLY 7 H GLY 7 -21.510 29.652 -1.466 28 HA2 GLY 7 1HA GLY 7 -21.172 32.506 -1.571 29 HA3 GLY 7 2HA GLY 7 -19.919 31.318 -1.246 30 H PHE 8 H PHE 8 -18.322 31.520 -2.655 31 HA PHE 8 HA PHE 8 -18.996 31.745 -5.505 32 HB2 PHE 8 1HB PHE 8 -17.246 33.538 -3.884 33 HB3 PHE 8 2HB PHE 8 -16.770 33.188 -5.542 34 HD1 PHE 8 2HD PHE 8 -19.177 33.165 -7.054 35 HD2 PHE 8 1HD PHE 8 -18.137 35.645 -3.755 36 HE1 PHE 8 2HE PHE 8 -20.732 34.890 -7.865 37 HE2 PHE 8 1HE PHE 8 -19.691 37.374 -4.560 38 HZ PHE 8 HZ PHE 8 -20.991 36.998 -6.618 39 H LYS 9 H LYS 9 -18.358 29.832 -6.275 40 HA LYS 9 HA LYS 9 -16.610 28.012 -5.320 41 HB2 LYS 9 1HB LYS 9 -16.413 27.103 -7.517 42 HB3 LYS 9 2HB LYS 9 -18.021 27.804 -7.392 43 HG2 LYS 9 1HG LYS 9 -15.797 29.433 -8.526 44 HG3 LYS 9 2HG LYS 9 -16.574 28.198 -9.519 45 HD2 LYS 9 1HD LYS 9 -18.768 29.373 -8.609 46 HD3 LYS 9 2HD LYS 9 -17.669 30.744 -8.440 47 HE2 LYS 9 1HE LYS 9 -17.026 30.454 -10.819 48 HE3 LYS 9 2HE LYS 9 -18.238 29.181 -10.956 49 HZ1 LYS 9 3HZ LYS 9 -19.831 30.989 -10.094 50 HZ2 LYS 9 1HZ LYS 9 -19.347 31.038 -11.714 51 HZ3 LYS 9 2HZ LYS 9 -18.632 32.076 -10.587 52 H VAL 10 H VAL 10 -14.414 27.503 -5.563 53 HA VAL 10 HA VAL 10 -12.682 29.683 -6.513 54 HB VAL 10 HB VAL 10 -11.131 29.238 -4.634 55 HG11 VAL 10 1HG1 VAL 10 -12.903 31.042 -4.619 56 HG12 VAL 10 2HG1 VAL 10 -13.853 29.974 -3.585 57 HG13 VAL 10 3HG1 VAL 10 -12.279 30.557 -3.043 58 HG21 VAL 10 3HG2 VAL 10 -12.956 28.043 -2.801 59 HG22 VAL 10 1HG2 VAL 10 -12.829 27.012 -4.227 60 HG23 VAL 10 2HG2 VAL 10 -11.378 27.458 -3.328 61 H ARG 11 H ARG 11 -10.900 29.067 -7.633 62 HA ARG 11 HA ARG 11 -10.582 26.183 -8.099 63 HB2 ARG 11 1HB ARG 11 -9.794 28.569 -9.777 64 HB3 ARG 11 2HB ARG 11 -9.363 26.910 -10.169 65 HG2 ARG 11 1HG ARG 11 -12.226 27.627 -9.735 66 HG3 ARG 11 2HG ARG 11 -11.441 28.015 -11.267 67 HD2 ARG 11 1HD ARG 11 -11.644 25.284 -10.003 68 HD3 ARG 11 2HD ARG 11 -12.564 25.860 -11.392 69 HE ARG 11 HE ARG 11 -10.016 26.177 -12.203 70 HH11 ARG 11 1HH1 ARG 11 -11.726 23.493 -10.791 71 HH12 ARG 11 2HH1 ARG 11 -10.768 22.292 -11.591 72 HH21 ARG 11 1HH2 ARG 11 -8.747 24.605 -13.262 73 HH22 ARG 11 2HH2 ARG 11 -9.073 22.926 -12.996 74 H VAL 12 H VAL 12 -8.522 25.234 -8.108 75 HA VAL 12 HA VAL 12 -6.522 26.724 -6.548 76 HB VAL 12 HB VAL 12 -7.364 24.629 -5.533 77 HG11 VAL 12 1HG1 VAL 12 -7.369 22.621 -6.561 78 HG12 VAL 12 2HG1 VAL 12 -7.366 23.603 -8.027 79 HG13 VAL 12 3HG1 VAL 12 -5.856 22.932 -7.410 80 HG21 VAL 12 3HG2 VAL 12 -5.202 23.729 -4.931 81 HG22 VAL 12 1HG2 VAL 12 -4.467 24.464 -6.355 82 HG23 VAL 12 2HG2 VAL 12 -5.094 25.484 -5.060 83 H GLY 13 H GLY 13 -4.267 26.440 -7.066 84 HA2 GLY 13 1HA GLY 13 -3.178 25.108 -9.213 85 HA3 GLY 13 2HA GLY 13 -3.778 26.621 -9.877 86 H GLU 14 H GLU 14 -3.204 27.892 -7.171 87 HA GLU 14 HA GLU 14 -0.477 28.640 -7.813 88 HB2 GLU 14 1HB GLU 14 -0.802 30.518 -6.488 89 HB3 GLU 14 2HB GLU 14 -2.419 30.214 -7.109 90 HG2 GLU 14 1HG GLU 14 -2.852 28.939 -4.967 91 HG3 GLU 14 2HG GLU 14 -1.344 29.628 -4.370 92 HA PRO 15 HA PRO 15 1.564 26.202 -4.787 93 HB2 PRO 15 1HB PRO 15 3.626 27.836 -4.116 94 HB3 PRO 15 2HB PRO 15 3.536 26.988 -5.665 95 HG2 PRO 15 1HG PRO 15 2.845 29.828 -5.017 96 HG3 PRO 15 2HG PRO 15 3.726 29.182 -6.413 97 HD2 PRO 15 1HD PRO 15 1.113 29.881 -6.535 98 HD3 PRO 15 2HD PRO 15 1.793 28.557 -7.502 99 H GLY 16 H GLY 16 2.317 26.190 -2.515 100 HA2 GLY 16 1HA GLY 16 1.677 28.315 -0.739 101 HA3 GLY 16 2HA GLY 16 0.396 27.112 -0.741 102 H GLN 17 H GLN 17 1.574 24.749 -0.804 103 HA GLN 17 HA GLN 17 3.516 24.766 1.409 104 HB2 GLN 17 1HB GLN 17 2.348 22.533 2.043 105 HB3 GLN 17 2HB GLN 17 1.600 24.055 2.510 106 HG2 GLN 17 1HG GLN 17 0.820 22.835 -0.084 107 HG3 GLN 17 2HG GLN 17 0.214 22.114 1.406 108 HE21 GLN 17 1HE2 GLN 17 -0.572 24.173 -0.953 109 HE22 GLN 17 2HE2 GLN 17 -1.643 25.232 -0.107 110 H ALA 18 H ALA 18 5.078 24.597 -0.357 111 HA ALA 18 HA ALA 18 5.272 22.700 -2.299 112 HB1 ALA 18 3HB ALA 18 6.921 24.559 -1.651 113 HB2 ALA 18 1HB ALA 18 7.664 23.344 -0.611 114 HB3 ALA 18 2HB ALA 18 7.572 23.077 -2.352 115 H GLY 19 H GLY 19 5.674 20.556 -2.457 116 HA2 GLY 19 1HA GLY 19 5.978 18.368 -1.828 117 HA3 GLY 19 2HA GLY 19 6.920 18.980 -0.476 118 H ASN 20 H ASN 20 3.509 18.805 -1.507 119 HA ASN 20 HA ASN 20 2.747 18.399 1.293 120 HB2 ASN 20 1HB ASN 20 1.522 20.154 0.163 121 HB3 ASN 20 2HB ASN 20 1.096 19.063 -1.153 122 HD21 ASN 20 1HD2 ASN 20 -0.708 20.561 0.448 123 HD22 ASN 20 2HD2 ASN 20 -1.713 19.435 1.290 124 HA PRO 21 HA PRO 21 2.545 14.047 0.133 125 HB2 PRO 21 1HB PRO 21 2.314 13.152 2.686 126 HB3 PRO 21 2HB PRO 21 3.861 13.614 1.965 127 HG2 PRO 21 1HG PRO 21 2.074 15.184 3.784 128 HG3 PRO 21 2HG PRO 21 3.840 15.020 3.817 129 HD2 PRO 21 1HD PRO 21 2.597 17.185 2.768 130 HD3 PRO 21 2HD PRO 21 4.141 16.574 2.141 131 H ALA 22 H ALA 22 0.389 15.797 2.315 132 HA ALA 22 HA ALA 22 -1.666 13.925 2.526 133 HB1 ALA 22 3HB ALA 22 -1.246 16.600 3.288 134 HB2 ALA 22 1HB ALA 22 -2.770 16.561 2.400 135 HB3 ALA 22 2HB ALA 22 -2.538 15.515 3.802 136 H LEU 23 H LEU 23 -1.177 16.490 0.117 137 HA LEU 23 HA LEU 23 -3.521 16.214 -1.325 138 HB2 LEU 23 1HB LEU 23 -0.763 17.106 -1.982 139 HB3 LEU 23 2HB LEU 23 -1.882 16.828 -3.314 140 HG LEU 23 HG LEU 23 -2.441 18.700 -1.018 141 HD11 LEU 23 1HD1 LEU 23 -1.735 19.652 -3.749 142 HD12 LEU 23 2HD1 LEU 23 -0.440 19.191 -2.645 143 HD13 LEU 23 3HD1 LEU 23 -1.574 20.463 -2.191 144 HD21 LEU 23 3HD2 LEU 23 -4.442 17.928 -2.104 145 HD22 LEU 23 1HD2 LEU 23 -3.757 18.259 -3.695 146 HD23 LEU 23 2HD2 LEU 23 -4.130 19.592 -2.602 147 H VAL 24 H VAL 24 -0.496 14.399 -1.635 148 HA VAL 24 HA VAL 24 -1.042 12.920 -3.905 149 HB VAL 24 HB VAL 24 0.429 12.026 -1.423 150 HG11 VAL 24 1HG1 VAL 24 -0.061 10.049 -2.590 151 HG12 VAL 24 2HG1 VAL 24 0.205 10.809 -4.160 152 HG13 VAL 24 3HG1 VAL 24 1.573 10.479 -3.096 153 HG21 VAL 24 3HG2 VAL 24 2.425 12.557 -2.916 154 HG22 VAL 24 1HG2 VAL 24 1.282 13.425 -3.942 155 HG23 VAL 24 2HG2 VAL 24 1.524 13.928 -2.269 156 H SER 25 H SER 25 -2.205 11.122 -4.381 157 HA SER 25 HA SER 25 -3.641 9.769 -2.209 158 HB2 SER 25 1HB SER 25 -4.867 10.984 -4.685 159 HB3 SER 25 2HB SER 25 -5.676 9.724 -3.754 160 HG SER 25 HG SER 25 -5.665 11.093 -1.967 161 H ALA 26 H ALA 26 -4.564 7.679 -2.880 162 HA ALA 26 HA ALA 26 -3.324 6.504 -5.258 163 HB1 ALA 26 3HB ALA 26 -3.154 4.598 -3.137 164 HB2 ALA 26 1HB ALA 26 -1.865 5.264 -4.141 165 HB3 ALA 26 2HB ALA 26 -2.338 6.085 -2.652 166 H TYR 27 H TYR 27 -4.614 5.094 -6.294 167 HA TYR 27 HA TYR 27 -6.787 3.769 -4.891 168 HB2 TYR 27 1HB TYR 27 -8.478 4.564 -6.535 169 HB3 TYR 27 2HB TYR 27 -7.848 5.852 -5.514 170 HD1 TYR 27 2HD TYR 27 -7.195 4.259 -8.831 171 HD2 TYR 27 1HD TYR 27 -7.209 7.831 -6.519 172 HE1 TYR 27 2HE TYR 27 -6.604 5.554 -10.838 173 HE2 TYR 27 1HE TYR 27 -6.620 9.136 -8.520 174 HH TYR 27 HH TYR 27 -6.028 7.550 -11.638 175 H GLY 28 H GLY 28 -7.858 2.133 -6.224 176 HA2 GLY 28 1HA GLY 28 -7.282 1.372 -8.782 177 HA3 GLY 28 2HA GLY 28 -5.938 0.737 -7.844 178 H THR 29 H THR 29 -6.599 -1.386 -8.441 179 HA THR 29 HA THR 29 -9.099 -2.312 -7.207 180 HB THR 29 HB THR 29 -7.358 -3.857 -9.130 181 HG1 THR 29 1HG THR 29 -8.432 -1.742 -9.851 182 HG21 THR 29 3HG2 THR 29 -8.948 -5.153 -7.741 183 HG22 THR 29 1HG2 THR 29 -9.337 -5.215 -9.460 184 HG23 THR 29 2HG2 THR 29 -10.267 -4.174 -8.383 185 H GLY 30 H GLY 30 -5.622 -2.752 -7.204 186 HA2 GLY 30 1HA GLY 30 -5.520 -5.112 -5.655 187 HA3 GLY 30 2HA GLY 30 -4.225 -3.935 -5.818 188 H LEU 31 H LEU 31 -6.379 -1.927 -4.800 189 HA LEU 31 HA LEU 31 -5.602 -2.188 -2.020 190 HB2 LEU 31 1HB LEU 31 -7.123 -0.071 -3.527 191 HB3 LEU 31 2HB LEU 31 -6.804 0.006 -1.796 192 HG LEU 31 HG LEU 31 -4.668 -0.074 -3.925 193 HD11 LEU 31 1HD1 LEU 31 -6.192 1.983 -3.851 194 HD12 LEU 31 2HD1 LEU 31 -4.450 2.242 -3.755 195 HD13 LEU 31 3HD1 LEU 31 -5.435 2.322 -2.294 196 HD21 LEU 31 3HD2 LEU 31 -3.313 -0.520 -2.223 197 HD22 LEU 31 1HD2 LEU 31 -4.640 -0.392 -1.068 198 HD23 LEU 31 2HD2 LEU 31 -3.737 1.049 -1.535 199 H GLU 32 H GLU 32 -8.316 -2.895 -3.991 200 HA GLU 32 HA GLU 32 -10.386 -2.680 -2.091 201 HB2 GLU 32 1HB GLU 32 -10.135 -4.482 -4.504 202 HB3 GLU 32 2HB GLU 32 -11.615 -4.250 -3.584 203 HG2 GLU 32 1HG GLU 32 -10.214 -1.879 -4.718 204 HG3 GLU 32 2HG GLU 32 -11.183 -2.904 -5.774 205 H GLY 33 H GLY 33 -7.989 -5.143 -2.708 206 HA2 GLY 33 1HA GLY 33 -8.159 -6.336 -0.213 207 HA3 GLY 33 2HA GLY 33 -9.248 -7.239 -1.255 208 H GLY 34 H GLY 34 -7.534 -8.878 -0.448 209 HA2 GLY 34 1HA GLY 34 -5.154 -8.820 -2.174 210 HA3 GLY 34 2HA GLY 34 -5.361 -9.829 -0.750 211 H THR 35 H THR 35 -5.632 -9.643 -4.131 212 HA THR 35 HA THR 35 -7.246 -12.084 -4.286 213 HB THR 35 HB THR 35 -6.885 -11.554 -6.855 214 HG1 THR 35 1HG THR 35 -5.826 -9.736 -7.083 215 HG21 THR 35 3HG2 THR 35 -8.991 -11.444 -5.327 216 HG22 THR 35 1HG2 THR 35 -9.007 -10.618 -6.884 217 HG23 THR 35 2HG2 THR 35 -8.734 -9.701 -5.403 218 H THR 36 H THR 36 -6.105 -13.900 -4.101 219 HA THR 36 HA THR 36 -3.332 -14.048 -4.871 220 HB THR 36 HB THR 36 -4.929 -16.484 -4.191 221 HG1 THR 36 1HG THR 36 -4.492 -14.264 -2.550 222 HG21 THR 36 3HG2 THR 36 -2.926 -17.315 -3.392 223 HG22 THR 36 1HG2 THR 36 -2.273 -15.713 -3.055 224 HG23 THR 36 2HG2 THR 36 -2.373 -16.292 -4.718 225 H GLY 37 H GLY 37 -2.543 -14.692 -6.771 226 HA2 GLY 37 1HA GLY 37 -2.474 -16.193 -8.631 227 HA3 GLY 37 2HA GLY 37 -4.218 -16.373 -8.507 228 H ILE 38 H ILE 38 -4.546 -13.427 -8.201 229 HA ILE 38 HA ILE 38 -4.359 -12.786 -11.057 230 HB ILE 38 HB ILE 38 -5.954 -11.304 -8.972 231 HG12 ILE 38 1HG1 ILE 38 -7.039 -13.378 -10.874 232 HG13 ILE 38 2HG1 ILE 38 -6.547 -13.775 -9.231 233 HG21 ILE 38 1HG2 ILE 38 -7.276 -10.703 -11.074 234 HG22 ILE 38 2HG2 ILE 38 -5.698 -9.946 -10.862 235 HG23 ILE 38 3HG2 ILE 38 -5.882 -11.304 -11.972 236 HD11 ILE 38 3HD1 ILE 38 -8.457 -11.539 -9.623 237 HD12 ILE 38 1HD1 ILE 38 -9.038 -13.191 -9.826 238 HD13 ILE 38 2HD1 ILE 38 -8.317 -12.691 -8.296 239 H GLN 39 H GLN 39 -3.816 -10.581 -11.682 240 HA GLN 39 HA GLN 39 -1.811 -9.415 -9.869 241 HB2 GLN 39 1HB GLN 39 -0.665 -10.097 -11.795 242 HB3 GLN 39 2HB GLN 39 -1.968 -9.591 -12.862 243 HG2 GLN 39 1HG GLN 39 -1.449 -7.257 -12.412 244 HG3 GLN 39 2HG GLN 39 -0.160 -7.749 -11.315 245 HE21 GLN 39 1HE2 GLN 39 1.416 -9.351 -12.383 246 HE22 GLN 39 2HE2 GLN 39 1.962 -8.912 -13.962 247 H SER 40 H SER 40 -2.710 -7.762 -8.809 248 HA SER 40 HA SER 40 -4.708 -6.085 -10.073 249 HB2 SER 40 1HB SER 40 -4.699 -4.920 -7.827 250 HB3 SER 40 2HB SER 40 -5.130 -6.630 -7.781 251 HG SER 40 HG SER 40 -3.096 -7.107 -7.017 252 H GLU 41 H GLU 41 -4.514 -3.691 -9.905 253 HA GLU 41 HA GLU 41 -1.802 -2.643 -9.925 254 HB2 GLU 41 1HB GLU 41 -2.144 -1.543 -12.135 255 HB3 GLU 41 2HB GLU 41 -2.029 -3.295 -12.228 256 HG2 GLU 41 1HG GLU 41 -4.609 -1.748 -12.238 257 HG3 GLU 41 2HG GLU 41 -3.780 -2.336 -13.678 258 H PHE 42 H PHE 42 -1.781 -0.766 -8.890 259 HA PHE 42 HA PHE 42 -4.206 0.902 -8.937 260 HB2 PHE 42 1HB PHE 42 -4.074 1.336 -6.625 261 HB3 PHE 42 2HB PHE 42 -3.804 -0.398 -6.762 262 HD1 PHE 42 1HD PHE 42 -2.075 2.851 -6.354 263 HD2 PHE 42 2HD PHE 42 -1.848 -1.379 -5.938 264 HE1 PHE 42 1HE PHE 42 0.040 3.090 -5.120 265 HE2 PHE 42 2HE PHE 42 0.267 -1.147 -4.702 266 HZ PHE 42 HZ PHE 42 1.213 1.089 -4.291 267 H PHE 43 H PHE 43 -3.873 2.945 -9.528 268 HA PHE 43 HA PHE 43 -1.149 3.847 -9.978 269 HB2 PHE 43 1HB PHE 43 -3.861 4.803 -10.821 270 HB3 PHE 43 2HB PHE 43 -2.485 5.896 -10.915 271 HD1 PHE 43 2HD PHE 43 -3.424 2.419 -11.884 272 HD2 PHE 43 1HD PHE 43 -1.295 5.969 -12.874 273 HE1 PHE 43 2HE PHE 43 -2.795 1.433 -14.048 274 HE2 PHE 43 1HE PHE 43 -0.663 4.989 -15.041 275 HZ PHE 43 HZ PHE 43 -1.412 2.718 -15.630 276 H ILE 44 H ILE 44 -0.664 6.195 -9.465 277 HA ILE 44 HA ILE 44 -1.750 6.898 -6.817 278 HB ILE 44 HB ILE 44 1.104 7.285 -7.727 279 HG12 ILE 44 1HG1 ILE 44 0.057 5.395 -5.613 280 HG13 ILE 44 2HG1 ILE 44 0.411 4.901 -7.265 281 HG21 ILE 44 1HG2 ILE 44 1.496 8.471 -5.854 282 HG22 ILE 44 2HG2 ILE 44 -0.238 8.781 -5.922 283 HG23 ILE 44 3HG2 ILE 44 0.388 7.502 -4.883 284 HD11 ILE 44 3HD1 ILE 44 2.754 5.891 -6.792 285 HD12 ILE 44 1HD1 ILE 44 2.284 5.735 -5.099 286 HD13 ILE 44 2HD1 ILE 44 2.327 4.310 -6.137 287 H ASN 45 H ASN 45 -2.694 8.820 -6.761 288 HA ASN 45 HA ASN 45 -2.608 10.605 -8.981 289 HB2 ASN 45 1HB ASN 45 -4.473 10.174 -7.150 290 HB3 ASN 45 2HB ASN 45 -3.642 11.487 -6.320 291 HD21 ASN 45 1HD2 ASN 45 -3.451 13.519 -7.417 292 HD22 ASN 45 2HD2 ASN 45 -4.639 13.983 -8.582 293 H THR 46 H THR 46 -0.261 10.920 -9.018 294 HA THR 46 HA THR 46 0.666 12.869 -7.015 295 HB THR 46 HB THR 46 2.573 11.537 -8.886 296 HG1 THR 46 1HG THR 46 1.436 9.768 -8.104 297 HG21 THR 46 3HG2 THR 46 4.126 12.255 -7.427 298 HG22 THR 46 1HG2 THR 46 3.173 11.766 -6.026 299 HG23 THR 46 2HG2 THR 46 2.847 13.307 -6.820 300 H THR 47 H THR 47 -0.979 13.883 -8.932 301 HA THR 47 HA THR 47 0.812 15.152 -10.891 302 HB THR 47 HB THR 47 -1.319 15.854 -12.035 303 HG1 THR 47 1HG THR 47 -3.156 14.441 -11.368 304 HG21 THR 47 3HG2 THR 47 -1.630 12.964 -12.040 305 HG22 THR 47 1HG2 THR 47 0.061 13.455 -12.141 306 HG23 THR 47 2HG2 THR 47 -1.101 14.043 -13.331 307 H ARG 48 H ARG 48 -1.821 15.878 -8.616 308 HA ARG 48 HA ARG 48 -1.476 18.716 -8.864 309 HB2 ARG 48 1HB ARG 48 -3.248 18.926 -7.345 310 HB3 ARG 48 2HB ARG 48 -3.620 17.454 -8.232 311 HG2 ARG 48 1HG ARG 48 -2.146 17.348 -5.630 312 HG3 ARG 48 2HG ARG 48 -3.906 17.466 -5.681 313 HD2 ARG 48 1HD ARG 48 -3.620 15.469 -7.396 314 HD3 ARG 48 2HD ARG 48 -2.119 15.237 -6.501 315 HE ARG 48 HE ARG 48 -3.341 14.572 -4.659 316 HH11 ARG 48 1HH1 ARG 48 -5.458 15.848 -7.111 317 HH12 ARG 48 2HH1 ARG 48 -6.904 15.286 -6.339 318 HH21 ARG 48 1HH2 ARG 48 -5.237 13.828 -3.633 319 HH22 ARG 48 2HH2 ARG 48 -6.777 14.138 -4.361 320 H ALA 49 H ALA 49 0.112 16.270 -7.148 321 HA ALA 49 HA ALA 49 0.968 17.992 -4.965 322 HB1 ALA 49 3HB ALA 49 0.531 15.326 -5.074 323 HB2 ALA 49 1HB ALA 49 2.279 15.383 -5.303 324 HB3 ALA 49 2HB ALA 49 1.552 16.115 -3.872 325 H GLY 50 H GLY 50 2.413 16.302 -7.741 326 HA2 GLY 50 1HA GLY 50 4.042 17.732 -9.001 327 HA3 GLY 50 2HA GLY 50 4.778 18.048 -7.437 328 HA PRO 51 HA PRO 51 6.287 13.997 -9.575 329 HB2 PRO 51 1HB PRO 51 8.285 14.929 -11.159 330 HB3 PRO 51 2HB PRO 51 6.629 14.708 -11.733 331 HG2 PRO 51 1HG PRO 51 8.002 17.210 -10.831 332 HG3 PRO 51 2HG PRO 51 6.929 16.962 -12.221 333 HD2 PRO 51 1HD PRO 51 6.079 18.077 -9.905 334 HD3 PRO 51 2HD PRO 51 5.023 17.085 -10.931 335 H GLY 52 H GLY 52 7.040 13.632 -7.447 336 HA2 GLY 52 1HA GLY 52 9.808 14.563 -6.992 337 HA3 GLY 52 2HA GLY 52 8.634 14.448 -5.689 338 H THR 53 H THR 53 10.143 13.060 -4.607 339 HA THR 53 HA THR 53 10.485 10.400 -5.793 340 HB THR 53 HB THR 53 11.759 11.515 -3.287 341 HG1 THR 53 1HG THR 53 13.312 12.265 -4.543 342 HG21 THR 53 3HG2 THR 53 12.349 9.392 -2.932 343 HG22 THR 53 1HG2 THR 53 13.332 9.492 -4.393 344 HG23 THR 53 2HG2 THR 53 11.679 8.884 -4.482 345 H LEU 54 H LEU 54 9.538 8.611 -4.981 346 HA LEU 54 HA LEU 54 7.938 8.912 -2.525 347 HB2 LEU 54 1HB LEU 54 6.356 7.273 -3.541 348 HB3 LEU 54 2HB LEU 54 6.410 8.844 -4.339 349 HG LEU 54 HG LEU 54 7.994 7.727 -6.016 350 HD11 LEU 54 1HD1 LEU 54 7.219 5.448 -4.324 351 HD12 LEU 54 2HD1 LEU 54 8.647 5.687 -5.330 352 HD13 LEU 54 3HD1 LEU 54 7.128 5.175 -6.064 353 HD21 LEU 54 3HD2 LEU 54 5.904 8.309 -6.835 354 HD22 LEU 54 1HD2 LEU 54 5.059 7.202 -5.753 355 HD23 LEU 54 2HD2 LEU 54 5.966 6.570 -7.127 356 H SER 55 H SER 55 7.435 6.807 -1.461 357 HA SER 55 HA SER 55 9.540 4.800 -1.885 358 HB2 SER 55 1HB SER 55 10.074 6.379 0.033 359 HB3 SER 55 2HB SER 55 8.671 5.708 0.863 360 HG SER 55 HG SER 55 10.628 3.982 -0.173 361 H VAL 56 H VAL 56 8.619 2.913 -2.291 362 HA VAL 56 HA VAL 56 5.960 2.352 -1.170 363 HB VAL 56 HB VAL 56 7.363 1.006 -3.483 364 HG11 VAL 56 1HG1 VAL 56 5.892 -0.570 -2.520 365 HG12 VAL 56 2HG1 VAL 56 4.637 0.644 -2.264 366 HG13 VAL 56 3HG1 VAL 56 5.030 0.111 -3.899 367 HG21 VAL 56 3HG2 VAL 56 6.382 2.444 -4.907 368 HG22 VAL 56 1HG2 VAL 56 4.899 2.530 -3.956 369 HG23 VAL 56 2HG2 VAL 56 6.298 3.503 -3.500 370 H THR 57 H THR 57 5.789 0.934 0.427 371 HA THR 57 HA THR 57 7.784 -1.212 0.654 372 HB THR 57 HB THR 57 6.751 0.275 3.067 373 HG1 THR 57 1HG THR 57 8.281 1.380 1.389 374 HG21 THR 57 3HG2 THR 57 8.311 -0.942 4.298 375 HG22 THR 57 1HG2 THR 57 9.262 -1.354 2.872 376 HG23 THR 57 2HG2 THR 57 7.703 -2.132 3.147 377 H ILE 58 H ILE 58 6.699 -3.052 0.435 378 HA ILE 58 HA ILE 58 3.989 -3.243 1.567 379 HB ILE 58 HB ILE 58 5.279 -4.931 -0.580 380 HG12 ILE 58 1HG1 ILE 58 2.940 -3.045 -0.855 381 HG13 ILE 58 2HG1 ILE 58 4.600 -2.535 -1.142 382 HG21 ILE 58 1HG2 ILE 58 2.568 -5.050 0.713 383 HG22 ILE 58 2HG2 ILE 58 2.916 -5.789 -0.849 384 HG23 ILE 58 3HG2 ILE 58 3.777 -6.327 0.593 385 HD11 ILE 58 3HD1 ILE 58 3.240 -3.192 -3.165 386 HD12 ILE 58 1HD1 ILE 58 4.821 -3.956 -2.998 387 HD13 ILE 58 2HD1 ILE 58 3.359 -4.853 -2.585 388 H GLU 59 H GLU 59 3.426 -4.940 2.900 389 HA GLU 59 HA GLU 59 5.651 -6.631 3.837 390 HB2 GLU 59 1HB GLU 59 5.083 -6.304 6.036 391 HB3 GLU 59 2HB GLU 59 4.629 -4.742 5.369 392 HG2 GLU 59 1HG GLU 59 2.297 -5.608 5.147 393 HG3 GLU 59 2HG GLU 59 2.812 -7.043 6.030 394 H GLY 60 H GLY 60 4.543 -8.479 5.311 395 HA2 GLY 60 1HA GLY 60 2.236 -9.698 5.105 396 HA3 GLY 60 2HA GLY 60 2.771 -9.877 3.441 397 HA PRO 61 HA PRO 61 4.351 -13.368 6.221 398 HB2 PRO 61 1HB PRO 61 2.860 -15.367 5.148 399 HB3 PRO 61 2HB PRO 61 2.318 -14.396 6.522 400 HG2 PRO 61 1HG PRO 61 1.611 -14.138 3.624 401 HG3 PRO 61 2HG PRO 61 0.558 -14.029 5.047 402 HD2 PRO 61 1HD PRO 61 1.470 -11.841 3.737 403 HD3 PRO 61 2HD PRO 61 1.169 -11.850 5.487 404 H SER 62 H SER 62 3.472 -13.307 2.786 405 HA SER 62 HA SER 62 5.952 -14.784 2.193 406 HB2 SER 62 1HB SER 62 3.231 -14.870 0.988 407 HB3 SER 62 2HB SER 62 4.605 -15.072 -0.099 408 HG SER 62 HG SER 62 4.032 -16.610 2.217 409 H LYS 63 H LYS 63 7.220 -14.107 0.423 410 HA LYS 63 HA LYS 63 7.244 -11.256 0.046 411 HB2 LYS 63 1HB LYS 63 9.345 -12.454 0.294 412 HB3 LYS 63 2HB LYS 63 8.980 -13.443 -1.114 413 HG2 LYS 63 1HG LYS 63 10.467 -11.875 -1.937 414 HG3 LYS 63 2HG LYS 63 8.897 -11.210 -2.392 415 HD2 LYS 63 1HD LYS 63 10.068 -9.381 -1.518 416 HD3 LYS 63 2HD LYS 63 9.024 -9.902 -0.193 417 HE2 LYS 63 1HE LYS 63 10.832 -10.988 0.908 418 HE3 LYS 63 2HE LYS 63 11.882 -10.802 -0.496 419 HZ1 LYS 63 3HZ LYS 63 11.963 -9.170 1.576 420 HZ2 LYS 63 1HZ LYS 63 10.795 -8.359 0.660 421 HZ3 LYS 63 2HZ LYS 63 12.325 -8.659 0.005 422 H VAL 64 H VAL 64 6.653 -10.105 -1.716 423 HA VAL 64 HA VAL 64 5.451 -11.609 -3.947 424 HB VAL 64 HB VAL 64 3.994 -9.709 -4.347 425 HG11 VAL 64 1HG1 VAL 64 4.001 -10.598 -1.465 426 HG12 VAL 64 2HG1 VAL 64 2.651 -9.798 -2.273 427 HG13 VAL 64 3HG1 VAL 64 3.185 -11.390 -2.813 428 HG21 VAL 64 3HG2 VAL 64 5.772 -8.419 -2.366 429 HG22 VAL 64 1HG2 VAL 64 4.966 -7.742 -3.781 430 HG23 VAL 64 2HG2 VAL 64 4.062 -7.996 -2.289 431 H LYS 65 H LYS 65 6.413 -11.446 -5.856 432 HA LYS 65 HA LYS 65 8.699 -9.823 -6.268 433 HB2 LYS 65 1HB LYS 65 8.448 -11.954 -7.412 434 HB3 LYS 65 2HB LYS 65 7.003 -11.376 -8.232 435 HG2 LYS 65 1HG LYS 65 8.233 -9.895 -9.582 436 HG3 LYS 65 2HG LYS 65 9.675 -10.053 -8.576 437 HD2 LYS 65 1HD LYS 65 10.078 -12.258 -9.338 438 HD3 LYS 65 2HD LYS 65 8.478 -12.372 -10.076 439 HE2 LYS 65 1HE LYS 65 10.613 -10.436 -10.957 440 HE3 LYS 65 2HE LYS 65 10.353 -12.017 -11.692 441 HZ1 LYS 65 3HZ LYS 65 8.580 -11.284 -12.807 442 HZ2 LYS 65 1HZ LYS 65 9.162 -9.730 -12.477 443 HZ3 LYS 65 2HZ LYS 65 7.969 -10.413 -11.491 444 H MET 66 H MET 66 7.631 -7.758 -5.656 445 HA MET 66 HA MET 66 5.679 -6.552 -7.301 446 HB2 MET 66 1HB MET 66 6.504 -5.897 -4.927 447 HB3 MET 66 2HB MET 66 7.735 -4.977 -5.781 448 HG2 MET 66 1HG MET 66 4.902 -4.598 -6.577 449 HG3 MET 66 2HG MET 66 5.444 -3.903 -5.051 450 HE1 MET 66 3HE MET 66 8.086 -2.995 -5.171 451 HE2 MET 66 1HE MET 66 8.314 -1.544 -6.147 452 HE3 MET 66 2HE MET 66 7.014 -1.610 -4.957 453 H ASP 67 H ASP 67 5.927 -4.823 -8.813 454 HA ASP 67 HA ASP 67 8.580 -4.543 -10.023 455 HB2 ASP 67 1HB ASP 67 6.100 -5.094 -11.661 456 HB3 ASP 67 2HB ASP 67 7.751 -4.934 -12.253 457 H CYS 68 H CYS 68 9.021 -2.535 -10.772 458 HA CYS 68 HA CYS 68 7.040 -0.472 -10.238 459 HB2 CYS 68 1HB CYS 68 9.965 -0.300 -10.984 460 HB3 CYS 68 2HB CYS 68 8.940 1.091 -10.653 461 HG CYS 68 HG CYS 68 10.713 -0.604 -8.560 462 H GLN 69 H GLN 69 6.130 0.849 -11.745 463 HA GLN 69 HA GLN 69 6.919 0.497 -14.549 464 HB2 GLN 69 1HB GLN 69 4.999 -0.958 -14.198 465 HB3 GLN 69 2HB GLN 69 4.091 0.371 -13.490 466 HG2 GLN 69 1HG GLN 69 3.274 0.185 -15.663 467 HG3 GLN 69 2HG GLN 69 4.386 1.551 -15.722 468 HE21 GLN 69 1HE2 GLN 69 5.710 1.572 -17.380 469 HE22 GLN 69 2HE2 GLN 69 6.251 0.197 -18.275 470 H GLU 70 H GLU 70 7.254 2.382 -15.514 471 HA GLU 70 HA GLU 70 6.546 4.838 -14.182 472 HB2 GLU 70 1HB GLU 70 8.708 4.313 -15.510 473 HB3 GLU 70 2HB GLU 70 7.739 4.664 -16.934 474 HG2 GLU 70 1HG GLU 70 7.209 6.887 -15.913 475 HG3 GLU 70 2HG GLU 70 8.399 6.520 -14.665 476 H THR 71 H THR 71 4.912 6.181 -14.646 477 HA THR 71 HA THR 71 3.398 5.757 -17.130 478 HB THR 71 HB THR 71 1.280 6.118 -15.881 479 HG1 THR 71 1HG THR 71 1.294 6.397 -13.755 480 HG21 THR 71 3HG2 THR 71 2.412 3.782 -14.489 481 HG22 THR 71 1HG2 THR 71 2.641 3.801 -16.237 482 HG23 THR 71 2HG2 THR 71 1.016 3.897 -15.560 483 HA PRO 72 HA PRO 72 3.509 10.127 -17.562 484 HB2 PRO 72 1HB PRO 72 1.202 10.560 -18.926 485 HB3 PRO 72 2HB PRO 72 2.627 9.815 -19.661 486 HG2 PRO 72 1HG PRO 72 0.159 8.516 -18.573 487 HG3 PRO 72 2HG PRO 72 1.048 8.155 -20.063 488 HD2 PRO 72 1HD PRO 72 1.315 6.674 -17.812 489 HD3 PRO 72 2HD PRO 72 2.650 6.920 -18.957 490 H GLU 73 H GLU 73 1.221 8.568 -15.645 491 HA GLU 73 HA GLU 73 0.053 11.114 -14.744 492 HB2 GLU 73 1HB GLU 73 -0.943 8.296 -14.751 493 HB3 GLU 73 2HB GLU 73 -1.527 9.400 -13.514 494 HG2 GLU 73 1HG GLU 73 -3.118 9.598 -15.170 495 HG3 GLU 73 2HG GLU 73 -2.060 10.973 -15.483 496 H GLY 74 H GLY 74 2.144 8.544 -13.871 497 HA2 GLY 74 1HA GLY 74 3.279 9.713 -11.680 498 HA3 GLY 74 2HA GLY 74 1.897 8.848 -11.024 499 H TYR 75 H TYR 75 2.044 6.699 -10.679 500 HA TYR 75 HA TYR 75 4.022 5.081 -12.005 501 HB2 TYR 75 1HB TYR 75 4.263 5.360 -9.010 502 HB3 TYR 75 2HB TYR 75 5.337 4.495 -10.103 503 HD1 TYR 75 2HD TYR 75 4.261 7.840 -8.982 504 HD2 TYR 75 1HD TYR 75 7.081 5.628 -11.274 505 HE1 TYR 75 2HE TYR 75 5.671 9.847 -9.173 506 HE2 TYR 75 1HE TYR 75 8.499 7.628 -11.471 507 HH TYR 75 HH TYR 75 7.416 10.765 -10.359 508 H LYS 76 H LYS 76 3.006 3.244 -12.405 509 HA LYS 76 HA LYS 76 0.736 2.438 -10.786 510 HB2 LYS 76 1HB LYS 76 0.540 2.326 -13.215 511 HB3 LYS 76 2HB LYS 76 1.922 1.241 -13.297 512 HG2 LYS 76 1HG LYS 76 0.430 -0.222 -11.689 513 HG3 LYS 76 2HG LYS 76 -0.870 0.702 -12.444 514 HD2 LYS 76 1HD LYS 76 1.205 -0.509 -14.200 515 HD3 LYS 76 2HD LYS 76 -0.005 -1.573 -13.479 516 HE2 LYS 76 1HE LYS 76 -0.906 0.938 -14.805 517 HE3 LYS 76 2HE LYS 76 -0.408 -0.420 -15.814 518 HZ1 LYS 76 3HZ LYS 76 -2.025 -1.809 -14.657 519 HZ2 LYS 76 1HZ LYS 76 -2.775 -0.484 -15.395 520 HZ3 LYS 76 2HZ LYS 76 -2.517 -0.487 -13.723 521 H VAL 77 H VAL 77 0.911 1.103 -9.120 522 HA VAL 77 HA VAL 77 3.258 -0.667 -8.970 523 HB VAL 77 HB VAL 77 1.495 0.385 -6.754 524 HG11 VAL 77 1HG1 VAL 77 2.819 -0.806 -5.205 525 HG12 VAL 77 2HG1 VAL 77 2.394 -1.968 -6.463 526 HG13 VAL 77 3HG1 VAL 77 4.002 -1.245 -6.436 527 HG21 VAL 77 3HG2 VAL 77 4.420 0.896 -6.925 528 HG22 VAL 77 1HG2 VAL 77 3.348 1.808 -7.988 529 HG23 VAL 77 2HG2 VAL 77 3.136 1.892 -6.239 530 H MET 78 H MET 78 2.979 -2.800 -9.063 531 HA MET 78 HA MET 78 0.301 -3.895 -8.522 532 HB2 MET 78 1HB MET 78 2.139 -4.910 -10.691 533 HB3 MET 78 2HB MET 78 0.475 -5.390 -10.387 534 HG2 MET 78 1HG MET 78 0.175 -3.985 -12.149 535 HG3 MET 78 2HG MET 78 -0.005 -2.850 -10.813 536 HE1 MET 78 3HE MET 78 3.602 -4.292 -11.969 537 HE2 MET 78 1HE MET 78 2.429 -4.472 -13.274 538 HE3 MET 78 2HE MET 78 3.750 -3.314 -13.430 539 H TYR 79 H TYR 79 0.227 -5.967 -7.621 540 HA TYR 79 HA TYR 79 2.729 -7.308 -6.983 541 HB2 TYR 79 1HB TYR 79 2.353 -7.339 -4.599 542 HB3 TYR 79 2HB TYR 79 2.355 -5.666 -5.145 543 HD1 TYR 79 2HD TYR 79 0.266 -4.377 -5.207 544 HD2 TYR 79 1HD TYR 79 0.361 -8.359 -3.710 545 HE1 TYR 79 2HE TYR 79 -1.929 -4.028 -4.155 546 HE2 TYR 79 1HE TYR 79 -1.835 -8.021 -2.655 547 HH TYR 79 HH TYR 79 -3.381 -6.476 -2.074 548 H THR 80 H THR 80 2.451 -9.400 -7.336 549 HA THR 80 HA THR 80 -0.268 -10.511 -7.173 550 HB THR 80 HB THR 80 2.082 -11.740 -8.615 551 HG1 THR 80 1HG THR 80 1.268 -9.566 -9.377 552 HG21 THR 80 3HG2 THR 80 -0.724 -12.460 -8.179 553 HG22 THR 80 1HG2 THR 80 0.644 -13.468 -8.647 554 HG23 THR 80 2HG2 THR 80 -0.219 -12.531 -9.867 555 HA PRO 81 HA PRO 81 1.644 -12.447 -3.524 556 HB2 PRO 81 1HB PRO 81 -0.724 -12.937 -2.290 557 HB3 PRO 81 2HB PRO 81 0.092 -11.371 -2.216 558 HG2 PRO 81 1HG PRO 81 -2.177 -12.245 -3.962 559 HG3 PRO 81 2HG PRO 81 -1.963 -10.717 -3.087 560 HD2 PRO 81 1HD PRO 81 -1.467 -10.959 -5.738 561 HD3 PRO 81 2HD PRO 81 -0.557 -9.848 -4.693 562 H MET 82 H MET 82 2.061 -14.564 -3.231 563 HA MET 82 HA MET 82 0.657 -16.476 -4.926 564 HB2 MET 82 1HB MET 82 3.200 -16.310 -4.762 565 HB3 MET 82 2HB MET 82 3.040 -17.040 -3.170 566 HG2 MET 82 1HG MET 82 2.238 -19.055 -4.049 567 HG3 MET 82 2HG MET 82 1.891 -18.330 -5.617 568 HE1 MET 82 3HE MET 82 4.003 -18.436 -7.711 569 HE2 MET 82 1HE MET 82 4.450 -20.109 -7.379 570 HE3 MET 82 2HE MET 82 2.785 -19.578 -7.142 571 H ALA 83 H ALA 83 1.064 -15.643 -1.571 572 HA ALA 83 HA ALA 83 -0.767 -17.837 -0.851 573 HB1 ALA 83 3HB ALA 83 0.598 -17.230 1.477 574 HB2 ALA 83 1HB ALA 83 0.857 -18.637 0.445 575 HB3 ALA 83 2HB ALA 83 1.845 -17.191 0.230 576 HA PRO 84 HA PRO 84 -3.427 -14.683 0.692 577 HB2 PRO 84 1HB PRO 84 -4.913 -16.183 2.398 578 HB3 PRO 84 2HB PRO 84 -5.087 -16.271 0.641 579 HG2 PRO 84 1HG PRO 84 -3.586 -18.086 2.490 580 HG3 PRO 84 2HG PRO 84 -4.628 -18.501 1.115 581 HD2 PRO 84 1HD PRO 84 -1.925 -18.488 0.944 582 HD3 PRO 84 2HD PRO 84 -2.971 -18.075 -0.430 583 H GLY 85 H GLY 85 -4.364 -14.008 2.947 584 HA2 GLY 85 1HA GLY 85 -3.663 -14.286 5.402 585 HA3 GLY 85 2HA GLY 85 -2.066 -13.889 4.786 586 H ASN 86 H ASN 86 -1.658 -11.942 5.657 587 HA ASN 86 HA ASN 86 -3.507 -9.765 4.967 588 HB2 ASN 86 1HB ASN 86 -2.802 -8.741 7.233 589 HB3 ASN 86 2HB ASN 86 -4.005 -10.028 7.243 590 HD21 ASN 86 1HD2 ASN 86 -3.562 -10.656 9.327 591 HD22 ASN 86 2HD2 ASN 86 -2.099 -11.460 9.772 592 H TYR 87 H TYR 87 -2.488 -8.328 3.753 593 HA TYR 87 HA TYR 87 0.415 -7.981 4.114 594 HB2 TYR 87 1HB TYR 87 -1.313 -7.695 1.656 595 HB3 TYR 87 2HB TYR 87 0.344 -7.106 1.733 596 HD1 TYR 87 1HD TYR 87 -1.520 -10.249 2.553 597 HD2 TYR 87 2HD TYR 87 1.945 -8.485 0.825 598 HE1 TYR 87 1HE TYR 87 -0.704 -12.482 1.924 599 HE2 TYR 87 2HE TYR 87 2.770 -10.713 0.190 600 HH TYR 87 HH TYR 87 0.888 -13.419 0.117 601 H LEU 88 H LEU 88 1.228 -5.784 3.539 602 HA LEU 88 HA LEU 88 -0.719 -3.661 4.106 603 HB2 LEU 88 1HB LEU 88 0.809 -4.514 6.083 604 HB3 LEU 88 2HB LEU 88 2.000 -3.475 5.304 605 HG LEU 88 HG LEU 88 -0.681 -2.349 5.970 606 HD11 LEU 88 1HD1 LEU 88 0.453 -1.657 8.186 607 HD12 LEU 88 2HD1 LEU 88 1.468 -3.075 7.920 608 HD13 LEU 88 3HD1 LEU 88 -0.280 -3.256 8.062 609 HD21 LEU 88 3HD2 LEU 88 1.526 -1.322 4.783 610 HD22 LEU 88 1HD2 LEU 88 1.817 -0.884 6.466 611 HD23 LEU 88 2HD2 LEU 88 0.334 -0.366 5.665 612 H ILE 89 H ILE 89 -0.186 -1.610 3.278 613 HA ILE 89 HA ILE 89 2.118 -1.527 1.452 614 HB ILE 89 HB ILE 89 -0.597 -0.405 0.767 615 HG12 ILE 89 1HG1 ILE 89 0.688 -2.846 -0.454 616 HG13 ILE 89 2HG1 ILE 89 -0.451 -2.949 0.884 617 HG21 ILE 89 1HG2 ILE 89 1.357 0.722 -0.237 618 HG22 ILE 89 2HG2 ILE 89 1.851 -0.816 -0.943 619 HG23 ILE 89 3HG2 ILE 89 0.333 -0.067 -1.436 620 HD11 ILE 89 3HD1 ILE 89 -0.995 -2.815 -1.875 621 HD12 ILE 89 1HD1 ILE 89 -2.139 -2.873 -0.535 622 HD13 ILE 89 2HD1 ILE 89 -1.582 -1.318 -1.152 623 H SER 90 H SER 90 3.416 0.003 2.217 624 HA SER 90 HA SER 90 2.251 2.381 3.477 625 HB2 SER 90 1HB SER 90 4.916 1.025 3.646 626 HB3 SER 90 2HB SER 90 4.800 2.743 4.026 627 HG SER 90 HG SER 90 4.489 1.522 5.896 628 H VAL 91 H VAL 91 2.367 4.346 2.578 629 HA VAL 91 HA VAL 91 4.090 4.697 0.214 630 HB VAL 91 HB VAL 91 1.267 5.714 0.560 631 HG11 VAL 91 1HG1 VAL 91 3.463 6.656 -1.081 632 HG12 VAL 91 2HG1 VAL 91 2.064 6.184 -2.048 633 HG13 VAL 91 3HG1 VAL 91 1.889 7.389 -0.772 634 HG21 VAL 91 3HG2 VAL 91 0.965 3.555 -0.148 635 HG22 VAL 91 1HG2 VAL 91 1.138 4.373 -1.701 636 HG23 VAL 91 2HG2 VAL 91 2.506 3.504 -1.005 637 H LYS 92 H LYS 92 5.643 6.051 0.848 638 HA LYS 92 HA LYS 92 4.907 8.359 2.518 639 HB2 LYS 92 1HB LYS 92 7.430 6.775 2.213 640 HB3 LYS 92 2HB LYS 92 7.520 8.449 2.746 641 HG2 LYS 92 1HG LYS 92 5.837 7.801 4.540 642 HG3 LYS 92 2HG LYS 92 6.191 6.128 4.104 643 HD2 LYS 92 1HD LYS 92 8.316 8.121 4.868 644 HD3 LYS 92 2HD LYS 92 7.521 7.060 6.034 645 HE2 LYS 92 1HE LYS 92 9.390 5.828 5.508 646 HE3 LYS 92 2HE LYS 92 8.219 5.181 4.359 647 HZ1 LYS 92 3HZ LYS 92 9.901 7.453 3.561 648 HZ2 LYS 92 1HZ LYS 92 9.218 6.235 2.606 649 HZ3 LYS 92 2HZ LYS 92 10.570 5.900 3.565 650 H TYR 93 H TYR 93 5.739 10.430 2.000 651 HA TYR 93 HA TYR 93 7.071 10.823 -0.539 652 HB2 TYR 93 1HB TYR 93 4.768 10.685 -1.283 653 HB3 TYR 93 2HB TYR 93 4.266 11.846 -0.060 654 HD1 TYR 93 2HD TYR 93 4.827 14.225 -0.301 655 HD2 TYR 93 1HD TYR 93 5.825 11.402 -3.323 656 HE1 TYR 93 2HE TYR 93 5.198 16.066 -1.889 657 HE2 TYR 93 1HE TYR 93 6.200 13.235 -4.920 658 HH TYR 93 HH TYR 93 5.091 16.201 -4.609 659 H GLY 94 H GLY 94 8.637 12.190 -0.006 660 HA2 GLY 94 1HA GLY 94 9.691 14.079 0.771 661 HA3 GLY 94 2HA GLY 94 8.100 14.799 0.963 662 H GLY 95 H GLY 95 10.324 12.489 2.502 663 HA2 GLY 95 1HA GLY 95 11.021 12.703 4.766 664 HA3 GLY 95 2HA GLY 95 9.566 13.633 5.096 665 HA PRO 96 HA PRO 96 9.113 9.136 6.453 666 HB2 PRO 96 1HB PRO 96 8.905 9.621 9.116 667 HB3 PRO 96 2HB PRO 96 10.451 9.325 8.311 668 HG2 PRO 96 1HG PRO 96 9.199 11.924 9.110 669 HG3 PRO 96 2HG PRO 96 10.885 11.398 9.271 670 HD2 PRO 96 1HD PRO 96 10.054 13.038 7.283 671 HD3 PRO 96 2HD PRO 96 11.375 11.870 7.069 672 H ASN 97 H ASN 97 7.412 11.964 6.299 673 HA ASN 97 HA ASN 97 5.076 11.152 7.786 674 HB2 ASN 97 1HB ASN 97 5.556 13.461 5.892 675 HB3 ASN 97 2HB ASN 97 4.062 13.209 6.789 676 HD21 ASN 97 1HD2 ASN 97 5.965 15.418 6.883 677 HD22 ASN 97 2HD2 ASN 97 6.478 15.534 8.529 678 H HIS 98 H HIS 98 3.598 9.786 7.058 679 HA HIS 98 HA HIS 98 3.594 8.876 4.344 680 HB2 HIS 98 1HB HIS 98 1.669 7.484 5.071 681 HB3 HIS 98 2HB HIS 98 3.071 7.316 6.124 682 HD2 HIS 98 2HD HIS 98 1.835 10.410 7.482 683 HE1 HIS 98 1HE HIS 98 -0.746 7.542 9.245 684 HE2 HIS 98 2HE HIS 98 0.039 9.935 9.281 685 H ILE 99 H ILE 99 1.268 8.619 3.317 686 HA ILE 99 HA ILE 99 0.242 11.348 3.045 687 HB ILE 99 HB ILE 99 -0.768 10.616 0.963 688 HG12 ILE 99 1HG1 ILE 99 0.502 7.912 1.297 689 HG13 ILE 99 2HG1 ILE 99 -1.120 8.223 1.907 690 HG21 ILE 99 1HG2 ILE 99 2.077 9.634 1.122 691 HG22 ILE 99 2HG2 ILE 99 1.233 10.212 -0.313 692 HG23 ILE 99 3HG2 ILE 99 1.603 11.329 1.000 693 HD11 ILE 99 3HD1 ILE 99 -1.335 7.242 -0.236 694 HD12 ILE 99 1HD1 ILE 99 -1.748 8.949 -0.401 695 HD13 ILE 99 2HD1 ILE 99 -0.171 8.366 -0.938 696 H VAL 100 H VAL 100 -2.231 11.175 2.223 697 HA VAL 100 HA VAL 100 -3.709 10.468 4.552 698 HB VAL 100 HB VAL 100 -4.510 11.478 1.836 699 HG11 VAL 100 1HG1 VAL 100 -6.822 11.716 2.860 700 HG12 VAL 100 2HG1 VAL 100 -6.337 10.090 2.375 701 HG13 VAL 100 3HG1 VAL 100 -6.290 10.555 4.076 702 HG21 VAL 100 3HG2 VAL 100 -3.514 12.801 3.952 703 HG22 VAL 100 1HG2 VAL 100 -4.650 13.515 2.807 704 HG23 VAL 100 2HG2 VAL 100 -5.234 12.865 4.340 705 H GLY 101 H GLY 101 -5.190 8.831 4.881 706 HA2 GLY 101 1HA GLY 101 -6.466 6.939 4.291 707 HA3 GLY 101 2HA GLY 101 -5.594 6.853 2.768 708 H SER 102 H SER 102 -2.969 6.876 3.695 709 HA SER 102 HA SER 102 -2.671 4.141 4.446 710 HB2 SER 102 1HB SER 102 -0.855 6.391 3.759 711 HB3 SER 102 2HB SER 102 -0.170 5.083 4.724 712 HG SER 102 HG SER 102 0.102 4.338 2.729 713 HA PRO 103 HA PRO 103 -0.518 3.216 5.304 714 HB2 PRO 103 1HB PRO 103 -0.628 1.105 7.007 715 HB3 PRO 103 2HB PRO 103 0.594 2.375 7.131 716 HG2 PRO 103 1HG PRO 103 -1.943 2.030 8.681 717 HG3 PRO 103 2HG PRO 103 -0.333 2.496 9.260 718 HD2 PRO 103 1HD PRO 103 -2.305 4.301 8.830 719 HD3 PRO 103 2HD PRO 103 -0.589 4.687 8.591 720 H PHE 104 H PHE 104 -1.220 1.444 4.085 721 HA PHE 104 HA PHE 104 -4.116 1.050 4.107 722 HB2 PHE 104 1HB PHE 104 -2.013 0.370 2.044 723 HB3 PHE 104 2HB PHE 104 -3.725 -0.002 1.868 724 HD1 PHE 104 2HD PHE 104 -5.280 2.150 2.366 725 HD2 PHE 104 1HD PHE 104 -1.265 2.234 0.957 726 HE1 PHE 104 2HE PHE 104 -5.667 4.383 1.409 727 HE2 PHE 104 1HE PHE 104 -1.645 4.468 -0.002 728 HZ PHE 104 HZ PHE 104 -3.849 5.545 0.222 729 H LYS 105 H LYS 105 -4.948 -0.674 5.058 730 HA LYS 105 HA LYS 105 -3.246 -3.039 5.452 731 HB2 LYS 105 1HB LYS 105 -5.668 -2.021 6.931 732 HB3 LYS 105 2HB LYS 105 -5.036 -3.645 7.165 733 HG2 LYS 105 1HG LYS 105 -2.899 -2.714 7.888 734 HG3 LYS 105 2HG LYS 105 -3.528 -1.082 7.646 735 HD2 LYS 105 1HD LYS 105 -5.409 -1.846 9.266 736 HD3 LYS 105 2HD LYS 105 -4.265 -3.111 9.722 737 HE2 LYS 105 1HE LYS 105 -2.602 -1.403 10.271 738 HE3 LYS 105 2HE LYS 105 -3.741 -0.140 9.807 739 HZ1 LYS 105 3HZ LYS 105 -5.111 -1.656 11.616 740 HZ2 LYS 105 1HZ LYS 105 -4.379 -0.161 11.921 741 HZ3 LYS 105 2HZ LYS 105 -3.547 -1.594 12.258 742 H ALA 106 H ALA 106 -3.538 -4.491 3.887 743 HA ALA 106 HA ALA 106 -6.255 -4.932 2.851 744 HB1 ALA 106 3HB ALA 106 -3.776 -6.013 1.566 745 HB2 ALA 106 1HB ALA 106 -5.343 -5.651 0.840 746 HB3 ALA 106 2HB ALA 106 -4.267 -4.338 1.318 747 H LYS 107 H LYS 107 -6.906 -7.146 2.402 748 HA LYS 107 HA LYS 107 -5.566 -9.143 4.096 749 HB2 LYS 107 1HB LYS 107 -7.466 -8.431 5.368 750 HB3 LYS 107 2HB LYS 107 -8.518 -8.525 3.961 751 HG2 LYS 107 1HG LYS 107 -8.616 -10.835 4.025 752 HG3 LYS 107 2HG LYS 107 -7.127 -10.972 4.965 753 HD2 LYS 107 1HD LYS 107 -8.812 -11.458 6.508 754 HD3 LYS 107 2HD LYS 107 -8.427 -9.764 6.823 755 HE2 LYS 107 1HE LYS 107 -10.815 -10.026 6.808 756 HE3 LYS 107 2HE LYS 107 -10.336 -9.116 5.377 757 HZ1 LYS 107 3HZ LYS 107 -12.013 -11.086 5.200 758 HZ2 LYS 107 1HZ LYS 107 -10.608 -12.029 5.169 759 HZ3 LYS 107 2HZ LYS 107 -10.854 -10.839 3.992 760 H VAL 108 H VAL 108 -4.942 -10.807 2.902 761 HA VAL 108 HA VAL 108 -6.191 -11.301 0.319 762 HB VAL 108 HB VAL 108 -3.903 -12.873 1.477 763 HG11 VAL 108 1HG1 VAL 108 -3.308 -13.162 -0.880 764 HG12 VAL 108 2HG1 VAL 108 -4.943 -13.740 -0.551 765 HG13 VAL 108 3HG1 VAL 108 -4.700 -12.187 -1.351 766 HG21 VAL 108 3HG2 VAL 108 -2.333 -11.295 0.775 767 HG22 VAL 108 1HG2 VAL 108 -3.512 -10.418 -0.201 768 HG23 VAL 108 2HG2 VAL 108 -3.578 -10.323 1.559 769 H THR 109 H THR 109 -7.394 -13.052 -0.198 770 HA THR 109 HA THR 109 -7.660 -15.223 1.750 771 HB THR 109 HB THR 109 -10.131 -15.204 1.496 772 HG1 THR 109 1HG THR 109 -9.572 -12.773 0.126 773 HG21 THR 109 3HG2 THR 109 -9.006 -12.621 2.585 774 HG22 THR 109 1HG2 THR 109 -9.042 -14.158 3.448 775 HG23 THR 109 2HG2 THR 109 -10.551 -13.354 3.017 776 H GLY 110 H GLY 110 -8.392 -17.200 0.879 777 HA2 GLY 110 1HA GLY 110 -9.432 -18.226 -1.185 778 HA3 GLY 110 2HA GLY 110 -8.217 -17.313 -2.067 779 H GLN 111 H GLN 111 -8.593 -20.149 -2.142 780 HA GLN 111 HA GLN 111 -6.945 -21.659 -0.536 781 HB2 GLN 111 1HB GLN 111 -6.626 -23.081 -2.672 782 HB3 GLN 111 2HB GLN 111 -8.250 -22.879 -2.030 783 HG2 GLN 111 1HG GLN 111 -7.300 -20.960 -4.087 784 HG3 GLN 111 2HG GLN 111 -7.726 -22.595 -4.592 785 HE21 GLN 111 1HE2 GLN 111 -9.877 -23.369 -3.830 786 HE22 GLN 111 2HE2 GLN 111 -11.179 -22.233 -3.834 787 H ARG 112 H ARG 112 -4.792 -22.239 -0.537 788 HA ARG 112 HA ARG 112 -2.939 -20.267 -1.355 789 HB2 ARG 112 1HB ARG 112 -1.224 -21.804 -0.548 790 HB3 ARG 112 2HB ARG 112 -2.564 -21.720 0.588 791 HG2 ARG 112 1HG ARG 112 -3.351 -23.849 -0.015 792 HG3 ARG 112 2HG ARG 112 -2.355 -23.891 -1.471 793 HD2 ARG 112 1HD ARG 112 -1.295 -23.876 1.352 794 HD3 ARG 112 2HD ARG 112 -1.478 -25.316 0.351 795 HE ARG 112 HE ARG 112 0.058 -23.753 -1.193 796 HH11 ARG 112 1HH1 ARG 112 0.280 -24.646 2.164 797 HH12 ARG 112 2HH1 ARG 112 2.009 -24.549 2.211 798 HH21 ARG 112 1HH2 ARG 112 2.335 -23.621 -1.145 799 HH22 ARG 112 2HH2 ARG 112 3.177 -23.965 0.328 800 H LEU 113 H LEU 113 -1.500 -20.192 -3.035 801 HA LEU 113 HA LEU 113 -2.050 -22.027 -5.256 802 HB2 LEU 113 1HB LEU 113 -0.658 -19.353 -5.218 803 HB3 LEU 113 2HB LEU 113 -0.943 -20.331 -6.656 804 HG LEU 113 HG LEU 113 -3.078 -19.075 -4.932 805 HD11 LEU 113 1HD1 LEU 113 -3.244 -17.367 -6.435 806 HD12 LEU 113 2HD1 LEU 113 -2.580 -18.318 -7.763 807 HD13 LEU 113 3HD1 LEU 113 -1.509 -17.672 -6.520 808 HD21 LEU 113 3HD2 LEU 113 -3.225 -20.682 -7.478 809 HD22 LEU 113 1HD2 LEU 113 -4.563 -19.745 -6.813 810 HD23 LEU 113 2HD2 LEU 113 -3.903 -21.105 -5.904 811 H VAL 114 H VAL 114 -0.746 -23.751 -5.173 812 HA VAL 114 HA VAL 114 1.974 -23.552 -4.215 813 HB VAL 114 HB VAL 114 2.104 -25.962 -4.657 814 HG11 VAL 114 1HG1 VAL 114 1.263 -25.389 -2.523 815 HG12 VAL 114 2HG1 VAL 114 -0.323 -24.977 -3.177 816 HG13 VAL 114 3HG1 VAL 114 0.207 -26.659 -3.139 817 HG21 VAL 114 3HG2 VAL 114 0.243 -27.202 -5.545 818 HG22 VAL 114 1HG2 VAL 114 -0.731 -25.736 -5.658 819 HG23 VAL 114 2HG2 VAL 114 0.682 -25.938 -6.694 820 H SER 115 H SER 115 3.783 -24.461 -5.496 821 HA SER 115 HA SER 115 4.425 -23.069 -7.705 822 HB2 SER 115 1HB SER 115 5.221 -25.805 -6.796 823 HB3 SER 115 2HB SER 115 5.771 -25.245 -8.376 824 HG SER 115 HG SER 115 7.043 -23.822 -7.446 825 HA PRO 116 HA PRO 116 1.829 -24.300 -11.037 826 HB2 PRO 116 1HB PRO 116 3.421 -23.593 -13.119 827 HB3 PRO 116 2HB PRO 116 2.571 -22.412 -12.116 828 HG2 PRO 116 1HG PRO 116 5.427 -23.301 -11.986 829 HG3 PRO 116 2HG PRO 116 4.758 -21.664 -11.857 830 HD2 PRO 116 1HD PRO 116 5.511 -23.104 -9.692 831 HD3 PRO 116 2HD PRO 116 4.170 -21.942 -9.646 832 H GLY 117 H GLY 117 5.267 -25.155 -11.521 833 HA2 GLY 117 1HA GLY 117 5.969 -27.455 -11.643 834 HA3 GLY 117 2HA GLY 117 4.384 -27.859 -12.285 835 H SER 118 H SER 118 7.548 -26.616 -13.010 836 HA SER 118 HA SER 118 7.487 -25.569 -15.461 837 HB2 SER 118 1HB SER 118 9.319 -27.872 -14.748 838 HB3 SER 118 2HB SER 118 9.621 -26.629 -15.961 839 HG SER 118 HG SER 118 10.326 -25.381 -14.436 840 H ALA 119 H ALA 119 5.870 -26.080 -16.857 841 HA ALA 119 HA ALA 119 5.009 -28.693 -17.472 842 HB1 ALA 119 3HB ALA 119 3.480 -26.989 -17.942 843 HB2 ALA 119 1HB ALA 119 4.670 -26.044 -18.838 844 HB3 ALA 119 2HB ALA 119 4.022 -27.531 -19.530 845 H ASN 120 H ASN 120 6.516 -30.122 -18.158 846 HA ASN 120 HA ASN 120 8.012 -29.416 -20.597 847 HB2 ASN 120 1HB ASN 120 9.480 -29.642 -18.605 848 HB3 ASN 120 2HB ASN 120 8.914 -31.298 -18.405 849 HD21 ASN 120 1HD2 ASN 120 10.605 -32.521 -18.878 850 HD22 ASN 120 2HD2 ASN 120 11.541 -32.423 -20.328 851 H GLU 121 H GLU 121 8.063 -30.895 -22.247 852 HA GLU 121 HA GLU 121 6.762 -33.484 -21.841 853 HB2 GLU 121 1HB GLU 121 5.873 -31.335 -23.737 854 HB3 GLU 121 2HB GLU 121 5.598 -33.027 -24.124 855 HG2 GLU 121 1HG GLU 121 4.258 -33.328 -22.170 856 HG3 GLU 121 2HG GLU 121 4.667 -31.717 -21.583 857 H THR 122 H THR 122 7.794 -35.090 -22.847 858 HA THR 122 HA THR 122 10.270 -34.903 -23.968 859 HB THR 122 HB THR 122 9.077 -37.028 -23.316 860 HG1 THR 122 1HG THR 122 10.251 -37.195 -25.899 861 HG21 THR 122 3HG2 THR 122 7.037 -36.643 -24.653 862 HG22 THR 122 1HG2 THR 122 7.790 -38.196 -25.015 863 HG23 THR 122 2HG2 THR 122 7.986 -36.841 -26.127 864 H SER 123 H SER 123 11.109 -34.973 -26.096 865 HA SER 123 HA SER 123 9.344 -34.460 -28.333 866 HB2 SER 123 1HB SER 123 9.742 -32.215 -27.254 867 HB3 SER 123 2HB SER 123 11.452 -32.406 -27.640 868 HG SER 123 HG SER 123 9.957 -31.249 -29.190 869 H SER 124 H SER 124 10.676 -34.142 -30.385 870 HA SER 124 HA SER 124 13.022 -35.919 -30.250 871 HB2 SER 124 1HB SER 124 12.514 -36.601 -32.527 872 HB3 SER 124 2HB SER 124 11.077 -36.805 -31.525 873 HG SER 124 HG SER 124 10.738 -34.460 -32.380 874 H ILE 125 H ILE 125 14.564 -35.566 -32.148 875 HA ILE 125 HA ILE 125 15.887 -33.198 -31.939 876 HB ILE 125 HB ILE 125 16.684 -35.258 -33.149 877 HG12 ILE 125 1HG1 ILE 125 17.920 -33.108 -33.158 878 HG13 ILE 125 2HG1 ILE 125 18.160 -34.028 -34.639 879 HG21 ILE 125 1HG2 ILE 125 15.506 -35.967 -34.894 880 HG22 ILE 125 2HG2 ILE 125 14.556 -34.482 -34.920 881 HG23 ILE 125 3HG2 ILE 125 16.088 -34.564 -35.791 882 HD11 ILE 125 3HD1 ILE 125 17.758 -32.054 -35.616 883 HD12 ILE 125 1HD1 ILE 125 16.068 -32.487 -35.354 884 HD13 ILE 125 2HD1 ILE 125 16.891 -31.418 -34.218 Start of MODEL 8 1 H1 GLY 1 H GLY 1 0.026 28.830 29.636 2 HA2 GLY 1 1HA GLY 1 1.611 28.405 27.587 3 HA3 GLY 1 2HA GLY 1 0.732 27.046 28.273 4 H SER 2 H SER 2 1.654 27.748 25.483 5 HA SER 2 HA SER 2 -0.962 27.577 24.139 6 HB2 SER 2 1HB SER 2 0.171 28.435 22.125 7 HB3 SER 2 2HB SER 2 0.338 29.553 23.479 8 HG SER 2 HG SER 2 2.262 27.875 22.303 9 H SER 3 H SER 3 2.385 26.386 23.989 10 HA SER 3 HA SER 3 1.608 24.203 22.248 11 HB2 SER 3 1HB SER 3 4.177 25.308 23.273 12 HB3 SER 3 2HB SER 3 4.151 23.606 22.813 13 HG SER 3 HG SER 3 3.214 24.369 20.778 14 H GLY 4 H GLY 4 0.607 22.506 23.110 15 HA2 GLY 4 1HA GLY 4 1.677 20.657 24.783 16 HA3 GLY 4 2HA GLY 4 0.935 21.803 25.889 17 H SER 5 H SER 5 -1.351 22.113 25.804 18 HA SER 5 HA SER 5 -2.938 19.969 25.906 19 HB2 SER 5 1HB SER 5 -3.515 22.776 25.052 20 HB3 SER 5 2HB SER 5 -4.797 21.573 24.917 21 HG SER 5 HG SER 5 -3.499 22.547 27.208 22 H SER 6 H SER 6 -4.229 18.719 24.564 23 HA SER 6 HA SER 6 -3.187 18.202 21.974 24 HB2 SER 6 1HB SER 6 -5.588 17.176 23.482 25 HB3 SER 6 2HB SER 6 -5.248 16.673 21.827 26 HG SER 6 HG SER 6 -3.473 16.410 24.028 27 H GLY 7 H GLY 7 -4.709 18.005 20.038 28 HA2 GLY 7 1HA GLY 7 -6.293 18.910 18.599 29 HA3 GLY 7 2HA GLY 7 -6.844 19.948 19.905 30 H PHE 8 H PHE 8 -4.340 21.140 20.521 31 HA PHE 8 HA PHE 8 -4.337 23.384 18.965 32 HB2 PHE 8 1HB PHE 8 -2.292 22.092 20.701 33 HB3 PHE 8 2HB PHE 8 -1.760 23.409 19.660 34 HD1 PHE 8 1HD PHE 8 -4.047 22.494 22.401 35 HD2 PHE 8 2HD PHE 8 -2.314 25.658 20.142 36 HE1 PHE 8 1HE PHE 8 -4.889 24.123 24.042 37 HE2 PHE 8 2HE PHE 8 -3.152 27.292 21.780 38 HZ PHE 8 HZ PHE 8 -4.441 26.525 23.734 39 H LYS 9 H LYS 9 -2.631 24.197 17.470 40 HA LYS 9 HA LYS 9 -2.558 22.798 15.102 41 HB2 LYS 9 1HB LYS 9 -0.802 24.970 16.208 42 HB3 LYS 9 2HB LYS 9 -0.482 24.280 14.622 43 HG2 LYS 9 1HG LYS 9 -3.238 25.215 15.204 44 HG3 LYS 9 2HG LYS 9 -1.983 26.426 14.933 45 HD2 LYS 9 1HD LYS 9 -1.420 24.986 12.840 46 HD3 LYS 9 2HD LYS 9 -3.050 24.347 13.063 47 HE2 LYS 9 1HE LYS 9 -2.517 27.299 12.977 48 HE3 LYS 9 2HE LYS 9 -2.740 26.361 11.501 49 HZ1 LYS 9 3HZ LYS 9 -4.901 25.628 12.397 50 HZ2 LYS 9 1HZ LYS 9 -4.824 27.302 12.162 51 HZ3 LYS 9 2HZ LYS 9 -4.689 26.660 13.721 52 H VAL 10 H VAL 10 -0.871 21.699 13.969 53 HA VAL 10 HA VAL 10 0.630 19.917 15.692 54 HB VAL 10 HB VAL 10 0.614 19.943 12.676 55 HG11 VAL 10 1HG1 VAL 10 2.264 18.578 14.239 56 HG12 VAL 10 2HG1 VAL 10 0.883 17.482 14.313 57 HG13 VAL 10 3HG1 VAL 10 1.602 17.892 12.756 58 HG21 VAL 10 3HG2 VAL 10 -1.307 18.631 14.592 59 HG22 VAL 10 1HG2 VAL 10 -1.677 19.809 13.332 60 HG23 VAL 10 2HG2 VAL 10 -1.156 18.182 12.893 61 H ARG 11 H ARG 11 2.656 20.268 16.290 62 HA ARG 11 HA ARG 11 4.189 22.459 15.533 63 HB2 ARG 11 1HB ARG 11 5.971 21.495 16.769 64 HB3 ARG 11 2HB ARG 11 4.490 20.997 17.575 65 HG2 ARG 11 1HG ARG 11 5.820 19.238 15.549 66 HG3 ARG 11 2HG ARG 11 6.336 19.257 17.236 67 HD2 ARG 11 1HD ARG 11 3.778 18.940 17.702 68 HD3 ARG 11 2HD ARG 11 3.759 18.339 16.044 69 HE ARG 11 HE ARG 11 4.854 16.451 16.748 70 HH11 ARG 11 1HH1 ARG 11 5.007 18.873 19.243 71 HH12 ARG 11 2HH1 ARG 11 5.667 17.797 20.429 72 HH21 ARG 11 1HH2 ARG 11 5.723 15.024 18.301 73 HH22 ARG 11 2HH2 ARG 11 6.075 15.608 19.892 74 H VAL 12 H VAL 12 5.802 22.806 14.060 75 HA VAL 12 HA VAL 12 7.007 20.776 12.494 76 HB VAL 12 HB VAL 12 4.793 20.708 11.430 77 HG11 VAL 12 1HG1 VAL 12 3.936 22.614 10.195 78 HG12 VAL 12 2HG1 VAL 12 4.140 23.034 11.897 79 HG13 VAL 12 3HG1 VAL 12 5.314 23.589 10.703 80 HG21 VAL 12 3HG2 VAL 12 6.885 21.959 9.652 81 HG22 VAL 12 1HG2 VAL 12 6.828 20.259 10.118 82 HG23 VAL 12 2HG2 VAL 12 5.537 20.948 9.134 83 H GLY 13 H GLY 13 8.686 21.559 11.205 84 HA2 GLY 13 1HA GLY 13 9.713 24.109 11.968 85 HA3 GLY 13 2HA GLY 13 10.424 23.012 10.793 86 H GLU 14 H GLU 14 10.925 24.610 9.309 87 HA GLU 14 HA GLU 14 9.203 26.634 8.435 88 HB2 GLU 14 1HB GLU 14 11.640 25.323 7.311 89 HB3 GLU 14 2HB GLU 14 10.701 26.386 6.273 90 HG2 GLU 14 1HG GLU 14 10.897 28.058 8.247 91 HG3 GLU 14 2HG GLU 14 12.244 27.034 8.742 92 HA PRO 15 HA PRO 15 6.313 24.741 5.732 93 HB2 PRO 15 1HB PRO 15 6.133 26.554 3.719 94 HB3 PRO 15 2HB PRO 15 5.465 26.839 5.330 95 HG2 PRO 15 1HG PRO 15 8.044 27.799 4.152 96 HG3 PRO 15 2HG PRO 15 6.868 28.684 5.141 97 HD2 PRO 15 1HD PRO 15 9.156 27.662 6.165 98 HD3 PRO 15 2HD PRO 15 7.658 27.785 7.110 99 H GLY 16 H GLY 16 6.424 23.133 4.289 100 HA2 GLY 16 1HA GLY 16 8.817 22.546 2.893 101 HA3 GLY 16 2HA GLY 16 7.280 21.719 2.694 102 H GLN 17 H GLN 17 9.203 22.420 0.647 103 HA GLN 17 HA GLN 17 7.959 24.591 -0.833 104 HB2 GLN 17 1HB GLN 17 10.497 24.050 -0.697 105 HB3 GLN 17 2HB GLN 17 10.135 22.821 -1.902 106 HG2 GLN 17 1HG GLN 17 9.680 24.352 -3.535 107 HG3 GLN 17 2HG GLN 17 9.199 25.599 -2.385 108 HE21 GLN 17 1HE2 GLN 17 11.270 25.242 -4.665 109 HE22 GLN 17 2HE2 GLN 17 12.696 25.955 -3.999 110 H ALA 18 H ALA 18 6.126 24.137 -1.862 111 HA ALA 18 HA ALA 18 4.486 22.919 -2.925 112 HB1 ALA 18 3HB ALA 18 6.912 23.009 -4.589 113 HB2 ALA 18 1HB ALA 18 5.684 21.846 -5.091 114 HB3 ALA 18 2HB ALA 18 5.271 23.554 -4.938 115 H GLY 19 H GLY 19 5.474 21.430 -0.786 116 HA2 GLY 19 1HA GLY 19 5.324 18.701 -1.904 117 HA3 GLY 19 2HA GLY 19 6.433 19.095 -0.599 118 H ASN 20 H ASN 20 3.283 18.120 -1.418 119 HA ASN 20 HA ASN 20 2.534 18.175 1.423 120 HB2 ASN 20 1HB ASN 20 1.373 19.963 -0.014 121 HB3 ASN 20 2HB ASN 20 0.510 18.622 -0.763 122 HD21 ASN 20 1HD2 ASN 20 -1.292 19.955 0.157 123 HD22 ASN 20 2HD2 ASN 20 -1.808 19.577 1.762 124 HA PRO 21 HA PRO 21 2.175 13.842 0.197 125 HB2 PRO 21 1HB PRO 21 2.167 12.901 2.744 126 HB3 PRO 21 2HB PRO 21 3.648 13.350 1.890 127 HG2 PRO 21 1HG PRO 21 2.071 14.914 3.896 128 HG3 PRO 21 2HG PRO 21 3.828 14.719 3.761 129 HD2 PRO 21 1HD PRO 21 2.534 16.926 2.873 130 HD3 PRO 21 2HD PRO 21 4.001 16.301 2.093 131 H ALA 22 H ALA 22 0.195 15.756 2.340 132 HA ALA 22 HA ALA 22 -1.848 13.889 2.851 133 HB1 ALA 22 3HB ALA 22 -2.143 16.883 2.668 134 HB2 ALA 22 1HB ALA 22 -3.183 15.759 3.544 135 HB3 ALA 22 2HB ALA 22 -1.523 16.024 4.078 136 H LEU 23 H LEU 23 -1.280 16.097 0.174 137 HA LEU 23 HA LEU 23 -3.822 15.815 -1.044 138 HB2 LEU 23 1HB LEU 23 -1.139 16.611 -2.155 139 HB3 LEU 23 2HB LEU 23 -2.633 16.655 -3.088 140 HG LEU 23 HG LEU 23 -2.205 18.232 -0.556 141 HD11 LEU 23 1HD1 LEU 23 -0.630 18.773 -2.496 142 HD12 LEU 23 2HD1 LEU 23 -1.577 20.096 -1.816 143 HD13 LEU 23 3HD1 LEU 23 -2.070 19.350 -3.336 144 HD21 LEU 23 3HD2 LEU 23 -4.509 17.994 -0.960 145 HD22 LEU 23 1HD2 LEU 23 -4.310 18.199 -2.700 146 HD23 LEU 23 2HD2 LEU 23 -4.086 19.575 -1.619 147 H VAL 24 H VAL 24 -0.710 14.192 -1.571 148 HA VAL 24 HA VAL 24 -1.275 12.638 -3.754 149 HB VAL 24 HB VAL 24 0.290 11.841 -1.297 150 HG11 VAL 24 1HG1 VAL 24 0.598 9.830 -2.183 151 HG12 VAL 24 2HG1 VAL 24 -0.529 10.240 -3.477 152 HG13 VAL 24 3HG1 VAL 24 1.195 10.556 -3.675 153 HG21 VAL 24 3HG2 VAL 24 0.883 13.427 -3.724 154 HG22 VAL 24 1HG2 VAL 24 1.529 13.568 -2.089 155 HG23 VAL 24 2HG2 VAL 24 2.137 12.316 -3.173 156 H SER 25 H SER 25 -2.593 10.992 -4.214 157 HA SER 25 HA SER 25 -3.872 9.552 -1.987 158 HB2 SER 25 1HB SER 25 -5.359 11.288 -3.137 159 HB3 SER 25 2HB SER 25 -5.313 10.233 -4.550 160 HG SER 25 HG SER 25 -7.114 9.747 -3.279 161 H ALA 26 H ALA 26 -4.964 7.494 -2.808 162 HA ALA 26 HA ALA 26 -3.514 6.290 -5.052 163 HB1 ALA 26 3HB ALA 26 -2.481 4.686 -3.860 164 HB2 ALA 26 1HB ALA 26 -2.654 5.833 -2.531 165 HB3 ALA 26 2HB ALA 26 -3.819 4.522 -2.723 166 H TYR 27 H TYR 27 -4.686 4.852 -6.227 167 HA TYR 27 HA TYR 27 -7.098 3.660 -5.182 168 HB2 TYR 27 1HB TYR 27 -8.516 4.617 -7.032 169 HB3 TYR 27 2HB TYR 27 -8.049 5.768 -5.786 170 HD1 TYR 27 2HD TYR 27 -6.958 4.542 -9.139 171 HD2 TYR 27 1HD TYR 27 -7.150 7.808 -6.418 172 HE1 TYR 27 2HE TYR 27 -6.032 6.027 -10.866 173 HE2 TYR 27 1HE TYR 27 -6.225 9.303 -8.139 174 HH TYR 27 HH TYR 27 -5.904 8.338 -11.430 175 H GLY 28 H GLY 28 -8.010 2.068 -6.610 176 HA2 GLY 28 1HA GLY 28 -7.361 1.380 -9.143 177 HA3 GLY 28 2HA GLY 28 -5.980 0.796 -8.226 178 H THR 29 H THR 29 -6.556 -1.336 -8.933 179 HA THR 29 HA THR 29 -8.974 -2.440 -7.682 180 HB THR 29 HB THR 29 -7.197 -3.732 -9.760 181 HG1 THR 29 1HG THR 29 -8.989 -3.189 -11.166 182 HG21 THR 29 3HG2 THR 29 -9.583 -4.586 -8.248 183 HG22 THR 29 1HG2 THR 29 -8.297 -5.549 -8.974 184 HG23 THR 29 2HG2 THR 29 -9.608 -4.928 -9.978 185 H GLY 30 H GLY 30 -5.575 -2.339 -7.399 186 HA2 GLY 30 1HA GLY 30 -5.152 -4.881 -6.185 187 HA3 GLY 30 2HA GLY 30 -4.065 -3.503 -6.110 188 H LEU 31 H LEU 31 -5.789 -1.648 -4.888 189 HA LEU 31 HA LEU 31 -5.442 -2.345 -2.170 190 HB2 LEU 31 1HB LEU 31 -7.104 -0.140 -3.379 191 HB3 LEU 31 2HB LEU 31 -6.621 -0.255 -1.688 192 HG LEU 31 HG LEU 31 -4.650 -0.008 -3.951 193 HD11 LEU 31 1HD1 LEU 31 -5.579 2.041 -4.190 194 HD12 LEU 31 2HD1 LEU 31 -4.562 2.399 -2.795 195 HD13 LEU 31 3HD1 LEU 31 -6.273 2.040 -2.569 196 HD21 LEU 31 3HD2 LEU 31 -3.061 0.473 -2.276 197 HD22 LEU 31 1HD2 LEU 31 -3.950 -0.937 -1.700 198 HD23 LEU 31 2HD2 LEU 31 -4.306 0.659 -1.039 199 H GLU 32 H GLU 32 -8.128 -2.602 -4.379 200 HA GLU 32 HA GLU 32 -10.332 -2.759 -2.810 201 HB2 GLU 32 1HB GLU 32 -9.596 -4.666 -5.037 202 HB3 GLU 32 2HB GLU 32 -11.213 -4.466 -4.378 203 HG2 GLU 32 1HG GLU 32 -9.692 -2.166 -5.550 204 HG3 GLU 32 2HG GLU 32 -10.653 -3.256 -6.548 205 H GLY 33 H GLY 33 -7.758 -5.142 -3.040 206 HA2 GLY 33 1HA GLY 33 -8.073 -6.188 -0.504 207 HA3 GLY 33 2HA GLY 33 -9.092 -7.171 -1.546 208 H GLY 34 H GLY 34 -7.622 -8.900 -0.817 209 HA2 GLY 34 1HA GLY 34 -5.054 -8.859 -2.272 210 HA3 GLY 34 2HA GLY 34 -5.374 -9.825 -0.839 211 H THR 35 H THR 35 -5.399 -9.733 -4.235 212 HA THR 35 HA THR 35 -7.030 -12.157 -4.442 213 HB THR 35 HB THR 35 -6.465 -11.715 -6.989 214 HG1 THR 35 1HG THR 35 -5.061 -9.972 -6.655 215 HG21 THR 35 3HG2 THR 35 -8.375 -9.755 -5.799 216 HG22 THR 35 1HG2 THR 35 -8.672 -11.479 -5.580 217 HG23 THR 35 2HG2 THR 35 -8.568 -10.802 -7.205 218 H THR 36 H THR 36 -5.942 -13.985 -4.119 219 HA THR 36 HA THR 36 -3.119 -14.194 -4.679 220 HB THR 36 HB THR 36 -4.814 -16.566 -3.993 221 HG1 THR 36 1HG THR 36 -4.328 -14.306 -2.399 222 HG21 THR 36 3HG2 THR 36 -2.860 -17.499 -3.405 223 HG22 THR 36 1HG2 THR 36 -2.333 -16.058 -2.537 224 HG23 THR 36 2HG2 THR 36 -2.108 -16.168 -4.283 225 H GLY 37 H GLY 37 -2.566 -14.311 -6.777 226 HA2 GLY 37 1HA GLY 37 -2.248 -16.049 -8.515 227 HA3 GLY 37 2HA GLY 37 -3.985 -16.304 -8.436 228 H ILE 38 H ILE 38 -4.380 -13.335 -8.166 229 HA ILE 38 HA ILE 38 -4.143 -12.735 -11.032 230 HB ILE 38 HB ILE 38 -5.891 -11.254 -9.083 231 HG12 ILE 38 1HG1 ILE 38 -6.460 -13.806 -10.588 232 HG13 ILE 38 2HG1 ILE 38 -6.634 -13.503 -8.863 233 HG21 ILE 38 1HG2 ILE 38 -6.486 -11.672 -11.972 234 HG22 ILE 38 2HG2 ILE 38 -6.902 -10.321 -10.918 235 HG23 ILE 38 3HG2 ILE 38 -5.252 -10.499 -11.512 236 HD11 ILE 38 3HD1 ILE 38 -8.569 -13.253 -10.912 237 HD12 ILE 38 1HD1 ILE 38 -8.753 -12.979 -9.179 238 HD13 ILE 38 2HD1 ILE 38 -8.274 -11.651 -10.237 239 H GLN 39 H GLN 39 -3.367 -10.745 -11.747 240 HA GLN 39 HA GLN 39 -1.671 -9.346 -9.804 241 HB2 GLN 39 1HB GLN 39 -0.316 -10.062 -11.565 242 HB3 GLN 39 2HB GLN 39 -1.540 -9.711 -12.778 243 HG2 GLN 39 1HG GLN 39 -1.192 -7.318 -12.438 244 HG3 GLN 39 2HG GLN 39 0.038 -7.671 -11.226 245 HE21 GLN 39 1HE2 GLN 39 1.621 -9.474 -12.201 246 HE22 GLN 39 2HE2 GLN 39 2.313 -9.015 -13.716 247 H SER 40 H SER 40 -2.381 -7.481 -9.035 248 HA SER 40 HA SER 40 -4.305 -5.931 -10.630 249 HB2 SER 40 1HB SER 40 -3.746 -5.735 -7.661 250 HB3 SER 40 2HB SER 40 -5.041 -4.927 -8.544 251 HG SER 40 HG SER 40 -4.746 -7.663 -7.935 252 H GLU 41 H GLU 41 -4.168 -3.544 -10.391 253 HA GLU 41 HA GLU 41 -1.477 -2.539 -9.848 254 HB2 GLU 41 1HB GLU 41 -1.353 -1.355 -11.966 255 HB3 GLU 41 2HB GLU 41 -1.530 -3.080 -12.251 256 HG2 GLU 41 1HG GLU 41 -2.975 -2.172 -13.792 257 HG3 GLU 41 2HG GLU 41 -4.050 -2.549 -12.447 258 H PHE 42 H PHE 42 -1.506 -0.641 -8.820 259 HA PHE 42 HA PHE 42 -4.010 0.912 -8.857 260 HB2 PHE 42 1HB PHE 42 -3.753 1.430 -6.555 261 HB3 PHE 42 2HB PHE 42 -3.467 -0.302 -6.689 262 HD1 PHE 42 1HD PHE 42 -1.638 2.940 -6.644 263 HD2 PHE 42 2HD PHE 42 -1.581 -1.216 -5.728 264 HE1 PHE 42 1HE PHE 42 0.538 3.219 -5.530 265 HE2 PHE 42 2HE PHE 42 0.594 -0.943 -4.611 266 HZ PHE 42 HZ PHE 42 1.656 1.276 -4.510 267 H PHE 43 H PHE 43 -3.874 3.044 -9.272 268 HA PHE 43 HA PHE 43 -1.222 4.110 -9.899 269 HB2 PHE 43 1HB PHE 43 -3.915 5.326 -10.533 270 HB3 PHE 43 2HB PHE 43 -2.356 5.782 -11.212 271 HD1 PHE 43 1HD PHE 43 -1.142 4.104 -12.661 272 HD2 PHE 43 2HD PHE 43 -5.220 3.664 -11.524 273 HE1 PHE 43 1HE PHE 43 -1.484 2.518 -14.511 274 HE2 PHE 43 2HE PHE 43 -5.568 2.077 -13.371 275 HZ PHE 43 HZ PHE 43 -3.698 1.502 -14.868 276 H ILE 44 H ILE 44 -0.676 6.304 -9.281 277 HA ILE 44 HA ILE 44 -1.872 7.043 -6.691 278 HB ILE 44 HB ILE 44 0.945 7.417 -7.702 279 HG12 ILE 44 1HG1 ILE 44 -0.182 5.947 -5.308 280 HG13 ILE 44 2HG1 ILE 44 0.416 5.198 -6.784 281 HG21 ILE 44 1HG2 ILE 44 0.927 9.323 -6.523 282 HG22 ILE 44 2HG2 ILE 44 -0.561 8.900 -5.678 283 HG23 ILE 44 3HG2 ILE 44 0.984 8.265 -5.113 284 HD11 ILE 44 3HD1 ILE 44 1.849 6.001 -4.445 285 HD12 ILE 44 1HD1 ILE 44 2.407 5.075 -5.838 286 HD13 ILE 44 2HD1 ILE 44 2.487 6.838 -5.860 287 H ASN 45 H ASN 45 -2.665 9.048 -6.413 288 HA ASN 45 HA ASN 45 -2.831 10.773 -8.733 289 HB2 ASN 45 1HB ASN 45 -4.696 10.205 -6.970 290 HB3 ASN 45 2HB ASN 45 -3.950 11.512 -6.054 291 HD21 ASN 45 1HD2 ASN 45 -4.918 10.865 -9.410 292 HD22 ASN 45 2HD2 ASN 45 -5.685 12.392 -9.660 293 H THR 46 H THR 46 -0.415 11.094 -8.593 294 HA THR 46 HA THR 46 0.320 13.140 -6.618 295 HB THR 46 HB THR 46 1.786 11.122 -6.831 296 HG1 THR 46 1HG THR 46 3.746 12.450 -7.029 297 HG21 THR 46 3HG2 THR 46 2.870 10.547 -8.748 298 HG22 THR 46 1HG2 THR 46 2.970 12.212 -9.321 299 HG23 THR 46 2HG2 THR 46 1.460 11.314 -9.479 300 H THR 47 H THR 47 -1.336 13.640 -9.003 301 HA THR 47 HA THR 47 0.338 15.077 -10.860 302 HB THR 47 HB THR 47 -1.777 15.764 -11.925 303 HG1 THR 47 1HG THR 47 -2.812 14.742 -9.538 304 HG21 THR 47 3HG2 THR 47 -0.758 13.146 -11.689 305 HG22 THR 47 1HG2 THR 47 -1.722 13.816 -13.004 306 HG23 THR 47 2HG2 THR 47 -2.516 13.009 -11.651 307 H ARG 48 H ARG 48 -1.388 15.777 -7.955 308 HA ARG 48 HA ARG 48 -1.184 18.665 -8.421 309 HB2 ARG 48 1HB ARG 48 -2.629 17.093 -6.282 310 HB3 ARG 48 2HB ARG 48 -2.577 18.849 -6.360 311 HG2 ARG 48 1HG ARG 48 -3.533 18.496 -8.756 312 HG3 ARG 48 2HG ARG 48 -4.001 16.916 -8.126 313 HD2 ARG 48 1HD ARG 48 -5.489 17.806 -6.618 314 HD3 ARG 48 2HD ARG 48 -4.638 19.348 -6.528 315 HE ARG 48 HE ARG 48 -6.720 18.626 -8.364 316 HH11 ARG 48 1HH1 ARG 48 -3.944 20.668 -7.866 317 HH12 ARG 48 2HH1 ARG 48 -4.472 21.880 -8.986 318 HH21 ARG 48 1HH2 ARG 48 -7.425 20.214 -9.841 319 HH22 ARG 48 2HH2 ARG 48 -6.453 21.621 -10.108 320 H ALA 49 H ALA 49 0.170 16.069 -6.579 321 HA ALA 49 HA ALA 49 1.388 17.698 -4.562 322 HB1 ALA 49 3HB ALA 49 1.424 14.839 -5.311 323 HB2 ALA 49 1HB ALA 49 2.825 15.447 -4.429 324 HB3 ALA 49 2HB ALA 49 1.211 15.598 -3.734 325 H GLY 50 H GLY 50 2.514 16.147 -7.552 326 HA2 GLY 50 1HA GLY 50 4.082 17.436 -8.929 327 HA3 GLY 50 2HA GLY 50 4.883 17.908 -7.438 328 HA PRO 51 HA PRO 51 6.500 13.795 -9.353 329 HB2 PRO 51 1HB PRO 51 8.425 14.718 -11.030 330 HB3 PRO 51 2HB PRO 51 6.767 14.400 -11.554 331 HG2 PRO 51 1HG PRO 51 8.054 17.000 -10.819 332 HG3 PRO 51 2HG PRO 51 6.963 16.634 -12.168 333 HD2 PRO 51 1HD PRO 51 6.116 17.839 -9.897 334 HD3 PRO 51 2HD PRO 51 5.081 16.751 -10.843 335 H GLY 52 H GLY 52 8.823 13.041 -9.205 336 HA2 GLY 52 1HA GLY 52 11.024 14.207 -8.291 337 HA3 GLY 52 2HA GLY 52 10.022 14.273 -6.849 338 H THR 53 H THR 53 10.925 12.831 -5.509 339 HA THR 53 HA THR 53 11.459 10.128 -6.553 340 HB THR 53 HB THR 53 12.951 9.841 -4.579 341 HG1 THR 53 1HG THR 53 13.513 11.734 -3.412 342 HG21 THR 53 3HG2 THR 53 13.460 11.147 -6.961 343 HG22 THR 53 1HG2 THR 53 14.671 10.540 -5.832 344 HG23 THR 53 2HG2 THR 53 14.152 12.223 -5.747 345 H LEU 54 H LEU 54 10.026 8.640 -5.987 346 HA LEU 54 HA LEU 54 8.589 8.966 -3.435 347 HB2 LEU 54 1HB LEU 54 7.336 9.100 -5.701 348 HB3 LEU 54 2HB LEU 54 7.540 7.349 -5.725 349 HG LEU 54 HG LEU 54 6.409 7.447 -3.385 350 HD11 LEU 54 1HD1 LEU 54 4.716 9.608 -4.126 351 HD12 LEU 54 2HD1 LEU 54 6.381 10.186 -4.091 352 HD13 LEU 54 3HD1 LEU 54 5.686 9.413 -2.666 353 HD21 LEU 54 3HD2 LEU 54 4.416 8.111 -5.445 354 HD22 LEU 54 1HD2 LEU 54 4.554 6.690 -4.410 355 HD23 LEU 54 2HD2 LEU 54 5.542 6.819 -5.865 356 H SER 55 H SER 55 8.167 7.101 -2.197 357 HA SER 55 HA SER 55 9.754 4.731 -2.931 358 HB2 SER 55 1HB SER 55 10.828 6.156 -1.139 359 HB3 SER 55 2HB SER 55 9.450 5.772 -0.109 360 HG SER 55 HG SER 55 10.035 3.639 -0.130 361 H VAL 56 H VAL 56 8.822 2.774 -2.593 362 HA VAL 56 HA VAL 56 6.221 2.712 -1.216 363 HB VAL 56 HB VAL 56 5.593 2.681 -3.492 364 HG11 VAL 56 1HG1 VAL 56 7.795 2.297 -4.463 365 HG12 VAL 56 2HG1 VAL 56 7.738 0.609 -3.951 366 HG13 VAL 56 3HG1 VAL 56 6.602 1.203 -5.163 367 HG21 VAL 56 3HG2 VAL 56 4.476 0.623 -3.701 368 HG22 VAL 56 1HG2 VAL 56 5.744 -0.247 -2.836 369 HG23 VAL 56 2HG2 VAL 56 4.679 0.856 -1.964 370 H THR 57 H THR 57 5.968 1.082 0.187 371 HA THR 57 HA THR 57 7.734 -1.253 -0.004 372 HB THR 57 HB THR 57 7.288 0.350 2.522 373 HG1 THR 57 1HG THR 57 8.885 1.180 1.042 374 HG21 THR 57 3HG2 THR 57 8.738 -1.270 3.610 375 HG22 THR 57 1HG2 THR 57 8.885 -2.180 2.107 376 HG23 THR 57 2HG2 THR 57 7.328 -2.082 2.930 377 H ILE 58 H ILE 58 6.825 -3.164 0.612 378 HA ILE 58 HA ILE 58 4.118 -3.071 1.764 379 HB ILE 58 HB ILE 58 4.933 -5.044 -0.363 380 HG12 ILE 58 1HG1 ILE 58 3.240 -2.569 -0.748 381 HG13 ILE 58 2HG1 ILE 58 4.938 -2.671 -1.200 382 HG21 ILE 58 1HG2 ILE 58 2.408 -4.397 1.095 383 HG22 ILE 58 2HG2 ILE 58 2.338 -5.089 -0.525 384 HG23 ILE 58 3HG2 ILE 58 3.148 -5.965 0.773 385 HD11 ILE 58 3HD1 ILE 58 4.363 -3.523 -3.151 386 HD12 ILE 58 1HD1 ILE 58 3.595 -4.888 -2.341 387 HD13 ILE 58 2HD1 ILE 58 2.663 -3.433 -2.692 388 H GLU 59 H GLU 59 3.525 -4.826 3.067 389 HA GLU 59 HA GLU 59 5.679 -6.712 3.744 390 HB2 GLU 59 1HB GLU 59 4.078 -4.966 5.588 391 HB3 GLU 59 2HB GLU 59 4.731 -6.496 6.155 392 HG2 GLU 59 1HG GLU 59 6.977 -5.771 5.642 393 HG3 GLU 59 2HG GLU 59 6.361 -4.268 4.957 394 H GLY 60 H GLY 60 4.840 -8.590 5.059 395 HA2 GLY 60 1HA GLY 60 2.222 -9.348 5.345 396 HA3 GLY 60 2HA GLY 60 2.605 -9.733 3.674 397 HA PRO 61 HA PRO 61 3.801 -13.282 6.491 398 HB2 PRO 61 1HB PRO 61 2.273 -15.152 5.250 399 HB3 PRO 61 2HB PRO 61 1.674 -14.147 6.574 400 HG2 PRO 61 1HG PRO 61 1.285 -13.822 3.624 401 HG3 PRO 61 2HG PRO 61 0.106 -13.635 4.935 402 HD2 PRO 61 1HD PRO 61 1.314 -11.522 3.750 403 HD3 PRO 61 2HD PRO 61 0.837 -11.514 5.460 404 H SER 62 H SER 62 3.175 -13.309 2.985 405 HA SER 62 HA SER 62 5.726 -14.742 2.631 406 HB2 SER 62 1HB SER 62 3.091 -15.066 1.223 407 HB3 SER 62 2HB SER 62 4.595 -15.511 0.417 408 HG SER 62 HG SER 62 3.532 -17.230 1.623 409 H LYS 63 H LYS 63 7.221 -13.502 1.739 410 HA LYS 63 HA LYS 63 7.039 -10.972 0.814 411 HB2 LYS 63 1HB LYS 63 8.838 -13.106 -0.351 412 HB3 LYS 63 2HB LYS 63 9.088 -11.371 -0.488 413 HG2 LYS 63 1HG LYS 63 8.964 -12.800 2.152 414 HG3 LYS 63 2HG LYS 63 10.463 -12.554 1.254 415 HD2 LYS 63 1HD LYS 63 8.714 -10.200 1.770 416 HD3 LYS 63 2HD LYS 63 9.669 -10.846 3.106 417 HE2 LYS 63 1HE LYS 63 11.104 -9.279 2.204 418 HE3 LYS 63 2HE LYS 63 11.628 -10.757 1.400 419 HZ1 LYS 63 3HZ LYS 63 11.156 -8.568 0.061 420 HZ2 LYS 63 1HZ LYS 63 9.564 -9.140 0.099 421 HZ3 LYS 63 2HZ LYS 63 10.787 -10.086 -0.589 422 H VAL 64 H VAL 64 6.887 -9.948 -1.229 423 HA VAL 64 HA VAL 64 5.648 -11.554 -3.359 424 HB VAL 64 HB VAL 64 4.108 -9.670 -3.844 425 HG11 VAL 64 1HG1 VAL 64 3.877 -10.854 -1.080 426 HG12 VAL 64 2HG1 VAL 64 2.560 -10.107 -1.985 427 HG13 VAL 64 3HG1 VAL 64 3.315 -11.585 -2.582 428 HG21 VAL 64 3HG2 VAL 64 3.914 -8.289 -1.476 429 HG22 VAL 64 1HG2 VAL 64 5.656 -8.436 -1.705 430 HG23 VAL 64 2HG2 VAL 64 4.662 -7.692 -2.957 431 H LYS 65 H LYS 65 6.454 -11.199 -5.334 432 HA LYS 65 HA LYS 65 8.548 -9.207 -5.632 433 HB2 LYS 65 1HB LYS 65 7.570 -11.343 -7.537 434 HB3 LYS 65 2HB LYS 65 8.974 -10.316 -7.797 435 HG2 LYS 65 1HG LYS 65 9.684 -11.319 -5.454 436 HG3 LYS 65 2HG LYS 65 8.619 -12.627 -5.974 437 HD2 LYS 65 1HD LYS 65 10.685 -11.561 -7.853 438 HD3 LYS 65 2HD LYS 65 11.160 -12.685 -6.577 439 HE2 LYS 65 1HE LYS 65 8.823 -13.338 -8.314 440 HE3 LYS 65 2HE LYS 65 10.455 -13.567 -8.941 441 HZ1 LYS 65 3HZ LYS 65 10.828 -15.301 -7.579 442 HZ2 LYS 65 1HZ LYS 65 9.141 -15.415 -7.557 443 HZ3 LYS 65 2HZ LYS 65 9.952 -14.642 -6.291 444 H MET 66 H MET 66 7.226 -7.317 -5.594 445 HA MET 66 HA MET 66 5.360 -6.957 -7.808 446 HB2 MET 66 1HB MET 66 4.779 -4.843 -6.708 447 HB3 MET 66 2HB MET 66 4.652 -6.200 -5.596 448 HG2 MET 66 1HG MET 66 5.678 -4.559 -4.331 449 HG3 MET 66 2HG MET 66 7.023 -5.564 -4.863 450 HE1 MET 66 3HE MET 66 6.286 -2.581 -3.821 451 HE2 MET 66 1HE MET 66 7.290 -1.407 -4.673 452 HE3 MET 66 2HE MET 66 5.621 -1.670 -5.178 453 H ASP 67 H ASP 67 5.606 -5.426 -9.418 454 HA ASP 67 HA ASP 67 8.355 -4.470 -9.795 455 HB2 ASP 67 1HB ASP 67 6.094 -4.913 -11.750 456 HB3 ASP 67 2HB ASP 67 7.620 -4.149 -12.187 457 H CYS 68 H CYS 68 8.500 -2.361 -11.070 458 HA CYS 68 HA CYS 68 6.401 -0.463 -10.316 459 HB2 CYS 68 1HB CYS 68 8.089 1.141 -9.492 460 HB3 CYS 68 2HB CYS 68 8.040 -0.326 -8.522 461 HG CYS 68 HG CYS 68 10.671 0.102 -8.559 462 H GLN 69 H GLN 69 5.761 0.323 -12.213 463 HA GLN 69 HA GLN 69 7.795 0.921 -14.252 464 HB2 GLN 69 1HB GLN 69 4.877 0.226 -14.436 465 HB3 GLN 69 2HB GLN 69 5.698 1.035 -15.764 466 HG2 GLN 69 1HG GLN 69 6.827 -1.475 -14.606 467 HG3 GLN 69 2HG GLN 69 5.496 -1.542 -15.759 468 HE21 GLN 69 1HE2 GLN 69 8.819 -1.371 -15.376 469 HE22 GLN 69 2HE2 GLN 69 9.251 -1.012 -17.010 470 H GLU 70 H GLU 70 7.197 2.811 -15.698 471 HA GLU 70 HA GLU 70 6.390 5.051 -13.980 472 HB2 GLU 70 1HB GLU 70 8.254 4.779 -16.293 473 HB3 GLU 70 2HB GLU 70 7.471 6.331 -16.032 474 HG2 GLU 70 1HG GLU 70 8.332 6.180 -13.643 475 HG3 GLU 70 2HG GLU 70 9.353 4.864 -14.218 476 H THR 71 H THR 71 4.697 6.332 -14.472 477 HA THR 71 HA THR 71 3.356 5.932 -17.060 478 HB THR 71 HB THR 71 1.171 5.961 -16.001 479 HG1 THR 71 1HG THR 71 2.708 6.468 -13.701 480 HG21 THR 71 3HG2 THR 71 1.878 3.760 -16.246 481 HG22 THR 71 1HG2 THR 71 1.462 3.839 -14.535 482 HG23 THR 71 2HG2 THR 71 3.150 3.928 -15.037 483 HA PRO 72 HA PRO 72 3.202 10.318 -17.301 484 HB2 PRO 72 1HB PRO 72 0.980 10.649 -18.826 485 HB3 PRO 72 2HB PRO 72 2.508 10.041 -19.474 486 HG2 PRO 72 1HG PRO 72 0.067 8.522 -18.640 487 HG3 PRO 72 2HG PRO 72 1.093 8.295 -20.069 488 HD2 PRO 72 1HD PRO 72 1.296 6.733 -17.866 489 HD3 PRO 72 2HD PRO 72 2.692 7.126 -18.890 490 H GLU 73 H GLU 73 0.783 8.502 -15.744 491 HA GLU 73 HA GLU 73 -0.737 10.850 -14.909 492 HB2 GLU 73 1HB GLU 73 -2.081 8.955 -15.487 493 HB3 GLU 73 2HB GLU 73 -1.131 7.893 -14.457 494 HG2 GLU 73 1HG GLU 73 -3.232 8.364 -13.401 495 HG3 GLU 73 2HG GLU 73 -1.933 9.126 -12.485 496 H GLY 74 H GLY 74 1.582 8.543 -13.685 497 HA2 GLY 74 1HA GLY 74 2.579 10.101 -11.657 498 HA3 GLY 74 2HA GLY 74 1.246 9.221 -10.924 499 H TYR 75 H TYR 75 1.588 7.198 -10.221 500 HA TYR 75 HA TYR 75 3.922 5.727 -11.203 501 HB2 TYR 75 1HB TYR 75 3.428 6.610 -8.387 502 HB3 TYR 75 2HB TYR 75 4.229 5.069 -8.672 503 HD1 TYR 75 1HD TYR 75 6.014 5.489 -10.846 504 HD2 TYR 75 2HD TYR 75 4.963 8.202 -7.741 505 HE1 TYR 75 1HE TYR 75 8.157 6.656 -11.149 506 HE2 TYR 75 2HE TYR 75 7.103 9.378 -8.036 507 HH TYR 75 HH TYR 75 9.471 8.303 -10.459 508 H LYS 76 H LYS 76 3.433 3.685 -11.643 509 HA LYS 76 HA LYS 76 1.001 2.541 -10.434 510 HB2 LYS 76 1HB LYS 76 0.707 2.802 -12.804 511 HB3 LYS 76 2HB LYS 76 2.265 2.057 -13.133 512 HG2 LYS 76 1HG LYS 76 1.289 -0.027 -12.006 513 HG3 LYS 76 2HG LYS 76 -0.275 0.765 -12.212 514 HD2 LYS 76 1HD LYS 76 0.536 1.064 -14.681 515 HD3 LYS 76 2HD LYS 76 1.622 -0.268 -14.277 516 HE2 LYS 76 1HE LYS 76 -0.282 -1.641 -13.632 517 HE3 LYS 76 2HE LYS 76 -1.380 -0.305 -13.974 518 HZ1 LYS 76 3HZ LYS 76 -1.012 -0.483 -16.245 519 HZ2 LYS 76 1HZ LYS 76 -1.077 -2.098 -15.745 520 HZ3 LYS 76 2HZ LYS 76 0.417 -1.370 -16.060 521 H VAL 77 H VAL 77 1.171 0.723 -9.276 522 HA VAL 77 HA VAL 77 3.720 -0.757 -9.393 523 HB VAL 77 HB VAL 77 1.997 -0.229 -6.968 524 HG11 VAL 77 1HG1 VAL 77 2.918 -2.497 -6.944 525 HG12 VAL 77 2HG1 VAL 77 4.537 -1.842 -7.198 526 HG13 VAL 77 3HG1 VAL 77 3.663 -1.484 -5.708 527 HG21 VAL 77 3HG2 VAL 77 3.708 1.155 -6.173 528 HG22 VAL 77 1HG2 VAL 77 4.874 0.539 -7.344 529 HG23 VAL 77 2HG2 VAL 77 3.560 1.590 -7.875 530 H MET 78 H MET 78 3.630 -2.945 -9.515 531 HA MET 78 HA MET 78 0.953 -4.177 -9.486 532 HB2 MET 78 1HB MET 78 3.283 -4.648 -11.336 533 HB3 MET 78 2HB MET 78 1.990 -5.825 -11.153 534 HG2 MET 78 1HG MET 78 0.364 -4.214 -11.921 535 HG3 MET 78 2HG MET 78 1.605 -2.967 -12.009 536 HE1 MET 78 3HE MET 78 3.606 -3.099 -13.235 537 HE2 MET 78 1HE MET 78 4.158 -4.632 -13.912 538 HE3 MET 78 2HE MET 78 3.516 -3.380 -14.975 539 H TYR 79 H TYR 79 0.679 -5.841 -8.143 540 HA TYR 79 HA TYR 79 2.953 -7.467 -7.327 541 HB2 TYR 79 1HB TYR 79 2.779 -7.076 -5.024 542 HB3 TYR 79 2HB TYR 79 2.637 -5.467 -5.725 543 HD1 TYR 79 1HD TYR 79 0.490 -8.318 -4.620 544 HD2 TYR 79 2HD TYR 79 0.904 -4.103 -5.025 545 HE1 TYR 79 1HE TYR 79 -1.645 -8.001 -3.440 546 HE2 TYR 79 2HE TYR 79 -1.229 -3.774 -3.845 547 HH TYR 79 HH TYR 79 -3.291 -5.042 -3.385 548 H THR 80 H THR 80 2.414 -9.548 -7.002 549 HA THR 80 HA THR 80 -0.452 -10.212 -6.815 550 HB THR 80 HB THR 80 1.646 -11.729 -8.380 551 HG1 THR 80 1HG THR 80 1.059 -10.054 -9.650 552 HG21 THR 80 3HG2 THR 80 -0.076 -13.238 -9.020 553 HG22 THR 80 1HG2 THR 80 -1.323 -12.239 -8.275 554 HG23 THR 80 2HG2 THR 80 -0.161 -13.099 -7.265 555 HA PRO 81 HA PRO 81 1.112 -12.197 -3.110 556 HB2 PRO 81 1HB PRO 81 -1.336 -12.879 -2.154 557 HB3 PRO 81 2HB PRO 81 -0.670 -11.248 -2.013 558 HG2 PRO 81 1HG PRO 81 -2.635 -12.327 -3.997 559 HG3 PRO 81 2HG PRO 81 -2.656 -10.781 -3.130 560 HD2 PRO 81 1HD PRO 81 -1.831 -11.000 -5.700 561 HD3 PRO 81 2HD PRO 81 -1.148 -9.806 -4.577 562 H MET 82 H MET 82 1.737 -14.251 -2.821 563 HA MET 82 HA MET 82 0.678 -16.294 -4.601 564 HB2 MET 82 1HB MET 82 3.119 -16.033 -4.342 565 HB3 MET 82 2HB MET 82 2.971 -16.423 -2.633 566 HG2 MET 82 1HG MET 82 1.911 -18.617 -3.433 567 HG3 MET 82 2HG MET 82 2.590 -18.205 -5.006 568 HE1 MET 82 3HE MET 82 6.134 -18.903 -4.920 569 HE2 MET 82 1HE MET 82 4.846 -20.027 -5.354 570 HE3 MET 82 2HE MET 82 4.683 -18.313 -5.732 571 H ALA 83 H ALA 83 0.729 -15.467 -1.204 572 HA ALA 83 HA ALA 83 -1.141 -17.679 -0.698 573 HB1 ALA 83 3HB ALA 83 1.449 -17.622 0.271 574 HB2 ALA 83 1HB ALA 83 0.475 -17.049 1.626 575 HB3 ALA 83 2HB ALA 83 0.122 -18.610 0.883 576 HA PRO 84 HA PRO 84 -3.715 -14.680 1.215 577 HB2 PRO 84 1HB PRO 84 -4.942 -16.179 3.117 578 HB3 PRO 84 2HB PRO 84 -5.302 -16.332 1.394 579 HG2 PRO 84 1HG PRO 84 -3.534 -18.025 3.118 580 HG3 PRO 84 2HG PRO 84 -4.700 -18.526 1.879 581 HD2 PRO 84 1HD PRO 84 -2.035 -18.413 1.411 582 HD3 PRO 84 2HD PRO 84 -3.241 -18.087 0.149 583 H GLY 85 H GLY 85 -4.375 -13.852 3.463 584 HA2 GLY 85 1HA GLY 85 -3.427 -14.047 5.863 585 HA3 GLY 85 2HA GLY 85 -1.918 -13.633 5.064 586 H ASN 86 H ASN 86 -1.551 -11.673 5.996 587 HA ASN 86 HA ASN 86 -3.439 -9.544 5.269 588 HB2 ASN 86 1HB ASN 86 -2.747 -8.473 7.527 589 HB3 ASN 86 2HB ASN 86 -3.954 -9.755 7.539 590 HD21 ASN 86 1HD2 ASN 86 -3.672 -11.238 9.025 591 HD22 ASN 86 2HD2 ASN 86 -2.166 -11.702 9.734 592 H TYR 87 H TYR 87 -2.398 -8.228 3.936 593 HA TYR 87 HA TYR 87 0.485 -7.795 4.335 594 HB2 TYR 87 1HB TYR 87 -1.225 -7.443 1.865 595 HB3 TYR 87 2HB TYR 87 0.483 -7.026 1.962 596 HD1 TYR 87 1HD TYR 87 -1.683 -9.964 2.800 597 HD2 TYR 87 2HD TYR 87 1.926 -8.559 1.038 598 HE1 TYR 87 1HE TYR 87 -1.092 -12.271 2.184 599 HE2 TYR 87 2HE TYR 87 2.526 -10.861 0.416 600 HH TYR 87 HH TYR 87 0.352 -13.580 1.116 601 H LEU 88 H LEU 88 1.337 -5.704 4.291 602 HA LEU 88 HA LEU 88 -0.641 -3.542 4.615 603 HB2 LEU 88 1HB LEU 88 0.728 -4.400 6.661 604 HB3 LEU 88 2HB LEU 88 2.039 -3.472 5.937 605 HG LEU 88 HG LEU 88 0.341 -1.509 5.987 606 HD11 LEU 88 1HD1 LEU 88 -1.149 -3.596 7.282 607 HD12 LEU 88 2HD1 LEU 88 -1.659 -1.971 6.827 608 HD13 LEU 88 3HD1 LEU 88 -0.887 -2.248 8.388 609 HD21 LEU 88 3HD2 LEU 88 1.566 -0.750 7.697 610 HD22 LEU 88 1HD2 LEU 88 2.400 -2.301 7.608 611 HD23 LEU 88 2HD2 LEU 88 1.080 -2.075 8.756 612 H ILE 89 H ILE 89 -0.507 -2.058 3.080 613 HA ILE 89 HA ILE 89 2.015 -1.757 1.608 614 HB ILE 89 HB ILE 89 -0.691 -0.674 0.830 615 HG12 ILE 89 1HG1 ILE 89 0.573 -3.113 -0.386 616 HG13 ILE 89 2HG1 ILE 89 -0.425 -3.253 1.057 617 HG21 ILE 89 1HG2 ILE 89 1.719 0.069 -0.102 618 HG22 ILE 89 2HG2 ILE 89 1.383 -1.291 -1.172 619 HG23 ILE 89 3HG2 ILE 89 0.254 0.061 -1.084 620 HD11 ILE 89 3HD1 ILE 89 -1.224 -2.338 -1.682 621 HD12 ILE 89 1HD1 ILE 89 -1.852 -3.693 -0.743 622 HD13 ILE 89 2HD1 ILE 89 -2.220 -2.037 -0.259 623 H SER 90 H SER 90 3.266 -0.081 2.059 624 HA SER 90 HA SER 90 2.035 2.317 3.247 625 HB2 SER 90 1HB SER 90 4.615 0.910 3.767 626 HB3 SER 90 2HB SER 90 4.575 2.663 3.951 627 HG SER 90 HG SER 90 2.546 2.100 5.243 628 H VAL 91 H VAL 91 2.683 4.355 2.533 629 HA VAL 91 HA VAL 91 4.441 4.468 0.191 630 HB VAL 91 HB VAL 91 1.664 5.651 0.288 631 HG11 VAL 91 1HG1 VAL 91 3.999 6.518 -1.116 632 HG12 VAL 91 2HG1 VAL 91 2.805 5.924 -2.272 633 HG13 VAL 91 3HG1 VAL 91 2.373 7.201 -1.134 634 HG21 VAL 91 3HG2 VAL 91 2.652 3.822 -1.849 635 HG22 VAL 91 1HG2 VAL 91 2.149 3.142 -0.301 636 HG23 VAL 91 2HG2 VAL 91 1.010 4.086 -1.262 637 H LYS 92 H LYS 92 5.937 5.962 0.520 638 HA LYS 92 HA LYS 92 5.331 8.195 2.339 639 HB2 LYS 92 1HB LYS 92 7.842 6.697 1.698 640 HB3 LYS 92 2HB LYS 92 7.952 8.360 2.259 641 HG2 LYS 92 1HG LYS 92 7.027 7.845 4.340 642 HG3 LYS 92 2HG LYS 92 6.383 6.303 3.770 643 HD2 LYS 92 1HD LYS 92 8.944 5.805 3.334 644 HD3 LYS 92 2HD LYS 92 9.152 7.029 4.589 645 HE2 LYS 92 1HE LYS 92 9.100 4.909 5.669 646 HE3 LYS 92 2HE LYS 92 7.565 5.706 6.009 647 HZ1 LYS 92 3HZ LYS 92 6.578 3.898 5.231 648 HZ2 LYS 92 1HZ LYS 92 8.043 3.235 4.705 649 HZ3 LYS 92 2HZ LYS 92 7.170 4.269 3.690 650 H TYR 93 H TYR 93 6.087 10.305 1.808 651 HA TYR 93 HA TYR 93 6.828 10.735 -0.996 652 HB2 TYR 93 1HB TYR 93 4.389 11.013 -0.855 653 HB3 TYR 93 2HB TYR 93 4.596 12.205 0.424 654 HD1 TYR 93 2HD TYR 93 5.600 14.411 -0.094 655 HD2 TYR 93 1HD TYR 93 4.694 11.595 -3.151 656 HE1 TYR 93 2HE TYR 93 5.757 16.197 -1.777 657 HE2 TYR 93 1HE TYR 93 4.849 13.373 -4.843 658 HH TYR 93 HH TYR 93 5.200 16.736 -3.948 659 H GLY 94 H GLY 94 8.695 11.792 -0.949 660 HA2 GLY 94 1HA GLY 94 10.171 13.523 -0.538 661 HA3 GLY 94 2HA GLY 94 8.939 14.284 0.458 662 H GLY 95 H GLY 95 8.479 12.715 2.503 663 HA2 GLY 95 1HA GLY 95 11.102 11.973 3.626 664 HA3 GLY 95 2HA GLY 95 10.028 13.044 4.514 665 HA PRO 96 HA PRO 96 9.188 8.766 6.006 666 HB2 PRO 96 1HB PRO 96 8.939 9.489 8.610 667 HB3 PRO 96 2HB PRO 96 10.497 9.123 7.860 668 HG2 PRO 96 1HG PRO 96 9.233 11.782 8.401 669 HG3 PRO 96 2HG PRO 96 10.915 11.275 8.636 670 HD2 PRO 96 1HD PRO 96 10.117 12.727 6.495 671 HD3 PRO 96 2HD PRO 96 11.440 11.547 6.408 672 H ASN 97 H ASN 97 7.587 11.833 6.301 673 HA ASN 97 HA ASN 97 5.248 11.169 7.616 674 HB2 ASN 97 1HB ASN 97 5.715 13.090 5.330 675 HB3 ASN 97 2HB ASN 97 4.193 12.989 6.210 676 HD21 ASN 97 1HD2 ASN 97 4.711 15.271 6.616 677 HD22 ASN 97 2HD2 ASN 97 5.702 15.655 7.979 678 H HIS 98 H HIS 98 3.417 10.096 7.118 679 HA HIS 98 HA HIS 98 3.382 8.629 4.590 680 HB2 HIS 98 1HB HIS 98 1.585 7.287 5.683 681 HB3 HIS 98 2HB HIS 98 3.110 7.265 6.563 682 HD2 HIS 98 2HD HIS 98 3.082 8.689 9.022 683 HE1 HIS 98 1HE HIS 98 -1.141 9.078 9.133 684 HE2 HIS 98 2HE HIS 98 1.011 9.391 10.404 685 H ILE 99 H ILE 99 1.651 8.665 3.166 686 HA ILE 99 HA ILE 99 0.221 11.138 3.029 687 HB ILE 99 HB ILE 99 -0.802 10.216 0.993 688 HG12 ILE 99 1HG1 ILE 99 0.849 7.732 1.409 689 HG13 ILE 99 2HG1 ILE 99 -0.816 7.833 1.971 690 HG21 ILE 99 1HG2 ILE 99 1.342 11.297 0.799 691 HG22 ILE 99 2HG2 ILE 99 2.174 9.803 1.229 692 HG23 ILE 99 3HG2 ILE 99 1.291 9.913 -0.294 693 HD11 ILE 99 3HD1 ILE 99 -1.623 7.493 -0.068 694 HD12 ILE 99 1HD1 ILE 99 -0.522 8.665 -0.792 695 HD13 ILE 99 2HD1 ILE 99 0.014 7.009 -0.510 696 H VAL 100 H VAL 100 -2.216 10.980 2.396 697 HA VAL 100 HA VAL 100 -3.615 10.110 4.704 698 HB VAL 100 HB VAL 100 -4.537 11.174 2.044 699 HG11 VAL 100 1HG1 VAL 100 -6.383 9.891 2.524 700 HG12 VAL 100 2HG1 VAL 100 -6.143 10.003 4.269 701 HG13 VAL 100 3HG1 VAL 100 -6.781 11.383 3.375 702 HG21 VAL 100 3HG2 VAL 100 -3.548 12.834 3.441 703 HG22 VAL 100 1HG2 VAL 100 -5.295 13.062 3.512 704 HG23 VAL 100 2HG2 VAL 100 -4.454 12.276 4.847 705 H GLY 101 H GLY 101 -4.865 8.343 5.079 706 HA2 GLY 101 1HA GLY 101 -6.170 6.464 4.411 707 HA3 GLY 101 2HA GLY 101 -5.312 6.452 2.877 708 H SER 102 H SER 102 -2.702 6.427 3.605 709 HA SER 102 HA SER 102 -2.342 3.718 4.401 710 HB2 SER 102 1HB SER 102 0.140 4.422 4.367 711 HB3 SER 102 2HB SER 102 -0.756 4.511 2.851 712 HG SER 102 HG SER 102 0.212 6.446 2.976 713 HA PRO 103 HA PRO 103 -0.318 2.661 5.170 714 HB2 PRO 103 1HB PRO 103 -0.509 0.617 6.947 715 HB3 PRO 103 2HB PRO 103 0.827 1.775 6.954 716 HG2 PRO 103 1HG PRO 103 -1.628 1.706 8.665 717 HG3 PRO 103 2HG PRO 103 0.050 2.039 9.130 718 HD2 PRO 103 1HD PRO 103 -1.776 4.003 8.758 719 HD3 PRO 103 2HD PRO 103 -0.050 4.225 8.404 720 H PHE 104 H PHE 104 -1.411 1.396 3.784 721 HA PHE 104 HA PHE 104 -4.263 1.055 4.176 722 HB2 PHE 104 1HB PHE 104 -2.507 0.282 1.836 723 HB3 PHE 104 2HB PHE 104 -4.267 0.246 1.855 724 HD1 PHE 104 2HD PHE 104 -5.473 2.470 2.298 725 HD2 PHE 104 1HD PHE 104 -1.383 2.189 1.156 726 HE1 PHE 104 2HE PHE 104 -5.529 4.808 1.534 727 HE2 PHE 104 1HE PHE 104 -1.432 4.527 0.391 728 HZ PHE 104 HZ PHE 104 -3.507 5.839 0.578 729 H LYS 105 H LYS 105 -5.121 -0.687 5.071 730 HA LYS 105 HA LYS 105 -3.513 -3.116 5.315 731 HB2 LYS 105 1HB LYS 105 -6.008 -2.135 6.686 732 HB3 LYS 105 2HB LYS 105 -5.466 -3.801 6.838 733 HG2 LYS 105 1HG LYS 105 -3.600 -3.227 8.058 734 HG3 LYS 105 2HG LYS 105 -3.571 -1.576 7.435 735 HD2 LYS 105 1HD LYS 105 -4.324 -1.291 9.613 736 HD3 LYS 105 2HD LYS 105 -5.824 -1.320 8.684 737 HE2 LYS 105 1HE LYS 105 -5.756 -3.876 9.182 738 HE3 LYS 105 2HE LYS 105 -4.660 -3.408 10.480 739 HZ1 LYS 105 3HZ LYS 105 -7.241 -3.526 10.847 740 HZ2 LYS 105 1HZ LYS 105 -7.186 -1.954 10.224 741 HZ3 LYS 105 2HZ LYS 105 -6.303 -2.345 11.612 742 H ALA 106 H ALA 106 -3.700 -4.512 3.690 743 HA ALA 106 HA ALA 106 -6.319 -4.843 2.395 744 HB1 ALA 106 3HB ALA 106 -4.455 -4.225 0.920 745 HB2 ALA 106 1HB ALA 106 -3.599 -5.690 1.404 746 HB3 ALA 106 2HB ALA 106 -5.120 -5.808 0.518 747 H LYS 107 H LYS 107 -7.399 -6.724 2.504 748 HA LYS 107 HA LYS 107 -6.145 -8.913 4.015 749 HB2 LYS 107 1HB LYS 107 -8.245 -7.851 4.912 750 HB3 LYS 107 2HB LYS 107 -9.090 -8.480 3.504 751 HG2 LYS 107 1HG LYS 107 -8.053 -10.759 4.322 752 HG3 LYS 107 2HG LYS 107 -8.013 -9.913 5.871 753 HD2 LYS 107 1HD LYS 107 -10.087 -11.012 5.842 754 HD3 LYS 107 2HD LYS 107 -10.461 -9.338 5.425 755 HE2 LYS 107 1HE LYS 107 -11.684 -10.795 3.957 756 HE3 LYS 107 2HE LYS 107 -10.425 -9.980 3.029 757 HZ1 LYS 107 3HZ LYS 107 -10.870 -12.707 3.234 758 HZ2 LYS 107 1HZ LYS 107 -9.432 -12.408 4.074 759 HZ3 LYS 107 2HZ LYS 107 -9.582 -11.931 2.459 760 H VAL 108 H VAL 108 -5.608 -10.706 2.969 761 HA VAL 108 HA VAL 108 -6.540 -11.099 0.235 762 HB VAL 108 HB VAL 108 -4.539 -12.791 1.727 763 HG11 VAL 108 1HG1 VAL 108 -4.890 -12.298 -1.227 764 HG12 VAL 108 2HG1 VAL 108 -3.783 -13.440 -0.463 765 HG13 VAL 108 3HG1 VAL 108 -5.525 -13.698 -0.363 766 HG21 VAL 108 3HG2 VAL 108 -2.822 -11.364 1.214 767 HG22 VAL 108 1HG2 VAL 108 -3.680 -10.646 -0.150 768 HG23 VAL 108 2HG2 VAL 108 -4.114 -10.198 1.499 769 H THR 109 H THR 109 -7.617 -12.921 -0.485 770 HA THR 109 HA THR 109 -9.141 -14.330 1.558 771 HB THR 109 HB THR 109 -10.269 -15.323 -0.571 772 HG1 THR 109 1HG THR 109 -8.440 -14.247 -1.847 773 HG21 THR 109 3HG2 THR 109 -11.834 -13.942 0.214 774 HG22 THR 109 1HG2 THR 109 -11.147 -12.669 -0.794 775 HG23 THR 109 2HG2 THR 109 -10.613 -12.857 0.877 776 H GLY 110 H GLY 110 -9.502 -16.679 1.344 777 HA2 GLY 110 1HA GLY 110 -7.001 -18.056 1.184 778 HA3 GLY 110 2HA GLY 110 -8.569 -18.780 1.510 779 H GLN 111 H GLN 111 -6.325 -17.790 -0.992 780 HA GLN 111 HA GLN 111 -7.744 -19.568 -2.861 781 HB2 GLN 111 1HB GLN 111 -6.669 -16.811 -3.290 782 HB3 GLN 111 2HB GLN 111 -6.660 -17.949 -4.630 783 HG2 GLN 111 1HG GLN 111 -8.993 -16.795 -3.158 784 HG3 GLN 111 2HG GLN 111 -8.649 -16.780 -4.887 785 HE21 GLN 111 1HE2 GLN 111 -8.413 -19.114 -5.785 786 HE22 GLN 111 2HE2 GLN 111 -9.686 -20.194 -5.341 787 H ARG 112 H ARG 112 -5.624 -20.305 -1.120 788 HA ARG 112 HA ARG 112 -3.059 -20.246 -1.874 789 HB2 ARG 112 1HB ARG 112 -4.252 -21.759 -0.133 790 HB3 ARG 112 2HB ARG 112 -4.304 -22.943 -1.433 791 HG2 ARG 112 1HG ARG 112 -2.371 -23.528 -0.346 792 HG3 ARG 112 2HG ARG 112 -1.754 -22.461 -1.608 793 HD2 ARG 112 1HD ARG 112 -0.710 -21.913 0.499 794 HD3 ARG 112 2HD ARG 112 -1.771 -20.595 0.003 795 HE ARG 112 HE ARG 112 -3.337 -22.118 1.618 796 HH11 ARG 112 1HH1 ARG 112 -0.213 -20.622 1.972 797 HH12 ARG 112 2HH1 ARG 112 -0.375 -20.384 3.680 798 HH21 ARG 112 1HH2 ARG 112 -3.562 -21.810 3.867 799 HH22 ARG 112 2HH2 ARG 112 -2.281 -21.061 4.757 800 H LEU 113 H LEU 113 -1.994 -20.444 -3.721 801 HA LEU 113 HA LEU 113 -3.236 -21.856 -5.953 802 HB2 LEU 113 1HB LEU 113 -0.776 -20.117 -5.860 803 HB3 LEU 113 2HB LEU 113 -1.499 -20.795 -7.317 804 HG LEU 113 HG LEU 113 -3.166 -19.031 -5.587 805 HD11 LEU 113 1HD1 LEU 113 -2.251 -17.049 -6.333 806 HD12 LEU 113 2HD1 LEU 113 -1.403 -17.820 -7.673 807 HD13 LEU 113 3HD1 LEU 113 -0.814 -18.024 -6.024 808 HD21 LEU 113 3HD2 LEU 113 -3.337 -18.501 -8.364 809 HD22 LEU 113 1HD2 LEU 113 -4.534 -19.261 -7.316 810 HD23 LEU 113 2HD2 LEU 113 -3.337 -20.252 -8.150 811 H VAL 114 H VAL 114 -0.910 -22.382 -3.559 812 HA VAL 114 HA VAL 114 -0.222 -24.943 -4.653 813 HB VAL 114 HB VAL 114 1.407 -23.707 -5.899 814 HG11 VAL 114 1HG1 VAL 114 2.000 -22.363 -3.278 815 HG12 VAL 114 2HG1 VAL 114 3.128 -22.326 -4.635 816 HG13 VAL 114 3HG1 VAL 114 1.518 -21.626 -4.806 817 HG21 VAL 114 3HG2 VAL 114 3.533 -24.581 -4.900 818 HG22 VAL 114 1HG2 VAL 114 2.597 -25.061 -3.485 819 HG23 VAL 114 2HG2 VAL 114 2.247 -25.777 -5.058 820 H SER 115 H SER 115 0.512 -26.354 -3.105 821 HA SER 115 HA SER 115 0.178 -25.513 -0.370 822 HB2 SER 115 1HB SER 115 0.495 -27.886 0.173 823 HB3 SER 115 2HB SER 115 -0.670 -27.697 -1.137 824 HG SER 115 HG SER 115 0.661 -29.238 -1.874 825 HA PRO 116 HA PRO 116 4.396 -24.706 0.583 826 HB2 PRO 116 1HB PRO 116 4.333 -25.155 3.260 827 HB3 PRO 116 2HB PRO 116 3.617 -23.724 2.509 828 HG2 PRO 116 1HG PRO 116 2.292 -26.251 3.416 829 HG3 PRO 116 2HG PRO 116 1.758 -24.572 3.620 830 HD2 PRO 116 1HD PRO 116 0.749 -26.200 1.706 831 HD3 PRO 116 2HD PRO 116 0.917 -24.448 1.478 832 H GLY 117 H GLY 117 6.332 -25.711 1.489 833 HA2 GLY 117 1HA GLY 117 6.452 -28.334 2.461 834 HA3 GLY 117 2HA GLY 117 6.613 -28.404 0.713 835 H SER 118 H SER 118 8.712 -28.941 0.472 836 HA SER 118 HA SER 118 10.683 -26.922 1.054 837 HB2 SER 118 1HB SER 118 10.449 -28.387 3.161 838 HB3 SER 118 2HB SER 118 11.214 -29.656 2.205 839 HG SER 118 HG SER 118 12.280 -27.105 2.842 840 H ALA 119 H ALA 119 12.655 -27.244 -0.067 841 HA ALA 119 HA ALA 119 12.346 -28.809 -2.472 842 HB1 ALA 119 3HB ALA 119 13.475 -26.427 -2.049 843 HB2 ALA 119 1HB ALA 119 14.910 -27.444 -1.910 844 HB3 ALA 119 2HB ALA 119 13.941 -27.482 -3.383 845 H ASN 120 H ASN 120 14.490 -29.918 -3.258 846 HA ASN 120 HA ASN 120 15.262 -31.801 -1.137 847 HB2 ASN 120 1HB ASN 120 14.106 -32.513 -3.376 848 HB3 ASN 120 2HB ASN 120 15.720 -32.322 -4.054 849 HD21 ASN 120 1HD2 ASN 120 13.853 -33.994 -1.589 850 HD22 ASN 120 2HD2 ASN 120 14.889 -35.372 -1.478 851 H GLU 121 H GLU 121 17.499 -32.855 -1.667 852 HA GLU 121 HA GLU 121 19.479 -30.969 -1.208 853 HB2 GLU 121 1HB GLU 121 19.640 -33.785 -2.273 854 HB3 GLU 121 2HB GLU 121 21.070 -32.828 -1.915 855 HG2 GLU 121 1HG GLU 121 20.586 -34.281 -0.066 856 HG3 GLU 121 2HG GLU 121 20.315 -32.607 0.414 857 H THR 122 H THR 122 19.689 -29.293 -2.598 858 HA THR 122 HA THR 122 20.913 -29.838 -5.159 859 HB THR 122 HB THR 122 19.322 -28.341 -6.397 860 HG1 THR 122 1HG THR 122 17.876 -27.370 -5.206 861 HG21 THR 122 3HG2 THR 122 17.907 -30.083 -6.996 862 HG22 THR 122 1HG2 THR 122 17.806 -30.703 -5.349 863 HG23 THR 122 2HG2 THR 122 19.279 -30.937 -6.290 864 H SER 123 H SER 123 22.291 -28.247 -5.766 865 HA SER 123 HA SER 123 22.258 -25.770 -4.168 866 HB2 SER 123 1HB SER 123 24.677 -25.732 -4.250 867 HB3 SER 123 2HB SER 123 24.161 -27.304 -3.642 868 HG SER 123 HG SER 123 25.552 -26.685 -5.901 869 H SER 124 H SER 124 23.607 -23.999 -5.298 870 HA SER 124 HA SER 124 22.613 -23.807 -8.048 871 HB2 SER 124 1HB SER 124 22.214 -22.038 -6.146 872 HB3 SER 124 2HB SER 124 23.838 -21.501 -6.576 873 HG SER 124 HG SER 124 22.534 -20.360 -7.892 874 H ILE 125 H ILE 125 24.062 -22.431 -9.522 875 HA ILE 125 HA ILE 125 26.433 -23.825 -10.018 876 HB ILE 125 HB ILE 125 25.314 -22.621 -11.792 877 HG12 ILE 125 1HG1 ILE 125 27.368 -21.149 -12.530 878 HG13 ILE 125 2HG1 ILE 125 28.128 -21.858 -11.109 879 HG21 ILE 125 1HG2 ILE 125 26.229 -19.987 -10.735 880 HG22 ILE 125 2HG2 ILE 125 24.911 -20.358 -11.845 881 HG23 ILE 125 3HG2 ILE 125 24.734 -20.693 -10.123 882 HD11 ILE 125 3HD1 ILE 125 28.767 -23.400 -12.620 883 HD12 ILE 125 1HD1 ILE 125 27.186 -24.082 -12.243 884 HD13 ILE 125 2HD1 ILE 125 27.397 -23.088 -13.685 Start of MODEL 9 1 H1 GLY 1 H GLY 1 -41.814 31.584 -17.052 2 HA2 GLY 1 1HA GLY 1 -41.915 28.900 -16.113 3 HA3 GLY 1 2HA GLY 1 -41.710 28.936 -17.858 4 H SER 2 H SER 2 -39.681 28.828 -18.519 5 HA SER 2 HA SER 2 -37.442 28.678 -17.000 6 HB2 SER 2 1HB SER 2 -36.137 29.175 -18.986 7 HB3 SER 2 2HB SER 2 -37.551 28.228 -19.449 8 HG SER 2 HG SER 2 -37.004 30.949 -19.886 9 H SER 3 H SER 3 -35.760 30.079 -16.380 10 HA SER 3 HA SER 3 -36.516 32.926 -16.262 11 HB2 SER 3 1HB SER 3 -35.275 32.983 -14.069 12 HB3 SER 3 2HB SER 3 -36.754 32.023 -14.047 13 HG SER 3 HG SER 3 -35.325 30.684 -13.149 14 H GLY 4 H GLY 4 -33.703 30.756 -15.893 15 HA2 GLY 4 1HA GLY 4 -31.820 30.938 -17.398 16 HA3 GLY 4 2HA GLY 4 -32.161 32.657 -17.537 17 H SER 5 H SER 5 -29.688 32.380 -17.075 18 HA SER 5 HA SER 5 -29.340 33.059 -14.258 19 HB2 SER 5 1HB SER 5 -27.725 30.926 -15.674 20 HB3 SER 5 2HB SER 5 -27.299 31.624 -14.111 21 HG SER 5 HG SER 5 -29.585 30.930 -13.562 22 H SER 6 H SER 6 -28.429 34.994 -14.260 23 HA SER 6 HA SER 6 -26.654 35.743 -16.472 24 HB2 SER 6 1HB SER 6 -28.557 37.240 -16.043 25 HB3 SER 6 2HB SER 6 -28.002 37.478 -14.387 26 HG SER 6 HG SER 6 -27.316 39.172 -15.749 27 H GLY 7 H GLY 7 -24.562 36.369 -16.164 28 HA2 GLY 7 1HA GLY 7 -22.907 37.298 -14.555 29 HA3 GLY 7 2HA GLY 7 -23.527 36.121 -13.406 30 H PHE 8 H PHE 8 -21.150 36.755 -15.671 31 HA PHE 8 HA PHE 8 -20.203 33.998 -15.499 32 HB2 PHE 8 1HB PHE 8 -19.610 33.996 -17.916 33 HB3 PHE 8 2HB PHE 8 -21.347 34.037 -17.632 34 HD1 PHE 8 2HD PHE 8 -22.497 36.324 -17.731 35 HD2 PHE 8 1HD PHE 8 -18.604 35.577 -19.281 36 HE1 PHE 8 2HE PHE 8 -22.682 38.324 -19.152 37 HE2 PHE 8 1HE PHE 8 -18.783 37.576 -20.703 38 HZ PHE 8 HZ PHE 8 -20.824 38.952 -20.641 39 H LYS 9 H LYS 9 -18.274 34.155 -14.584 40 HA LYS 9 HA LYS 9 -16.340 36.064 -15.659 41 HB2 LYS 9 1HB LYS 9 -17.155 35.873 -12.762 42 HB3 LYS 9 2HB LYS 9 -15.617 36.564 -13.263 43 HG2 LYS 9 1HG LYS 9 -16.744 38.289 -14.509 44 HG3 LYS 9 2HG LYS 9 -18.313 37.554 -14.171 45 HD2 LYS 9 1HD LYS 9 -18.335 38.275 -11.999 46 HD3 LYS 9 2HD LYS 9 -16.575 38.267 -11.865 47 HE2 LYS 9 1HE LYS 9 -16.412 40.289 -13.148 48 HE3 LYS 9 2HE LYS 9 -18.136 40.251 -13.513 49 HZ1 LYS 9 3HZ LYS 9 -17.184 40.382 -10.723 50 HZ2 LYS 9 1HZ LYS 9 -18.688 40.833 -11.353 51 HZ3 LYS 9 2HZ LYS 9 -17.324 41.786 -11.657 52 H VAL 10 H VAL 10 -14.125 35.640 -14.513 53 HA VAL 10 HA VAL 10 -13.788 32.732 -14.173 54 HB VAL 10 HB VAL 10 -11.929 34.604 -15.647 55 HG11 VAL 10 1HG1 VAL 10 -11.465 31.727 -15.844 56 HG12 VAL 10 2HG1 VAL 10 -10.322 33.047 -15.587 57 HG13 VAL 10 3HG1 VAL 10 -11.219 32.377 -14.224 58 HG21 VAL 10 3HG2 VAL 10 -13.942 34.020 -16.918 59 HG22 VAL 10 1HG2 VAL 10 -12.498 33.290 -17.618 60 HG23 VAL 10 2HG2 VAL 10 -13.606 32.308 -16.660 61 H ARG 11 H ARG 11 -12.677 32.108 -12.426 62 HA ARG 11 HA ARG 11 -11.333 34.196 -10.845 63 HB2 ARG 11 1HB ARG 11 -11.721 32.731 -8.894 64 HB3 ARG 11 2HB ARG 11 -13.219 33.208 -9.682 65 HG2 ARG 11 1HG ARG 11 -12.830 30.913 -10.957 66 HG3 ARG 11 2HG ARG 11 -11.945 30.545 -9.475 67 HD2 ARG 11 1HD ARG 11 -13.846 30.818 -8.137 68 HD3 ARG 11 2HD ARG 11 -14.716 31.689 -9.399 69 HE ARG 11 HE ARG 11 -14.380 29.283 -10.524 70 HH11 ARG 11 1HH1 ARG 11 -15.506 30.226 -7.368 71 HH12 ARG 11 2HH1 ARG 11 -16.547 28.854 -7.185 72 HH21 ARG 11 1HH2 ARG 11 -15.747 27.471 -10.296 73 HH22 ARG 11 2HH2 ARG 11 -16.683 27.287 -8.851 74 H VAL 12 H VAL 12 -9.193 34.128 -10.862 75 HA VAL 12 HA VAL 12 -7.547 32.375 -12.102 76 HB VAL 12 HB VAL 12 -6.919 33.778 -9.501 77 HG11 VAL 12 1HG1 VAL 12 -5.162 32.493 -11.577 78 HG12 VAL 12 2HG1 VAL 12 -4.563 33.684 -10.421 79 HG13 VAL 12 3HG1 VAL 12 -5.234 32.157 -9.848 80 HG21 VAL 12 3HG2 VAL 12 -7.105 34.675 -12.314 81 HG22 VAL 12 1HG2 VAL 12 -7.384 35.564 -10.816 82 HG23 VAL 12 2HG2 VAL 12 -5.737 35.276 -11.377 83 H GLY 13 H GLY 13 -8.548 32.149 -8.692 84 HA2 GLY 13 1HA GLY 13 -9.134 29.952 -7.813 85 HA3 GLY 13 2HA GLY 13 -7.840 29.284 -8.796 86 H GLU 14 H GLU 14 -6.169 28.651 -7.624 87 HA GLU 14 HA GLU 14 -5.487 30.198 -5.210 88 HB2 GLU 14 1HB GLU 14 -5.366 27.249 -5.771 89 HB3 GLU 14 2HB GLU 14 -4.363 27.970 -4.521 90 HG2 GLU 14 1HG GLU 14 -6.149 28.461 -3.173 91 HG3 GLU 14 2HG GLU 14 -7.286 28.524 -4.518 92 HA PRO 15 HA PRO 15 -1.489 31.013 -6.821 93 HB2 PRO 15 1HB PRO 15 0.041 30.901 -4.581 94 HB3 PRO 15 2HB PRO 15 -1.086 32.223 -4.910 95 HG2 PRO 15 1HG PRO 15 -1.441 29.821 -3.158 96 HG3 PRO 15 2HG PRO 15 -1.888 31.509 -2.847 97 HD2 PRO 15 1HD PRO 15 -3.687 29.648 -3.642 98 HD3 PRO 15 2HD PRO 15 -3.819 31.360 -4.097 99 H GLY 16 H GLY 16 -1.911 28.114 -4.883 100 HA2 GLY 16 1HA GLY 16 -1.166 26.015 -5.900 101 HA3 GLY 16 2HA GLY 16 0.283 26.865 -6.417 102 H GLN 17 H GLN 17 0.491 24.497 -5.055 103 HA GLN 17 HA GLN 17 1.578 25.393 -2.471 104 HB2 GLN 17 1HB GLN 17 0.993 23.160 -1.545 105 HB3 GLN 17 2HB GLN 17 -0.411 24.125 -1.982 106 HG2 GLN 17 1HG GLN 17 0.753 22.029 -3.790 107 HG3 GLN 17 2HG GLN 17 -0.494 21.684 -2.593 108 HE21 GLN 17 1HE2 GLN 17 -0.144 22.048 -5.717 109 HE22 GLN 17 2HE2 GLN 17 -1.621 22.835 -6.144 110 H ALA 18 H ALA 18 3.487 24.389 -1.778 111 HA ALA 18 HA ALA 18 5.011 23.133 -3.947 112 HB1 ALA 18 3HB ALA 18 6.209 24.130 -1.389 113 HB2 ALA 18 1HB ALA 18 6.957 23.953 -2.977 114 HB3 ALA 18 2HB ALA 18 5.789 25.243 -2.691 115 H GLY 19 H GLY 19 4.757 20.973 -3.887 116 HA2 GLY 19 1HA GLY 19 4.776 18.813 -3.105 117 HA3 GLY 19 2HA GLY 19 6.012 19.385 -1.994 118 H ASN 20 H ASN 20 2.856 18.203 -2.302 119 HA ASN 20 HA ASN 20 2.448 18.529 0.579 120 HB2 ASN 20 1HB ASN 20 1.138 20.302 -0.540 121 HB3 ASN 20 2HB ASN 20 0.306 19.074 -1.489 122 HD21 ASN 20 1HD2 ASN 20 -1.680 19.750 -0.646 123 HD22 ASN 20 2HD2 ASN 20 -2.168 19.340 0.960 124 HA PRO 21 HA PRO 21 1.740 14.166 -0.024 125 HB2 PRO 21 1HB PRO 21 1.369 13.591 2.603 126 HB3 PRO 21 2HB PRO 21 2.966 13.857 1.894 127 HG2 PRO 21 1HG PRO 21 1.248 15.747 3.454 128 HG3 PRO 21 2HG PRO 21 2.994 15.466 3.572 129 HD2 PRO 21 1HD PRO 21 1.945 17.577 2.239 130 HD3 PRO 21 2HD PRO 21 3.458 16.791 1.744 131 H ALA 22 H ALA 22 -0.351 16.332 1.808 132 HA ALA 22 HA ALA 22 -2.537 14.710 2.271 133 HB1 ALA 22 3HB ALA 22 -3.629 17.180 1.593 134 HB2 ALA 22 1HB ALA 22 -3.143 16.635 3.199 135 HB3 ALA 22 2HB ALA 22 -2.013 17.545 2.196 136 H LEU 23 H LEU 23 -1.753 16.563 -0.650 137 HA LEU 23 HA LEU 23 -4.104 15.938 -2.073 138 HB2 LEU 23 1HB LEU 23 -1.350 16.763 -2.947 139 HB3 LEU 23 2HB LEU 23 -2.658 16.481 -4.095 140 HG LEU 23 HG LEU 23 -2.838 18.498 -1.866 141 HD11 LEU 23 1HD1 LEU 23 -2.559 19.824 -4.308 142 HD12 LEU 23 2HD1 LEU 23 -1.282 18.609 -4.282 143 HD13 LEU 23 3HD1 LEU 23 -1.408 19.783 -2.972 144 HD21 LEU 23 3HD2 LEU 23 -4.822 19.124 -2.761 145 HD22 LEU 23 1HD2 LEU 23 -4.832 17.445 -3.300 146 HD23 LEU 23 2HD2 LEU 23 -4.334 18.723 -4.408 147 H VAL 24 H VAL 24 -0.896 14.420 -2.030 148 HA VAL 24 HA VAL 24 -1.243 12.515 -4.000 149 HB VAL 24 HB VAL 24 0.252 12.174 -1.396 150 HG11 VAL 24 1HG1 VAL 24 0.003 10.505 -3.824 151 HG12 VAL 24 2HG1 VAL 24 1.622 10.686 -3.148 152 HG13 VAL 24 3HG1 VAL 24 0.317 10.039 -2.153 153 HG21 VAL 24 3HG2 VAL 24 2.048 13.244 -2.319 154 HG22 VAL 24 1HG2 VAL 24 1.587 12.829 -3.970 155 HG23 VAL 24 2HG2 VAL 24 0.744 14.123 -3.117 156 H SER 25 H SER 25 -2.286 10.611 -4.181 157 HA SER 25 HA SER 25 -3.453 9.369 -1.809 158 HB2 SER 25 1HB SER 25 -5.396 10.472 -2.328 159 HB3 SER 25 2HB SER 25 -4.980 10.625 -4.035 160 HG SER 25 HG SER 25 -5.694 8.174 -2.799 161 H ALA 26 H ALA 26 -4.186 7.175 -2.185 162 HA ALA 26 HA ALA 26 -3.174 5.942 -4.648 163 HB1 ALA 26 3HB ALA 26 -1.358 5.476 -3.297 164 HB2 ALA 26 1HB ALA 26 -2.349 5.298 -1.848 165 HB3 ALA 26 2HB ALA 26 -2.356 4.038 -3.083 166 H TYR 27 H TYR 27 -4.562 4.531 -5.503 167 HA TYR 27 HA TYR 27 -6.289 2.898 -3.891 168 HB2 TYR 27 1HB TYR 27 -8.394 3.762 -4.973 169 HB3 TYR 27 2HB TYR 27 -7.656 4.858 -3.810 170 HD1 TYR 27 2HD TYR 27 -7.929 4.172 -7.454 171 HD2 TYR 27 1HD TYR 27 -7.107 7.048 -4.428 172 HE1 TYR 27 2HE TYR 27 -7.896 5.947 -9.157 173 HE2 TYR 27 1HE TYR 27 -7.073 8.831 -6.123 174 HH TYR 27 HH TYR 27 -8.089 9.178 -8.448 175 H GLY 28 H GLY 28 -7.710 1.503 -5.281 176 HA2 GLY 28 1HA GLY 28 -7.722 1.200 -7.964 177 HA3 GLY 28 2HA GLY 28 -6.146 0.559 -7.524 178 H THR 29 H THR 29 -6.585 -1.545 -8.111 179 HA THR 29 HA THR 29 -8.820 -2.893 -6.777 180 HB THR 29 HB THR 29 -7.001 -4.036 -8.901 181 HG1 THR 29 1HG THR 29 -8.923 -3.550 -10.254 182 HG21 THR 29 3HG2 THR 29 -9.698 -4.861 -7.824 183 HG22 THR 29 1HG2 THR 29 -8.176 -5.738 -7.669 184 HG23 THR 29 2HG2 THR 29 -8.939 -5.568 -9.250 185 H GLY 30 H GLY 30 -5.369 -2.651 -6.766 186 HA2 GLY 30 1HA GLY 30 -4.959 -5.130 -5.329 187 HA3 GLY 30 2HA GLY 30 -3.735 -3.929 -5.714 188 H LEU 31 H LEU 31 -5.877 -1.978 -4.490 189 HA LEU 31 HA LEU 31 -4.832 -2.252 -1.763 190 HB2 LEU 31 1HB LEU 31 -6.052 0.090 -3.213 191 HB3 LEU 31 2HB LEU 31 -5.590 0.113 -1.513 192 HG LEU 31 HG LEU 31 -3.675 -0.340 -3.800 193 HD11 LEU 31 1HD1 LEU 31 -2.901 1.954 -3.291 194 HD12 LEU 31 2HD1 LEU 31 -4.284 2.149 -2.214 195 HD13 LEU 31 3HD1 LEU 31 -4.540 1.900 -3.941 196 HD21 LEU 31 3HD2 LEU 31 -1.953 -0.025 -2.140 197 HD22 LEU 31 1HD2 LEU 31 -3.024 -1.330 -1.631 198 HD23 LEU 31 2HD2 LEU 31 -3.163 0.264 -0.889 199 H GLU 32 H GLU 32 -7.704 -2.502 -3.614 200 HA GLU 32 HA GLU 32 -9.542 -2.029 -1.461 201 HB2 GLU 32 1HB GLU 32 -11.249 -2.520 -2.988 202 HB3 GLU 32 2HB GLU 32 -9.992 -1.791 -3.978 203 HG2 GLU 32 1HG GLU 32 -9.331 -3.893 -4.846 204 HG3 GLU 32 2HG GLU 32 -10.314 -4.761 -3.668 205 H GLY 33 H GLY 33 -7.819 -4.767 -2.741 206 HA2 GLY 33 1HA GLY 33 -8.386 -6.355 -0.455 207 HA3 GLY 33 2HA GLY 33 -9.352 -6.890 -1.822 208 H GLY 34 H GLY 34 -7.767 -8.756 -0.909 209 HA2 GLY 34 1HA GLY 34 -5.326 -8.676 -2.566 210 HA3 GLY 34 2HA GLY 34 -5.524 -9.663 -1.125 211 H THR 35 H THR 35 -5.793 -9.540 -4.503 212 HA THR 35 HA THR 35 -7.481 -11.920 -4.649 213 HB THR 35 HB THR 35 -6.895 -11.495 -7.219 214 HG1 THR 35 1HG THR 35 -6.794 -9.158 -7.489 215 HG21 THR 35 3HG2 THR 35 -9.109 -11.310 -5.829 216 HG22 THR 35 1HG2 THR 35 -9.005 -10.584 -7.431 217 HG23 THR 35 2HG2 THR 35 -8.831 -9.577 -5.994 218 H THR 36 H THR 36 -6.410 -13.753 -4.236 219 HA THR 36 HA THR 36 -3.631 -14.099 -4.857 220 HB THR 36 HB THR 36 -5.376 -16.437 -4.223 221 HG1 THR 36 1HG THR 36 -5.031 -14.169 -2.629 222 HG21 THR 36 3HG2 THR 36 -3.188 -16.349 -2.527 223 HG22 THR 36 1HG2 THR 36 -2.574 -15.687 -4.041 224 HG23 THR 36 2HG2 THR 36 -3.317 -17.287 -4.015 225 H GLY 37 H GLY 37 -2.945 -14.417 -6.871 226 HA2 GLY 37 1HA GLY 37 -2.730 -16.053 -8.658 227 HA3 GLY 37 2HA GLY 37 -4.469 -16.292 -8.566 228 H ILE 38 H ILE 38 -4.542 -13.197 -8.228 229 HA ILE 38 HA ILE 38 -4.420 -12.637 -11.119 230 HB ILE 38 HB ILE 38 -6.154 -11.206 -9.108 231 HG12 ILE 38 1HG1 ILE 38 -6.807 -13.537 -10.919 232 HG13 ILE 38 2HG1 ILE 38 -6.895 -13.500 -9.162 233 HG21 ILE 38 1HG2 ILE 38 -7.111 -10.097 -10.885 234 HG22 ILE 38 2HG2 ILE 38 -5.434 -10.221 -11.413 235 HG23 ILE 38 3HG2 ILE 38 -6.644 -11.336 -12.049 236 HD11 ILE 38 3HD1 ILE 38 -9.005 -13.167 -10.798 237 HD12 ILE 38 1HD1 ILE 38 -8.910 -12.520 -9.161 238 HD13 ILE 38 2HD1 ILE 38 -8.529 -11.489 -10.540 239 H GLN 39 H GLN 39 -3.578 -10.680 -11.829 240 HA GLN 39 HA GLN 39 -1.690 -9.445 -9.997 241 HB2 GLN 39 1HB GLN 39 -0.787 -9.989 -12.132 242 HB3 GLN 39 2HB GLN 39 -2.128 -9.223 -12.971 243 HG2 GLN 39 1HG GLN 39 -1.348 -7.044 -11.969 244 HG3 GLN 39 2HG GLN 39 0.107 -7.902 -11.465 245 HE21 GLN 39 1HE2 GLN 39 1.733 -8.018 -12.852 246 HE22 GLN 39 2HE2 GLN 39 1.650 -7.644 -14.536 247 H SER 40 H SER 40 -2.161 -7.678 -8.887 248 HA SER 40 HA SER 40 -4.373 -5.977 -9.803 249 HB2 SER 40 1HB SER 40 -3.079 -6.062 -7.068 250 HB3 SER 40 2HB SER 40 -4.552 -5.200 -7.512 251 HG SER 40 HG SER 40 -5.309 -7.047 -6.685 252 H GLU 41 H GLU 41 -4.152 -3.629 -9.406 253 HA GLU 41 HA GLU 41 -1.448 -2.584 -9.292 254 HB2 GLU 41 1HB GLU 41 -1.621 -1.366 -11.405 255 HB3 GLU 41 2HB GLU 41 -1.718 -3.101 -11.671 256 HG2 GLU 41 1HG GLU 41 -3.405 -2.410 -13.022 257 HG3 GLU 41 2HG GLU 41 -4.304 -2.641 -11.524 258 H PHE 42 H PHE 42 -1.384 -0.632 -8.345 259 HA PHE 42 HA PHE 42 -3.893 0.892 -8.136 260 HB2 PHE 42 1HB PHE 42 -3.569 1.303 -5.833 261 HB3 PHE 42 2HB PHE 42 -3.249 -0.417 -6.034 262 HD1 PHE 42 1HD PHE 42 -1.730 2.875 -5.451 263 HD2 PHE 42 2HD PHE 42 -1.073 -1.325 -5.663 264 HE1 PHE 42 1HE PHE 42 0.476 3.171 -4.403 265 HE2 PHE 42 2HE PHE 42 1.134 -1.036 -4.614 266 HZ PHE 42 HZ PHE 42 1.911 1.214 -3.982 267 H PHE 43 H PHE 43 -3.703 2.903 -8.849 268 HA PHE 43 HA PHE 43 -1.073 3.985 -9.418 269 HB2 PHE 43 1HB PHE 43 -3.872 4.921 -10.048 270 HB3 PHE 43 2HB PHE 43 -2.444 5.880 -10.423 271 HD1 PHE 43 1HD PHE 43 -0.822 5.089 -12.090 272 HD2 PHE 43 2HD PHE 43 -4.460 3.011 -11.340 273 HE1 PHE 43 1HE PHE 43 -0.558 3.868 -14.210 274 HE2 PHE 43 2HE PHE 43 -4.202 1.787 -13.458 275 HZ PHE 43 HZ PHE 43 -2.248 2.214 -14.896 276 H ILE 44 H ILE 44 -0.565 6.251 -8.863 277 HA ILE 44 HA ILE 44 -1.663 6.989 -6.228 278 HB ILE 44 HB ILE 44 1.186 7.166 -7.201 279 HG12 ILE 44 1HG1 ILE 44 -0.008 5.847 -4.754 280 HG13 ILE 44 2HG1 ILE 44 0.397 5.002 -6.244 281 HG21 ILE 44 1HG2 ILE 44 1.723 8.320 -5.133 282 HG22 ILE 44 2HG2 ILE 44 0.554 9.249 -6.070 283 HG23 ILE 44 3HG2 ILE 44 0.022 8.318 -4.670 284 HD11 ILE 44 3HD1 ILE 44 2.340 6.454 -4.464 285 HD12 ILE 44 1HD1 ILE 44 2.113 4.708 -4.546 286 HD13 ILE 44 2HD1 ILE 44 2.740 5.582 -5.944 287 H ASN 45 H ASN 45 -2.974 8.667 -6.637 288 HA ASN 45 HA ASN 45 -2.745 10.496 -8.730 289 HB2 ASN 45 1HB ASN 45 -4.730 10.029 -7.128 290 HB3 ASN 45 2HB ASN 45 -3.980 11.239 -6.091 291 HD21 ASN 45 1HD2 ASN 45 -5.974 10.679 -8.756 292 HD22 ASN 45 2HD2 ASN 45 -6.163 12.317 -9.270 293 H THR 46 H THR 46 -0.528 11.103 -8.792 294 HA THR 46 HA THR 46 0.211 13.099 -6.752 295 HB THR 46 HB THR 46 1.676 11.098 -6.712 296 HG1 THR 46 1HG THR 46 2.997 13.427 -7.694 297 HG21 THR 46 3HG2 THR 46 2.302 10.141 -8.623 298 HG22 THR 46 1HG2 THR 46 3.276 11.563 -8.990 299 HG23 THR 46 2HG2 THR 46 1.606 11.469 -9.551 300 H THR 47 H THR 47 -1.311 13.515 -9.215 301 HA THR 47 HA THR 47 0.504 14.831 -11.047 302 HB THR 47 HB THR 47 -1.392 15.271 -12.424 303 HG1 THR 47 1HG THR 47 -2.898 14.688 -10.085 304 HG21 THR 47 3HG2 THR 47 -2.505 13.013 -12.525 305 HG22 THR 47 1HG2 THR 47 -1.599 12.582 -11.076 306 HG23 THR 47 2HG2 THR 47 -0.743 12.981 -12.565 307 H ARG 48 H ARG 48 -1.434 15.666 -8.322 308 HA ARG 48 HA ARG 48 -1.323 18.519 -8.949 309 HB2 ARG 48 1HB ARG 48 -2.868 16.837 -7.036 310 HB3 ARG 48 2HB ARG 48 -2.560 18.511 -6.595 311 HG2 ARG 48 1HG ARG 48 -3.677 17.882 -9.287 312 HG3 ARG 48 2HG ARG 48 -4.731 17.868 -7.872 313 HD2 ARG 48 1HD ARG 48 -4.266 20.146 -7.396 314 HD3 ARG 48 2HD ARG 48 -2.940 20.186 -8.558 315 HE ARG 48 HE ARG 48 -5.704 20.596 -9.105 316 HH11 ARG 48 1HH1 ARG 48 -2.751 19.327 -10.443 317 HH12 ARG 48 2HH1 ARG 48 -3.230 19.589 -12.087 318 HH21 ARG 48 1HH2 ARG 48 -6.346 20.947 -11.266 319 HH22 ARG 48 2HH2 ARG 48 -5.274 20.512 -12.554 320 H ALA 49 H ALA 49 0.083 16.131 -6.841 321 HA ALA 49 HA ALA 49 1.282 18.016 -5.039 322 HB1 ALA 49 3HB ALA 49 1.339 15.076 -5.404 323 HB2 ALA 49 1HB ALA 49 2.699 15.816 -4.559 324 HB3 ALA 49 2HB ALA 49 1.057 16.035 -3.951 325 H GLY 50 H GLY 50 2.654 15.792 -7.479 326 HA2 GLY 50 1HA GLY 50 4.187 16.833 -9.132 327 HA3 GLY 50 2HA GLY 50 4.889 17.704 -7.777 328 HA PRO 51 HA PRO 51 6.765 13.327 -8.526 329 HB2 PRO 51 1HB PRO 51 8.695 13.875 -10.355 330 HB3 PRO 51 2HB PRO 51 7.071 13.340 -10.803 331 HG2 PRO 51 1HG PRO 51 8.211 16.108 -10.765 332 HG3 PRO 51 2HG PRO 51 7.181 15.339 -11.987 333 HD2 PRO 51 1HD PRO 51 6.208 17.056 -10.133 334 HD3 PRO 51 2HD PRO 51 5.255 15.702 -10.773 335 H GLY 52 H GLY 52 7.675 13.458 -6.504 336 HA2 GLY 52 1HA GLY 52 10.201 14.985 -6.325 337 HA3 GLY 52 2HA GLY 52 9.083 14.844 -4.977 338 H THR 53 H THR 53 8.852 12.810 -3.927 339 HA THR 53 HA THR 53 11.133 10.999 -4.386 340 HB THR 53 HB THR 53 9.779 11.619 -1.752 341 HG1 THR 53 1HG THR 53 11.135 13.249 -1.842 342 HG21 THR 53 3HG2 THR 53 10.594 9.310 -1.884 343 HG22 THR 53 1HG2 THR 53 11.557 10.265 -0.758 344 HG23 THR 53 2HG2 THR 53 12.185 9.898 -2.365 345 H LEU 54 H LEU 54 10.797 8.768 -4.097 346 HA LEU 54 HA LEU 54 7.985 7.917 -3.940 347 HB2 LEU 54 1HB LEU 54 10.082 6.854 -5.826 348 HB3 LEU 54 2HB LEU 54 8.452 6.209 -5.640 349 HG LEU 54 HG LEU 54 8.905 9.051 -6.489 350 HD11 LEU 54 1HD1 LEU 54 9.875 6.881 -7.916 351 HD12 LEU 54 2HD1 LEU 54 9.550 8.497 -8.542 352 HD13 LEU 54 3HD1 LEU 54 8.320 7.240 -8.667 353 HD21 LEU 54 3HD2 LEU 54 6.652 7.828 -5.756 354 HD22 LEU 54 1HD2 LEU 54 6.682 7.348 -7.453 355 HD23 LEU 54 2HD2 LEU 54 6.699 9.058 -7.020 356 H SER 55 H SER 55 7.685 6.583 -2.295 357 HA SER 55 HA SER 55 9.703 4.559 -1.689 358 HB2 SER 55 1HB SER 55 10.153 6.524 -0.211 359 HB3 SER 55 2HB SER 55 8.530 6.346 0.454 360 HG SER 55 HG SER 55 10.803 4.834 0.888 361 H VAL 56 H VAL 56 8.718 2.661 -1.634 362 HA VAL 56 HA VAL 56 6.028 2.484 -0.463 363 HB VAL 56 HB VAL 56 5.375 0.850 -2.194 364 HG11 VAL 56 1HG1 VAL 56 5.842 2.890 -4.078 365 HG12 VAL 56 2HG1 VAL 56 4.394 2.620 -3.107 366 HG13 VAL 56 3HG1 VAL 56 5.674 3.676 -2.509 367 HG21 VAL 56 3HG2 VAL 56 7.970 1.666 -3.499 368 HG22 VAL 56 1HG2 VAL 56 7.563 0.069 -2.871 369 HG23 VAL 56 2HG2 VAL 56 6.704 0.711 -4.271 370 H THR 57 H THR 57 5.573 0.602 0.645 371 HA THR 57 HA THR 57 7.629 -1.481 0.734 372 HB THR 57 HB THR 57 6.514 -0.179 3.226 373 HG1 THR 57 1HG THR 57 8.133 1.065 2.059 374 HG21 THR 57 3HG2 THR 57 6.956 -2.540 3.555 375 HG22 THR 57 1HG2 THR 57 8.188 -1.588 4.382 376 HG23 THR 57 2HG2 THR 57 8.560 -2.368 2.844 377 H ILE 58 H ILE 58 6.734 -3.427 0.592 378 HA ILE 58 HA ILE 58 3.893 -3.715 1.317 379 HB ILE 58 HB ILE 58 5.486 -5.394 -0.623 380 HG12 ILE 58 1HG1 ILE 58 3.261 -3.499 -1.337 381 HG13 ILE 58 2HG1 ILE 58 4.928 -2.944 -1.239 382 HG21 ILE 58 1HG2 ILE 58 3.697 -6.640 0.440 383 HG22 ILE 58 2HG2 ILE 58 2.545 -5.368 0.038 384 HG23 ILE 58 3HG2 ILE 58 3.294 -6.316 -1.246 385 HD11 ILE 58 3HD1 ILE 58 5.463 -3.865 -3.195 386 HD12 ILE 58 1HD1 ILE 58 4.592 -5.357 -2.841 387 HD13 ILE 58 2HD1 ILE 58 3.722 -3.953 -3.462 388 H GLU 59 H GLU 59 3.413 -4.979 2.984 389 HA GLU 59 HA GLU 59 5.452 -6.887 3.921 390 HB2 GLU 59 1HB GLU 59 4.641 -4.865 5.374 391 HB3 GLU 59 2HB GLU 59 3.236 -5.881 5.668 392 HG2 GLU 59 1HG GLU 59 5.962 -7.007 6.083 393 HG3 GLU 59 2HG GLU 59 5.275 -5.924 7.292 394 H GLY 60 H GLY 60 4.599 -8.833 5.024 395 HA2 GLY 60 1HA GLY 60 2.135 -9.872 5.141 396 HA3 GLY 60 2HA GLY 60 2.467 -9.984 3.419 397 HA PRO 61 HA PRO 61 4.121 -13.729 5.768 398 HB2 PRO 61 1HB PRO 61 2.486 -15.573 4.629 399 HB3 PRO 61 2HB PRO 61 2.069 -14.705 6.111 400 HG2 PRO 61 1HG PRO 61 1.199 -14.174 3.296 401 HG3 PRO 61 2HG PRO 61 0.240 -14.149 4.787 402 HD2 PRO 61 1HD PRO 61 1.160 -11.891 3.610 403 HD3 PRO 61 2HD PRO 61 0.965 -12.040 5.368 404 H SER 62 H SER 62 3.013 -13.384 2.412 405 HA SER 62 HA SER 62 5.397 -14.880 1.542 406 HB2 SER 62 1HB SER 62 2.630 -14.664 0.403 407 HB3 SER 62 2HB SER 62 3.987 -15.034 -0.660 408 HG SER 62 HG SER 62 4.468 -16.764 0.894 409 H LYS 63 H LYS 63 6.960 -13.608 0.823 410 HA LYS 63 HA LYS 63 6.600 -10.889 0.136 411 HB2 LYS 63 1HB LYS 63 8.719 -11.965 0.999 412 HB3 LYS 63 2HB LYS 63 8.952 -12.628 -0.613 413 HG2 LYS 63 1HG LYS 63 10.227 -10.750 -0.769 414 HG3 LYS 63 2HG LYS 63 8.679 -10.108 -1.324 415 HD2 LYS 63 1HD LYS 63 9.505 -8.540 0.237 416 HD3 LYS 63 2HD LYS 63 8.250 -9.445 1.086 417 HE2 LYS 63 1HE LYS 63 9.916 -9.460 2.660 418 HE3 LYS 63 2HE LYS 63 10.271 -10.958 1.802 419 HZ1 LYS 63 3HZ LYS 63 12.205 -9.420 2.255 420 HZ2 LYS 63 1HZ LYS 63 11.555 -8.393 1.079 421 HZ3 LYS 63 2HZ LYS 63 12.037 -9.959 0.661 422 H VAL 64 H VAL 64 6.616 -9.849 -1.844 423 HA VAL 64 HA VAL 64 6.279 -11.575 -4.210 424 HB VAL 64 HB VAL 64 4.708 -9.874 -5.108 425 HG11 VAL 64 1HG1 VAL 64 2.987 -10.387 -3.053 426 HG12 VAL 64 2HG1 VAL 64 3.360 -11.505 -4.367 427 HG13 VAL 64 3HG1 VAL 64 4.210 -11.637 -2.826 428 HG21 VAL 64 3HG2 VAL 64 4.915 -7.859 -4.110 429 HG22 VAL 64 1HG2 VAL 64 3.702 -8.512 -3.009 430 HG23 VAL 64 2HG2 VAL 64 5.408 -8.555 -2.567 431 H LYS 65 H LYS 65 7.672 -11.194 -5.795 432 HA LYS 65 HA LYS 65 9.512 -8.989 -5.626 433 HB2 LYS 65 1HB LYS 65 10.042 -11.359 -6.423 434 HB3 LYS 65 2HB LYS 65 9.244 -10.918 -7.927 435 HG2 LYS 65 1HG LYS 65 11.507 -10.564 -8.343 436 HG3 LYS 65 2HG LYS 65 10.871 -8.952 -8.009 437 HD2 LYS 65 1HD LYS 65 12.788 -8.966 -6.726 438 HD3 LYS 65 2HD LYS 65 11.579 -9.494 -5.554 439 HE2 LYS 65 1HE LYS 65 12.256 -11.880 -6.460 440 HE3 LYS 65 2HE LYS 65 13.745 -11.040 -6.890 441 HZ1 LYS 65 3HZ LYS 65 13.648 -10.217 -4.466 442 HZ2 LYS 65 1HZ LYS 65 14.171 -11.797 -4.769 443 HZ3 LYS 65 2HZ LYS 65 12.596 -11.518 -4.220 444 H MET 66 H MET 66 7.058 -7.878 -5.850 445 HA MET 66 HA MET 66 6.015 -7.376 -8.361 446 HB2 MET 66 1HB MET 66 5.195 -5.227 -7.397 447 HB3 MET 66 2HB MET 66 4.861 -6.629 -6.388 448 HG2 MET 66 1HG MET 66 5.604 -5.189 -4.802 449 HG3 MET 66 2HG MET 66 7.134 -5.933 -5.260 450 HE1 MET 66 3HE MET 66 8.831 -4.019 -7.486 451 HE2 MET 66 1HE MET 66 9.345 -3.422 -5.908 452 HE3 MET 66 2HE MET 66 8.883 -5.113 -6.103 453 H ASP 67 H ASP 67 6.073 -4.868 -9.144 454 HA ASP 67 HA ASP 67 8.898 -4.129 -9.492 455 HB2 ASP 67 1HB ASP 67 6.836 -4.162 -11.706 456 HB3 ASP 67 2HB ASP 67 8.527 -3.694 -11.859 457 H CYS 68 H CYS 68 9.078 -1.886 -10.503 458 HA CYS 68 HA CYS 68 6.959 -0.145 -9.424 459 HB2 CYS 68 1HB CYS 68 9.925 -0.017 -9.122 460 HB3 CYS 68 2HB CYS 68 9.036 1.497 -9.225 461 HG CYS 68 HG CYS 68 7.840 -0.750 -7.022 462 H GLN 69 H GLN 69 6.768 -0.963 -12.003 463 HA GLN 69 HA GLN 69 8.080 0.456 -13.977 464 HB2 GLN 69 1HB GLN 69 5.395 -0.809 -13.756 465 HB3 GLN 69 2HB GLN 69 5.675 0.273 -15.115 466 HG2 GLN 69 1HG GLN 69 7.789 -1.129 -15.524 467 HG3 GLN 69 2HG GLN 69 7.032 -2.311 -14.458 468 HE21 GLN 69 1HE2 GLN 69 7.590 -1.839 -17.522 469 HE22 GLN 69 2HE2 GLN 69 6.141 -2.442 -18.245 470 H GLU 70 H GLU 70 7.560 2.348 -15.161 471 HA GLU 70 HA GLU 70 6.396 4.434 -13.490 472 HB2 GLU 70 1HB GLU 70 8.228 4.376 -15.841 473 HB3 GLU 70 2HB GLU 70 7.257 5.819 -15.589 474 HG2 GLU 70 1HG GLU 70 9.310 6.230 -14.532 475 HG3 GLU 70 2HG GLU 70 8.167 5.876 -13.239 476 H THR 71 H THR 71 4.816 5.904 -14.269 477 HA THR 71 HA THR 71 3.320 5.071 -16.647 478 HB THR 71 HB THR 71 1.170 5.381 -15.397 479 HG1 THR 71 1HG THR 71 1.205 5.803 -13.305 480 HG21 THR 71 3HG2 THR 71 1.439 3.185 -14.069 481 HG22 THR 71 1HG2 THR 71 3.082 3.172 -14.707 482 HG23 THR 71 2HG2 THR 71 1.707 3.145 -15.811 483 HA PRO 72 HA PRO 72 3.020 9.379 -17.455 484 HB2 PRO 72 1HB PRO 72 0.697 9.467 -18.858 485 HB3 PRO 72 2HB PRO 72 2.196 8.803 -19.521 486 HG2 PRO 72 1HG PRO 72 -0.148 7.370 -18.332 487 HG3 PRO 72 2HG PRO 72 0.789 6.970 -19.784 488 HD2 PRO 72 1HD PRO 72 1.172 5.721 -17.412 489 HD3 PRO 72 2HD PRO 72 2.490 5.996 -18.570 490 H GLU 73 H GLU 73 0.915 7.787 -15.384 491 HA GLU 73 HA GLU 73 -0.777 10.099 -14.863 492 HB2 GLU 73 1HB GLU 73 -1.886 7.966 -14.829 493 HB3 GLU 73 2HB GLU 73 -0.714 7.317 -13.691 494 HG2 GLU 73 1HG GLU 73 -2.464 7.755 -12.297 495 HG3 GLU 73 2HG GLU 73 -1.560 9.263 -12.166 496 H GLY 74 H GLY 74 1.744 8.193 -13.270 497 HA2 GLY 74 1HA GLY 74 2.978 10.232 -11.926 498 HA3 GLY 74 2HA GLY 74 1.676 9.738 -10.854 499 H TYR 75 H TYR 75 1.573 7.153 -10.793 500 HA TYR 75 HA TYR 75 4.031 5.755 -10.917 501 HB2 TYR 75 1HB TYR 75 4.169 7.412 -8.854 502 HB3 TYR 75 2HB TYR 75 3.225 6.151 -8.069 503 HD1 TYR 75 2HD TYR 75 6.018 5.930 -10.535 504 HD2 TYR 75 1HD TYR 75 4.648 5.056 -6.603 505 HE1 TYR 75 2HE TYR 75 8.081 4.661 -10.105 506 HE2 TYR 75 1HE TYR 75 6.707 3.785 -6.162 507 HH TYR 75 HH TYR 75 8.687 3.156 -6.945 508 H LYS 76 H LYS 76 3.578 3.653 -11.039 509 HA LYS 76 HA LYS 76 1.097 2.672 -9.794 510 HB2 LYS 76 1HB LYS 76 0.646 2.883 -12.150 511 HB3 LYS 76 2HB LYS 76 2.148 2.065 -12.560 512 HG2 LYS 76 1HG LYS 76 1.290 0.001 -11.560 513 HG3 LYS 76 2HG LYS 76 -0.223 0.826 -11.176 514 HD2 LYS 76 1HD LYS 76 -0.662 -0.326 -13.172 515 HD3 LYS 76 2HD LYS 76 -0.373 1.342 -13.673 516 HE2 LYS 76 1HE LYS 76 2.096 0.519 -13.934 517 HE3 LYS 76 2HE LYS 76 1.348 -1.075 -14.018 518 HZ1 LYS 76 3HZ LYS 76 1.420 1.006 -15.983 519 HZ2 LYS 76 1HZ LYS 76 -0.151 0.441 -15.709 520 HZ3 LYS 76 2HZ LYS 76 1.068 -0.639 -16.167 521 H VAL 77 H VAL 77 1.171 0.652 -8.880 522 HA VAL 77 HA VAL 77 3.739 -0.782 -9.013 523 HB VAL 77 HB VAL 77 2.103 -0.247 -6.531 524 HG11 VAL 77 1HG1 VAL 77 2.880 -2.504 -6.409 525 HG12 VAL 77 2HG1 VAL 77 4.491 -2.035 -6.954 526 HG13 VAL 77 3HG1 VAL 77 3.911 -1.521 -5.370 527 HG21 VAL 77 3HG2 VAL 77 4.647 0.510 -5.975 528 HG22 VAL 77 1HG2 VAL 77 4.542 0.911 -7.690 529 HG23 VAL 77 2HG2 VAL 77 3.387 1.602 -6.550 530 H MET 78 H MET 78 3.382 -2.700 -9.905 531 HA MET 78 HA MET 78 0.797 -4.021 -9.462 532 HB2 MET 78 1HB MET 78 2.912 -4.649 -11.528 533 HB3 MET 78 2HB MET 78 1.303 -5.353 -11.432 534 HG2 MET 78 1HG MET 78 0.289 -3.238 -11.949 535 HG3 MET 78 2HG MET 78 1.855 -2.433 -11.893 536 HE1 MET 78 3HE MET 78 3.881 -3.454 -14.457 537 HE2 MET 78 1HE MET 78 2.919 -2.102 -15.055 538 HE3 MET 78 2HE MET 78 3.345 -2.193 -13.346 539 H TYR 79 H TYR 79 0.670 -5.760 -8.203 540 HA TYR 79 HA TYR 79 3.022 -7.449 -7.812 541 HB2 TYR 79 1HB TYR 79 3.009 -7.328 -5.460 542 HB3 TYR 79 2HB TYR 79 2.860 -5.655 -5.988 543 HD1 TYR 79 1HD TYR 79 0.983 -8.538 -4.628 544 HD2 TYR 79 2HD TYR 79 0.955 -4.358 -5.423 545 HE1 TYR 79 1HE TYR 79 -1.054 -8.300 -3.271 546 HE2 TYR 79 2HE TYR 79 -1.082 -4.109 -4.067 547 HH TYR 79 HH TYR 79 -3.057 -5.771 -3.391 548 H THR 80 H THR 80 2.527 -9.553 -7.776 549 HA THR 80 HA THR 80 -0.314 -10.289 -7.495 550 HB THR 80 HB THR 80 1.644 -12.046 -8.925 551 HG1 THR 80 1HG THR 80 1.506 -10.860 -10.738 552 HG21 THR 80 3HG2 THR 80 -0.260 -13.223 -9.049 553 HG22 THR 80 1HG2 THR 80 -0.767 -12.042 -10.255 554 HG23 THR 80 2HG2 THR 80 -1.245 -11.841 -8.569 555 HA PRO 81 HA PRO 81 1.394 -12.346 -3.862 556 HB2 PRO 81 1HB PRO 81 -1.027 -12.862 -2.747 557 HB3 PRO 81 2HB PRO 81 -0.234 -11.286 -2.635 558 HG2 PRO 81 1HG PRO 81 -2.404 -12.188 -4.490 559 HG3 PRO 81 2HG PRO 81 -2.251 -10.658 -3.607 560 HD2 PRO 81 1HD PRO 81 -1.621 -10.895 -6.230 561 HD3 PRO 81 2HD PRO 81 -0.777 -9.773 -5.143 562 H MET 82 H MET 82 1.587 -14.488 -3.277 563 HA MET 82 HA MET 82 0.303 -16.416 -5.089 564 HB2 MET 82 1HB MET 82 2.955 -16.316 -3.731 565 HB3 MET 82 2HB MET 82 2.235 -17.895 -4.019 566 HG2 MET 82 1HG MET 82 3.552 -17.570 -5.886 567 HG3 MET 82 2HG MET 82 1.951 -17.088 -6.441 568 HE1 MET 82 3HE MET 82 2.177 -15.643 -8.239 569 HE2 MET 82 1HE MET 82 3.258 -14.261 -8.424 570 HE3 MET 82 2HE MET 82 3.906 -15.901 -8.481 571 H ALA 83 H ALA 83 0.732 -15.522 -1.760 572 HA ALA 83 HA ALA 83 -1.080 -17.711 -0.986 573 HB1 ALA 83 3HB ALA 83 1.033 -16.688 0.878 574 HB2 ALA 83 1HB ALA 83 0.124 -18.198 0.947 575 HB3 ALA 83 2HB ALA 83 1.376 -17.978 -0.276 576 HA PRO 84 HA PRO 84 -3.610 -14.528 0.704 577 HB2 PRO 84 1HB PRO 84 -5.023 -16.003 2.492 578 HB3 PRO 84 2HB PRO 84 -5.290 -16.095 0.748 579 HG2 PRO 84 1HG PRO 84 -3.718 -17.923 2.522 580 HG3 PRO 84 2HG PRO 84 -4.835 -18.329 1.206 581 HD2 PRO 84 1HD PRO 84 -2.146 -18.352 0.892 582 HD3 PRO 84 2HD PRO 84 -3.257 -17.930 -0.426 583 H GLY 85 H GLY 85 -4.402 -13.804 2.984 584 HA2 GLY 85 1HA GLY 85 -3.605 -14.069 5.407 585 HA3 GLY 85 2HA GLY 85 -2.020 -13.747 4.719 586 H ASN 86 H ASN 86 -1.676 -11.868 5.882 587 HA ASN 86 HA ASN 86 -3.461 -9.621 5.212 588 HB2 ASN 86 1HB ASN 86 -2.421 -8.594 7.346 589 HB3 ASN 86 2HB ASN 86 -3.640 -9.851 7.537 590 HD21 ASN 86 1HD2 ASN 86 -0.533 -8.854 8.317 591 HD22 ASN 86 2HD2 ASN 86 0.032 -10.319 9.037 592 H TYR 87 H TYR 87 -2.603 -8.183 3.880 593 HA TYR 87 HA TYR 87 0.328 -7.876 3.839 594 HB2 TYR 87 1HB TYR 87 -1.697 -7.687 1.613 595 HB3 TYR 87 2HB TYR 87 -0.066 -7.046 1.457 596 HD1 TYR 87 1HD TYR 87 -1.623 -10.217 2.700 597 HD2 TYR 87 2HD TYR 87 1.376 -8.402 0.290 598 HE1 TYR 87 1HE TYR 87 -0.819 -12.444 2.033 599 HE2 TYR 87 2HE TYR 87 2.188 -10.623 -0.384 600 HH TYR 87 HH TYR 87 0.547 -13.322 -0.179 601 H LEU 88 H LEU 88 1.196 -5.852 3.928 602 HA LEU 88 HA LEU 88 -0.694 -3.608 4.203 603 HB2 LEU 88 1HB LEU 88 0.627 -4.554 6.275 604 HB3 LEU 88 2HB LEU 88 1.937 -3.588 5.601 605 HG LEU 88 HG LEU 88 -0.763 -2.523 6.426 606 HD11 LEU 88 1HD1 LEU 88 0.763 -1.367 8.166 607 HD12 LEU 88 2HD1 LEU 88 1.874 -2.693 7.825 608 HD13 LEU 88 3HD1 LEU 88 0.257 -3.035 8.438 609 HD21 LEU 88 3HD2 LEU 88 1.411 -1.432 4.855 610 HD22 LEU 88 1HD2 LEU 88 1.085 -0.462 6.292 611 HD23 LEU 88 2HD2 LEU 88 -0.209 -0.793 5.139 612 H ILE 89 H ILE 89 -0.330 -1.881 2.956 613 HA ILE 89 HA ILE 89 2.235 -1.748 1.511 614 HB ILE 89 HB ILE 89 -0.506 -0.879 0.592 615 HG12 ILE 89 1HG1 ILE 89 1.261 -2.773 -0.894 616 HG13 ILE 89 2HG1 ILE 89 0.409 -3.367 0.527 617 HG21 ILE 89 1HG2 ILE 89 2.170 -0.550 -0.759 618 HG22 ILE 89 2HG2 ILE 89 0.606 -0.235 -1.509 619 HG23 ILE 89 3HG2 ILE 89 1.139 0.739 -0.139 620 HD11 ILE 89 3HD1 ILE 89 -0.739 -3.738 -1.666 621 HD12 ILE 89 1HD1 ILE 89 -1.699 -2.908 -0.442 622 HD13 ILE 89 2HD1 ILE 89 -0.967 -1.992 -1.760 623 H SER 90 H SER 90 3.461 -0.188 2.334 624 HA SER 90 HA SER 90 2.182 2.246 3.362 625 HB2 SER 90 1HB SER 90 4.917 1.048 3.820 626 HB3 SER 90 2HB SER 90 4.476 2.666 4.366 627 HG SER 90 HG SER 90 2.830 0.493 5.030 628 H VAL 91 H VAL 91 2.839 4.295 2.701 629 HA VAL 91 HA VAL 91 4.748 4.495 0.500 630 HB VAL 91 HB VAL 91 1.926 5.553 0.291 631 HG11 VAL 91 1HG1 VAL 91 4.015 6.813 -0.718 632 HG12 VAL 91 2HG1 VAL 91 3.853 5.584 -1.973 633 HG13 VAL 91 3HG1 VAL 91 2.506 6.666 -1.619 634 HG21 VAL 91 3HG2 VAL 91 3.316 3.372 -1.264 635 HG22 VAL 91 1HG2 VAL 91 2.045 3.141 -0.064 636 HG23 VAL 91 2HG2 VAL 91 1.691 3.984 -1.572 637 H LYS 92 H LYS 92 6.126 6.028 1.078 638 HA LYS 92 HA LYS 92 5.139 8.298 2.670 639 HB2 LYS 92 1HB LYS 92 6.804 7.221 3.929 640 HB3 LYS 92 2HB LYS 92 7.814 6.936 2.518 641 HG2 LYS 92 1HG LYS 92 8.232 9.370 2.377 642 HG3 LYS 92 2HG LYS 92 7.311 9.579 3.869 643 HD2 LYS 92 1HD LYS 92 9.516 9.498 4.609 644 HD3 LYS 92 2HD LYS 92 8.948 7.846 4.858 645 HE2 LYS 92 1HE LYS 92 10.252 8.567 2.274 646 HE3 LYS 92 2HE LYS 92 11.256 8.316 3.701 647 HZ1 LYS 92 3HZ LYS 92 11.174 6.213 2.859 648 HZ2 LYS 92 1HZ LYS 92 9.618 6.389 2.220 649 HZ3 LYS 92 2HZ LYS 92 9.827 6.152 3.881 650 H TYR 93 H TYR 93 5.772 10.408 2.137 651 HA TYR 93 HA TYR 93 7.269 10.852 -0.312 652 HB2 TYR 93 1HB TYR 93 5.121 10.627 -1.292 653 HB3 TYR 93 2HB TYR 93 4.353 11.552 -0.007 654 HD1 TYR 93 1HD TYR 93 7.311 12.236 -2.189 655 HD2 TYR 93 2HD TYR 93 3.458 13.488 -0.890 656 HE1 TYR 93 1HE TYR 93 7.527 14.281 -3.539 657 HE2 TYR 93 2HE TYR 93 3.662 15.535 -2.237 658 HH TYR 93 HH TYR 93 5.015 16.783 -3.497 659 H GLY 94 H GLY 94 8.331 12.774 -0.326 660 HA2 GLY 94 1HA GLY 94 9.302 14.644 0.597 661 HA3 GLY 94 2HA GLY 94 7.641 15.156 0.858 662 H GLY 95 H GLY 95 10.325 13.355 2.293 663 HA2 GLY 95 1HA GLY 95 11.038 13.397 4.501 664 HA3 GLY 95 2HA GLY 95 9.665 14.421 4.894 665 HA PRO 96 HA PRO 96 8.970 10.178 6.681 666 HB2 PRO 96 1HB PRO 96 8.384 11.053 9.183 667 HB3 PRO 96 2HB PRO 96 10.033 10.712 8.646 668 HG2 PRO 96 1HG PRO 96 8.614 13.339 8.853 669 HG3 PRO 96 2HG PRO 96 10.274 12.926 9.316 670 HD2 PRO 96 1HD PRO 96 9.683 14.201 7.002 671 HD3 PRO 96 2HD PRO 96 11.051 13.079 7.152 672 H ASN 97 H ASN 97 7.234 12.985 6.054 673 HA ASN 97 HA ASN 97 4.739 12.219 7.253 674 HB2 ASN 97 1HB ASN 97 5.191 14.252 5.062 675 HB3 ASN 97 2HB ASN 97 3.814 14.153 6.155 676 HD21 ASN 97 1HD2 ASN 97 6.610 15.744 5.552 677 HD22 ASN 97 2HD2 ASN 97 6.945 16.358 7.132 678 H HIS 98 H HIS 98 3.748 10.441 6.535 679 HA HIS 98 HA HIS 98 3.982 9.503 3.843 680 HB2 HIS 98 1HB HIS 98 2.173 7.870 4.620 681 HB3 HIS 98 2HB HIS 98 3.712 7.817 5.474 682 HD2 HIS 98 2HD HIS 98 3.511 8.104 8.173 683 HE1 HIS 98 1HE HIS 98 -0.516 9.433 8.298 684 HE2 HIS 98 2HE HIS 98 1.513 8.813 9.655 685 H ILE 99 H ILE 99 1.907 8.894 2.625 686 HA ILE 99 HA ILE 99 0.470 11.337 2.122 687 HB ILE 99 HB ILE 99 -0.579 10.157 0.285 688 HG12 ILE 99 1HG1 ILE 99 0.897 7.652 1.058 689 HG13 ILE 99 2HG1 ILE 99 -0.723 7.975 1.667 690 HG21 ILE 99 1HG2 ILE 99 1.486 10.961 -0.380 691 HG22 ILE 99 2HG2 ILE 99 2.370 9.837 0.649 692 HG23 ILE 99 3HG2 ILE 99 1.587 9.257 -0.820 693 HD11 ILE 99 3HD1 ILE 99 -1.140 8.382 -0.945 694 HD12 ILE 99 1HD1 ILE 99 0.174 7.209 -1.030 695 HD13 ILE 99 2HD1 ILE 99 -1.309 6.809 -0.164 696 H VAL 100 H VAL 100 -2.018 10.865 1.540 697 HA VAL 100 HA VAL 100 -3.252 10.319 4.087 698 HB VAL 100 HB VAL 100 -4.323 11.246 1.433 699 HG11 VAL 100 1HG1 VAL 100 -6.508 11.537 2.714 700 HG12 VAL 100 2HG1 VAL 100 -6.090 9.902 2.201 701 HG13 VAL 100 3HG1 VAL 100 -5.845 10.390 3.878 702 HG21 VAL 100 3HG2 VAL 100 -4.230 12.534 4.161 703 HG22 VAL 100 1HG2 VAL 100 -3.145 12.885 2.815 704 HG23 VAL 100 2HG2 VAL 100 -4.862 13.271 2.688 705 H GLY 101 H GLY 101 -4.637 8.661 4.605 706 HA2 GLY 101 1HA GLY 101 -5.968 6.757 4.162 707 HA3 GLY 101 2HA GLY 101 -5.224 6.637 2.574 708 H SER 102 H SER 102 -2.511 6.814 3.467 709 HA SER 102 HA SER 102 -2.081 4.068 4.105 710 HB2 SER 102 1HB SER 102 -0.185 6.413 3.870 711 HB3 SER 102 2HB SER 102 0.345 4.758 4.170 712 HG SER 102 HG SER 102 0.409 5.174 1.963 713 HA PRO 103 HA PRO 103 -0.136 2.990 4.943 714 HB2 PRO 103 1HB PRO 103 -0.421 0.851 6.591 715 HB3 PRO 103 2HB PRO 103 0.903 2.011 6.744 716 HG2 PRO 103 1HG PRO 103 -1.652 1.839 8.293 717 HG3 PRO 103 2HG PRO 103 -0.008 2.153 8.878 718 HD2 PRO 103 1HD PRO 103 -1.822 4.128 8.502 719 HD3 PRO 103 2HD PRO 103 -0.080 4.375 8.268 720 H PHE 104 H PHE 104 -0.931 0.962 3.981 721 HA PHE 104 HA PHE 104 -3.873 0.917 3.908 722 HB2 PHE 104 1HB PHE 104 -1.856 0.111 1.804 723 HB3 PHE 104 2HB PHE 104 -3.595 -0.108 1.648 724 HD1 PHE 104 2HD PHE 104 -5.021 2.068 1.990 725 HD2 PHE 104 1HD PHE 104 -0.893 2.014 0.951 726 HE1 PHE 104 2HE PHE 104 -5.225 4.343 1.074 727 HE2 PHE 104 1HE PHE 104 -1.091 4.289 0.034 728 HZ PHE 104 HZ PHE 104 -3.259 5.456 0.094 729 H LYS 105 H LYS 105 -4.688 -0.694 5.063 730 HA LYS 105 HA LYS 105 -3.191 -3.204 5.293 731 HB2 LYS 105 1HB LYS 105 -5.414 -1.976 6.908 732 HB3 LYS 105 2HB LYS 105 -4.987 -3.674 7.075 733 HG2 LYS 105 1HG LYS 105 -2.565 -2.660 7.392 734 HG3 LYS 105 2HG LYS 105 -3.494 -1.248 7.901 735 HD2 LYS 105 1HD LYS 105 -3.091 -2.482 9.869 736 HD3 LYS 105 2HD LYS 105 -4.768 -2.824 9.434 737 HE2 LYS 105 1HE LYS 105 -3.885 -4.916 9.978 738 HE3 LYS 105 2HE LYS 105 -3.829 -4.875 8.216 739 HZ1 LYS 105 3HZ LYS 105 -1.587 -4.825 8.197 740 HZ2 LYS 105 1HZ LYS 105 -1.762 -5.576 9.703 741 HZ3 LYS 105 2HZ LYS 105 -1.465 -3.913 9.617 742 H ALA 106 H ALA 106 -3.656 -4.389 3.507 743 HA ALA 106 HA ALA 106 -6.452 -4.692 2.693 744 HB1 ALA 106 3HB ALA 106 -4.017 -5.783 1.298 745 HB2 ALA 106 1HB ALA 106 -5.644 -5.590 0.646 746 HB3 ALA 106 2HB ALA 106 -4.665 -4.169 1.009 747 H LYS 107 H LYS 107 -7.247 -6.865 2.168 748 HA LYS 107 HA LYS 107 -6.046 -8.946 3.872 749 HB2 LYS 107 1HB LYS 107 -8.021 -8.144 4.997 750 HB3 LYS 107 2HB LYS 107 -8.970 -8.272 3.521 751 HG2 LYS 107 1HG LYS 107 -9.168 -10.545 3.677 752 HG3 LYS 107 2HG LYS 107 -7.672 -10.722 4.598 753 HD2 LYS 107 1HD LYS 107 -9.262 -11.123 6.220 754 HD3 LYS 107 2HD LYS 107 -8.978 -9.394 6.428 755 HE2 LYS 107 1HE LYS 107 -10.946 -8.887 5.101 756 HE3 LYS 107 2HE LYS 107 -11.207 -10.603 4.794 757 HZ1 LYS 107 3HZ LYS 107 -11.944 -9.035 7.067 758 HZ2 LYS 107 1HZ LYS 107 -11.078 -10.418 7.512 759 HZ3 LYS 107 2HZ LYS 107 -12.489 -10.565 6.592 760 H VAL 108 H VAL 108 -5.302 -10.518 2.618 761 HA VAL 108 HA VAL 108 -6.503 -11.011 0.010 762 HB VAL 108 HB VAL 108 -4.121 -12.420 1.208 763 HG11 VAL 108 1HG1 VAL 108 -5.108 -13.519 -0.721 764 HG12 VAL 108 2HG1 VAL 108 -5.026 -12.016 -1.641 765 HG13 VAL 108 3HG1 VAL 108 -3.542 -12.828 -1.142 766 HG21 VAL 108 3HG2 VAL 108 -3.581 -10.318 -0.747 767 HG22 VAL 108 1HG2 VAL 108 -4.239 -9.719 0.775 768 HG23 VAL 108 2HG2 VAL 108 -2.767 -10.690 0.772 769 H THR 109 H THR 109 -7.634 -12.797 -0.541 770 HA THR 109 HA THR 109 -7.795 -15.029 1.345 771 HB THR 109 HB THR 109 -10.270 -15.096 1.138 772 HG1 THR 109 1HG THR 109 -10.027 -13.503 -0.796 773 HG21 THR 109 3HG2 THR 109 -10.723 -13.200 2.668 774 HG22 THR 109 1HG2 THR 109 -9.113 -12.570 2.323 775 HG23 THR 109 2HG2 THR 109 -9.296 -14.127 3.132 776 H GLY 110 H GLY 110 -8.531 -16.997 0.420 777 HA2 GLY 110 1HA GLY 110 -9.568 -17.949 -1.690 778 HA3 GLY 110 2HA GLY 110 -8.334 -17.019 -2.526 779 H GLN 111 H GLN 111 -8.995 -20.005 -2.121 780 HA GLN 111 HA GLN 111 -7.216 -21.432 -0.698 781 HB2 GLN 111 1HB GLN 111 -7.132 -23.060 -2.616 782 HB3 GLN 111 2HB GLN 111 -8.748 -22.580 -2.115 783 HG2 GLN 111 1HG GLN 111 -8.747 -20.921 -3.979 784 HG3 GLN 111 2HG GLN 111 -7.225 -21.624 -4.524 785 HE21 GLN 111 1HE2 GLN 111 -7.788 -22.578 -6.377 786 HE22 GLN 111 2HE2 GLN 111 -9.012 -23.787 -6.538 787 H ARG 112 H ARG 112 -5.136 -21.057 -0.316 788 HA ARG 112 HA ARG 112 -3.356 -19.521 -1.651 789 HB2 ARG 112 1HB ARG 112 -1.601 -20.642 -0.514 790 HB3 ARG 112 2HB ARG 112 -3.007 -20.742 0.538 791 HG2 ARG 112 1HG ARG 112 -2.520 -22.984 -1.343 792 HG3 ARG 112 2HG ARG 112 -1.463 -22.828 0.061 793 HD2 ARG 112 1HD ARG 112 -3.164 -23.220 1.555 794 HD3 ARG 112 2HD ARG 112 -4.409 -22.633 0.453 795 HE ARG 112 HE ARG 112 -3.167 -25.032 -0.479 796 HH11 ARG 112 1HH1 ARG 112 -5.588 -23.763 1.677 797 HH12 ARG 112 2HH1 ARG 112 -6.535 -25.214 1.677 798 HH21 ARG 112 1HH2 ARG 112 -4.405 -26.948 -0.487 799 HH22 ARG 112 2HH2 ARG 112 -5.861 -27.025 0.447 800 H LEU 113 H LEU 113 -1.432 -20.117 -2.963 801 HA LEU 113 HA LEU 113 -2.192 -22.053 -5.046 802 HB2 LEU 113 1HB LEU 113 -0.324 -19.703 -5.296 803 HB3 LEU 113 2HB LEU 113 -0.889 -20.747 -6.598 804 HG LEU 113 HG LEU 113 -2.768 -19.040 -4.987 805 HD11 LEU 113 1HD1 LEU 113 -0.756 -17.930 -6.392 806 HD12 LEU 113 2HD1 LEU 113 -2.351 -17.199 -6.214 807 HD13 LEU 113 3HD1 LEU 113 -1.962 -18.122 -7.666 808 HD21 LEU 113 3HD2 LEU 113 -4.034 -20.571 -6.154 809 HD22 LEU 113 1HD2 LEU 113 -2.905 -20.636 -7.507 810 HD23 LEU 113 2HD2 LEU 113 -3.954 -19.233 -7.302 811 H VAL 114 H VAL 114 -0.526 -23.319 -6.025 812 HA VAL 114 HA VAL 114 1.710 -23.850 -4.189 813 HB VAL 114 HB VAL 114 1.837 -26.077 -5.269 814 HG11 VAL 114 1HG1 VAL 114 0.225 -25.300 -3.284 815 HG12 VAL 114 2HG1 VAL 114 -0.990 -25.894 -4.418 816 HG13 VAL 114 3HG1 VAL 114 0.298 -26.964 -3.862 817 HG21 VAL 114 3HG2 VAL 114 0.796 -26.500 -7.185 818 HG22 VAL 114 1HG2 VAL 114 -0.764 -26.154 -6.439 819 HG23 VAL 114 2HG2 VAL 114 0.163 -24.854 -7.187 820 H SER 115 H SER 115 3.751 -23.570 -4.839 821 HA SER 115 HA SER 115 4.283 -23.268 -7.717 822 HB2 SER 115 1HB SER 115 4.273 -21.024 -6.957 823 HB3 SER 115 2HB SER 115 5.131 -21.439 -5.473 824 HG SER 115 HG SER 115 6.350 -21.914 -7.956 825 HA PRO 116 HA PRO 116 7.151 -26.357 -5.788 826 HB2 PRO 116 1HB PRO 116 6.931 -28.158 -7.807 827 HB3 PRO 116 2HB PRO 116 5.807 -28.101 -6.444 828 HG2 PRO 116 1HG PRO 116 5.493 -26.992 -9.207 829 HG3 PRO 116 2HG PRO 116 4.314 -27.866 -8.211 830 HD2 PRO 116 1HD PRO 116 4.288 -25.171 -8.470 831 HD3 PRO 116 2HD PRO 116 3.773 -25.993 -6.983 832 H GLY 117 H GLY 117 6.971 -24.583 -8.722 833 HA2 GLY 117 1HA GLY 117 9.693 -24.082 -8.916 834 HA3 GLY 117 2HA GLY 117 9.379 -25.476 -9.939 835 H SER 118 H SER 118 9.584 -22.174 -9.884 836 HA SER 118 HA SER 118 7.510 -21.383 -11.619 837 HB2 SER 118 1HB SER 118 8.958 -19.853 -10.230 838 HB3 SER 118 2HB SER 118 10.244 -20.104 -11.410 839 HG SER 118 HG SER 118 8.979 -18.217 -11.826 840 H ALA 119 H ALA 119 10.957 -21.953 -12.346 841 HA ALA 119 HA ALA 119 10.662 -21.799 -15.144 842 HB1 ALA 119 3HB ALA 119 12.888 -22.075 -15.201 843 HB2 ALA 119 1HB ALA 119 12.782 -21.902 -13.448 844 HB3 ALA 119 2HB ALA 119 12.839 -23.509 -14.175 845 H ASN 120 H ASN 120 9.833 -23.192 -16.553 846 HA ASN 120 HA ASN 120 8.912 -25.774 -15.670 847 HB2 ASN 120 1HB ASN 120 8.246 -25.904 -18.189 848 HB3 ASN 120 2HB ASN 120 7.394 -24.785 -17.129 849 HD21 ASN 120 1HD2 ASN 120 10.014 -25.025 -19.470 850 HD22 ASN 120 2HD2 ASN 120 9.908 -23.393 -20.028 851 H GLU 121 H GLU 121 9.432 -27.782 -16.719 852 HA GLU 121 HA GLU 121 12.198 -27.831 -17.730 853 HB2 GLU 121 1HB GLU 121 11.678 -28.988 -15.530 854 HB3 GLU 121 2HB GLU 121 10.724 -30.136 -16.460 855 HG2 GLU 121 1HG GLU 121 12.840 -30.526 -17.827 856 HG3 GLU 121 2HG GLU 121 13.684 -29.675 -16.533 857 H THR 122 H THR 122 12.508 -28.447 -19.760 858 HA THR 122 HA THR 122 10.264 -29.560 -21.260 859 HB THR 122 HB THR 122 11.508 -27.598 -22.167 860 HG1 THR 122 1HG THR 122 11.887 -28.727 -24.295 861 HG21 THR 122 3HG2 THR 122 13.754 -29.505 -21.911 862 HG22 THR 122 1HG2 THR 122 13.743 -27.745 -21.800 863 HG23 THR 122 2HG2 THR 122 13.718 -28.529 -23.380 864 H SER 123 H SER 123 10.465 -31.415 -22.582 865 HA SER 123 HA SER 123 12.643 -33.233 -21.782 866 HB2 SER 123 1HB SER 123 10.264 -33.748 -20.941 867 HB3 SER 123 2HB SER 123 9.902 -34.170 -22.614 868 HG SER 123 HG SER 123 12.161 -35.279 -21.375 869 H SER 124 H SER 124 13.785 -34.191 -23.358 870 HA SER 124 HA SER 124 12.725 -34.241 -26.083 871 HB2 SER 124 1HB SER 124 14.136 -32.144 -25.696 872 HB3 SER 124 2HB SER 124 15.517 -33.230 -25.545 873 HG SER 124 HG SER 124 13.795 -32.984 -27.790 874 H ILE 125 H ILE 125 12.994 -36.196 -26.913 875 HA ILE 125 HA ILE 125 14.988 -37.980 -25.718 876 HB ILE 125 HB ILE 125 12.653 -38.630 -27.520 877 HG12 ILE 125 1HG1 ILE 125 11.991 -39.829 -25.263 878 HG13 ILE 125 2HG1 ILE 125 13.043 -38.609 -24.554 879 HG21 ILE 125 1HG2 ILE 125 14.967 -40.105 -27.058 880 HG22 ILE 125 2HG2 ILE 125 13.749 -40.831 -26.010 881 HG23 ILE 125 3HG2 ILE 125 13.452 -40.693 -27.743 882 HD11 ILE 125 3HD1 ILE 125 11.412 -37.196 -26.295 883 HD12 ILE 125 1HD1 ILE 125 10.345 -38.374 -25.532 884 HD13 ILE 125 2HD1 ILE 125 11.288 -37.263 -24.538 Start of MODEL 10 1 H1 GLY 1 H GLY 1 -8.929 45.003 -38.992 2 HA2 GLY 1 1HA GLY 1 -8.544 42.475 -39.570 3 HA3 GLY 1 2HA GLY 1 -6.863 42.981 -39.473 4 H SER 2 H SER 2 -9.862 43.298 -37.567 5 HA SER 2 HA SER 2 -8.254 43.035 -35.128 6 HB2 SER 2 1HB SER 2 -9.774 44.991 -35.305 7 HB3 SER 2 2HB SER 2 -11.145 43.887 -35.422 8 HG SER 2 HG SER 2 -11.133 44.017 -33.325 9 H SER 3 H SER 3 -9.303 41.796 -33.320 10 HA SER 3 HA SER 3 -10.638 39.386 -34.369 11 HB2 SER 3 1HB SER 3 -8.285 38.948 -33.736 12 HB3 SER 3 2HB SER 3 -8.631 39.520 -32.104 13 HG SER 3 HG SER 3 -9.325 37.595 -31.685 14 H GLY 4 H GLY 4 -10.025 41.172 -31.339 15 HA2 GLY 4 1HA GLY 4 -11.745 42.022 -29.941 16 HA3 GLY 4 2HA GLY 4 -12.869 40.894 -30.684 17 H SER 5 H SER 5 -10.355 41.295 -28.293 18 HA SER 5 HA SER 5 -10.642 38.560 -27.349 19 HB2 SER 5 1HB SER 5 -8.851 40.861 -26.617 20 HB3 SER 5 2HB SER 5 -8.987 39.457 -25.558 21 HG SER 5 HG SER 5 -8.600 38.337 -27.775 22 H SER 6 H SER 6 -12.847 38.646 -26.706 23 HA SER 6 HA SER 6 -13.268 40.095 -24.175 24 HB2 SER 6 1HB SER 6 -14.603 40.945 -26.174 25 HB3 SER 6 2HB SER 6 -15.470 39.410 -26.125 26 HG SER 6 HG SER 6 -15.278 41.273 -23.989 27 H GLY 7 H GLY 7 -13.438 38.756 -22.512 28 HA2 GLY 7 1HA GLY 7 -14.551 37.040 -21.309 29 HA3 GLY 7 2HA GLY 7 -14.959 36.271 -22.835 30 H PHE 8 H PHE 8 -12.914 35.580 -24.120 31 HA PHE 8 HA PHE 8 -11.733 33.439 -23.056 32 HB2 PHE 8 1HB PHE 8 -10.302 35.440 -24.817 33 HB3 PHE 8 2HB PHE 8 -9.822 33.763 -24.582 34 HD1 PHE 8 1HD PHE 8 -12.288 36.002 -26.105 35 HD2 PHE 8 2HD PHE 8 -11.011 31.968 -25.644 36 HE1 PHE 8 1HE PHE 8 -13.749 35.331 -27.967 37 HE2 PHE 8 2HE PHE 8 -12.469 31.290 -27.507 38 HZ PHE 8 HZ PHE 8 -13.840 32.972 -28.671 39 H LYS 9 H LYS 9 -10.868 33.185 -21.105 40 HA LYS 9 HA LYS 9 -9.431 35.285 -19.772 41 HB2 LYS 9 1HB LYS 9 -10.032 32.415 -19.070 42 HB3 LYS 9 2HB LYS 9 -9.039 33.444 -18.046 43 HG2 LYS 9 1HG LYS 9 -10.866 34.953 -17.686 44 HG3 LYS 9 2HG LYS 9 -11.864 34.093 -18.860 45 HD2 LYS 9 1HD LYS 9 -12.214 32.302 -17.449 46 HD3 LYS 9 2HD LYS 9 -10.742 32.609 -16.524 47 HE2 LYS 9 1HE LYS 9 -11.912 34.768 -15.771 48 HE3 LYS 9 2HE LYS 9 -13.388 34.019 -16.379 49 HZ1 LYS 9 3HZ LYS 9 -13.544 32.935 -14.471 50 HZ2 LYS 9 1HZ LYS 9 -12.077 33.579 -13.928 51 HZ3 LYS 9 2HZ LYS 9 -12.092 32.130 -14.801 52 H VAL 10 H VAL 10 -7.267 34.789 -18.744 53 HA VAL 10 HA VAL 10 -5.483 33.753 -20.824 54 HB VAL 10 HB VAL 10 -4.950 35.989 -20.126 55 HG11 VAL 10 1HG1 VAL 10 -5.674 36.525 -18.066 56 HG12 VAL 10 2HG1 VAL 10 -5.444 34.888 -17.448 57 HG13 VAL 10 3HG1 VAL 10 -4.072 35.991 -17.559 58 HG21 VAL 10 3HG2 VAL 10 -2.792 35.501 -20.321 59 HG22 VAL 10 1HG2 VAL 10 -2.742 34.935 -18.651 60 HG23 VAL 10 2HG2 VAL 10 -3.158 33.816 -19.950 61 H ARG 11 H ARG 11 -4.088 32.087 -20.500 62 HA ARG 11 HA ARG 11 -4.673 30.226 -18.438 63 HB2 ARG 11 1HB ARG 11 -2.432 30.343 -20.459 64 HB3 ARG 11 2HB ARG 11 -2.686 28.992 -19.363 65 HG2 ARG 11 1HG ARG 11 -4.704 29.963 -21.374 66 HG3 ARG 11 2HG ARG 11 -3.593 28.615 -21.628 67 HD2 ARG 11 1HD ARG 11 -4.585 27.634 -19.485 68 HD3 ARG 11 2HD ARG 11 -5.864 28.833 -19.676 69 HE ARG 11 HE ARG 11 -5.396 27.232 -22.021 70 HH11 ARG 11 1HH1 ARG 11 -7.113 27.478 -19.003 71 HH12 ARG 11 2HH1 ARG 11 -8.391 26.415 -19.493 72 HH21 ARG 11 1HH2 ARG 11 -7.072 25.831 -22.678 73 HH22 ARG 11 2HH2 ARG 11 -8.366 25.478 -21.584 74 H VAL 12 H VAL 12 -3.772 29.925 -16.493 75 HA VAL 12 HA VAL 12 -1.234 31.265 -15.877 76 HB VAL 12 HB VAL 12 -3.014 32.726 -15.042 77 HG11 VAL 12 1HG1 VAL 12 -4.914 31.670 -14.479 78 HG12 VAL 12 2HG1 VAL 12 -4.076 30.178 -14.048 79 HG13 VAL 12 3HG1 VAL 12 -4.156 31.511 -12.895 80 HG21 VAL 12 3HG2 VAL 12 -1.737 33.235 -13.288 81 HG22 VAL 12 1HG2 VAL 12 -2.164 31.738 -12.458 82 HG23 VAL 12 2HG2 VAL 12 -0.834 31.756 -13.617 83 H GLY 13 H GLY 13 0.051 30.243 -14.351 84 HA2 GLY 13 1HA GLY 13 -0.605 27.440 -13.905 85 HA3 GLY 13 2HA GLY 13 0.953 28.203 -13.627 86 H GLU 14 H GLU 14 1.278 27.446 -11.569 87 HA GLU 14 HA GLU 14 -0.767 27.856 -9.547 88 HB2 GLU 14 1HB GLU 14 2.023 26.726 -9.267 89 HB3 GLU 14 2HB GLU 14 0.757 26.677 -8.048 90 HG2 GLU 14 1HG GLU 14 0.560 24.584 -8.911 91 HG3 GLU 14 2HG GLU 14 -0.576 25.447 -9.946 92 HA PRO 15 HA PRO 15 0.753 31.658 -7.962 93 HB2 PRO 15 1HB PRO 15 0.139 31.394 -5.331 94 HB3 PRO 15 2HB PRO 15 -1.082 31.669 -6.579 95 HG2 PRO 15 1HG PRO 15 -0.265 29.109 -5.259 96 HG3 PRO 15 2HG PRO 15 -1.892 29.699 -5.646 97 HD2 PRO 15 1HD PRO 15 -0.603 27.872 -7.173 98 HD3 PRO 15 2HD PRO 15 -1.736 29.057 -7.855 99 H GLY 16 H GLY 16 1.573 28.895 -5.849 100 HA2 GLY 16 1HA GLY 16 4.293 30.025 -5.625 101 HA3 GLY 16 2HA GLY 16 3.453 29.358 -4.232 102 H GLN 17 H GLN 17 4.547 27.574 -3.700 103 HA GLN 17 HA GLN 17 5.246 25.685 -5.846 104 HB2 GLN 17 1HB GLN 17 6.518 26.367 -3.234 105 HB3 GLN 17 2HB GLN 17 6.692 24.727 -3.846 106 HG2 GLN 17 1HG GLN 17 7.412 27.181 -5.425 107 HG3 GLN 17 2HG GLN 17 8.554 26.283 -4.427 108 HE21 GLN 17 1HE2 GLN 17 9.575 24.611 -5.302 109 HE22 GLN 17 2HE2 GLN 17 9.190 23.883 -6.820 110 H ALA 18 H ALA 18 4.442 23.659 -5.837 111 HA ALA 18 HA ALA 18 2.473 23.021 -3.763 112 HB1 ALA 18 3HB ALA 18 2.907 21.766 -6.471 113 HB2 ALA 18 1HB ALA 18 1.612 21.366 -5.341 114 HB3 ALA 18 2HB ALA 18 1.684 22.972 -6.069 115 H GLY 19 H GLY 19 2.510 21.106 -2.603 116 HA2 GLY 19 1HA GLY 19 4.083 18.879 -2.988 117 HA3 GLY 19 2HA GLY 19 5.099 20.006 -2.102 118 H ASN 20 H ASN 20 1.942 18.391 -2.007 119 HA ASN 20 HA ASN 20 2.205 18.270 0.920 120 HB2 ASN 20 1HB ASN 20 0.445 19.940 -0.113 121 HB3 ASN 20 2HB ASN 20 -0.509 18.475 -0.322 122 HD21 ASN 20 1HD2 ASN 20 -2.035 19.292 1.151 123 HD22 ASN 20 2HD2 ASN 20 -1.743 19.260 2.854 124 HA PRO 21 HA PRO 21 1.769 13.933 0.022 125 HB2 PRO 21 1HB PRO 21 1.860 13.098 2.604 126 HB3 PRO 21 2HB PRO 21 3.298 13.593 1.703 127 HG2 PRO 21 1HG PRO 21 1.672 15.148 3.676 128 HG3 PRO 21 2HG PRO 21 3.434 15.046 3.513 129 HD2 PRO 21 1HD PRO 21 2.003 17.139 2.564 130 HD3 PRO 21 2HD PRO 21 3.488 16.565 1.780 131 H ALA 22 H ALA 22 -0.146 15.574 2.517 132 HA ALA 22 HA ALA 22 -2.104 13.663 2.947 133 HB1 ALA 22 3HB ALA 22 -1.719 16.409 3.566 134 HB2 ALA 22 1HB ALA 22 -3.367 16.200 2.972 135 HB3 ALA 22 2HB ALA 22 -2.794 15.244 4.339 136 H LEU 23 H LEU 23 -1.987 16.199 0.465 137 HA LEU 23 HA LEU 23 -4.495 15.745 -0.675 138 HB2 LEU 23 1HB LEU 23 -1.921 16.797 -1.810 139 HB3 LEU 23 2HB LEU 23 -3.394 16.689 -2.772 140 HG LEU 23 HG LEU 23 -3.198 18.264 -0.211 141 HD11 LEU 23 1HD1 LEU 23 -1.943 19.721 -1.329 142 HD12 LEU 23 2HD1 LEU 23 -3.371 20.052 -2.309 143 HD13 LEU 23 3HD1 LEU 23 -2.180 18.872 -2.857 144 HD21 LEU 23 3HD2 LEU 23 -5.387 17.419 -1.665 145 HD22 LEU 23 1HD2 LEU 23 -5.125 19.069 -2.229 146 HD23 LEU 23 2HD2 LEU 23 -5.353 18.751 -0.509 147 H VAL 24 H VAL 24 -1.329 14.376 -1.537 148 HA VAL 24 HA VAL 24 -1.798 12.915 -3.732 149 HB VAL 24 HB VAL 24 -0.437 11.828 -1.262 150 HG11 VAL 24 1HG1 VAL 24 0.103 9.999 -2.409 151 HG12 VAL 24 2HG1 VAL 24 -1.082 10.499 -3.618 152 HG13 VAL 24 3HG1 VAL 24 0.614 10.947 -3.806 153 HG21 VAL 24 3HG2 VAL 24 1.632 12.612 -2.429 154 HG22 VAL 24 1HG2 VAL 24 0.594 13.448 -3.585 155 HG23 VAL 24 2HG2 VAL 24 0.568 13.908 -1.883 156 H SER 25 H SER 25 -3.212 11.446 -4.402 157 HA SER 25 HA SER 25 -4.790 10.003 -2.376 158 HB2 SER 25 1HB SER 25 -5.472 10.953 -5.155 159 HB3 SER 25 2HB SER 25 -6.428 9.714 -4.340 160 HG SER 25 HG SER 25 -6.329 11.464 -2.548 161 H ALA 26 H ALA 26 -5.379 7.805 -2.814 162 HA ALA 26 HA ALA 26 -3.688 6.434 -4.788 163 HB1 ALA 26 3HB ALA 26 -3.204 6.379 -2.054 164 HB2 ALA 26 1HB ALA 26 -4.019 4.851 -2.392 165 HB3 ALA 26 2HB ALA 26 -2.548 5.280 -3.266 166 H TYR 27 H TYR 27 -4.775 5.023 -6.000 167 HA TYR 27 HA TYR 27 -7.107 3.647 -4.943 168 HB2 TYR 27 1HB TYR 27 -8.483 4.308 -6.936 169 HB3 TYR 27 2HB TYR 27 -8.162 5.621 -5.808 170 HD1 TYR 27 2HD TYR 27 -7.188 4.191 -9.080 171 HD2 TYR 27 1HD TYR 27 -7.001 7.568 -6.498 172 HE1 TYR 27 2HE TYR 27 -6.279 5.542 -10.922 173 HE2 TYR 27 1HE TYR 27 -6.093 8.929 -8.334 174 HH TYR 27 HH TYR 27 -6.346 8.409 -11.307 175 H GLY 28 H GLY 28 -8.032 2.159 -6.741 176 HA2 GLY 28 1HA GLY 28 -6.982 1.263 -8.993 177 HA3 GLY 28 2HA GLY 28 -5.738 0.741 -7.867 178 H THR 29 H THR 29 -6.429 -1.370 -8.874 179 HA THR 29 HA THR 29 -8.905 -2.445 -7.758 180 HB THR 29 HB THR 29 -6.930 -3.790 -9.611 181 HG1 THR 29 1HG THR 29 -7.785 -2.380 -10.964 182 HG21 THR 29 3HG2 THR 29 -9.596 -4.762 -9.838 183 HG22 THR 29 1HG2 THR 29 -9.141 -4.788 -8.135 184 HG23 THR 29 2HG2 THR 29 -8.150 -5.631 -9.326 185 H GLY 30 H GLY 30 -5.458 -2.604 -7.340 186 HA2 GLY 30 1HA GLY 30 -5.372 -5.042 -5.873 187 HA3 GLY 30 2HA GLY 30 -4.124 -3.805 -5.901 188 H LEU 31 H LEU 31 -5.965 -1.709 -4.982 189 HA LEU 31 HA LEU 31 -5.574 -2.046 -2.188 190 HB2 LEU 31 1HB LEU 31 -7.234 0.001 -3.653 191 HB3 LEU 31 2HB LEU 31 -6.717 0.100 -1.971 192 HG LEU 31 HG LEU 31 -4.854 0.110 -4.345 193 HD11 LEU 31 1HD1 LEU 31 -4.963 2.539 -2.795 194 HD12 LEU 31 2HD1 LEU 31 -6.539 2.151 -3.485 195 HD13 LEU 31 3HD1 LEU 31 -5.130 2.304 -4.535 196 HD21 LEU 31 3HD2 LEU 31 -4.370 0.676 -1.421 197 HD22 LEU 31 1HD2 LEU 31 -3.178 0.800 -2.715 198 HD23 LEU 31 2HD2 LEU 31 -3.859 -0.771 -2.291 199 H GLU 32 H GLU 32 -8.346 -2.366 -4.330 200 HA GLU 32 HA GLU 32 -10.480 -2.388 -2.657 201 HB2 GLU 32 1HB GLU 32 -9.897 -4.349 -4.880 202 HB3 GLU 32 2HB GLU 32 -11.471 -4.151 -4.124 203 HG2 GLU 32 1HG GLU 32 -10.080 -1.805 -5.339 204 HG3 GLU 32 2HG GLU 32 -10.962 -2.947 -6.352 205 H GLY 33 H GLY 33 -8.081 -4.955 -3.016 206 HA2 GLY 33 1HA GLY 33 -8.339 -5.891 -0.395 207 HA3 GLY 33 2HA GLY 33 -9.376 -6.881 -1.411 208 H GLY 34 H GLY 34 -7.787 -8.511 -0.480 209 HA2 GLY 34 1HA GLY 34 -5.271 -8.555 -2.003 210 HA3 GLY 34 2HA GLY 34 -5.608 -9.502 -0.561 211 H THR 35 H THR 35 -5.605 -9.451 -3.957 212 HA THR 35 HA THR 35 -7.272 -11.848 -4.160 213 HB THR 35 HB THR 35 -6.639 -11.468 -6.698 214 HG1 THR 35 1HG THR 35 -5.203 -9.654 -5.944 215 HG21 THR 35 3HG2 THR 35 -8.524 -9.460 -5.521 216 HG22 THR 35 1HG2 THR 35 -8.877 -11.183 -5.406 217 HG23 THR 35 2HG2 THR 35 -8.693 -10.424 -6.987 218 H THR 36 H THR 36 -6.287 -13.734 -3.893 219 HA THR 36 HA THR 36 -3.437 -14.009 -4.348 220 HB THR 36 HB THR 36 -5.269 -16.275 -3.608 221 HG1 THR 36 1HG THR 36 -5.170 -14.049 -2.263 222 HG21 THR 36 3HG2 THR 36 -2.668 -15.937 -2.297 223 HG22 THR 36 1HG2 THR 36 -2.574 -16.161 -4.044 224 HG23 THR 36 2HG2 THR 36 -3.384 -17.366 -3.042 225 H GLY 37 H GLY 37 -2.711 -14.379 -6.338 226 HA2 GLY 37 1HA GLY 37 -2.444 -16.054 -8.077 227 HA3 GLY 37 2HA GLY 37 -4.178 -16.325 -8.002 228 H ILE 38 H ILE 38 -4.795 -13.464 -7.882 229 HA ILE 38 HA ILE 38 -4.582 -12.937 -10.742 230 HB ILE 38 HB ILE 38 -6.124 -11.309 -8.730 231 HG12 ILE 38 1HG1 ILE 38 -6.969 -13.795 -10.227 232 HG13 ILE 38 2HG1 ILE 38 -6.910 -13.573 -8.482 233 HG21 ILE 38 1HG2 ILE 38 -5.589 -10.580 -11.177 234 HG22 ILE 38 2HG2 ILE 38 -6.867 -11.722 -11.590 235 HG23 ILE 38 3HG2 ILE 38 -7.213 -10.360 -10.524 236 HD11 ILE 38 3HD1 ILE 38 -8.608 -11.645 -9.873 237 HD12 ILE 38 1HD1 ILE 38 -9.132 -13.322 -10.023 238 HD13 ILE 38 2HD1 ILE 38 -8.919 -12.605 -8.426 239 H GLN 39 H GLN 39 -3.789 -11.009 -11.611 240 HA GLN 39 HA GLN 39 -1.831 -9.654 -9.905 241 HB2 GLN 39 1HB GLN 39 -0.760 -10.440 -11.828 242 HB3 GLN 39 2HB GLN 39 -2.110 -10.014 -12.871 243 HG2 GLN 39 1HG GLN 39 -1.590 -7.653 -12.604 244 HG3 GLN 39 2HG GLN 39 -0.256 -8.062 -11.527 245 HE21 GLN 39 1HE2 GLN 39 1.582 -9.088 -12.388 246 HE22 GLN 39 2HE2 GLN 39 1.951 -9.003 -14.073 247 H SER 40 H SER 40 -2.458 -7.818 -8.998 248 HA SER 40 HA SER 40 -4.429 -6.143 -10.395 249 HB2 SER 40 1HB SER 40 -3.630 -6.170 -7.474 250 HB3 SER 40 2HB SER 40 -4.847 -5.111 -8.187 251 HG SER 40 HG SER 40 -4.944 -7.949 -8.203 252 H GLU 41 H GLU 41 -4.170 -3.772 -10.120 253 HA GLU 41 HA GLU 41 -1.443 -2.848 -9.693 254 HB2 GLU 41 1HB GLU 41 -1.181 -1.840 -11.834 255 HB3 GLU 41 2HB GLU 41 -1.648 -3.512 -12.114 256 HG2 GLU 41 1HG GLU 41 -4.063 -2.471 -12.195 257 HG3 GLU 41 2HG GLU 41 -3.168 -1.008 -12.601 258 H PHE 42 H PHE 42 -1.440 -0.953 -8.674 259 HA PHE 42 HA PHE 42 -3.889 0.683 -8.780 260 HB2 PHE 42 1HB PHE 42 -3.737 1.150 -6.507 261 HB3 PHE 42 2HB PHE 42 -3.216 -0.531 -6.571 262 HD1 PHE 42 1HD PHE 42 -2.150 2.933 -6.071 263 HD2 PHE 42 2HD PHE 42 -0.933 -1.145 -6.128 264 HE1 PHE 42 1HE PHE 42 -0.047 3.548 -4.951 265 HE2 PHE 42 2HE PHE 42 1.171 -0.537 -5.007 266 HZ PHE 42 HZ PHE 42 1.616 1.812 -4.417 267 H PHE 43 H PHE 43 -3.695 2.834 -9.158 268 HA PHE 43 HA PHE 43 -0.994 3.810 -9.777 269 HB2 PHE 43 1HB PHE 43 -3.669 4.893 -10.685 270 HB3 PHE 43 2HB PHE 43 -2.089 5.471 -11.202 271 HD1 PHE 43 2HD PHE 43 -4.272 2.470 -11.211 272 HD2 PHE 43 1HD PHE 43 -1.037 4.536 -13.051 273 HE1 PHE 43 2HE PHE 43 -4.285 0.841 -13.055 274 HE2 PHE 43 1HE PHE 43 -1.045 2.910 -14.898 275 HZ PHE 43 HZ PHE 43 -2.670 1.060 -14.901 276 H ILE 44 H ILE 44 -0.574 6.123 -9.351 277 HA ILE 44 HA ILE 44 -1.879 6.982 -6.851 278 HB ILE 44 HB ILE 44 0.966 7.468 -7.743 279 HG12 ILE 44 1HG1 ILE 44 -0.050 5.905 -5.364 280 HG13 ILE 44 2HG1 ILE 44 0.388 5.163 -6.899 281 HG21 ILE 44 1HG2 ILE 44 -0.712 8.690 -5.647 282 HG22 ILE 44 2HG2 ILE 44 0.922 8.233 -5.169 283 HG23 ILE 44 3HG2 ILE 44 0.676 9.343 -6.517 284 HD11 ILE 44 3HD1 ILE 44 2.670 6.065 -6.634 285 HD12 ILE 44 1HD1 ILE 44 2.207 6.680 -5.047 286 HD13 ILE 44 2HD1 ILE 44 2.206 4.943 -5.355 287 H ASN 45 H ASN 45 -2.522 9.086 -6.636 288 HA ASN 45 HA ASN 45 -2.637 10.635 -9.108 289 HB2 ASN 45 1HB ASN 45 -4.659 10.139 -7.579 290 HB3 ASN 45 2HB ASN 45 -3.987 11.377 -6.522 291 HD21 ASN 45 1HD2 ASN 45 -5.931 10.758 -9.181 292 HD22 ASN 45 2HD2 ASN 45 -6.125 12.381 -9.740 293 H THR 46 H THR 46 -0.112 10.654 -8.238 294 HA THR 46 HA THR 46 0.375 12.924 -6.508 295 HB THR 46 HB THR 46 1.872 10.978 -6.401 296 HG1 THR 46 1HG THR 46 3.043 12.654 -5.763 297 HG21 THR 46 3HG2 THR 46 3.576 11.182 -8.532 298 HG22 THR 46 1HG2 THR 46 2.006 11.446 -9.290 299 HG23 THR 46 2HG2 THR 46 2.303 9.974 -8.366 300 H THR 47 H THR 47 -1.094 13.767 -8.649 301 HA THR 47 HA THR 47 0.805 15.033 -10.493 302 HB THR 47 HB THR 47 -1.137 15.616 -11.861 303 HG1 THR 47 1HG THR 47 -2.741 14.123 -10.056 304 HG21 THR 47 3HG2 THR 47 -0.063 13.124 -11.561 305 HG22 THR 47 1HG2 THR 47 -1.198 13.585 -12.829 306 HG23 THR 47 2HG2 THR 47 -1.785 12.799 -11.362 307 H ARG 48 H ARG 48 -1.783 15.790 -8.205 308 HA ARG 48 HA ARG 48 -1.468 18.637 -8.570 309 HB2 ARG 48 1HB ARG 48 -3.113 16.991 -6.645 310 HB3 ARG 48 2HB ARG 48 -3.102 18.750 -6.649 311 HG2 ARG 48 1HG ARG 48 -3.694 18.407 -9.194 312 HG3 ARG 48 2HG ARG 48 -4.283 16.852 -8.603 313 HD2 ARG 48 1HD ARG 48 -5.486 18.271 -6.802 314 HD3 ARG 48 2HD ARG 48 -5.204 19.615 -7.907 315 HE ARG 48 HE ARG 48 -6.389 17.412 -9.251 316 HH11 ARG 48 1HH1 ARG 48 -7.099 20.046 -7.089 317 HH12 ARG 48 2HH1 ARG 48 -8.759 20.166 -7.570 318 HH21 ARG 48 1HH2 ARG 48 -8.573 17.559 -9.893 319 HH22 ARG 48 2HH2 ARG 48 -9.596 18.750 -9.165 320 H ALA 49 H ALA 49 -0.426 16.177 -6.305 321 HA ALA 49 HA ALA 49 0.437 17.842 -4.215 322 HB1 ALA 49 3HB ALA 49 0.658 15.061 -4.929 323 HB2 ALA 49 1HB ALA 49 2.176 15.658 -4.258 324 HB3 ALA 49 2HB ALA 49 0.681 15.816 -3.336 325 H GLY 50 H GLY 50 2.148 16.610 -7.074 326 HA2 GLY 50 1HA GLY 50 3.712 18.109 -8.190 327 HA3 GLY 50 2HA GLY 50 4.196 18.684 -6.601 328 HA PRO 51 HA PRO 51 7.148 15.377 -8.136 329 HB2 PRO 51 1HB PRO 51 9.381 16.917 -8.035 330 HB3 PRO 51 2HB PRO 51 8.346 16.819 -9.464 331 HG2 PRO 51 1HG PRO 51 8.436 18.917 -7.330 332 HG3 PRO 51 2HG PRO 51 8.302 19.113 -9.088 333 HD2 PRO 51 1HD PRO 51 6.165 19.293 -7.434 334 HD3 PRO 51 2HD PRO 51 6.040 18.668 -9.091 335 H GLY 52 H GLY 52 9.344 14.848 -6.995 336 HA2 GLY 52 1HA GLY 52 10.429 15.443 -4.731 337 HA3 GLY 52 2HA GLY 52 8.833 15.061 -4.104 338 H THR 53 H THR 53 10.793 13.661 -3.032 339 HA THR 53 HA THR 53 11.298 11.219 -4.494 340 HB THR 53 HB THR 53 12.451 10.483 -2.416 341 HG1 THR 53 1HG THR 53 12.348 11.667 -0.624 342 HG21 THR 53 3HG2 THR 53 13.132 13.080 -3.739 343 HG22 THR 53 1HG2 THR 53 13.917 11.509 -3.892 344 HG23 THR 53 2HG2 THR 53 14.137 12.466 -2.427 345 H LEU 54 H LEU 54 10.469 9.196 -4.054 346 HA LEU 54 HA LEU 54 8.415 8.954 -1.986 347 HB2 LEU 54 1HB LEU 54 6.703 8.376 -3.373 348 HB3 LEU 54 2HB LEU 54 7.540 9.549 -4.388 349 HG LEU 54 HG LEU 54 6.924 7.733 -5.780 350 HD11 LEU 54 1HD1 LEU 54 8.900 7.503 -6.819 351 HD12 LEU 54 2HD1 LEU 54 9.697 6.855 -5.386 352 HD13 LEU 54 3HD1 LEU 54 9.483 8.596 -5.563 353 HD21 LEU 54 3HD2 LEU 54 6.969 6.196 -3.551 354 HD22 LEU 54 1HD2 LEU 54 8.435 5.648 -4.364 355 HD23 LEU 54 2HD2 LEU 54 6.881 5.562 -5.195 356 H SER 55 H SER 55 7.778 6.688 -1.605 357 HA SER 55 HA SER 55 9.663 4.683 -2.577 358 HB2 SER 55 1HB SER 55 9.411 5.578 0.276 359 HB3 SER 55 2HB SER 55 9.830 3.903 -0.084 360 HG SER 55 HG SER 55 11.588 5.571 0.158 361 H VAL 56 H VAL 56 8.893 2.576 -2.494 362 HA VAL 56 HA VAL 56 6.159 2.209 -1.474 363 HB VAL 56 HB VAL 56 7.167 1.250 -4.157 364 HG11 VAL 56 1HG1 VAL 56 4.338 0.990 -3.243 365 HG12 VAL 56 2HG1 VAL 56 5.227 0.045 -4.440 366 HG13 VAL 56 3HG1 VAL 56 5.530 -0.200 -2.720 367 HG21 VAL 56 3HG2 VAL 56 6.439 3.724 -3.755 368 HG22 VAL 56 1HG2 VAL 56 5.849 2.850 -5.169 369 HG23 VAL 56 2HG2 VAL 56 4.811 3.045 -3.757 370 H THR 57 H THR 57 6.300 0.732 0.077 371 HA THR 57 HA THR 57 7.856 -1.707 -0.450 372 HB THR 57 HB THR 57 7.738 -0.354 2.250 373 HG1 THR 57 1HG THR 57 9.093 0.919 1.102 374 HG21 THR 57 3HG2 THR 57 8.394 -2.982 1.475 375 HG22 THR 57 1HG2 THR 57 8.621 -2.235 3.055 376 HG23 THR 57 2HG2 THR 57 9.916 -2.178 1.859 377 H ILE 58 H ILE 58 6.778 -3.545 -0.084 378 HA ILE 58 HA ILE 58 4.227 -3.371 1.384 379 HB ILE 58 HB ILE 58 4.967 -5.256 -0.858 380 HG12 ILE 58 1HG1 ILE 58 2.851 -3.102 -0.847 381 HG13 ILE 58 2HG1 ILE 58 4.486 -2.827 -1.440 382 HG21 ILE 58 1HG2 ILE 58 3.310 -6.565 -0.183 383 HG22 ILE 58 2HG2 ILE 58 3.045 -5.514 1.207 384 HG23 ILE 58 3HG2 ILE 58 2.182 -5.215 -0.302 385 HD11 ILE 58 3HD1 ILE 58 3.104 -3.283 -3.309 386 HD12 ILE 58 1HD1 ILE 58 4.120 -4.701 -3.051 387 HD13 ILE 58 2HD1 ILE 58 2.431 -4.721 -2.541 388 H GLU 59 H GLU 59 3.823 -4.791 2.999 389 HA GLU 59 HA GLU 59 5.907 -6.796 3.567 390 HB2 GLU 59 1HB GLU 59 4.288 -5.090 5.457 391 HB3 GLU 59 2HB GLU 59 5.197 -6.499 5.985 392 HG2 GLU 59 1HG GLU 59 6.356 -4.069 4.640 393 HG3 GLU 59 2HG GLU 59 6.422 -4.425 6.365 394 H GLY 60 H GLY 60 5.256 -8.796 4.443 395 HA2 GLY 60 1HA GLY 60 2.642 -9.532 5.101 396 HA3 GLY 60 2HA GLY 60 2.854 -9.835 3.383 397 HA PRO 61 HA PRO 61 4.385 -13.459 5.977 398 HB2 PRO 61 1HB PRO 61 2.596 -15.281 5.056 399 HB3 PRO 61 2HB PRO 61 2.291 -14.266 6.470 400 HG2 PRO 61 1HG PRO 61 1.350 -13.918 3.649 401 HG3 PRO 61 2HG PRO 61 0.451 -13.705 5.163 402 HD2 PRO 61 1HD PRO 61 1.465 -11.620 3.765 403 HD3 PRO 61 2HD PRO 61 1.328 -11.606 5.535 404 H SER 62 H SER 62 3.378 -13.060 2.633 405 HA SER 62 HA SER 62 5.588 -14.831 1.819 406 HB2 SER 62 1HB SER 62 2.764 -14.712 0.864 407 HB3 SER 62 2HB SER 62 4.022 -15.059 -0.322 408 HG SER 62 HG SER 62 3.221 -16.548 1.918 409 H LYS 63 H LYS 63 6.882 -14.148 0.155 410 HA LYS 63 HA LYS 63 6.994 -11.344 -0.327 411 HB2 LYS 63 1HB LYS 63 8.893 -13.155 -0.303 412 HB3 LYS 63 2HB LYS 63 8.485 -13.328 -2.005 413 HG2 LYS 63 1HG LYS 63 9.203 -11.197 -2.531 414 HG3 LYS 63 2HG LYS 63 9.040 -10.622 -0.870 415 HD2 LYS 63 1HD LYS 63 11.015 -12.771 -1.525 416 HD3 LYS 63 2HD LYS 63 11.407 -11.081 -1.853 417 HE2 LYS 63 1HE LYS 63 10.647 -10.697 0.598 418 HE3 LYS 63 2HE LYS 63 10.892 -12.435 0.768 419 HZ1 LYS 63 3HZ LYS 63 12.862 -10.316 0.319 420 HZ2 LYS 63 1HZ LYS 63 13.174 -11.842 -0.344 421 HZ3 LYS 63 2HZ LYS 63 12.948 -11.674 1.324 422 H VAL 64 H VAL 64 6.399 -10.162 -2.079 423 HA VAL 64 HA VAL 64 4.895 -11.585 -4.177 424 HB VAL 64 HB VAL 64 3.707 -9.402 -4.530 425 HG11 VAL 64 1HG1 VAL 64 3.489 -10.996 -2.013 426 HG12 VAL 64 2HG1 VAL 64 2.430 -9.608 -2.270 427 HG13 VAL 64 3HG1 VAL 64 2.415 -10.954 -3.410 428 HG21 VAL 64 3HG2 VAL 64 5.680 -8.485 -2.719 429 HG22 VAL 64 1HG2 VAL 64 4.397 -7.561 -3.501 430 HG23 VAL 64 2HG2 VAL 64 4.112 -8.310 -1.930 431 H LYS 65 H LYS 65 5.019 -10.768 -6.333 432 HA LYS 65 HA LYS 65 7.663 -9.767 -6.981 433 HB2 LYS 65 1HB LYS 65 5.391 -10.654 -8.769 434 HB3 LYS 65 2HB LYS 65 7.009 -10.236 -9.318 435 HG2 LYS 65 1HG LYS 65 6.628 -12.380 -7.274 436 HG3 LYS 65 2HG LYS 65 6.370 -12.721 -8.986 437 HD2 LYS 65 1HD LYS 65 8.693 -11.629 -9.310 438 HD3 LYS 65 2HD LYS 65 8.887 -11.907 -7.578 439 HE2 LYS 65 1HE LYS 65 8.852 -14.205 -7.811 440 HE3 LYS 65 2HE LYS 65 7.982 -14.140 -9.343 441 HZ1 LYS 65 3HZ LYS 65 9.888 -14.156 -10.446 442 HZ2 LYS 65 1HZ LYS 65 10.699 -14.428 -8.987 443 HZ3 LYS 65 2HZ LYS 65 10.498 -12.850 -9.561 444 H MET 66 H MET 66 7.907 -7.624 -6.780 445 HA MET 66 HA MET 66 5.757 -5.853 -7.692 446 HB2 MET 66 1HB MET 66 8.092 -5.519 -5.849 447 HB3 MET 66 2HB MET 66 7.390 -4.103 -6.619 448 HG2 MET 66 1HG MET 66 5.254 -4.552 -5.619 449 HG3 MET 66 2HG MET 66 5.842 -6.077 -4.961 450 HE1 MET 66 3HE MET 66 7.489 -2.247 -4.781 451 HE2 MET 66 1HE MET 66 5.737 -2.377 -4.933 452 HE3 MET 66 2HE MET 66 6.453 -1.862 -3.406 453 H ASP 67 H ASP 67 5.911 -5.510 -9.827 454 HA ASP 67 HA ASP 67 8.535 -5.138 -11.053 455 HB2 ASP 67 1HB ASP 67 6.853 -6.635 -12.125 456 HB3 ASP 67 2HB ASP 67 5.814 -5.233 -12.372 457 H CYS 68 H CYS 68 8.959 -3.090 -10.049 458 HA CYS 68 HA CYS 68 7.431 -0.826 -10.056 459 HB2 CYS 68 1HB CYS 68 9.450 0.445 -9.890 460 HB3 CYS 68 2HB CYS 68 9.740 -1.092 -9.084 461 HG CYS 68 HG CYS 68 11.794 -1.774 -10.464 462 H GLN 69 H GLN 69 6.701 0.611 -11.508 463 HA GLN 69 HA GLN 69 7.870 0.734 -14.170 464 HB2 GLN 69 1HB GLN 69 6.161 -1.004 -14.379 465 HB3 GLN 69 2HB GLN 69 4.954 0.084 -13.708 466 HG2 GLN 69 1HG GLN 69 6.435 0.954 -16.129 467 HG3 GLN 69 2HG GLN 69 5.200 -0.292 -16.302 468 HE21 GLN 69 1HE2 GLN 69 4.488 1.666 -17.687 469 HE22 GLN 69 2HE2 GLN 69 3.374 2.739 -16.918 470 H GLU 70 H GLU 70 7.956 2.770 -14.870 471 HA GLU 70 HA GLU 70 6.749 4.858 -13.287 472 HB2 GLU 70 1HB GLU 70 8.038 6.387 -14.620 473 HB3 GLU 70 2HB GLU 70 9.062 5.020 -14.206 474 HG2 GLU 70 1HG GLU 70 8.711 4.070 -16.420 475 HG3 GLU 70 2HG GLU 70 7.660 5.422 -16.839 476 H THR 71 H THR 71 5.239 6.371 -13.974 477 HA THR 71 HA THR 71 3.832 5.746 -16.486 478 HB THR 71 HB THR 71 1.725 6.532 -15.226 479 HG1 THR 71 1HG THR 71 3.301 7.018 -13.323 480 HG21 THR 71 3HG2 THR 71 1.241 4.367 -15.411 481 HG22 THR 71 1HG2 THR 71 2.157 4.031 -13.943 482 HG23 THR 71 2HG2 THR 71 2.960 3.986 -15.513 483 HA PRO 72 HA PRO 72 4.089 10.020 -17.461 484 HB2 PRO 72 1HB PRO 72 1.793 10.378 -18.865 485 HB3 PRO 72 2HB PRO 72 3.180 9.486 -19.502 486 HG2 PRO 72 1HG PRO 72 0.666 8.442 -18.256 487 HG3 PRO 72 2HG PRO 72 1.529 7.859 -19.692 488 HD2 PRO 72 1HD PRO 72 1.749 6.661 -17.273 489 HD3 PRO 72 2HD PRO 72 3.084 6.704 -18.442 490 H GLU 73 H GLU 73 1.959 8.856 -15.218 491 HA GLU 73 HA GLU 73 0.872 11.540 -14.666 492 HB2 GLU 73 1HB GLU 73 -0.335 8.820 -14.414 493 HB3 GLU 73 2HB GLU 73 -0.819 10.062 -13.268 494 HG2 GLU 73 1HG GLU 73 -0.938 10.443 -16.245 495 HG3 GLU 73 2HG GLU 73 -2.278 9.801 -15.296 496 H GLY 74 H GLY 74 1.851 8.498 -13.084 497 HA2 GLY 74 1HA GLY 74 3.297 10.009 -11.072 498 HA3 GLY 74 2HA GLY 74 1.907 9.117 -10.472 499 H TYR 75 H TYR 75 2.083 6.969 -10.097 500 HA TYR 75 HA TYR 75 4.310 5.467 -11.200 501 HB2 TYR 75 1HB TYR 75 3.969 5.818 -8.214 502 HB3 TYR 75 2HB TYR 75 5.107 4.721 -8.990 503 HD1 TYR 75 1HD TYR 75 6.423 6.176 -11.017 504 HD2 TYR 75 2HD TYR 75 5.050 7.607 -7.253 505 HE1 TYR 75 1HE TYR 75 8.105 7.969 -11.092 506 HE2 TYR 75 2HE TYR 75 6.727 9.405 -7.318 507 HH TYR 75 HH TYR 75 9.320 9.438 -9.028 508 H LYS 76 H LYS 76 3.582 3.537 -11.773 509 HA LYS 76 HA LYS 76 1.190 2.478 -10.424 510 HB2 LYS 76 1HB LYS 76 0.763 2.869 -12.753 511 HB3 LYS 76 2HB LYS 76 2.248 2.051 -13.220 512 HG2 LYS 76 1HG LYS 76 1.165 -0.006 -12.053 513 HG3 LYS 76 2HG LYS 76 -0.336 0.893 -12.284 514 HD2 LYS 76 1HD LYS 76 -0.022 0.951 -14.651 515 HD3 LYS 76 2HD LYS 76 1.615 0.309 -14.505 516 HE2 LYS 76 1HE LYS 76 0.609 -1.764 -13.515 517 HE3 LYS 76 2HE LYS 76 -0.977 -1.118 -13.932 518 HZ1 LYS 76 3HZ LYS 76 1.148 -1.439 -15.962 519 HZ2 LYS 76 1HZ LYS 76 -0.518 -1.267 -16.199 520 HZ3 LYS 76 2HZ LYS 76 0.102 -2.708 -15.567 521 H VAL 77 H VAL 77 1.507 0.820 -9.108 522 HA VAL 77 HA VAL 77 3.866 -0.892 -9.533 523 HB VAL 77 HB VAL 77 2.322 -0.335 -6.998 524 HG11 VAL 77 1HG1 VAL 77 4.089 -1.713 -5.908 525 HG12 VAL 77 2HG1 VAL 77 3.009 -2.632 -6.960 526 HG13 VAL 77 3HG1 VAL 77 4.629 -2.205 -7.512 527 HG21 VAL 77 3HG2 VAL 77 4.525 0.584 -6.253 528 HG22 VAL 77 1HG2 VAL 77 5.093 0.414 -7.914 529 HG23 VAL 77 2HG2 VAL 77 3.753 1.500 -7.547 530 H MET 78 H MET 78 3.666 -3.121 -9.473 531 HA MET 78 HA MET 78 0.922 -4.183 -9.405 532 HB2 MET 78 1HB MET 78 3.105 -5.022 -11.321 533 HB3 MET 78 2HB MET 78 1.491 -5.713 -11.230 534 HG2 MET 78 1HG MET 78 0.490 -3.790 -12.095 535 HG3 MET 78 2HG MET 78 1.913 -2.800 -11.777 536 HE1 MET 78 3HE MET 78 4.058 -2.671 -14.009 537 HE2 MET 78 1HE MET 78 4.166 -3.672 -12.560 538 HE3 MET 78 2HE MET 78 4.488 -4.376 -14.145 539 H TYR 79 H TYR 79 0.629 -6.044 -8.290 540 HA TYR 79 HA TYR 79 2.881 -7.719 -7.572 541 HB2 TYR 79 1HB TYR 79 2.696 -7.486 -5.213 542 HB3 TYR 79 2HB TYR 79 2.783 -5.851 -5.860 543 HD1 TYR 79 1HD TYR 79 0.234 -8.413 -4.904 544 HD2 TYR 79 2HD TYR 79 1.264 -4.289 -5.092 545 HE1 TYR 79 1HE TYR 79 -1.852 -7.844 -3.731 546 HE2 TYR 79 2HE TYR 79 -0.818 -3.709 -3.919 547 HH TYR 79 HH TYR 79 -3.141 -4.815 -3.638 548 H THR 80 H THR 80 2.242 -9.732 -6.608 549 HA THR 80 HA THR 80 -0.622 -10.331 -6.641 550 HB THR 80 HB THR 80 1.422 -11.914 -8.211 551 HG1 THR 80 1HG THR 80 0.350 -9.839 -9.035 552 HG21 THR 80 3HG2 THR 80 -0.462 -13.173 -6.974 553 HG22 THR 80 1HG2 THR 80 -0.231 -13.493 -8.693 554 HG23 THR 80 2HG2 THR 80 -1.534 -12.430 -8.160 555 HA PRO 81 HA PRO 81 0.977 -12.274 -2.913 556 HB2 PRO 81 1HB PRO 81 -1.470 -12.722 -1.824 557 HB3 PRO 81 2HB PRO 81 -0.668 -11.148 -1.770 558 HG2 PRO 81 1HG PRO 81 -2.806 -12.121 -3.625 559 HG3 PRO 81 2HG PRO 81 -2.660 -10.552 -2.811 560 HD2 PRO 81 1HD PRO 81 -1.979 -10.917 -5.407 561 HD3 PRO 81 2HD PRO 81 -1.149 -9.750 -4.356 562 H MET 82 H MET 82 1.697 -14.299 -3.114 563 HA MET 82 HA MET 82 0.244 -16.308 -4.561 564 HB2 MET 82 1HB MET 82 2.654 -16.297 -4.692 565 HB3 MET 82 2HB MET 82 2.793 -16.429 -2.944 566 HG2 MET 82 1HG MET 82 1.717 -18.652 -3.070 567 HG3 MET 82 2HG MET 82 1.720 -18.515 -4.827 568 HE1 MET 82 3HE MET 82 3.494 -18.496 -6.277 569 HE2 MET 82 1HE MET 82 5.140 -19.065 -5.996 570 HE3 MET 82 2HE MET 82 3.794 -20.203 -5.949 571 H ALA 83 H ALA 83 0.719 -15.450 -1.211 572 HA ALA 83 HA ALA 83 -1.119 -17.622 -0.453 573 HB1 ALA 83 3HB ALA 83 1.116 -18.229 0.277 574 HB2 ALA 83 1HB ALA 83 1.281 -16.686 1.115 575 HB3 ALA 83 2HB ALA 83 0.093 -17.868 1.667 576 HA PRO 84 HA PRO 84 -3.570 -14.437 1.343 577 HB2 PRO 84 1HB PRO 84 -4.973 -15.924 3.130 578 HB3 PRO 84 2HB PRO 84 -5.272 -15.979 1.388 579 HG2 PRO 84 1HG PRO 84 -3.697 -17.863 3.100 580 HG3 PRO 84 2HG PRO 84 -4.844 -18.227 1.797 581 HD2 PRO 84 1HD PRO 84 -2.161 -18.284 1.434 582 HD3 PRO 84 2HD PRO 84 -3.289 -17.821 0.144 583 H GLY 85 H GLY 85 -4.054 -13.398 3.419 584 HA2 GLY 85 1HA GLY 85 -3.299 -13.827 5.916 585 HA3 GLY 85 2HA GLY 85 -1.729 -13.530 5.183 586 H ASN 86 H ASN 86 -1.399 -11.684 6.458 587 HA ASN 86 HA ASN 86 -3.149 -9.401 5.824 588 HB2 ASN 86 1HB ASN 86 -1.982 -8.401 7.911 589 HB3 ASN 86 2HB ASN 86 -3.220 -9.631 8.150 590 HD21 ASN 86 1HD2 ASN 86 -2.532 -10.494 10.023 591 HD22 ASN 86 2HD2 ASN 86 -1.011 -11.286 10.232 592 H TYR 87 H TYR 87 -2.339 -7.981 4.443 593 HA TYR 87 HA TYR 87 0.589 -7.696 4.269 594 HB2 TYR 87 1HB TYR 87 -1.536 -7.466 2.139 595 HB3 TYR 87 2HB TYR 87 0.103 -6.864 1.912 596 HD1 TYR 87 1HD TYR 87 -1.590 -9.993 3.077 597 HD2 TYR 87 2HD TYR 87 1.572 -8.259 0.818 598 HE1 TYR 87 1HE TYR 87 -0.871 -12.237 2.371 599 HE2 TYR 87 2HE TYR 87 2.298 -10.498 0.105 600 HH TYR 87 HH TYR 87 0.402 -13.343 0.768 601 H LEU 88 H LEU 88 1.465 -5.626 4.050 602 HA LEU 88 HA LEU 88 -0.387 -3.396 4.566 603 HB2 LEU 88 1HB LEU 88 1.145 -4.317 6.498 604 HB3 LEU 88 2HB LEU 88 2.377 -3.358 5.679 605 HG LEU 88 HG LEU 88 0.795 -1.386 5.922 606 HD11 LEU 88 1HD1 LEU 88 -0.488 -3.089 8.039 607 HD12 LEU 88 2HD1 LEU 88 -1.180 -2.883 6.430 608 HD13 LEU 88 3HD1 LEU 88 -0.966 -1.485 7.483 609 HD21 LEU 88 3HD2 LEU 88 1.357 -2.007 8.678 610 HD22 LEU 88 1HD2 LEU 88 2.116 -0.821 7.616 611 HD23 LEU 88 2HD2 LEU 88 2.701 -2.485 7.641 612 H ILE 89 H ILE 89 -0.268 -1.856 3.082 613 HA ILE 89 HA ILE 89 2.110 -1.730 1.366 614 HB ILE 89 HB ILE 89 -0.652 -0.592 0.921 615 HG12 ILE 89 1HG1 ILE 89 0.716 -2.827 -0.578 616 HG13 ILE 89 2HG1 ILE 89 -0.343 -3.115 0.798 617 HG21 ILE 89 1HG2 ILE 89 0.054 0.187 -1.169 618 HG22 ILE 89 2HG2 ILE 89 1.352 0.650 -0.070 619 HG23 ILE 89 3HG2 ILE 89 1.543 -0.756 -1.118 620 HD11 ILE 89 3HD1 ILE 89 -1.572 -1.390 -1.174 621 HD12 ILE 89 1HD1 ILE 89 -1.090 -2.946 -1.850 622 HD13 ILE 89 2HD1 ILE 89 -2.161 -2.887 -0.450 623 H SER 90 H SER 90 3.557 -0.250 1.920 624 HA SER 90 HA SER 90 2.716 2.141 3.368 625 HB2 SER 90 1HB SER 90 5.406 0.885 2.836 626 HB3 SER 90 2HB SER 90 5.248 2.497 3.532 627 HG SER 90 HG SER 90 4.333 1.651 5.321 628 H VAL 91 H VAL 91 2.371 3.994 2.355 629 HA VAL 91 HA VAL 91 3.686 4.447 -0.245 630 HB VAL 91 HB VAL 91 0.985 5.461 0.651 631 HG11 VAL 91 1HG1 VAL 91 0.825 6.189 -1.753 632 HG12 VAL 91 2HG1 VAL 91 1.962 7.103 -0.759 633 HG13 VAL 91 3HG1 VAL 91 2.556 5.879 -1.882 634 HG21 VAL 91 3HG2 VAL 91 0.367 3.381 0.051 635 HG22 VAL 91 1HG2 VAL 91 0.543 4.003 -1.590 636 HG23 VAL 91 2HG2 VAL 91 1.856 3.088 -0.849 637 H LYS 92 H LYS 92 5.369 5.740 0.245 638 HA LYS 92 HA LYS 92 4.915 8.041 2.010 639 HB2 LYS 92 1HB LYS 92 7.488 6.821 0.991 640 HB3 LYS 92 2HB LYS 92 7.389 8.221 2.051 641 HG2 LYS 92 1HG LYS 92 6.437 6.901 3.809 642 HG3 LYS 92 2HG LYS 92 6.311 5.498 2.745 643 HD2 LYS 92 1HD LYS 92 8.646 5.208 2.680 644 HD3 LYS 92 2HD LYS 92 8.946 6.816 3.342 645 HE2 LYS 92 1HE LYS 92 9.312 5.501 5.191 646 HE3 LYS 92 2HE LYS 92 7.606 5.895 5.391 647 HZ1 LYS 92 3HZ LYS 92 8.823 3.358 5.056 648 HZ2 LYS 92 1HZ LYS 92 7.683 3.620 3.833 649 HZ3 LYS 92 2HZ LYS 92 7.221 3.728 5.456 650 H TYR 93 H TYR 93 5.792 10.125 1.390 651 HA TYR 93 HA TYR 93 6.402 10.559 -1.409 652 HB2 TYR 93 1HB TYR 93 4.048 10.664 -1.628 653 HB3 TYR 93 2HB TYR 93 3.867 11.559 -0.123 654 HD1 TYR 93 2HD TYR 93 4.580 13.956 -0.031 655 HD2 TYR 93 1HD TYR 93 4.425 11.782 -3.686 656 HE1 TYR 93 2HE TYR 93 4.600 16.072 -1.284 657 HE2 TYR 93 1HE TYR 93 4.445 13.893 -4.949 658 HH TYR 93 HH TYR 93 4.398 16.112 -4.829 659 H GLY 94 H GLY 94 7.515 12.451 -1.785 660 HA2 GLY 94 1HA GLY 94 9.081 14.030 -1.128 661 HA3 GLY 94 2HA GLY 94 7.644 14.788 -0.458 662 H GLY 95 H GLY 95 9.535 11.920 0.499 663 HA2 GLY 95 1HA GLY 95 11.082 12.132 2.405 664 HA3 GLY 95 2HA GLY 95 9.896 13.202 3.137 665 HA PRO 96 HA PRO 96 9.331 8.844 4.738 666 HB2 PRO 96 1HB PRO 96 9.539 9.493 7.366 667 HB3 PRO 96 2HB PRO 96 10.936 9.079 6.365 668 HG2 PRO 96 1HG PRO 96 9.914 11.775 7.168 669 HG3 PRO 96 2HG PRO 96 11.584 11.182 7.116 670 HD2 PRO 96 1HD PRO 96 10.530 12.740 5.168 671 HD3 PRO 96 2HD PRO 96 11.759 11.502 4.840 672 H ASN 97 H ASN 97 7.787 11.816 4.807 673 HA ASN 97 HA ASN 97 5.678 11.242 6.641 674 HB2 ASN 97 1HB ASN 97 5.538 13.200 4.349 675 HB3 ASN 97 2HB ASN 97 4.675 13.261 5.883 676 HD21 ASN 97 1HD2 ASN 97 5.838 13.790 7.780 677 HD22 ASN 97 2HD2 ASN 97 7.313 14.685 7.692 678 H HIS 98 H HIS 98 4.016 9.921 6.361 679 HA HIS 98 HA HIS 98 3.537 8.663 3.822 680 HB2 HIS 98 1HB HIS 98 1.605 7.594 5.142 681 HB3 HIS 98 2HB HIS 98 3.248 7.226 5.658 682 HD2 HIS 98 2HD HIS 98 3.380 7.306 8.345 683 HE1 HIS 98 1HE HIS 98 0.538 10.385 9.015 684 HE2 HIS 98 2HE HIS 98 2.206 8.826 10.078 685 H ILE 99 H ILE 99 1.067 8.381 3.252 686 HA ILE 99 HA ILE 99 -0.045 11.101 3.048 687 HB ILE 99 HB ILE 99 -1.193 10.344 1.014 688 HG12 ILE 99 1HG1 ILE 99 0.463 7.838 1.075 689 HG13 ILE 99 2HG1 ILE 99 -1.124 7.880 1.836 690 HG21 ILE 99 1HG2 ILE 99 1.095 11.362 0.970 691 HG22 ILE 99 2HG2 ILE 99 1.748 9.730 0.838 692 HG23 ILE 99 3HG2 ILE 99 0.702 10.366 -0.431 693 HD11 ILE 99 3HD1 ILE 99 -1.020 8.895 -0.918 694 HD12 ILE 99 1HD1 ILE 99 -0.686 7.175 -0.722 695 HD13 ILE 99 2HD1 ILE 99 -2.203 7.852 -0.129 696 H VAL 100 H VAL 100 -2.501 11.045 2.631 697 HA VAL 100 HA VAL 100 -3.796 10.136 4.917 698 HB VAL 100 HB VAL 100 -4.910 10.896 2.221 699 HG11 VAL 100 1HG1 VAL 100 -7.107 11.033 3.298 700 HG12 VAL 100 2HG1 VAL 100 -6.481 9.383 3.306 701 HG13 VAL 100 3HG1 VAL 100 -6.421 10.357 4.776 702 HG21 VAL 100 3HG2 VAL 100 -5.595 12.940 3.452 703 HG22 VAL 100 1HG2 VAL 100 -4.726 12.336 4.863 704 HG23 VAL 100 2HG2 VAL 100 -3.847 12.717 3.383 705 H GLY 101 H GLY 101 -5.126 8.398 5.379 706 HA2 GLY 101 1HA GLY 101 -6.147 6.334 5.079 707 HA3 GLY 101 2HA GLY 101 -5.655 6.368 3.392 708 H SER 102 H SER 102 -2.954 6.559 3.520 709 HA SER 102 HA SER 102 -2.171 3.915 4.050 710 HB2 SER 102 1HB SER 102 -0.783 4.866 2.487 711 HB3 SER 102 2HB SER 102 -0.771 6.434 3.294 712 HG SER 102 HG SER 102 0.615 5.525 4.868 713 HA PRO 103 HA PRO 103 -0.078 2.928 4.474 714 HB2 PRO 103 1HB PRO 103 0.057 0.718 6.046 715 HB3 PRO 103 2HB PRO 103 1.326 1.948 6.006 716 HG2 PRO 103 1HG PRO 103 -0.885 1.571 7.988 717 HG3 PRO 103 2HG PRO 103 0.821 1.960 8.276 718 HD2 PRO 103 1HD PRO 103 -1.130 3.837 8.329 719 HD3 PRO 103 2HD PRO 103 0.524 4.194 7.792 720 H PHE 104 H PHE 104 -1.227 1.632 3.141 721 HA PHE 104 HA PHE 104 -4.015 1.177 3.768 722 HB2 PHE 104 1HB PHE 104 -2.447 0.513 1.268 723 HB3 PHE 104 2HB PHE 104 -4.197 0.434 1.435 724 HD1 PHE 104 2HD PHE 104 -5.320 2.680 2.237 725 HD2 PHE 104 1HD PHE 104 -1.515 2.398 0.352 726 HE1 PHE 104 2HE PHE 104 -5.492 5.035 1.546 727 HE2 PHE 104 1HE PHE 104 -1.680 4.753 -0.342 728 HZ PHE 104 HZ PHE 104 -3.671 6.075 0.254 729 H LYS 105 H LYS 105 -4.510 -0.532 4.976 730 HA LYS 105 HA LYS 105 -2.940 -2.985 4.745 731 HB2 LYS 105 1HB LYS 105 -3.722 -1.807 6.960 732 HB3 LYS 105 2HB LYS 105 -5.229 -2.657 6.647 733 HG2 LYS 105 1HG LYS 105 -2.696 -4.207 6.563 734 HG3 LYS 105 2HG LYS 105 -3.332 -3.711 8.133 735 HD2 LYS 105 1HD LYS 105 -5.193 -4.973 6.181 736 HD3 LYS 105 2HD LYS 105 -4.032 -6.003 7.022 737 HE2 LYS 105 1HE LYS 105 -4.863 -4.934 9.168 738 HE3 LYS 105 2HE LYS 105 -6.181 -4.263 8.208 739 HZ1 LYS 105 3HZ LYS 105 -5.924 -7.025 7.686 740 HZ2 LYS 105 1HZ LYS 105 -7.245 -6.184 8.328 741 HZ3 LYS 105 2HZ LYS 105 -6.043 -6.781 9.356 742 H ALA 106 H ALA 106 -3.571 -4.479 3.347 743 HA ALA 106 HA ALA 106 -6.428 -4.676 2.671 744 HB1 ALA 106 3HB ALA 106 -4.276 -5.964 1.047 745 HB2 ALA 106 1HB ALA 106 -5.866 -5.385 0.548 746 HB3 ALA 106 2HB ALA 106 -4.578 -4.232 0.899 747 H LYS 107 H LYS 107 -7.426 -6.719 2.550 748 HA LYS 107 HA LYS 107 -6.086 -8.787 4.160 749 HB2 LYS 107 1HB LYS 107 -8.200 -7.784 5.069 750 HB3 LYS 107 2HB LYS 107 -9.052 -8.456 3.685 751 HG2 LYS 107 1HG LYS 107 -8.418 -10.708 4.385 752 HG3 LYS 107 2HG LYS 107 -7.560 -10.034 5.772 753 HD2 LYS 107 1HD LYS 107 -9.587 -10.606 6.714 754 HD3 LYS 107 2HD LYS 107 -9.860 -8.914 6.290 755 HE2 LYS 107 1HE LYS 107 -11.207 -9.455 4.479 756 HE3 LYS 107 2HE LYS 107 -10.551 -11.087 4.352 757 HZ1 LYS 107 3HZ LYS 107 -12.618 -11.433 5.279 758 HZ2 LYS 107 1HZ LYS 107 -12.557 -10.040 6.237 759 HZ3 LYS 107 2HZ LYS 107 -11.634 -11.393 6.655 760 H VAL 108 H VAL 108 -5.335 -10.439 3.022 761 HA VAL 108 HA VAL 108 -6.447 -11.043 0.400 762 HB VAL 108 HB VAL 108 -4.165 -12.498 1.715 763 HG11 VAL 108 1HG1 VAL 108 -4.969 -12.010 -1.149 764 HG12 VAL 108 2HG1 VAL 108 -3.455 -12.772 -0.657 765 HG13 VAL 108 3HG1 VAL 108 -4.995 -13.543 -0.277 766 HG21 VAL 108 3HG2 VAL 108 -3.064 -10.619 -0.013 767 HG22 VAL 108 1HG2 VAL 108 -4.270 -9.723 0.910 768 HG23 VAL 108 2HG2 VAL 108 -2.993 -10.603 1.749 769 H THR 109 H THR 109 -7.651 -12.785 -0.084 770 HA THR 109 HA THR 109 -8.004 -14.852 1.982 771 HB THR 109 HB THR 109 -10.398 -14.996 1.409 772 HG1 THR 109 1HG THR 109 -10.947 -14.066 -0.409 773 HG21 THR 109 3HG2 THR 109 -10.811 -12.413 2.172 774 HG22 THR 109 1HG2 THR 109 -9.135 -12.658 2.662 775 HG23 THR 109 2HG2 THR 109 -10.398 -13.728 3.272 776 H GLY 110 H GLY 110 -9.082 -16.850 1.065 777 HA2 GLY 110 1HA GLY 110 -9.579 -18.006 -1.094 778 HA3 GLY 110 2HA GLY 110 -8.064 -17.326 -1.669 779 H GLN 111 H GLN 111 -7.515 -19.561 -2.164 780 HA GLN 111 HA GLN 111 -6.818 -21.166 0.194 781 HB2 GLN 111 1HB GLN 111 -7.990 -22.600 -1.164 782 HB3 GLN 111 2HB GLN 111 -7.458 -21.810 -2.642 783 HG2 GLN 111 1HG GLN 111 -5.527 -23.018 -2.762 784 HG3 GLN 111 2HG GLN 111 -5.440 -23.261 -1.018 785 HE21 GLN 111 1HE2 GLN 111 -4.951 -25.477 -1.670 786 HE22 GLN 111 2HE2 GLN 111 -6.260 -26.561 -1.979 787 H ARG 112 H ARG 112 -4.740 -21.952 0.508 788 HA ARG 112 HA ARG 112 -2.625 -20.274 -0.290 789 HB2 ARG 112 1HB ARG 112 -2.631 -23.020 0.966 790 HB3 ARG 112 2HB ARG 112 -1.169 -22.076 0.711 791 HG2 ARG 112 1HG ARG 112 -2.225 -20.261 2.092 792 HG3 ARG 112 2HG ARG 112 -3.498 -21.416 2.492 793 HD2 ARG 112 1HD ARG 112 -2.093 -22.736 3.745 794 HD3 ARG 112 2HD ARG 112 -0.652 -22.211 2.876 795 HE ARG 112 HE ARG 112 -1.750 -20.039 4.297 796 HH11 ARG 112 1HH1 ARG 112 -0.037 -23.026 4.810 797 HH12 ARG 112 2HH1 ARG 112 0.723 -22.490 6.272 798 HH21 ARG 112 1HH2 ARG 112 -0.756 -19.323 6.221 799 HH22 ARG 112 2HH2 ARG 112 0.313 -20.384 7.074 800 H LEU 113 H LEU 113 -2.216 -20.123 -2.434 801 HA LEU 113 HA LEU 113 -2.428 -22.048 -4.382 802 HB2 LEU 113 1HB LEU 113 -0.493 -19.756 -4.141 803 HB3 LEU 113 2HB LEU 113 -0.644 -20.740 -5.595 804 HG LEU 113 HG LEU 113 -2.884 -19.112 -4.398 805 HD11 LEU 113 1HD1 LEU 113 -2.435 -17.407 -5.902 806 HD12 LEU 113 2HD1 LEU 113 -1.412 -18.428 -6.912 807 HD13 LEU 113 3HD1 LEU 113 -0.827 -17.871 -5.344 808 HD21 LEU 113 3HD2 LEU 113 -3.745 -20.934 -5.674 809 HD22 LEU 113 1HD2 LEU 113 -2.589 -20.646 -6.974 810 HD23 LEU 113 2HD2 LEU 113 -3.877 -19.481 -6.666 811 H VAL 114 H VAL 114 -1.637 -24.052 -4.232 812 HA VAL 114 HA VAL 114 1.258 -24.364 -3.927 813 HB VAL 114 HB VAL 114 0.284 -24.786 -1.699 814 HG11 VAL 114 1HG1 VAL 114 -1.099 -26.842 -1.402 815 HG12 VAL 114 2HG1 VAL 114 -1.914 -25.541 -2.271 816 HG13 VAL 114 3HG1 VAL 114 -1.264 -26.922 -3.155 817 HG21 VAL 114 3HG2 VAL 114 1.748 -26.797 -3.275 818 HG22 VAL 114 1HG2 VAL 114 2.173 -26.014 -1.752 819 HG23 VAL 114 2HG2 VAL 114 1.052 -27.376 -1.762 820 H SER 115 H SER 115 2.126 -25.897 -5.222 821 HA SER 115 HA SER 115 0.883 -26.798 -7.479 822 HB2 SER 115 1HB SER 115 2.679 -28.509 -7.636 823 HB3 SER 115 2HB SER 115 3.299 -26.915 -7.206 824 HG SER 115 HG SER 115 2.607 -28.644 -5.129 825 HA PRO 116 HA PRO 116 -1.929 -29.960 -6.263 826 HB2 PRO 116 1HB PRO 116 -2.138 -31.271 -8.632 827 HB3 PRO 116 2HB PRO 116 -2.883 -29.695 -8.337 828 HG2 PRO 116 1HG PRO 116 -0.321 -30.346 -9.743 829 HG3 PRO 116 2HG PRO 116 -1.585 -29.188 -10.198 830 HD2 PRO 116 1HD PRO 116 0.719 -28.431 -8.992 831 HD3 PRO 116 2HD PRO 116 -0.819 -27.584 -8.731 832 H GLY 117 H GLY 117 1.197 -30.685 -7.618 833 HA2 GLY 117 1HA GLY 117 1.825 -32.740 -5.891 834 HA3 GLY 117 2HA GLY 117 1.075 -33.516 -7.278 835 H SER 118 H SER 118 2.950 -34.579 -7.904 836 HA SER 118 HA SER 118 5.072 -32.827 -8.963 837 HB2 SER 118 1HB SER 118 5.842 -34.176 -7.034 838 HB3 SER 118 2HB SER 118 5.393 -35.645 -7.900 839 HG SER 118 HG SER 118 7.201 -33.749 -8.967 840 H ALA 119 H ALA 119 3.323 -35.877 -9.387 841 HA ALA 119 HA ALA 119 2.962 -37.197 -11.214 842 HB1 ALA 119 3HB ALA 119 1.661 -36.049 -12.598 843 HB2 ALA 119 1HB ALA 119 2.213 -34.568 -11.815 844 HB3 ALA 119 2HB ALA 119 3.045 -35.170 -13.249 845 H ASN 120 H ASN 120 5.672 -37.021 -10.483 846 HA ASN 120 HA ASN 120 7.190 -36.709 -12.944 847 HB2 ASN 120 1HB ASN 120 8.188 -35.876 -10.883 848 HB3 ASN 120 2HB ASN 120 8.058 -37.471 -10.147 849 HD21 ASN 120 1HD2 ASN 120 9.423 -35.879 -13.005 850 HD22 ASN 120 2HD2 ASN 120 10.883 -36.802 -13.033 851 H GLU 121 H GLU 121 7.620 -38.321 -14.295 852 HA GLU 121 HA GLU 121 6.738 -40.989 -13.712 853 HB2 GLU 121 1HB GLU 121 8.277 -39.937 -16.092 854 HB3 GLU 121 2HB GLU 121 7.497 -41.509 -15.986 855 HG2 GLU 121 1HG GLU 121 5.320 -40.376 -15.736 856 HG3 GLU 121 2HG GLU 121 6.133 -38.827 -15.949 857 H THR 122 H THR 122 7.882 -42.397 -12.579 858 HA THR 122 HA THR 122 10.788 -42.111 -12.419 859 HB THR 122 HB THR 122 10.701 -43.634 -10.536 860 HG1 THR 122 1HG THR 122 7.881 -43.769 -10.814 861 HG21 THR 122 3HG2 THR 122 9.277 -42.335 -9.003 862 HG22 THR 122 1HG2 THR 122 8.514 -41.556 -10.387 863 HG23 THR 122 2HG2 THR 122 10.227 -41.293 -10.061 864 H SER 123 H SER 123 8.312 -44.466 -13.320 865 HA SER 123 HA SER 123 8.518 -46.594 -14.200 866 HB2 SER 123 1HB SER 123 9.584 -46.505 -16.447 867 HB3 SER 123 2HB SER 123 8.478 -45.161 -16.163 868 HG SER 123 HG SER 123 10.637 -44.675 -17.091 869 H SER 124 H SER 124 10.238 -46.420 -12.051 870 HA SER 124 HA SER 124 12.795 -47.516 -12.955 871 HB2 SER 124 1HB SER 124 13.525 -47.250 -10.636 872 HB3 SER 124 2HB SER 124 12.824 -45.744 -11.228 873 HG SER 124 HG SER 124 11.856 -47.538 -9.323 874 H ILE 125 H ILE 125 13.614 -49.497 -12.098 875 HA ILE 125 HA ILE 125 11.824 -51.636 -12.194 876 HB ILE 125 HB ILE 125 13.625 -53.059 -11.567 877 HG12 ILE 125 1HG1 ILE 125 14.322 -51.845 -9.540 878 HG13 ILE 125 2HG1 ILE 125 15.700 -52.239 -10.562 879 HG21 ILE 125 1HG2 ILE 125 15.574 -51.629 -12.839 880 HG22 ILE 125 2HG2 ILE 125 14.310 -52.562 -13.638 881 HG23 ILE 125 3HG2 ILE 125 14.104 -50.828 -13.392 882 HD11 ILE 125 3HD1 ILE 125 15.384 -49.858 -11.501 883 HD12 ILE 125 1HD1 ILE 125 14.435 -49.586 -10.040 884 HD13 ILE 125 2HD1 ILE 125 16.128 -50.066 -9.916 Start of MODEL 11 1 H1 GLY 1 H GLY 1 -36.441 41.765 -0.485 2 HA2 GLY 1 1HA GLY 1 -35.510 40.708 -3.051 3 HA3 GLY 1 2HA GLY 1 -34.487 40.441 -1.647 4 H SER 2 H SER 2 -35.706 39.478 0.286 5 HA SER 2 HA SER 2 -36.554 37.492 1.063 6 HB2 SER 2 1HB SER 2 -38.520 39.023 1.021 7 HB3 SER 2 2HB SER 2 -38.934 38.398 -0.576 8 HG SER 2 HG SER 2 -38.534 36.504 1.406 9 H SER 3 H SER 3 -34.914 36.879 -0.972 10 HA SER 3 HA SER 3 -36.159 34.504 -2.064 11 HB2 SER 3 1HB SER 3 -35.614 34.969 -4.380 12 HB3 SER 3 2HB SER 3 -36.629 36.272 -3.762 13 HG SER 3 HG SER 3 -34.399 37.239 -3.273 14 H GLY 4 H GLY 4 -34.451 33.272 -3.435 15 HA2 GLY 4 1HA GLY 4 -31.700 33.773 -3.017 16 HA3 GLY 4 2HA GLY 4 -32.284 32.660 -1.789 17 H SER 5 H SER 5 -30.317 31.916 -3.576 18 HA SER 5 HA SER 5 -31.354 29.510 -4.605 19 HB2 SER 5 1HB SER 5 -32.213 31.246 -6.297 20 HB3 SER 5 2HB SER 5 -30.532 31.396 -6.808 21 HG SER 5 HG SER 5 -32.283 29.572 -7.548 22 H SER 6 H SER 6 -29.716 28.203 -5.674 23 HA SER 6 HA SER 6 -27.005 29.183 -5.766 24 HB2 SER 6 1HB SER 6 -26.104 27.625 -4.113 25 HB3 SER 6 2HB SER 6 -27.289 28.690 -3.357 26 HG SER 6 HG SER 6 -28.755 27.039 -3.333 27 H GLY 7 H GLY 7 -25.470 27.271 -6.262 28 HA2 GLY 7 1HA GLY 7 -26.635 24.941 -7.459 29 HA3 GLY 7 2HA GLY 7 -26.131 26.122 -8.659 30 H PHE 8 H PHE 8 -23.829 26.948 -8.337 31 HA PHE 8 HA PHE 8 -22.118 24.608 -8.031 32 HB2 PHE 8 1HB PHE 8 -22.108 26.368 -9.992 33 HB3 PHE 8 2HB PHE 8 -21.088 27.283 -8.887 34 HD1 PHE 8 1HD PHE 8 -21.402 23.943 -10.487 35 HD2 PHE 8 2HD PHE 8 -18.812 26.868 -8.798 36 HE1 PHE 8 1HE PHE 8 -19.452 22.628 -11.209 37 HE2 PHE 8 2HE PHE 8 -16.858 25.558 -9.517 38 HZ PHE 8 HZ PHE 8 -17.176 23.435 -10.725 39 H LYS 9 H LYS 9 -19.857 25.110 -7.113 40 HA LYS 9 HA LYS 9 -20.224 26.539 -4.565 41 HB2 LYS 9 1HB LYS 9 -18.305 24.295 -5.219 42 HB3 LYS 9 2HB LYS 9 -18.496 25.062 -3.648 43 HG2 LYS 9 1HG LYS 9 -20.648 24.146 -3.352 44 HG3 LYS 9 2HG LYS 9 -20.752 23.654 -5.044 45 HD2 LYS 9 1HD LYS 9 -18.890 22.074 -4.660 46 HD3 LYS 9 2HD LYS 9 -18.887 22.528 -2.954 47 HE2 LYS 9 1HE LYS 9 -20.178 20.614 -2.939 48 HE3 LYS 9 2HE LYS 9 -21.402 21.878 -3.052 49 HZ1 LYS 9 3HZ LYS 9 -21.997 20.289 -4.641 50 HZ2 LYS 9 1HZ LYS 9 -20.410 20.096 -5.195 51 HZ3 LYS 9 2HZ LYS 9 -21.259 21.518 -5.539 52 H VAL 10 H VAL 10 -18.071 27.312 -3.615 53 HA VAL 10 HA VAL 10 -16.289 28.346 -5.709 54 HB VAL 10 HB VAL 10 -16.220 30.545 -4.620 55 HG11 VAL 10 1HG1 VAL 10 -18.424 31.339 -5.339 56 HG12 VAL 10 2HG1 VAL 10 -17.734 30.201 -6.498 57 HG13 VAL 10 3HG1 VAL 10 -19.004 29.675 -5.392 58 HG21 VAL 10 3HG2 VAL 10 -17.838 29.151 -2.628 59 HG22 VAL 10 1HG2 VAL 10 -16.839 30.596 -2.470 60 HG23 VAL 10 2HG2 VAL 10 -18.486 30.725 -3.086 61 H ARG 11 H ARG 11 -14.282 27.752 -5.263 62 HA ARG 11 HA ARG 11 -13.496 27.444 -2.440 63 HB2 ARG 11 1HB ARG 11 -12.684 25.939 -4.913 64 HB3 ARG 11 2HB ARG 11 -11.667 25.941 -3.479 65 HG2 ARG 11 1HG ARG 11 -13.459 24.970 -2.171 66 HG3 ARG 11 2HG ARG 11 -14.538 25.035 -3.566 67 HD2 ARG 11 1HD ARG 11 -12.670 23.633 -4.722 68 HD3 ARG 11 2HD ARG 11 -12.181 23.267 -3.068 69 HE ARG 11 HE ARG 11 -14.855 22.746 -3.108 70 HH11 ARG 11 1HH1 ARG 11 -12.123 21.684 -4.987 71 HH12 ARG 11 2HH1 ARG 11 -12.799 20.127 -5.331 72 HH21 ARG 11 1HH2 ARG 11 -15.756 20.698 -3.555 73 HH22 ARG 11 2HH2 ARG 11 -14.866 19.567 -4.517 74 H VAL 12 H VAL 12 -11.251 27.937 -1.926 75 HA VAL 12 HA VAL 12 -9.798 29.616 -3.799 76 HB VAL 12 HB VAL 12 -10.720 30.691 -1.130 77 HG11 VAL 12 1HG1 VAL 12 -9.324 32.412 -3.085 78 HG12 VAL 12 2HG1 VAL 12 -9.263 32.414 -1.321 79 HG13 VAL 12 3HG1 VAL 12 -8.338 31.222 -2.236 80 HG21 VAL 12 3HG2 VAL 12 -11.416 31.472 -3.958 81 HG22 VAL 12 1HG2 VAL 12 -12.500 30.803 -2.738 82 HG23 VAL 12 2HG2 VAL 12 -11.832 32.422 -2.532 83 H GLY 13 H GLY 13 -7.679 29.258 -3.617 84 HA2 GLY 13 1HA GLY 13 -6.603 28.412 -1.013 85 HA3 GLY 13 2HA GLY 13 -6.296 27.421 -2.432 86 H GLU 14 H GLU 14 -5.021 29.759 -0.497 87 HA GLU 14 HA GLU 14 -3.714 31.409 -2.419 88 HB2 GLU 14 1HB GLU 14 -2.955 30.898 0.462 89 HB3 GLU 14 2HB GLU 14 -2.404 32.235 -0.537 90 HG2 GLU 14 1HG GLU 14 -4.653 33.116 -0.657 91 HG3 GLU 14 2HG GLU 14 -5.263 31.740 0.260 92 HA PRO 15 HA PRO 15 -0.307 28.912 -3.614 93 HB2 PRO 15 1HB PRO 15 1.592 30.809 -4.021 94 HB3 PRO 15 2HB PRO 15 0.221 30.573 -5.111 95 HG2 PRO 15 1HG PRO 15 0.586 32.597 -2.936 96 HG3 PRO 15 2HG PRO 15 -0.074 32.815 -4.568 97 HD2 PRO 15 1HD PRO 15 -1.650 32.581 -2.379 98 HD3 PRO 15 2HD PRO 15 -2.143 31.988 -3.978 99 H GLY 16 H GLY 16 1.311 27.789 -2.662 100 HA2 GLY 16 1HA GLY 16 2.886 28.995 -0.532 101 HA3 GLY 16 2HA GLY 16 1.850 27.658 -0.054 102 H GLN 17 H GLN 17 3.955 26.717 0.578 103 HA GLN 17 HA GLN 17 5.976 26.052 -1.218 104 HB2 GLN 17 1HB GLN 17 6.242 25.815 1.192 105 HB3 GLN 17 2HB GLN 17 5.029 24.542 1.224 106 HG2 GLN 17 1HG GLN 17 7.007 23.364 1.305 107 HG3 GLN 17 2HG GLN 17 6.599 23.315 -0.410 108 HE21 GLN 17 1HE2 GLN 17 8.940 24.093 1.869 109 HE22 GLN 17 2HE2 GLN 17 10.046 24.917 0.829 110 H ALA 18 H ALA 18 5.440 25.205 -3.158 111 HA ALA 18 HA ALA 18 3.387 23.472 -3.779 112 HB1 ALA 18 3HB ALA 18 6.089 23.471 -5.114 113 HB2 ALA 18 1HB ALA 18 4.545 22.988 -5.817 114 HB3 ALA 18 2HB ALA 18 4.838 24.679 -5.406 115 H GLY 19 H GLY 19 3.023 21.329 -3.615 116 HA2 GLY 19 1HA GLY 19 3.838 19.049 -3.579 117 HA3 GLY 19 2HA GLY 19 5.244 19.621 -2.693 118 H ASN 20 H ASN 20 2.278 18.115 -2.432 119 HA ASN 20 HA ASN 20 2.343 18.415 0.485 120 HB2 ASN 20 1HB ASN 20 0.580 19.906 -0.221 121 HB3 ASN 20 2HB ASN 20 -0.115 18.664 -1.258 122 HD21 ASN 20 1HD2 ASN 20 -1.988 19.435 0.127 123 HD22 ASN 20 2HD2 ASN 20 -2.285 18.538 1.574 124 HA PRO 21 HA PRO 21 2.277 13.986 0.082 125 HB2 PRO 21 1HB PRO 21 2.263 13.454 2.744 126 HB3 PRO 21 2HB PRO 21 3.715 13.961 1.873 127 HG2 PRO 21 1HG PRO 21 1.853 15.589 3.559 128 HG3 PRO 21 2HG PRO 21 3.625 15.613 3.507 129 HD2 PRO 21 1HD PRO 21 2.105 17.464 2.243 130 HD3 PRO 21 2HD PRO 21 3.677 16.929 1.615 131 H ALA 22 H ALA 22 0.019 15.846 2.040 132 HA ALA 22 HA ALA 22 -1.807 13.763 2.587 133 HB1 ALA 22 3HB ALA 22 -2.216 15.525 3.964 134 HB2 ALA 22 1HB ALA 22 -1.859 16.724 2.720 135 HB3 ALA 22 2HB ALA 22 -3.409 15.881 2.714 136 H LEU 23 H LEU 23 -1.687 16.200 0.007 137 HA LEU 23 HA LEU 23 -4.084 15.647 -1.259 138 HB2 LEU 23 1HB LEU 23 -1.434 16.631 -2.232 139 HB3 LEU 23 2HB LEU 23 -2.731 16.310 -3.382 140 HG LEU 23 HG LEU 23 -2.865 18.269 -1.089 141 HD11 LEU 23 1HD1 LEU 23 -2.637 18.764 -4.054 142 HD12 LEU 23 2HD1 LEU 23 -1.334 18.962 -2.883 143 HD13 LEU 23 3HD1 LEU 23 -2.766 19.987 -2.789 144 HD21 LEU 23 3HD2 LEU 23 -4.823 17.477 -3.229 145 HD22 LEU 23 1HD2 LEU 23 -4.928 19.011 -2.364 146 HD23 LEU 23 2HD2 LEU 23 -5.054 17.490 -1.480 147 H VAL 24 H VAL 24 -0.910 14.140 -1.806 148 HA VAL 24 HA VAL 24 -1.357 12.488 -3.895 149 HB VAL 24 HB VAL 24 0.060 11.805 -1.320 150 HG11 VAL 24 1HG1 VAL 24 1.223 10.072 -2.748 151 HG12 VAL 24 2HG1 VAL 24 -0.445 9.712 -2.299 152 HG13 VAL 24 3HG1 VAL 24 -0.074 10.298 -3.921 153 HG21 VAL 24 3HG2 VAL 24 0.943 12.906 -3.976 154 HG22 VAL 24 1HG2 VAL 24 1.143 13.614 -2.373 155 HG23 VAL 24 2HG2 VAL 24 2.072 12.186 -2.828 156 H SER 25 H SER 25 -2.481 10.674 -4.369 157 HA SER 25 HA SER 25 -3.981 9.359 -2.211 158 HB2 SER 25 1HB SER 25 -5.342 11.060 -3.626 159 HB3 SER 25 2HB SER 25 -5.256 9.836 -4.893 160 HG SER 25 HG SER 25 -6.423 9.617 -2.324 161 H ALA 26 H ALA 26 -4.831 7.216 -2.859 162 HA ALA 26 HA ALA 26 -3.390 5.961 -5.075 163 HB1 ALA 26 3HB ALA 26 -3.408 4.368 -2.600 164 HB2 ALA 26 1HB ALA 26 -2.166 4.529 -3.843 165 HB3 ALA 26 2HB ALA 26 -2.337 5.769 -2.600 166 H TYR 27 H TYR 27 -4.611 4.543 -6.162 167 HA TYR 27 HA TYR 27 -6.786 3.134 -4.863 168 HB2 TYR 27 1HB TYR 27 -8.419 3.910 -6.638 169 HB3 TYR 27 2HB TYR 27 -7.988 5.110 -5.424 170 HD1 TYR 27 2HD TYR 27 -7.112 3.989 -8.868 171 HD2 TYR 27 1HD TYR 27 -7.220 7.207 -6.086 172 HE1 TYR 27 2HE TYR 27 -6.448 5.546 -10.652 173 HE2 TYR 27 1HE TYR 27 -6.557 8.773 -7.863 174 HH TYR 27 HH TYR 27 -6.304 9.025 -10.095 175 H GLY 28 H GLY 28 -7.816 1.548 -6.332 176 HA2 GLY 28 1HA GLY 28 -7.200 0.841 -8.856 177 HA3 GLY 28 2HA GLY 28 -5.780 0.299 -7.973 178 H THR 29 H THR 29 -6.246 -1.863 -8.550 179 HA THR 29 HA THR 29 -8.639 -3.018 -7.291 180 HB THR 29 HB THR 29 -6.880 -4.586 -9.134 181 HG1 THR 29 1HG THR 29 -8.991 -3.002 -10.148 182 HG21 THR 29 3HG2 THR 29 -9.589 -4.984 -9.677 183 HG22 THR 29 1HG2 THR 29 -9.491 -4.835 -7.923 184 HG23 THR 29 2HG2 THR 29 -8.524 -6.049 -8.760 185 H GLY 30 H GLY 30 -5.253 -2.775 -6.992 186 HA2 GLY 30 1HA GLY 30 -5.019 -5.241 -5.439 187 HA3 GLY 30 2HA GLY 30 -3.699 -4.179 -5.907 188 H LEU 31 H LEU 31 -5.957 -2.121 -4.835 189 HA LEU 31 HA LEU 31 -4.850 -2.141 -2.110 190 HB2 LEU 31 1HB LEU 31 -5.953 0.087 -3.805 191 HB3 LEU 31 2HB LEU 31 -5.599 0.266 -2.088 192 HG LEU 31 HG LEU 31 -3.541 -0.477 -4.163 193 HD11 LEU 31 1HD1 LEU 31 -2.800 1.809 -4.099 194 HD12 LEU 31 2HD1 LEU 31 -4.043 2.221 -2.918 195 HD13 LEU 31 3HD1 LEU 31 -4.502 1.770 -4.560 196 HD21 LEU 31 3HD2 LEU 31 -3.543 -0.098 -1.235 197 HD22 LEU 31 1HD2 LEU 31 -2.193 0.617 -2.117 198 HD23 LEU 31 2HD2 LEU 31 -2.517 -1.111 -2.252 199 H GLU 32 H GLU 32 -7.705 -2.550 -3.926 200 HA GLU 32 HA GLU 32 -9.493 -1.897 -1.735 201 HB2 GLU 32 1HB GLU 32 -11.282 -2.369 -3.251 202 HB3 GLU 32 2HB GLU 32 -10.074 -1.443 -4.131 203 HG2 GLU 32 1HG GLU 32 -9.441 -3.236 -5.424 204 HG3 GLU 32 2HG GLU 32 -10.017 -4.420 -4.253 205 H GLY 33 H GLY 33 -7.583 -4.488 -2.549 206 HA2 GLY 33 1HA GLY 33 -8.377 -6.165 -0.525 207 HA3 GLY 33 2HA GLY 33 -9.356 -6.642 -1.904 208 H GLY 34 H GLY 34 -7.663 -8.462 -0.789 209 HA2 GLY 34 1HA GLY 34 -5.326 -8.517 -2.583 210 HA3 GLY 34 2HA GLY 34 -5.467 -9.416 -1.080 211 H THR 35 H THR 35 -5.874 -9.491 -4.445 212 HA THR 35 HA THR 35 -7.525 -11.910 -4.349 213 HB THR 35 HB THR 35 -7.200 -11.566 -6.977 214 HG1 THR 35 1HG THR 35 -7.119 -9.312 -7.418 215 HG21 THR 35 3HG2 THR 35 -9.349 -10.686 -7.028 216 HG22 THR 35 1HG2 THR 35 -9.088 -9.698 -5.592 217 HG23 THR 35 2HG2 THR 35 -9.289 -11.443 -5.436 218 H THR 36 H THR 36 -6.332 -13.673 -3.955 219 HA THR 36 HA THR 36 -3.616 -13.943 -4.830 220 HB THR 36 HB THR 36 -5.255 -16.277 -3.908 221 HG1 THR 36 1HG THR 36 -4.605 -13.969 -2.457 222 HG21 THR 36 3HG2 THR 36 -2.690 -16.156 -4.568 223 HG22 THR 36 1HG2 THR 36 -3.254 -17.167 -3.239 224 HG23 THR 36 2HG2 THR 36 -2.539 -15.589 -2.906 225 H GLY 37 H GLY 37 -3.002 -14.484 -6.813 226 HA2 GLY 37 1HA GLY 37 -2.984 -16.257 -8.500 227 HA3 GLY 37 2HA GLY 37 -4.735 -16.310 -8.359 228 H ILE 38 H ILE 38 -4.783 -13.304 -8.230 229 HA ILE 38 HA ILE 38 -4.484 -12.854 -11.124 230 HB ILE 38 HB ILE 38 -6.267 -11.325 -9.229 231 HG12 ILE 38 1HG1 ILE 38 -6.821 -13.717 -10.979 232 HG13 ILE 38 2HG1 ILE 38 -7.156 -13.523 -9.261 233 HG21 ILE 38 1HG2 ILE 38 -6.864 -10.042 -10.968 234 HG22 ILE 38 2HG2 ILE 38 -5.358 -10.604 -11.693 235 HG23 ILE 38 3HG2 ILE 38 -6.880 -11.402 -12.091 236 HD11 ILE 38 3HD1 ILE 38 -9.212 -12.915 -9.777 237 HD12 ILE 38 1HD1 ILE 38 -8.566 -11.487 -10.585 238 HD13 ILE 38 2HD1 ILE 38 -8.832 -12.973 -11.498 239 H GLN 39 H GLN 39 -3.498 -11.004 -11.883 240 HA GLN 39 HA GLN 39 -1.690 -9.713 -10.014 241 HB2 GLN 39 1HB GLN 39 -0.609 -10.343 -11.999 242 HB3 GLN 39 2HB GLN 39 -1.930 -9.768 -13.008 243 HG2 GLN 39 1HG GLN 39 -1.354 -7.457 -12.421 244 HG3 GLN 39 2HG GLN 39 -0.006 -8.053 -11.454 245 HE21 GLN 39 1HE2 GLN 39 1.637 -9.315 -12.599 246 HE22 GLN 39 2HE2 GLN 39 2.009 -8.900 -14.234 247 H SER 40 H SER 40 -2.504 -8.069 -8.883 248 HA SER 40 HA SER 40 -4.502 -6.314 -10.063 249 HB2 SER 40 1HB SER 40 -4.289 -5.246 -7.679 250 HB3 SER 40 2HB SER 40 -5.102 -6.800 -7.869 251 HG SER 40 HG SER 40 -3.033 -6.258 -6.346 252 H GLU 41 H GLU 41 -4.269 -3.940 -9.773 253 HA GLU 41 HA GLU 41 -1.538 -2.943 -9.686 254 HB2 GLU 41 1HB GLU 41 -1.657 -1.827 -11.829 255 HB3 GLU 41 2HB GLU 41 -1.918 -3.551 -12.056 256 HG2 GLU 41 1HG GLU 41 -4.440 -2.889 -11.890 257 HG3 GLU 41 2HG GLU 41 -3.836 -1.291 -12.326 258 H PHE 42 H PHE 42 -1.393 -0.870 -8.966 259 HA PHE 42 HA PHE 42 -3.849 0.715 -8.767 260 HB2 PHE 42 1HB PHE 42 -3.588 1.155 -6.455 261 HB3 PHE 42 2HB PHE 42 -3.390 -0.586 -6.623 262 HD1 PHE 42 1HD PHE 42 -1.560 2.594 -6.191 263 HD2 PHE 42 2HD PHE 42 -1.400 -1.653 -5.972 264 HE1 PHE 42 1HE PHE 42 0.618 2.738 -5.054 265 HE2 PHE 42 2HE PHE 42 0.777 -1.516 -4.834 266 HZ PHE 42 HZ PHE 42 1.788 0.681 -4.373 267 H PHE 43 H PHE 43 -3.531 2.721 -9.455 268 HA PHE 43 HA PHE 43 -0.798 3.667 -9.838 269 HB2 PHE 43 1HB PHE 43 -3.372 4.961 -10.753 270 HB3 PHE 43 2HB PHE 43 -1.742 5.333 -11.305 271 HD1 PHE 43 2HD PHE 43 -4.353 2.712 -11.294 272 HD2 PHE 43 1HD PHE 43 -0.767 4.152 -13.078 273 HE1 PHE 43 2HE PHE 43 -4.597 1.065 -13.106 274 HE2 PHE 43 1HE PHE 43 -1.006 2.508 -14.894 275 HZ PHE 43 HZ PHE 43 -2.923 0.961 -14.908 276 H ILE 44 H ILE 44 0.003 5.569 -8.982 277 HA ILE 44 HA ILE 44 -1.399 6.527 -6.600 278 HB ILE 44 HB ILE 44 1.460 6.799 -7.509 279 HG12 ILE 44 1HG1 ILE 44 0.486 5.698 -4.890 280 HG13 ILE 44 2HG1 ILE 44 0.461 4.695 -6.337 281 HG21 ILE 44 1HG2 ILE 44 -0.057 8.543 -5.783 282 HG22 ILE 44 2HG2 ILE 44 1.275 7.785 -4.912 283 HG23 ILE 44 3HG2 ILE 44 1.594 8.710 -6.379 284 HD11 ILE 44 3HD1 ILE 44 2.913 5.224 -6.588 285 HD12 ILE 44 1HD1 ILE 44 2.836 5.911 -4.966 286 HD13 ILE 44 2HD1 ILE 44 2.470 4.204 -5.220 287 H ASN 45 H ASN 45 -2.437 8.403 -6.594 288 HA ASN 45 HA ASN 45 -2.349 10.138 -8.883 289 HB2 ASN 45 1HB ASN 45 -4.363 9.560 -7.311 290 HB3 ASN 45 2HB ASN 45 -3.723 10.868 -6.321 291 HD21 ASN 45 1HD2 ASN 45 -5.983 11.604 -6.928 292 HD22 ASN 45 2HD2 ASN 45 -6.110 12.592 -8.339 293 H THR 46 H THR 46 -0.122 10.782 -8.797 294 HA THR 46 HA THR 46 0.488 12.722 -6.666 295 HB THR 46 HB THR 46 2.275 11.306 -6.512 296 HG1 THR 46 1HG THR 46 2.904 13.484 -7.454 297 HG21 THR 46 3HG2 THR 46 3.257 10.067 -8.402 298 HG22 THR 46 1HG2 THR 46 2.095 10.826 -9.489 299 HG23 THR 46 2HG2 THR 46 1.534 9.738 -8.220 300 H THR 47 H THR 47 -0.091 12.331 -10.021 301 HA THR 47 HA THR 47 1.324 14.507 -11.082 302 HB THR 47 HB THR 47 -0.012 12.618 -12.292 303 HG1 THR 47 1HG THR 47 1.185 14.502 -13.210 304 HG21 THR 47 3HG2 THR 47 -2.221 12.972 -12.815 305 HG22 THR 47 1HG2 THR 47 -2.105 14.719 -12.602 306 HG23 THR 47 2HG2 THR 47 -2.172 13.661 -11.192 307 H ARG 48 H ARG 48 -1.455 14.397 -9.079 308 HA ARG 48 HA ARG 48 -2.030 17.229 -9.650 309 HB2 ARG 48 1HB ARG 48 -4.249 16.824 -8.660 310 HB3 ARG 48 2HB ARG 48 -3.949 15.790 -10.050 311 HG2 ARG 48 1HG ARG 48 -4.811 14.239 -8.649 312 HG3 ARG 48 2HG ARG 48 -3.122 14.132 -8.147 313 HD2 ARG 48 1HD ARG 48 -4.632 14.261 -6.224 314 HD3 ARG 48 2HD ARG 48 -3.555 15.655 -6.302 315 HE ARG 48 HE ARG 48 -5.807 16.472 -7.600 316 HH11 ARG 48 1HH1 ARG 48 -5.136 15.144 -4.452 317 HH12 ARG 48 2HH1 ARG 48 -6.450 15.968 -3.680 318 HH21 ARG 48 1HH2 ARG 48 -7.541 17.562 -6.595 319 HH22 ARG 48 2HH2 ARG 48 -7.818 17.342 -4.900 320 H ALA 49 H ALA 49 -0.712 15.093 -7.391 321 HA ALA 49 HA ALA 49 -1.336 16.651 -5.040 322 HB1 ALA 49 3HB ALA 49 0.017 15.055 -3.839 323 HB2 ALA 49 1HB ALA 49 -1.057 14.197 -4.944 324 HB3 ALA 49 2HB ALA 49 0.648 14.401 -5.350 325 H GLY 50 H GLY 50 1.803 15.674 -6.438 326 HA2 GLY 50 1HA GLY 50 3.019 17.970 -7.036 327 HA3 GLY 50 2HA GLY 50 3.035 18.043 -5.280 328 HA PRO 51 HA PRO 51 6.741 15.658 -6.983 329 HB2 PRO 51 1HB PRO 51 8.655 17.420 -6.206 330 HB3 PRO 51 2HB PRO 51 7.860 17.498 -7.783 331 HG2 PRO 51 1HG PRO 51 7.305 19.078 -5.302 332 HG3 PRO 51 2HG PRO 51 7.388 19.631 -6.985 333 HD2 PRO 51 1HD PRO 51 5.041 19.166 -5.718 334 HD3 PRO 51 2HD PRO 51 5.253 18.903 -7.460 335 H GLY 52 H GLY 52 8.665 14.954 -5.657 336 HA2 GLY 52 1HA GLY 52 9.357 15.261 -3.139 337 HA3 GLY 52 2HA GLY 52 7.773 14.540 -2.899 338 H THR 53 H THR 53 9.986 13.310 -1.878 339 HA THR 53 HA THR 53 11.102 11.361 -3.625 340 HB THR 53 HB THR 53 10.991 11.529 -0.613 341 HG1 THR 53 1HG THR 53 13.258 11.717 -2.306 342 HG21 THR 53 3HG2 THR 53 11.488 9.349 -0.567 343 HG22 THR 53 1HG2 THR 53 13.036 9.786 -1.288 344 HG23 THR 53 2HG2 THR 53 11.695 9.284 -2.317 345 H LEU 54 H LEU 54 9.923 9.820 -4.555 346 HA LEU 54 HA LEU 54 7.587 8.734 -3.197 347 HB2 LEU 54 1HB LEU 54 7.181 9.248 -5.453 348 HB3 LEU 54 2HB LEU 54 8.686 8.497 -5.979 349 HG LEU 54 HG LEU 54 6.590 7.257 -6.583 350 HD11 LEU 54 1HD1 LEU 54 7.676 5.264 -6.494 351 HD12 LEU 54 2HD1 LEU 54 8.146 5.466 -4.807 352 HD13 LEU 54 3HD1 LEU 54 9.022 6.324 -6.075 353 HD21 LEU 54 3HD2 LEU 54 5.864 7.734 -3.988 354 HD22 LEU 54 1HD2 LEU 54 6.380 6.048 -3.933 355 HD23 LEU 54 2HD2 LEU 54 5.116 6.547 -5.058 356 H SER 55 H SER 55 7.747 7.000 -1.954 357 HA SER 55 HA SER 55 9.797 4.985 -2.603 358 HB2 SER 55 1HB SER 55 9.098 6.264 -0.001 359 HB3 SER 55 2HB SER 55 9.558 4.562 0.015 360 HG SER 55 HG SER 55 11.073 6.816 -0.655 361 H VAL 56 H VAL 56 9.207 2.856 -2.506 362 HA VAL 56 HA VAL 56 6.380 2.304 -1.874 363 HB VAL 56 HB VAL 56 8.078 1.251 -4.124 364 HG11 VAL 56 1HG1 VAL 56 7.195 -0.767 -3.602 365 HG12 VAL 56 2HG1 VAL 56 5.850 -0.069 -2.698 366 HG13 VAL 56 3HG1 VAL 56 5.800 -0.116 -4.461 367 HG21 VAL 56 3HG2 VAL 56 5.342 1.892 -4.739 368 HG22 VAL 56 1HG2 VAL 56 6.127 3.248 -3.929 369 HG23 VAL 56 2HG2 VAL 56 6.827 2.575 -5.401 370 H THR 57 H THR 57 6.007 0.761 -0.417 371 HA THR 57 HA THR 57 7.978 -1.339 0.039 372 HB THR 57 HB THR 57 6.967 0.365 2.323 373 HG1 THR 57 1HG THR 57 8.523 1.632 1.584 374 HG21 THR 57 3HG2 THR 57 7.406 -1.639 3.335 375 HG22 THR 57 1HG2 THR 57 9.028 -0.949 3.357 376 HG23 THR 57 2HG2 THR 57 8.585 -2.122 2.117 377 H ILE 58 H ILE 58 7.112 -3.236 0.784 378 HA ILE 58 HA ILE 58 4.270 -3.249 1.521 379 HB ILE 58 HB ILE 58 5.510 -5.167 -0.456 380 HG12 ILE 58 1HG1 ILE 58 3.439 -3.004 -0.894 381 HG13 ILE 58 2HG1 ILE 58 5.127 -2.898 -1.381 382 HG21 ILE 58 1HG2 ILE 58 2.925 -5.640 -0.706 383 HG22 ILE 58 2HG2 ILE 58 3.897 -6.455 0.518 384 HG23 ILE 58 3HG2 ILE 58 2.901 -5.069 0.962 385 HD11 ILE 58 3HD1 ILE 58 4.564 -5.113 -2.662 386 HD12 ILE 58 1HD1 ILE 58 2.913 -4.504 -2.539 387 HD13 ILE 58 2HD1 ILE 58 4.153 -3.538 -3.340 388 H GLU 59 H GLU 59 3.600 -5.081 2.751 389 HA GLU 59 HA GLU 59 5.730 -6.804 3.783 390 HB2 GLU 59 1HB GLU 59 5.304 -4.716 5.251 391 HB3 GLU 59 2HB GLU 59 3.798 -5.511 5.687 392 HG2 GLU 59 1HG GLU 59 5.250 -7.517 6.315 393 HG3 GLU 59 2HG GLU 59 6.606 -6.393 6.238 394 H GLY 60 H GLY 60 5.043 -8.809 4.533 395 HA2 GLY 60 1HA GLY 60 2.422 -9.582 5.081 396 HA3 GLY 60 2HA GLY 60 2.678 -9.831 3.361 397 HA PRO 61 HA PRO 61 4.178 -13.515 5.898 398 HB2 PRO 61 1HB PRO 61 2.399 -15.320 4.925 399 HB3 PRO 61 2HB PRO 61 2.082 -14.335 6.358 400 HG2 PRO 61 1HG PRO 61 1.161 -13.929 3.539 401 HG3 PRO 61 2HG PRO 61 0.251 -13.749 5.051 402 HD2 PRO 61 1HD PRO 61 1.272 -11.633 3.705 403 HD3 PRO 61 2HD PRO 61 1.122 -11.657 5.474 404 H SER 62 H SER 62 3.133 -13.120 2.552 405 HA SER 62 HA SER 62 5.239 -14.998 1.710 406 HB2 SER 62 1HB SER 62 2.685 -15.259 1.064 407 HB3 SER 62 2HB SER 62 3.108 -14.076 -0.173 408 HG SER 62 HG SER 62 4.104 -15.590 -1.224 409 H LYS 63 H LYS 63 6.748 -14.384 0.203 410 HA LYS 63 HA LYS 63 7.171 -11.536 -0.065 411 HB2 LYS 63 1HB LYS 63 8.931 -13.439 0.351 412 HB3 LYS 63 2HB LYS 63 8.889 -13.594 -1.400 413 HG2 LYS 63 1HG LYS 63 9.305 -10.908 -0.174 414 HG3 LYS 63 2HG LYS 63 10.646 -12.053 -0.257 415 HD2 LYS 63 1HD LYS 63 9.012 -11.512 -2.699 416 HD3 LYS 63 2HD LYS 63 10.244 -10.351 -2.200 417 HE2 LYS 63 1HE LYS 63 11.501 -11.683 -3.562 418 HE3 LYS 63 2HE LYS 63 11.726 -12.530 -2.032 419 HZ1 LYS 63 3HZ LYS 63 10.337 -14.228 -2.664 420 HZ2 LYS 63 1HZ LYS 63 11.060 -13.843 -4.144 421 HZ3 LYS 63 2HZ LYS 63 9.500 -13.291 -3.797 422 H VAL 64 H VAL 64 6.247 -10.420 -1.643 423 HA VAL 64 HA VAL 64 5.746 -11.756 -4.220 424 HB VAL 64 HB VAL 64 4.042 -10.037 -4.635 425 HG11 VAL 64 1HG1 VAL 64 3.138 -11.992 -3.742 426 HG12 VAL 64 2HG1 VAL 64 3.841 -11.703 -2.150 427 HG13 VAL 64 3HG1 VAL 64 2.485 -10.722 -2.707 428 HG21 VAL 64 3HG2 VAL 64 3.375 -8.469 -2.931 429 HG22 VAL 64 1HG2 VAL 64 4.567 -9.126 -1.808 430 HG23 VAL 64 2HG2 VAL 64 5.097 -8.266 -3.254 431 H LYS 65 H LYS 65 5.979 -10.447 -6.161 432 HA LYS 65 HA LYS 65 8.256 -8.612 -5.923 433 HB2 LYS 65 1HB LYS 65 8.623 -9.043 -8.310 434 HB3 LYS 65 2HB LYS 65 8.594 -10.539 -7.386 435 HG2 LYS 65 1HG LYS 65 6.045 -10.500 -8.082 436 HG3 LYS 65 2HG LYS 65 6.676 -9.511 -9.402 437 HD2 LYS 65 1HD LYS 65 7.966 -12.121 -8.690 438 HD3 LYS 65 2HD LYS 65 6.530 -12.076 -9.715 439 HE2 LYS 65 1HE LYS 65 9.135 -10.645 -10.239 440 HE3 LYS 65 2HE LYS 65 8.573 -12.105 -11.052 441 HZ1 LYS 65 3HZ LYS 65 7.775 -9.345 -11.443 442 HZ2 LYS 65 1HZ LYS 65 6.511 -10.470 -11.463 443 HZ3 LYS 65 2HZ LYS 65 7.803 -10.631 -12.541 444 H MET 66 H MET 66 8.250 -6.581 -6.877 445 HA MET 66 HA MET 66 5.623 -5.619 -7.804 446 HB2 MET 66 1HB MET 66 7.643 -3.967 -6.287 447 HB3 MET 66 2HB MET 66 5.993 -3.523 -6.701 448 HG2 MET 66 1HG MET 66 5.760 -4.081 -4.499 449 HG3 MET 66 2HG MET 66 5.374 -5.614 -5.277 450 HE1 MET 66 3HE MET 66 8.656 -4.669 -2.364 451 HE2 MET 66 1HE MET 66 8.819 -3.758 -3.866 452 HE3 MET 66 2HE MET 66 7.326 -3.660 -2.933 453 H ASP 67 H ASP 67 5.873 -5.477 -9.957 454 HA ASP 67 HA ASP 67 8.352 -4.647 -11.161 455 HB2 ASP 67 1HB ASP 67 5.738 -4.845 -12.630 456 HB3 ASP 67 2HB ASP 67 7.367 -5.159 -13.223 457 H CYS 68 H CYS 68 8.872 -2.563 -10.768 458 HA CYS 68 HA CYS 68 6.962 -0.450 -10.691 459 HB2 CYS 68 1HB CYS 68 8.854 1.022 -10.429 460 HB3 CYS 68 2HB CYS 68 9.134 -0.423 -9.465 461 HG CYS 68 HG CYS 68 10.559 0.230 -12.508 462 H GLN 69 H GLN 69 6.441 1.071 -12.208 463 HA GLN 69 HA GLN 69 7.768 1.043 -14.796 464 HB2 GLN 69 1HB GLN 69 5.827 -0.653 -14.756 465 HB3 GLN 69 2HB GLN 69 4.775 0.755 -14.719 466 HG2 GLN 69 1HG GLN 69 5.380 1.427 -16.849 467 HG3 GLN 69 2HG GLN 69 6.879 0.500 -16.823 468 HE21 GLN 69 1HE2 GLN 69 3.368 0.183 -16.896 469 HE22 GLN 69 2HE2 GLN 69 3.340 -1.310 -17.765 470 H GLU 70 H GLU 70 7.142 2.854 -16.160 471 HA GLU 70 HA GLU 70 6.576 5.203 -14.552 472 HB2 GLU 70 1HB GLU 70 7.377 6.483 -16.388 473 HB3 GLU 70 2HB GLU 70 8.444 5.094 -16.245 474 HG2 GLU 70 1HG GLU 70 6.124 4.927 -18.096 475 HG3 GLU 70 2HG GLU 70 7.529 5.878 -18.572 476 H THR 71 H THR 71 4.899 6.651 -14.909 477 HA THR 71 HA THR 71 2.873 6.013 -16.898 478 HB THR 71 HB THR 71 1.054 6.162 -15.149 479 HG1 THR 71 1HG THR 71 1.643 5.819 -13.016 480 HG21 THR 71 3HG2 THR 71 2.753 3.764 -14.594 481 HG22 THR 71 1HG2 THR 71 2.106 4.022 -16.214 482 HG23 THR 71 2HG2 THR 71 1.010 3.869 -14.840 483 HA PRO 72 HA PRO 72 2.412 10.378 -17.066 484 HB2 PRO 72 1HB PRO 72 -0.177 10.594 -17.853 485 HB3 PRO 72 2HB PRO 72 1.112 10.045 -18.930 486 HG2 PRO 72 1HG PRO 72 -0.896 8.432 -17.404 487 HG3 PRO 72 2HG PRO 72 -0.337 8.232 -19.075 488 HD2 PRO 72 1HD PRO 72 0.588 6.708 -17.037 489 HD3 PRO 72 2HD PRO 72 1.593 7.147 -18.432 490 H GLU 73 H GLU 73 0.608 8.475 -14.880 491 HA GLU 73 HA GLU 73 -0.547 10.830 -13.569 492 HB2 GLU 73 1HB GLU 73 -1.829 8.609 -14.103 493 HB3 GLU 73 2HB GLU 73 -1.024 8.017 -12.656 494 HG2 GLU 73 1HG GLU 73 -2.033 9.768 -11.334 495 HG3 GLU 73 2HG GLU 73 -2.771 10.465 -12.775 496 H GLY 74 H GLY 74 2.106 8.743 -13.384 497 HA2 GLY 74 1HA GLY 74 3.616 9.885 -11.544 498 HA3 GLY 74 2HA GLY 74 2.454 9.078 -10.501 499 H TYR 75 H TYR 75 2.671 6.937 -10.088 500 HA TYR 75 HA TYR 75 4.567 5.374 -11.672 501 HB2 TYR 75 1HB TYR 75 4.750 5.417 -8.662 502 HB3 TYR 75 2HB TYR 75 5.868 4.681 -9.805 503 HD1 TYR 75 1HD TYR 75 7.341 6.132 -11.193 504 HD2 TYR 75 2HD TYR 75 4.931 7.713 -8.063 505 HE1 TYR 75 1HE TYR 75 8.703 8.180 -11.187 506 HE2 TYR 75 2HE TYR 75 6.284 9.766 -8.050 507 HH TYR 75 HH TYR 75 8.286 10.656 -8.746 508 H LYS 76 H LYS 76 3.527 3.599 -12.255 509 HA LYS 76 HA LYS 76 1.285 2.619 -10.692 510 HB2 LYS 76 1HB LYS 76 1.037 2.755 -13.111 511 HB3 LYS 76 2HB LYS 76 2.431 1.707 -13.337 512 HG2 LYS 76 1HG LYS 76 1.098 -0.024 -11.993 513 HG3 LYS 76 2HG LYS 76 -0.296 1.011 -12.314 514 HD2 LYS 76 1HD LYS 76 0.252 0.856 -14.749 515 HD3 LYS 76 2HD LYS 76 1.488 -0.335 -14.339 516 HE2 LYS 76 1HE LYS 76 -0.222 -1.779 -13.364 517 HE3 LYS 76 2HE LYS 76 -1.460 -0.583 -13.742 518 HZ1 LYS 76 3HZ LYS 76 -0.453 -0.902 -16.142 519 HZ2 LYS 76 1HZ LYS 76 -1.663 -1.922 -15.543 520 HZ3 LYS 76 2HZ LYS 76 -0.047 -2.421 -15.519 521 H VAL 77 H VAL 77 1.335 0.922 -9.360 522 HA VAL 77 HA VAL 77 3.712 -0.822 -9.423 523 HB VAL 77 HB VAL 77 2.139 0.023 -6.985 524 HG11 VAL 77 1HG1 VAL 77 4.638 -1.655 -7.178 525 HG12 VAL 77 2HG1 VAL 77 3.783 -1.202 -5.701 526 HG13 VAL 77 3HG1 VAL 77 3.018 -2.280 -6.869 527 HG21 VAL 77 3HG2 VAL 77 3.414 1.884 -7.432 528 HG22 VAL 77 1HG2 VAL 77 4.528 0.949 -6.434 529 HG23 VAL 77 2HG2 VAL 77 4.706 0.952 -8.189 530 H MET 78 H MET 78 3.393 -2.985 -9.384 531 HA MET 78 HA MET 78 0.643 -3.957 -8.988 532 HB2 MET 78 1HB MET 78 2.561 -5.027 -11.062 533 HB3 MET 78 2HB MET 78 0.882 -5.495 -10.828 534 HG2 MET 78 1HG MET 78 0.070 -3.632 -11.848 535 HG3 MET 78 2HG MET 78 1.456 -2.643 -11.392 536 HE1 MET 78 3HE MET 78 4.219 -3.770 -13.687 537 HE2 MET 78 1HE MET 78 3.518 -2.155 -13.565 538 HE3 MET 78 2HE MET 78 3.726 -3.138 -12.115 539 H TYR 79 H TYR 79 0.431 -6.038 -8.111 540 HA TYR 79 HA TYR 79 2.781 -7.557 -7.396 541 HB2 TYR 79 1HB TYR 79 2.684 -7.338 -5.071 542 HB3 TYR 79 2HB TYR 79 2.432 -5.691 -5.636 543 HD1 TYR 79 1HD TYR 79 0.767 -8.663 -4.218 544 HD2 TYR 79 2HD TYR 79 0.374 -4.549 -5.233 545 HE1 TYR 79 1HE TYR 79 -1.330 -8.554 -2.938 546 HE2 TYR 79 2HE TYR 79 -1.724 -4.429 -3.955 547 HH TYR 79 HH TYR 79 -3.274 -5.592 -2.846 548 H THR 80 H THR 80 2.328 -9.678 -7.189 549 HA THR 80 HA THR 80 -0.514 -10.452 -7.068 550 HB THR 80 HB THR 80 1.645 -12.013 -8.489 551 HG1 THR 80 1HG THR 80 1.430 -10.576 -10.021 552 HG21 THR 80 3HG2 THR 80 -1.367 -12.188 -8.451 553 HG22 THR 80 1HG2 THR 80 -0.218 -13.386 -7.856 554 HG23 THR 80 2HG2 THR 80 -0.342 -13.066 -9.586 555 HA PRO 81 HA PRO 81 1.200 -12.371 -3.338 556 HB2 PRO 81 1HB PRO 81 -1.217 -12.713 -2.151 557 HB3 PRO 81 2HB PRO 81 -0.342 -11.178 -2.123 558 HG2 PRO 81 1HG PRO 81 -2.598 -12.039 -3.892 559 HG3 PRO 81 2HG PRO 81 -2.345 -10.484 -3.078 560 HD2 PRO 81 1HD PRO 81 -1.790 -10.863 -5.701 561 HD3 PRO 81 2HD PRO 81 -0.864 -9.743 -4.681 562 H MET 82 H MET 82 1.715 -14.460 -3.286 563 HA MET 82 HA MET 82 0.246 -16.390 -4.837 564 HB2 MET 82 1HB MET 82 2.827 -16.222 -4.359 565 HB3 MET 82 2HB MET 82 2.417 -17.154 -2.925 566 HG2 MET 82 1HG MET 82 1.448 -18.897 -4.321 567 HG3 MET 82 2HG MET 82 1.827 -17.960 -5.764 568 HE1 MET 82 3HE MET 82 3.235 -18.534 -7.096 569 HE2 MET 82 1HE MET 82 4.979 -18.567 -6.832 570 HE3 MET 82 2HE MET 82 4.068 -20.075 -6.890 571 H ALA 83 H ALA 83 0.596 -15.550 -1.456 572 HA ALA 83 HA ALA 83 -1.439 -17.580 -0.804 573 HB1 ALA 83 3HB ALA 83 0.694 -18.276 0.118 574 HB2 ALA 83 1HB ALA 83 0.882 -16.714 0.917 575 HB3 ALA 83 2HB ALA 83 -0.407 -17.811 1.415 576 HA PRO 84 HA PRO 84 -3.872 -14.256 0.741 577 HB2 PRO 84 1HB PRO 84 -5.423 -15.617 2.505 578 HB3 PRO 84 2HB PRO 84 -5.627 -15.740 0.753 579 HG2 PRO 84 1HG PRO 84 -4.215 -17.596 2.630 580 HG3 PRO 84 2HG PRO 84 -5.299 -17.981 1.281 581 HD2 PRO 84 1HD PRO 84 -2.604 -18.139 1.075 582 HD3 PRO 84 2HD PRO 84 -3.642 -17.698 -0.296 583 H GLY 85 H GLY 85 -4.733 -13.466 2.988 584 HA2 GLY 85 1HA GLY 85 -4.001 -13.738 5.442 585 HA3 GLY 85 2HA GLY 85 -2.402 -13.424 4.785 586 H ASN 86 H ASN 86 -1.965 -11.504 5.758 587 HA ASN 86 HA ASN 86 -3.677 -9.246 4.972 588 HB2 ASN 86 1HB ASN 86 -3.002 -8.231 7.244 589 HB3 ASN 86 2HB ASN 86 -4.246 -9.477 7.239 590 HD21 ASN 86 1HD2 ASN 86 -4.032 -10.709 8.951 591 HD22 ASN 86 2HD2 ASN 86 -2.548 -11.317 9.593 592 H TYR 87 H TYR 87 -2.518 -8.009 3.659 593 HA TYR 87 HA TYR 87 0.382 -7.810 4.069 594 HB2 TYR 87 1HB TYR 87 -1.365 -7.253 1.672 595 HB3 TYR 87 2HB TYR 87 0.334 -6.798 1.740 596 HD1 TYR 87 1HD TYR 87 -1.673 -9.850 2.568 597 HD2 TYR 87 2HD TYR 87 1.724 -8.222 0.591 598 HE1 TYR 87 1HE TYR 87 -1.047 -12.102 1.801 599 HE2 TYR 87 2HE TYR 87 2.359 -10.469 -0.182 600 HH TYR 87 HH TYR 87 0.370 -13.308 0.593 601 H LEU 88 H LEU 88 1.363 -5.658 3.588 602 HA LEU 88 HA LEU 88 -0.384 -3.407 4.274 603 HB2 LEU 88 1HB LEU 88 0.864 -4.405 6.282 604 HB3 LEU 88 2HB LEU 88 2.314 -3.723 5.548 605 HG LEU 88 HG LEU 88 1.020 -1.488 5.615 606 HD11 LEU 88 1HD1 LEU 88 -0.883 -3.248 6.818 607 HD12 LEU 88 2HD1 LEU 88 -1.032 -1.531 6.448 608 HD13 LEU 88 3HD1 LEU 88 -0.367 -2.043 7.998 609 HD21 LEU 88 3HD2 LEU 88 2.344 -2.950 7.839 610 HD22 LEU 88 1HD2 LEU 88 1.581 -1.400 8.192 611 HD23 LEU 88 2HD2 LEU 88 2.854 -1.499 6.975 612 H ILE 89 H ILE 89 0.237 -1.430 3.436 613 HA ILE 89 HA ILE 89 2.661 -1.396 1.772 614 HB ILE 89 HB ILE 89 -0.017 -0.288 0.922 615 HG12 ILE 89 1HG1 ILE 89 1.422 -2.503 -0.490 616 HG13 ILE 89 2HG1 ILE 89 0.454 -2.876 0.932 617 HG21 ILE 89 1HG2 ILE 89 0.992 0.432 -1.052 618 HG22 ILE 89 2HG2 ILE 89 2.158 0.865 0.197 619 HG23 ILE 89 3HG2 ILE 89 2.422 -0.568 -0.797 620 HD11 ILE 89 3HD1 ILE 89 -1.401 -2.823 -0.264 621 HD12 ILE 89 1HD1 ILE 89 -1.035 -1.201 -0.849 622 HD13 ILE 89 2HD1 ILE 89 -0.413 -2.609 -1.709 623 H SER 90 H SER 90 3.945 0.176 2.449 624 HA SER 90 HA SER 90 2.744 2.559 3.684 625 HB2 SER 90 1HB SER 90 5.529 1.403 3.942 626 HB3 SER 90 2HB SER 90 5.007 2.917 4.680 627 HG SER 90 HG SER 90 3.252 1.471 5.594 628 H VAL 91 H VAL 91 2.801 4.416 2.615 629 HA VAL 91 HA VAL 91 4.778 4.730 0.449 630 HB VAL 91 HB VAL 91 1.952 5.789 0.572 631 HG11 VAL 91 1HG1 VAL 91 2.631 7.435 -0.758 632 HG12 VAL 91 2HG1 VAL 91 4.261 6.764 -0.844 633 HG13 VAL 91 3HG1 VAL 91 3.021 6.218 -1.973 634 HG21 VAL 91 3HG2 VAL 91 1.480 4.342 -1.251 635 HG22 VAL 91 1HG2 VAL 91 3.184 3.934 -1.453 636 HG23 VAL 91 2HG2 VAL 91 2.305 3.368 -0.034 637 H LYS 92 H LYS 92 6.211 6.281 0.799 638 HA LYS 92 HA LYS 92 5.479 8.499 2.595 639 HB2 LYS 92 1HB LYS 92 8.128 7.152 2.084 640 HB3 LYS 92 2HB LYS 92 8.007 8.715 2.881 641 HG2 LYS 92 1HG LYS 92 6.596 7.690 4.620 642 HG3 LYS 92 2HG LYS 92 6.808 6.123 3.836 643 HD2 LYS 92 1HD LYS 92 9.347 6.653 4.076 644 HD3 LYS 92 2HD LYS 92 8.805 7.796 5.308 645 HE2 LYS 92 1HE LYS 92 7.431 5.695 6.136 646 HE3 LYS 92 2HE LYS 92 8.708 4.822 5.289 647 HZ1 LYS 92 3HZ LYS 92 9.141 5.249 7.691 648 HZ2 LYS 92 1HZ LYS 92 9.235 6.901 7.337 649 HZ3 LYS 92 2HZ LYS 92 10.347 5.825 6.654 650 H TYR 93 H TYR 93 5.812 10.579 1.951 651 HA TYR 93 HA TYR 93 7.013 11.006 -0.700 652 HB2 TYR 93 1HB TYR 93 4.302 11.763 0.264 653 HB3 TYR 93 2HB TYR 93 5.152 12.927 -0.746 654 HD1 TYR 93 1HD TYR 93 4.623 9.219 -0.748 655 HD2 TYR 93 2HD TYR 93 4.572 12.849 -2.968 656 HE1 TYR 93 1HE TYR 93 3.929 7.976 -2.754 657 HE2 TYR 93 2HE TYR 93 3.877 11.616 -4.979 658 HH TYR 93 HH TYR 93 3.392 8.095 -4.900 659 H GLY 94 H GLY 94 8.742 12.247 -0.433 660 HA2 GLY 94 1HA GLY 94 10.173 13.833 0.419 661 HA3 GLY 94 2HA GLY 94 8.741 14.851 0.454 662 H GLY 95 H GLY 95 10.353 12.285 2.328 663 HA2 GLY 95 1HA GLY 95 11.047 12.806 4.608 664 HA3 GLY 95 2HA GLY 95 9.582 13.764 4.765 665 HA PRO 96 HA PRO 96 8.986 9.414 6.470 666 HB2 PRO 96 1HB PRO 96 8.523 10.148 9.043 667 HB3 PRO 96 2HB PRO 96 10.139 9.794 8.421 668 HG2 PRO 96 1HG PRO 96 8.811 12.443 8.844 669 HG3 PRO 96 2HG PRO 96 10.474 11.954 9.215 670 HD2 PRO 96 1HD PRO 96 9.835 13.387 7.008 671 HD3 PRO 96 2HD PRO 96 11.172 12.219 7.034 672 H ASN 97 H ASN 97 7.346 12.473 7.205 673 HA ASN 97 HA ASN 97 4.909 11.625 8.087 674 HB2 ASN 97 1HB ASN 97 5.278 13.836 6.057 675 HB3 ASN 97 2HB ASN 97 3.973 13.680 7.229 676 HD21 ASN 97 1HD2 ASN 97 4.189 15.225 8.673 677 HD22 ASN 97 2HD2 ASN 97 5.657 15.679 9.465 678 H HIS 98 H HIS 98 3.749 9.984 7.313 679 HA HIS 98 HA HIS 98 3.744 9.212 4.571 680 HB2 HIS 98 1HB HIS 98 1.786 7.735 5.377 681 HB3 HIS 98 2HB HIS 98 3.382 7.443 6.064 682 HD2 HIS 98 2HD HIS 98 3.684 8.407 8.760 683 HE1 HIS 98 1HE HIS 98 -0.499 8.644 9.426 684 HE2 HIS 98 2HE HIS 98 1.785 8.758 10.481 685 H ILE 99 H ILE 99 1.608 8.890 3.389 686 HA ILE 99 HA ILE 99 0.336 11.471 3.166 687 HB ILE 99 HB ILE 99 -0.780 10.592 1.219 688 HG12 ILE 99 1HG1 ILE 99 0.467 7.896 1.665 689 HG13 ILE 99 2HG1 ILE 99 -1.094 8.285 2.381 690 HG21 ILE 99 1HG2 ILE 99 1.723 11.163 1.221 691 HG22 ILE 99 2HG2 ILE 99 1.977 9.424 1.092 692 HG23 ILE 99 3HG2 ILE 99 1.075 10.278 -0.160 693 HD11 ILE 99 3HD1 ILE 99 -0.712 8.777 -0.521 694 HD12 ILE 99 1HD1 ILE 99 -0.906 7.116 0.039 695 HD13 ILE 99 2HD1 ILE 99 -2.161 8.311 0.369 696 H VAL 100 H VAL 100 -2.173 11.260 2.616 697 HA VAL 100 HA VAL 100 -3.435 10.625 5.089 698 HB VAL 100 HB VAL 100 -4.477 11.549 2.425 699 HG11 VAL 100 1HG1 VAL 100 -6.207 10.115 3.235 700 HG12 VAL 100 2HG1 VAL 100 -6.076 10.785 4.863 701 HG13 VAL 100 3HG1 VAL 100 -6.701 11.779 3.546 702 HG21 VAL 100 3HG2 VAL 100 -3.415 13.263 3.693 703 HG22 VAL 100 1HG2 VAL 100 -5.155 13.515 3.832 704 HG23 VAL 100 2HG2 VAL 100 -4.260 12.784 5.165 705 H GLY 101 H GLY 101 -4.708 8.927 5.662 706 HA2 GLY 101 1HA GLY 101 -6.036 7.011 5.292 707 HA3 GLY 101 2HA GLY 101 -5.421 6.932 3.647 708 H SER 102 H SER 102 -2.768 6.823 3.877 709 HA SER 102 HA SER 102 -2.224 4.184 4.524 710 HB2 SER 102 1HB SER 102 -0.525 6.598 4.046 711 HB3 SER 102 2HB SER 102 0.241 5.137 4.670 712 HG SER 102 HG SER 102 -0.072 5.541 2.233 713 HA PRO 103 HA PRO 103 -0.042 3.225 5.131 714 HB2 PRO 103 1HB PRO 103 -0.006 0.953 6.616 715 HB3 PRO 103 2HB PRO 103 1.211 2.225 6.777 716 HG2 PRO 103 1HG PRO 103 -1.201 1.685 8.467 717 HG3 PRO 103 2HG PRO 103 0.444 2.117 8.970 718 HD2 PRO 103 1HD PRO 103 -1.571 3.923 8.870 719 HD3 PRO 103 2HD PRO 103 0.119 4.359 8.546 720 H PHE 104 H PHE 104 -0.862 1.689 3.731 721 HA PHE 104 HA PHE 104 -3.729 1.259 3.893 722 HB2 PHE 104 1HB PHE 104 -1.756 0.547 1.712 723 HB3 PHE 104 2HB PHE 104 -3.507 0.406 1.591 724 HD1 PHE 104 2HD PHE 104 -4.778 2.677 2.224 725 HD2 PHE 104 1HD PHE 104 -0.790 2.390 0.766 726 HE1 PHE 104 2HE PHE 104 -4.909 4.998 1.419 727 HE2 PHE 104 1HE PHE 104 -0.914 4.711 -0.041 728 HZ PHE 104 HZ PHE 104 -2.976 6.018 0.284 729 H LYS 105 H LYS 105 -4.606 -0.522 4.691 730 HA LYS 105 HA LYS 105 -2.949 -2.951 4.869 731 HB2 LYS 105 1HB LYS 105 -4.789 -3.533 6.651 732 HB3 LYS 105 2HB LYS 105 -3.442 -2.483 7.071 733 HG2 LYS 105 1HG LYS 105 -4.753 -0.590 7.112 734 HG3 LYS 105 2HG LYS 105 -5.981 -1.290 6.055 735 HD2 LYS 105 1HD LYS 105 -6.985 -1.263 8.170 736 HD3 LYS 105 2HD LYS 105 -6.430 -2.927 7.975 737 HE2 LYS 105 1HE LYS 105 -4.384 -2.329 9.255 738 HE3 LYS 105 2HE LYS 105 -5.074 -0.732 9.538 739 HZ1 LYS 105 3HZ LYS 105 -5.613 -1.946 11.431 740 HZ2 LYS 105 1HZ LYS 105 -6.004 -3.343 10.560 741 HZ3 LYS 105 2HZ LYS 105 -7.035 -2.003 10.517 742 H ALA 106 H ALA 106 -3.438 -4.180 3.151 743 HA ALA 106 HA ALA 106 -6.238 -4.448 2.331 744 HB1 ALA 106 3HB ALA 106 -5.517 -4.951 0.236 745 HB2 ALA 106 1HB ALA 106 -4.119 -4.024 0.782 746 HB3 ALA 106 2HB ALA 106 -4.074 -5.787 0.812 747 H LYS 107 H LYS 107 -7.354 -6.329 2.462 748 HA LYS 107 HA LYS 107 -6.051 -8.526 3.911 749 HB2 LYS 107 1HB LYS 107 -7.963 -7.742 5.086 750 HB3 LYS 107 2HB LYS 107 -8.938 -7.706 3.623 751 HG2 LYS 107 1HG LYS 107 -9.190 -10.018 3.585 752 HG3 LYS 107 2HG LYS 107 -7.818 -10.279 4.665 753 HD2 LYS 107 1HD LYS 107 -10.240 -8.779 5.595 754 HD3 LYS 107 2HD LYS 107 -10.214 -10.544 5.601 755 HE2 LYS 107 1HE LYS 107 -7.901 -10.146 6.818 756 HE3 LYS 107 2HE LYS 107 -8.653 -8.606 7.234 757 HZ1 LYS 107 3HZ LYS 107 -9.186 -11.229 8.259 758 HZ2 LYS 107 1HZ LYS 107 -10.593 -10.431 7.765 759 HZ3 LYS 107 2HZ LYS 107 -9.574 -9.717 8.910 760 H VAL 108 H VAL 108 -5.454 -10.238 2.773 761 HA VAL 108 HA VAL 108 -6.576 -10.695 0.125 762 HB VAL 108 HB VAL 108 -4.481 -12.432 1.385 763 HG11 VAL 108 1HG1 VAL 108 -4.929 -11.515 -1.453 764 HG12 VAL 108 2HG1 VAL 108 -3.733 -12.692 -0.906 765 HG13 VAL 108 3HG1 VAL 108 -5.453 -13.061 -0.787 766 HG21 VAL 108 3HG2 VAL 108 -3.438 -10.425 1.822 767 HG22 VAL 108 1HG2 VAL 108 -2.877 -10.753 0.182 768 HG23 VAL 108 2HG2 VAL 108 -4.193 -9.611 0.452 769 H THR 109 H THR 109 -7.502 -12.662 -0.535 770 HA THR 109 HA THR 109 -8.219 -14.586 1.547 771 HB THR 109 HB THR 109 -10.591 -14.618 0.706 772 HG1 THR 109 1HG THR 109 -11.287 -12.781 -0.446 773 HG21 THR 109 3HG2 THR 109 -11.095 -13.365 2.484 774 HG22 THR 109 1HG2 THR 109 -10.467 -11.908 1.716 775 HG23 THR 109 2HG2 THR 109 -9.380 -12.976 2.604 776 H GLY 110 H GLY 110 -8.976 -16.627 0.714 777 HA2 GLY 110 1HA GLY 110 -9.528 -17.745 -1.525 778 HA3 GLY 110 2HA GLY 110 -7.955 -17.127 -2.005 779 H GLN 111 H GLN 111 -7.753 -19.535 -2.431 780 HA GLN 111 HA GLN 111 -6.989 -20.977 0.014 781 HB2 GLN 111 1HB GLN 111 -8.452 -22.405 -1.028 782 HB3 GLN 111 2HB GLN 111 -8.039 -21.829 -2.637 783 HG2 GLN 111 1HG GLN 111 -6.237 -23.231 -2.829 784 HG3 GLN 111 2HG GLN 111 -6.006 -23.350 -1.086 785 HE21 GLN 111 1HE2 GLN 111 -5.881 -25.614 -1.280 786 HE22 GLN 111 2HE2 GLN 111 -7.300 -26.575 -1.495 787 H ARG 112 H ARG 112 -4.906 -21.244 0.441 788 HA ARG 112 HA ARG 112 -2.782 -20.141 -0.753 789 HB2 ARG 112 1HB ARG 112 -2.746 -22.933 0.409 790 HB3 ARG 112 2HB ARG 112 -1.359 -21.865 0.231 791 HG2 ARG 112 1HG ARG 112 -2.661 -20.242 1.727 792 HG3 ARG 112 2HG ARG 112 -3.676 -21.633 2.113 793 HD2 ARG 112 1HD ARG 112 -1.438 -22.827 2.615 794 HD3 ARG 112 2HD ARG 112 -0.767 -21.197 2.683 795 HE ARG 112 HE ARG 112 -3.107 -21.532 4.309 796 HH11 ARG 112 1HH1 ARG 112 0.349 -21.921 4.172 797 HH12 ARG 112 2HH1 ARG 112 0.559 -21.835 5.889 798 HH21 ARG 112 1HH2 ARG 112 -2.845 -21.417 6.572 799 HH22 ARG 112 2HH2 ARG 112 -1.259 -21.549 7.254 800 H LEU 113 H LEU 113 -2.124 -20.112 -2.792 801 HA LEU 113 HA LEU 113 -2.717 -22.287 -4.594 802 HB2 LEU 113 1HB LEU 113 -0.978 -19.950 -5.273 803 HB3 LEU 113 2HB LEU 113 -2.050 -20.878 -6.320 804 HG LEU 113 HG LEU 113 -3.017 -19.016 -4.154 805 HD11 LEU 113 1HD1 LEU 113 -1.840 -17.677 -5.744 806 HD12 LEU 113 2HD1 LEU 113 -3.567 -17.494 -6.049 807 HD13 LEU 113 3HD1 LEU 113 -2.591 -18.525 -7.095 808 HD21 LEU 113 3HD2 LEU 113 -5.046 -19.778 -4.632 809 HD22 LEU 113 1HD2 LEU 113 -4.304 -21.011 -5.651 810 HD23 LEU 113 2HD2 LEU 113 -4.803 -19.472 -6.353 811 H VAL 114 H VAL 114 -1.406 -23.907 -5.129 812 HA VAL 114 HA VAL 114 1.304 -23.929 -4.042 813 HB VAL 114 HB VAL 114 1.321 -26.313 -4.589 814 HG11 VAL 114 1HG1 VAL 114 0.224 -26.826 -2.705 815 HG12 VAL 114 2HG1 VAL 114 -0.108 -25.096 -2.602 816 HG13 VAL 114 3HG1 VAL 114 -1.304 -26.184 -3.308 817 HG21 VAL 114 3HG2 VAL 114 -1.019 -25.553 -6.170 818 HG22 VAL 114 1HG2 VAL 114 0.090 -26.911 -6.364 819 HG23 VAL 114 2HG2 VAL 114 -1.245 -27.019 -5.217 820 H SER 115 H SER 115 2.890 -23.203 -5.288 821 HA SER 115 HA SER 115 2.772 -22.605 -7.977 822 HB2 SER 115 1HB SER 115 5.118 -22.297 -7.910 823 HB3 SER 115 2HB SER 115 4.569 -21.961 -6.268 824 HG SER 115 HG SER 115 6.394 -23.681 -6.987 825 HA PRO 116 HA PRO 116 2.893 -26.449 -10.115 826 HB2 PRO 116 1HB PRO 116 3.916 -25.597 -12.482 827 HB3 PRO 116 2HB PRO 116 2.256 -25.261 -11.976 828 HG2 PRO 116 1HG PRO 116 4.671 -23.498 -11.839 829 HG3 PRO 116 2HG PRO 116 3.017 -23.093 -12.335 830 HD2 PRO 116 1HD PRO 116 3.986 -22.506 -9.875 831 HD3 PRO 116 2HD PRO 116 2.279 -22.900 -10.160 832 H GLY 117 H GLY 117 5.808 -24.441 -10.617 833 HA2 GLY 117 1HA GLY 117 8.023 -25.012 -10.168 834 HA3 GLY 117 2HA GLY 117 7.492 -26.632 -9.741 835 H SER 118 H SER 118 7.366 -28.219 -11.317 836 HA SER 118 HA SER 118 8.898 -27.627 -13.732 837 HB2 SER 118 1HB SER 118 8.150 -30.185 -12.324 838 HB3 SER 118 2HB SER 118 8.823 -30.190 -13.954 839 HG SER 118 HG SER 118 10.021 -29.182 -11.590 840 H ALA 119 H ALA 119 7.301 -26.553 -14.940 841 HA ALA 119 HA ALA 119 4.836 -27.953 -15.574 842 HB1 ALA 119 3HB ALA 119 5.641 -25.431 -16.939 843 HB2 ALA 119 1HB ALA 119 4.046 -25.974 -16.417 844 HB3 ALA 119 2HB ALA 119 5.208 -25.379 -15.230 845 H ASN 120 H ASN 120 4.606 -29.273 -17.251 846 HA ASN 120 HA ASN 120 6.608 -29.156 -19.408 847 HB2 ASN 120 1HB ASN 120 6.384 -31.260 -17.919 848 HB3 ASN 120 2HB ASN 120 4.897 -31.559 -18.816 849 HD21 ASN 120 1HD2 ASN 120 5.273 -33.113 -20.217 850 HD22 ASN 120 2HD2 ASN 120 6.639 -33.225 -21.268 851 H GLU 121 H GLU 121 5.757 -30.022 -21.541 852 HA GLU 121 HA GLU 121 2.957 -29.237 -21.970 853 HB2 GLU 121 1HB GLU 121 4.425 -27.378 -22.648 854 HB3 GLU 121 2HB GLU 121 5.289 -28.461 -23.731 855 HG2 GLU 121 1HG GLU 121 3.392 -28.712 -25.133 856 HG3 GLU 121 2HG GLU 121 2.348 -27.898 -23.969 857 H THR 122 H THR 122 1.992 -30.130 -23.906 858 HA THR 122 HA THR 122 2.974 -32.819 -24.421 859 HB THR 122 HB THR 122 0.583 -32.483 -23.896 860 HG1 THR 122 1HG THR 122 1.468 -34.154 -25.446 861 HG21 THR 122 3HG2 THR 122 -0.640 -31.622 -26.150 862 HG22 THR 122 1HG2 THR 122 0.802 -30.608 -26.161 863 HG23 THR 122 2HG2 THR 122 -0.281 -30.584 -24.770 864 H SER 123 H SER 123 2.938 -33.678 -26.646 865 HA SER 123 HA SER 123 3.337 -31.710 -28.761 866 HB2 SER 123 1HB SER 123 5.570 -32.177 -27.639 867 HB3 SER 123 2HB SER 123 5.431 -33.826 -28.247 868 HG SER 123 HG SER 123 5.531 -31.435 -29.770 869 H SER 124 H SER 124 1.882 -32.383 -30.198 870 HA SER 124 HA SER 124 0.725 -34.841 -30.478 871 HB2 SER 124 1HB SER 124 0.272 -32.583 -31.718 872 HB3 SER 124 2HB SER 124 1.347 -33.250 -32.947 873 HG SER 124 HG SER 124 -1.222 -33.987 -32.245 874 H ILE 125 H ILE 125 3.316 -33.689 -32.647 875 HA ILE 125 HA ILE 125 4.215 -36.487 -32.887 876 HB ILE 125 HB ILE 125 4.316 -34.342 -35.012 877 HG12 ILE 125 1HG1 ILE 125 2.870 -36.260 -36.143 878 HG13 ILE 125 2HG1 ILE 125 2.488 -36.639 -34.467 879 HG21 ILE 125 1HG2 ILE 125 6.238 -35.979 -34.935 880 HG22 ILE 125 2HG2 ILE 125 5.062 -37.241 -35.300 881 HG23 ILE 125 3HG2 ILE 125 5.329 -35.927 -36.446 882 HD11 ILE 125 3HD1 ILE 125 1.163 -34.845 -36.035 883 HD12 ILE 125 1HD1 ILE 125 1.125 -34.891 -34.273 884 HD13 ILE 125 2HD1 ILE 125 2.242 -33.807 -35.103 Start of MODEL 12 1 H1 GLY 1 H GLY 1 13.003 48.345 -45.898 2 HA2 GLY 1 1HA GLY 1 14.513 46.445 -44.212 3 HA3 GLY 1 2HA GLY 1 13.070 47.294 -43.679 4 H SER 2 H SER 2 11.195 46.251 -43.817 5 HA SER 2 HA SER 2 9.656 44.640 -44.276 6 HB2 SER 2 1HB SER 2 10.138 45.649 -46.625 7 HB3 SER 2 2HB SER 2 11.000 44.139 -46.919 8 HG SER 2 HG SER 2 8.294 44.620 -46.709 9 H SER 3 H SER 3 11.867 43.824 -42.799 10 HA SER 3 HA SER 3 12.760 41.274 -43.861 11 HB2 SER 3 1HB SER 3 13.343 42.713 -41.265 12 HB3 SER 3 2HB SER 3 14.015 41.137 -41.684 13 HG SER 3 HG SER 3 14.771 42.283 -43.665 14 H GLY 4 H GLY 4 10.805 42.468 -41.146 15 HA2 GLY 4 1HA GLY 4 8.718 41.011 -40.905 16 HA3 GLY 4 2HA GLY 4 9.876 39.706 -40.694 17 H SER 5 H SER 5 8.435 39.630 -38.671 18 HA SER 5 HA SER 5 9.998 40.593 -36.483 19 HB2 SER 5 1HB SER 5 8.411 42.541 -37.254 20 HB3 SER 5 2HB SER 5 7.179 41.608 -36.404 21 HG SER 5 HG SER 5 8.535 43.288 -35.226 22 H SER 6 H SER 6 9.249 39.776 -34.421 23 HA SER 6 HA SER 6 7.107 37.797 -34.511 24 HB2 SER 6 1HB SER 6 8.717 36.163 -33.322 25 HB3 SER 6 2HB SER 6 8.872 36.347 -35.069 26 HG SER 6 HG SER 6 10.395 37.934 -33.307 27 H GLY 7 H GLY 7 6.920 36.747 -32.224 28 HA2 GLY 7 1HA GLY 7 7.734 38.515 -30.065 29 HA3 GLY 7 2HA GLY 7 6.008 38.466 -30.390 30 H PHE 8 H PHE 8 7.029 37.731 -27.931 31 HA PHE 8 HA PHE 8 6.218 34.928 -27.851 32 HB2 PHE 8 1HB PHE 8 8.671 35.847 -26.354 33 HB3 PHE 8 2HB PHE 8 8.079 34.201 -26.552 34 HD1 PHE 8 2HD PHE 8 8.106 33.201 -28.889 35 HD2 PHE 8 1HD PHE 8 10.215 36.748 -27.844 36 HE1 PHE 8 2HE PHE 8 9.551 32.919 -30.861 37 HE2 PHE 8 1HE PHE 8 11.662 36.472 -29.815 38 HZ PHE 8 HZ PHE 8 11.332 34.555 -31.325 39 H LYS 9 H LYS 9 5.518 34.225 -25.752 40 HA LYS 9 HA LYS 9 4.154 36.290 -24.310 41 HB2 LYS 9 1HB LYS 9 4.380 33.308 -23.940 42 HB3 LYS 9 2HB LYS 9 3.491 34.326 -22.814 43 HG2 LYS 9 1HG LYS 9 1.874 34.877 -24.399 44 HG3 LYS 9 2HG LYS 9 2.893 34.370 -25.749 45 HD2 LYS 9 1HD LYS 9 2.735 32.035 -24.500 46 HD3 LYS 9 2HD LYS 9 1.236 32.742 -23.893 47 HE2 LYS 9 1HE LYS 9 0.263 32.796 -25.967 48 HE3 LYS 9 2HE LYS 9 1.807 32.919 -26.808 49 HZ1 LYS 9 3HZ LYS 9 1.085 30.778 -27.265 50 HZ2 LYS 9 1HZ LYS 9 0.500 30.516 -25.699 51 HZ3 LYS 9 2HZ LYS 9 2.167 30.541 -25.986 52 H VAL 10 H VAL 10 4.206 36.134 -21.804 53 HA VAL 10 HA VAL 10 7.001 35.949 -20.894 54 HB VAL 10 HB VAL 10 5.030 38.119 -20.162 55 HG11 VAL 10 1HG1 VAL 10 6.438 38.852 -18.538 56 HG12 VAL 10 2HG1 VAL 10 6.846 37.137 -18.473 57 HG13 VAL 10 3HG1 VAL 10 7.878 38.256 -19.362 58 HG21 VAL 10 3HG2 VAL 10 7.026 39.497 -21.159 59 HG22 VAL 10 1HG2 VAL 10 7.365 37.990 -22.011 60 HG23 VAL 10 2HG2 VAL 10 5.807 38.790 -22.220 61 H ARG 11 H ARG 11 7.185 34.499 -19.329 62 HA ARG 11 HA ARG 11 4.875 33.554 -17.889 63 HB2 ARG 11 1HB ARG 11 7.801 32.822 -17.783 64 HB3 ARG 11 2HB ARG 11 6.588 32.077 -16.752 65 HG2 ARG 11 1HG ARG 11 5.571 30.980 -18.516 66 HG3 ARG 11 2HG ARG 11 6.238 32.087 -19.718 67 HD2 ARG 11 1HD ARG 11 8.492 31.173 -19.235 68 HD3 ARG 11 2HD ARG 11 7.748 30.004 -18.144 69 HE ARG 11 HE ARG 11 6.531 29.833 -20.677 70 HH11 ARG 11 1HH1 ARG 11 9.532 29.107 -19.067 71 HH12 ARG 11 2HH1 ARG 11 9.932 27.793 -20.124 72 HH21 ARG 11 1HH2 ARG 11 7.046 28.106 -22.074 73 HH22 ARG 11 2HH2 ARG 11 8.517 27.225 -21.835 74 H VAL 12 H VAL 12 4.342 33.915 -15.791 75 HA VAL 12 HA VAL 12 5.512 36.210 -14.505 76 HB VAL 12 HB VAL 12 3.333 34.344 -13.556 77 HG11 VAL 12 1HG1 VAL 12 4.193 35.362 -11.623 78 HG12 VAL 12 2HG1 VAL 12 4.420 36.911 -12.437 79 HG13 VAL 12 3HG1 VAL 12 2.793 36.338 -12.065 80 HG21 VAL 12 3HG2 VAL 12 1.802 36.110 -14.240 81 HG22 VAL 12 1HG2 VAL 12 3.158 37.084 -14.808 82 HG23 VAL 12 2HG2 VAL 12 2.768 35.563 -15.610 83 H GLY 13 H GLY 13 5.265 32.736 -13.802 84 HA2 GLY 13 1HA GLY 13 7.780 32.535 -12.605 85 HA3 GLY 13 2HA GLY 13 6.614 32.822 -11.322 86 H GLU 14 H GLU 14 8.165 30.489 -11.524 87 HA GLU 14 HA GLU 14 6.760 28.362 -12.761 88 HB2 GLU 14 1HB GLU 14 8.988 28.600 -10.805 89 HB3 GLU 14 2HB GLU 14 8.148 27.058 -10.887 90 HG2 GLU 14 1HG GLU 14 9.858 26.743 -12.382 91 HG3 GLU 14 2HG GLU 14 8.550 27.267 -13.441 92 HA PRO 15 HA PRO 15 3.569 27.358 -9.925 93 HB2 PRO 15 1HB PRO 15 3.636 24.645 -9.893 94 HB3 PRO 15 2HB PRO 15 3.053 25.575 -11.278 95 HG2 PRO 15 1HG PRO 15 5.727 24.302 -10.842 96 HG3 PRO 15 2HG PRO 15 4.724 24.324 -12.304 97 HD2 PRO 15 1HD PRO 15 6.843 25.976 -11.966 98 HD3 PRO 15 2HD PRO 15 5.402 26.448 -12.888 99 H GLY 16 H GLY 16 3.620 27.676 -7.793 100 HA2 GLY 16 1HA GLY 16 5.722 26.348 -6.217 101 HA3 GLY 16 2HA GLY 16 4.866 27.808 -5.742 102 H GLN 17 H GLN 17 4.913 26.170 -3.783 103 HA GLN 17 HA GLN 17 3.743 24.847 -2.345 104 HB2 GLN 17 1HB GLN 17 1.484 26.055 -3.941 105 HB3 GLN 17 2HB GLN 17 1.235 25.088 -2.493 106 HG2 GLN 17 1HG GLN 17 2.828 26.777 -1.370 107 HG3 GLN 17 2HG GLN 17 2.468 27.796 -2.762 108 HE21 GLN 17 1HE2 GLN 17 1.840 28.317 -0.017 109 HE22 GLN 17 2HE2 GLN 17 0.120 28.435 0.097 110 H ALA 18 H ALA 18 4.807 23.474 -4.531 111 HA ALA 18 HA ALA 18 2.714 21.520 -5.205 112 HB1 ALA 18 3HB ALA 18 5.408 21.711 -6.519 113 HB2 ALA 18 1HB ALA 18 3.948 20.919 -7.113 114 HB3 ALA 18 2HB ALA 18 4.031 22.680 -7.044 115 H GLY 19 H GLY 19 3.690 21.386 -2.632 116 HA2 GLY 19 1HA GLY 19 4.975 18.764 -2.696 117 HA3 GLY 19 2HA GLY 19 5.820 20.037 -1.826 118 H ASN 20 H ASN 20 2.539 18.652 -2.046 119 HA ASN 20 HA ASN 20 2.431 18.737 0.897 120 HB2 ASN 20 1HB ASN 20 0.880 20.375 0.359 121 HB3 ASN 20 2HB ASN 20 0.395 19.573 -1.132 122 HD21 ASN 20 1HD2 ASN 20 -1.768 20.014 -0.348 123 HD22 ASN 20 2HD2 ASN 20 -2.501 18.914 0.764 124 HA PRO 21 HA PRO 21 1.770 14.379 0.524 125 HB2 PRO 21 1HB PRO 21 1.022 13.923 3.093 126 HB3 PRO 21 2HB PRO 21 2.698 14.224 2.620 127 HG2 PRO 21 1HG PRO 21 0.692 16.112 3.791 128 HG3 PRO 21 2HG PRO 21 2.409 15.917 4.187 129 HD2 PRO 21 1HD PRO 21 1.499 17.907 2.592 130 HD3 PRO 21 2HD PRO 21 3.099 17.166 2.377 131 H ALA 22 H ALA 22 -0.654 16.264 2.338 132 HA ALA 22 HA ALA 22 -2.787 14.556 2.285 133 HB1 ALA 22 3HB ALA 22 -2.657 17.544 2.080 134 HB2 ALA 22 1HB ALA 22 -4.201 16.691 2.098 135 HB3 ALA 22 2HB ALA 22 -3.096 16.543 3.465 136 H LEU 23 H LEU 23 -2.021 16.959 -0.239 137 HA LEU 23 HA LEU 23 -4.039 16.461 -2.017 138 HB2 LEU 23 1HB LEU 23 -1.204 17.304 -2.321 139 HB3 LEU 23 2HB LEU 23 -2.109 16.889 -3.775 140 HG LEU 23 HG LEU 23 -2.874 19.026 -1.786 141 HD11 LEU 23 1HD1 LEU 23 -1.925 20.591 -3.135 142 HD12 LEU 23 2HD1 LEU 23 -2.111 19.615 -4.592 143 HD13 LEU 23 3HD1 LEU 23 -0.822 19.251 -3.445 144 HD21 LEU 23 3HD2 LEU 23 -4.475 17.627 -3.582 145 HD22 LEU 23 1HD2 LEU 23 -4.107 19.149 -4.394 146 HD23 LEU 23 2HD2 LEU 23 -4.851 19.160 -2.795 147 H VAL 24 H VAL 24 -0.938 14.733 -1.807 148 HA VAL 24 HA VAL 24 -1.236 12.989 -3.928 149 HB VAL 24 HB VAL 24 0.025 12.374 -1.251 150 HG11 VAL 24 1HG1 VAL 24 -0.032 10.302 -2.208 151 HG12 VAL 24 2HG1 VAL 24 -0.045 10.939 -3.854 152 HG13 VAL 24 3HG1 VAL 24 1.457 10.915 -2.928 153 HG21 VAL 24 3HG2 VAL 24 2.071 12.877 -2.959 154 HG22 VAL 24 1HG2 VAL 24 0.854 14.011 -3.545 155 HG23 VAL 24 2HG2 VAL 24 1.375 14.069 -1.861 156 H SER 25 H SER 25 -2.714 11.513 -4.394 157 HA SER 25 HA SER 25 -4.127 10.183 -2.174 158 HB2 SER 25 1HB SER 25 -5.602 11.749 -3.381 159 HB3 SER 25 2HB SER 25 -5.252 10.909 -4.891 160 HG SER 25 HG SER 25 -6.905 10.186 -2.800 161 H ALA 26 H ALA 26 -4.921 8.019 -2.646 162 HA ALA 26 HA ALA 26 -3.469 6.652 -4.806 163 HB1 ALA 26 3HB ALA 26 -2.449 5.149 -3.449 164 HB2 ALA 26 1HB ALA 26 -2.540 6.493 -2.311 165 HB3 ALA 26 2HB ALA 26 -3.734 5.197 -2.242 166 H TYR 27 H TYR 27 -4.706 5.319 -5.964 167 HA TYR 27 HA TYR 27 -6.988 3.981 -4.783 168 HB2 TYR 27 1HB TYR 27 -8.621 4.861 -6.346 169 HB3 TYR 27 2HB TYR 27 -7.888 6.192 -5.457 170 HD1 TYR 27 1HD TYR 27 -5.755 7.241 -6.669 171 HD2 TYR 27 2HD TYR 27 -8.870 5.102 -8.625 172 HE1 TYR 27 1HE TYR 27 -5.170 8.340 -8.790 173 HE2 TYR 27 2HE TYR 27 -8.293 6.195 -10.752 174 HH TYR 27 HH TYR 27 -7.155 8.014 -11.637 175 H GLY 28 H GLY 28 -8.028 2.474 -6.346 176 HA2 GLY 28 1HA GLY 28 -7.345 1.761 -8.835 177 HA3 GLY 28 2HA GLY 28 -5.958 1.183 -7.924 178 H THR 29 H THR 29 -6.532 -0.948 -8.649 179 HA THR 29 HA THR 29 -8.937 -2.073 -7.393 180 HB THR 29 HB THR 29 -8.089 -4.128 -8.865 181 HG1 THR 29 1HG THR 29 -7.277 -3.147 -10.882 182 HG21 THR 29 3HG2 THR 29 -10.127 -2.308 -9.028 183 HG22 THR 29 1HG2 THR 29 -9.926 -3.702 -10.089 184 HG23 THR 29 2HG2 THR 29 -9.336 -2.118 -10.593 185 H GLY 30 H GLY 30 -5.435 -2.405 -7.573 186 HA2 GLY 30 1HA GLY 30 -5.160 -4.791 -6.122 187 HA3 GLY 30 2HA GLY 30 -3.941 -3.531 -6.246 188 H LEU 31 H LEU 31 -6.360 -1.832 -5.071 189 HA LEU 31 HA LEU 31 -5.486 -2.224 -2.308 190 HB2 LEU 31 1HB LEU 31 -7.006 0.010 -3.640 191 HB3 LEU 31 2HB LEU 31 -6.632 -0.044 -1.918 192 HG LEU 31 HG LEU 31 -4.525 -0.039 -4.072 193 HD11 LEU 31 1HD1 LEU 31 -4.808 2.406 -2.540 194 HD12 LEU 31 2HD1 LEU 31 -6.239 2.054 -3.509 195 HD13 LEU 31 3HD1 LEU 31 -4.658 2.172 -4.282 196 HD21 LEU 31 3HD2 LEU 31 -3.003 -0.026 -2.417 197 HD22 LEU 31 1HD2 LEU 31 -4.305 -0.737 -1.465 198 HD23 LEU 31 2HD2 LEU 31 -3.992 0.996 -1.373 199 H GLU 32 H GLU 32 -8.205 -2.703 -4.360 200 HA GLU 32 HA GLU 32 -10.330 -2.588 -2.572 201 HB2 GLU 32 1HB GLU 32 -9.950 -4.505 -4.879 202 HB3 GLU 32 2HB GLU 32 -11.480 -4.151 -4.088 203 HG2 GLU 32 1HG GLU 32 -11.475 -1.918 -4.887 204 HG3 GLU 32 2HG GLU 32 -9.811 -2.057 -5.450 205 H GLY 33 H GLY 33 -7.921 -5.090 -3.070 206 HA2 GLY 33 1HA GLY 33 -8.148 -6.197 -0.533 207 HA3 GLY 33 2HA GLY 33 -9.219 -7.124 -1.574 208 H GLY 34 H GLY 34 -7.623 -8.815 -0.781 209 HA2 GLY 34 1HA GLY 34 -5.208 -8.820 -2.477 210 HA3 GLY 34 2HA GLY 34 -5.373 -9.710 -0.971 211 H THR 35 H THR 35 -5.617 -9.856 -4.330 212 HA THR 35 HA THR 35 -7.267 -12.280 -4.270 213 HB THR 35 HB THR 35 -6.852 -11.982 -6.883 214 HG1 THR 35 1HG THR 35 -6.828 -9.280 -6.021 215 HG21 THR 35 3HG2 THR 35 -8.986 -11.056 -7.033 216 HG22 THR 35 1HG2 THR 35 -8.770 -10.077 -5.583 217 HG23 THR 35 2HG2 THR 35 -8.997 -11.821 -5.444 218 H THR 36 H THR 36 -6.107 -14.050 -3.845 219 HA THR 36 HA THR 36 -3.344 -14.300 -4.603 220 HB THR 36 HB THR 36 -4.933 -16.663 -3.703 221 HG1 THR 36 1HG THR 36 -4.582 -14.281 -2.285 222 HG21 THR 36 3HG2 THR 36 -2.935 -17.449 -2.998 223 HG22 THR 36 1HG2 THR 36 -2.407 -15.874 -2.407 224 HG23 THR 36 2HG2 THR 36 -2.289 -16.256 -4.125 225 H GLY 37 H GLY 37 -2.694 -14.838 -6.576 226 HA2 GLY 37 1HA GLY 37 -2.586 -16.644 -8.223 227 HA3 GLY 37 2HA GLY 37 -4.336 -16.760 -8.104 228 H ILE 38 H ILE 38 -4.597 -13.801 -8.069 229 HA ILE 38 HA ILE 38 -4.303 -13.406 -10.964 230 HB ILE 38 HB ILE 38 -6.006 -11.776 -9.083 231 HG12 ILE 38 1HG1 ILE 38 -7.015 -13.973 -10.883 232 HG13 ILE 38 2HG1 ILE 38 -6.557 -14.283 -9.212 233 HG21 ILE 38 1HG2 ILE 38 -7.224 -11.388 -11.317 234 HG22 ILE 38 2HG2 ILE 38 -5.701 -10.547 -11.035 235 HG23 ILE 38 3HG2 ILE 38 -5.739 -11.982 -12.060 236 HD11 ILE 38 3HD1 ILE 38 -9.041 -13.678 -9.966 237 HD12 ILE 38 1HD1 ILE 38 -8.386 -13.261 -8.383 238 HD13 ILE 38 2HD1 ILE 38 -8.429 -12.052 -9.667 239 H GLN 39 H GLN 39 -3.946 -11.091 -11.645 240 HA GLN 39 HA GLN 39 -1.894 -9.877 -9.916 241 HB2 GLN 39 1HB GLN 39 -0.845 -10.615 -11.909 242 HB3 GLN 39 2HB GLN 39 -2.152 -10.002 -12.915 243 HG2 GLN 39 1HG GLN 39 -1.508 -7.719 -12.393 244 HG3 GLN 39 2HG GLN 39 -0.225 -8.310 -11.338 245 HE21 GLN 39 1HE2 GLN 39 -1.366 -8.986 -14.634 246 HE22 GLN 39 2HE2 GLN 39 0.191 -8.883 -15.376 247 H SER 40 H SER 40 -2.370 -7.970 -9.066 248 HA SER 40 HA SER 40 -4.375 -6.288 -10.423 249 HB2 SER 40 1HB SER 40 -3.868 -6.501 -7.445 250 HB3 SER 40 2HB SER 40 -5.077 -5.477 -8.220 251 HG SER 40 HG SER 40 -5.735 -7.682 -9.165 252 H GLU 41 H GLU 41 -4.110 -4.002 -10.244 253 HA GLU 41 HA GLU 41 -1.529 -3.039 -9.280 254 HB2 GLU 41 1HB GLU 41 -0.984 -1.922 -11.355 255 HB3 GLU 41 2HB GLU 41 -1.191 -3.641 -11.657 256 HG2 GLU 41 1HG GLU 41 -2.222 -2.435 -13.433 257 HG3 GLU 41 2HG GLU 41 -3.490 -3.173 -12.456 258 H PHE 42 H PHE 42 -1.493 -0.855 -8.754 259 HA PHE 42 HA PHE 42 -4.022 0.611 -9.062 260 HB2 PHE 42 1HB PHE 42 -3.985 1.341 -6.784 261 HB3 PHE 42 2HB PHE 42 -3.801 -0.410 -6.769 262 HD1 PHE 42 1HD PHE 42 -1.870 2.754 -6.595 263 HD2 PHE 42 2HD PHE 42 -2.009 -1.397 -5.667 264 HE1 PHE 42 1HE PHE 42 0.181 2.989 -5.256 265 HE2 PHE 42 2HE PHE 42 0.041 -1.169 -4.325 266 HZ PHE 42 HZ PHE 42 1.138 1.026 -4.118 267 H PHE 43 H PHE 43 -3.844 2.891 -9.073 268 HA PHE 43 HA PHE 43 -1.142 3.837 -9.744 269 HB2 PHE 43 1HB PHE 43 -3.844 4.932 -10.550 270 HB3 PHE 43 2HB PHE 43 -2.298 5.657 -10.980 271 HD1 PHE 43 1HD PHE 43 -0.761 4.468 -12.507 272 HD2 PHE 43 2HD PHE 43 -4.696 3.054 -11.714 273 HE1 PHE 43 1HE PHE 43 -0.647 3.040 -14.507 274 HE2 PHE 43 2HE PHE 43 -4.588 1.622 -13.712 275 HZ PHE 43 HZ PHE 43 -2.562 1.613 -15.111 276 H ILE 44 H ILE 44 -0.457 5.899 -9.007 277 HA ILE 44 HA ILE 44 -1.831 6.773 -6.551 278 HB ILE 44 HB ILE 44 1.099 7.007 -7.248 279 HG12 ILE 44 1HG1 ILE 44 -0.045 5.433 -4.962 280 HG13 ILE 44 2HG1 ILE 44 0.040 4.724 -6.571 281 HG21 ILE 44 1HG2 ILE 44 -0.269 8.731 -5.696 282 HG22 ILE 44 2HG2 ILE 44 0.161 7.508 -4.501 283 HG23 ILE 44 3HG2 ILE 44 1.424 8.310 -5.435 284 HD11 ILE 44 3HD1 ILE 44 2.501 5.293 -6.540 285 HD12 ILE 44 1HD1 ILE 44 2.299 5.635 -4.822 286 HD13 ILE 44 2HD1 ILE 44 1.972 4.017 -5.444 287 H ASN 45 H ASN 45 -2.808 8.672 -6.695 288 HA ASN 45 HA ASN 45 -2.414 10.434 -8.900 289 HB2 ASN 45 1HB ASN 45 -4.576 10.101 -7.623 290 HB3 ASN 45 2HB ASN 45 -3.868 11.063 -6.328 291 HD21 ASN 45 1HD2 ASN 45 -6.047 12.109 -7.136 292 HD22 ASN 45 2HD2 ASN 45 -5.823 13.428 -8.231 293 H THR 46 H THR 46 -0.003 10.533 -8.389 294 HA THR 46 HA THR 46 0.559 12.681 -6.455 295 HB THR 46 HB THR 46 1.855 10.749 -5.916 296 HG1 THR 46 1HG THR 46 3.692 12.315 -7.392 297 HG21 THR 46 3HG2 THR 46 1.725 9.489 -7.950 298 HG22 THR 46 1HG2 THR 46 3.431 9.756 -7.591 299 HG23 THR 46 2HG2 THR 46 2.629 10.719 -8.832 300 H THR 47 H THR 47 -0.518 13.702 -8.630 301 HA THR 47 HA THR 47 1.766 14.745 -10.175 302 HB THR 47 HB THR 47 0.659 13.572 -11.830 303 HG1 THR 47 1HG THR 47 -0.814 16.007 -11.878 304 HG21 THR 47 3HG2 THR 47 -1.260 12.983 -10.268 305 HG22 THR 47 1HG2 THR 47 -1.666 13.161 -11.975 306 HG23 THR 47 2HG2 THR 47 -2.043 14.456 -10.839 307 H ARG 48 H ARG 48 -1.328 15.393 -8.653 308 HA ARG 48 HA ARG 48 -1.322 18.189 -9.341 309 HB2 ARG 48 1HB ARG 48 -3.067 16.392 -7.714 310 HB3 ARG 48 2HB ARG 48 -3.175 18.128 -7.459 311 HG2 ARG 48 1HG ARG 48 -3.406 16.917 -10.192 312 HG3 ARG 48 2HG ARG 48 -4.795 17.071 -9.114 313 HD2 ARG 48 1HD ARG 48 -4.200 19.527 -8.927 314 HD3 ARG 48 2HD ARG 48 -3.081 19.260 -10.263 315 HE ARG 48 HE ARG 48 -4.865 19.309 -11.677 316 HH11 ARG 48 1HH1 ARG 48 -6.011 18.537 -8.482 317 HH12 ARG 48 2HH1 ARG 48 -7.684 18.562 -8.934 318 HH21 ARG 48 1HH2 ARG 48 -7.063 19.345 -12.285 319 HH22 ARG 48 2HH2 ARG 48 -8.281 19.021 -11.098 320 H ALA 49 H ALA 49 0.176 16.278 -6.979 321 HA ALA 49 HA ALA 49 0.382 18.426 -5.022 322 HB1 ALA 49 3HB ALA 49 1.457 16.823 -3.599 323 HB2 ALA 49 1HB ALA 49 0.030 16.071 -4.311 324 HB3 ALA 49 2HB ALA 49 1.634 15.686 -4.935 325 H GLY 50 H GLY 50 2.586 16.427 -6.989 326 HA2 GLY 50 1HA GLY 50 4.228 18.249 -8.050 327 HA3 GLY 50 2HA GLY 50 4.802 18.211 -6.389 328 HA PRO 51 HA PRO 51 6.434 14.613 -9.136 329 HB2 PRO 51 1HB PRO 51 8.697 15.722 -10.145 330 HB3 PRO 51 2HB PRO 51 7.146 15.766 -10.991 331 HG2 PRO 51 1HG PRO 51 8.459 17.884 -9.332 332 HG3 PRO 51 2HG PRO 51 7.613 18.041 -10.883 333 HD2 PRO 51 1HD PRO 51 6.449 18.664 -8.518 334 HD3 PRO 51 2HD PRO 51 5.532 18.016 -9.893 335 H GLY 52 H GLY 52 8.508 13.474 -8.769 336 HA2 GLY 52 1HA GLY 52 10.666 13.907 -7.370 337 HA3 GLY 52 2HA GLY 52 9.494 14.071 -6.070 338 H THR 53 H THR 53 11.352 12.215 -5.698 339 HA THR 53 HA THR 53 10.491 9.642 -6.699 340 HB THR 53 HB THR 53 12.601 10.327 -4.643 341 HG1 THR 53 1HG THR 53 13.970 9.710 -6.505 342 HG21 THR 53 3HG2 THR 53 12.035 8.097 -4.211 343 HG22 THR 53 1HG2 THR 53 13.404 7.976 -5.314 344 HG23 THR 53 2HG2 THR 53 11.764 7.738 -5.916 345 H LEU 54 H LEU 54 9.847 7.879 -5.334 346 HA LEU 54 HA LEU 54 8.697 8.675 -2.749 347 HB2 LEU 54 1HB LEU 54 6.636 7.651 -3.197 348 HB3 LEU 54 2HB LEU 54 7.001 8.620 -4.623 349 HG LEU 54 HG LEU 54 7.479 5.649 -4.462 350 HD11 LEU 54 1HD1 LEU 54 5.100 6.109 -4.184 351 HD12 LEU 54 2HD1 LEU 54 5.430 5.395 -5.762 352 HD13 LEU 54 3HD1 LEU 54 5.121 7.126 -5.624 353 HD21 LEU 54 3HD2 LEU 54 7.152 6.249 -7.065 354 HD22 LEU 54 1HD2 LEU 54 8.720 6.221 -6.256 355 HD23 LEU 54 2HD2 LEU 54 7.876 7.752 -6.489 356 H SER 55 H SER 55 8.168 6.810 -1.355 357 HA SER 55 HA SER 55 9.966 4.534 -1.882 358 HB2 SER 55 1HB SER 55 9.465 6.086 0.644 359 HB3 SER 55 2HB SER 55 10.035 4.419 0.714 360 HG SER 55 HG SER 55 11.370 6.183 -0.987 361 H VAL 56 H VAL 56 8.611 2.962 -2.532 362 HA VAL 56 HA VAL 56 6.236 2.419 -0.872 363 HB VAL 56 HB VAL 56 6.733 1.665 -3.756 364 HG11 VAL 56 1HG1 VAL 56 5.411 0.009 -2.429 365 HG12 VAL 56 2HG1 VAL 56 4.224 1.281 -2.132 366 HG13 VAL 56 3HG1 VAL 56 4.535 0.730 -3.779 367 HG21 VAL 56 3HG2 VAL 56 4.570 3.485 -2.764 368 HG22 VAL 56 1HG2 VAL 56 6.187 4.103 -3.102 369 HG23 VAL 56 2HG2 VAL 56 5.249 3.340 -4.386 370 H THR 57 H THR 57 6.340 0.678 0.370 371 HA THR 57 HA THR 57 7.848 -1.661 -0.554 372 HB THR 57 HB THR 57 8.072 -0.610 2.270 373 HG1 THR 57 1HG THR 57 9.902 -0.433 0.089 374 HG21 THR 57 3HG2 THR 57 10.192 -2.329 1.579 375 HG22 THR 57 1HG2 THR 57 8.715 -3.113 1.020 376 HG23 THR 57 2HG2 THR 57 8.877 -2.641 2.712 377 H ILE 58 H ILE 58 6.502 -3.327 -0.573 378 HA ILE 58 HA ILE 58 4.180 -3.331 1.201 379 HB ILE 58 HB ILE 58 4.808 -5.262 -1.031 380 HG12 ILE 58 1HG1 ILE 58 2.897 -2.938 -1.195 381 HG13 ILE 58 2HG1 ILE 58 4.584 -2.784 -1.672 382 HG21 ILE 58 1HG2 ILE 58 2.856 -5.275 0.995 383 HG22 ILE 58 2HG2 ILE 58 2.027 -4.855 -0.503 384 HG23 ILE 58 3HG2 ILE 58 2.972 -6.341 -0.405 385 HD11 ILE 58 3HD1 ILE 58 3.376 -5.094 -2.892 386 HD12 ILE 58 1HD1 ILE 58 2.459 -3.629 -3.245 387 HD13 ILE 58 2HD1 ILE 58 4.177 -3.711 -3.639 388 H GLU 59 H GLU 59 3.739 -4.950 2.665 389 HA GLU 59 HA GLU 59 5.876 -6.924 3.120 390 HB2 GLU 59 1HB GLU 59 4.552 -5.056 5.038 391 HB3 GLU 59 2HB GLU 59 5.047 -6.642 5.613 392 HG2 GLU 59 1HG GLU 59 7.280 -6.194 5.364 393 HG3 GLU 59 2HG GLU 59 7.008 -4.977 4.118 394 H GLY 60 H GLY 60 5.239 -8.938 3.977 395 HA2 GLY 60 1HA GLY 60 2.652 -9.648 4.759 396 HA3 GLY 60 2HA GLY 60 2.765 -9.908 3.025 397 HA PRO 61 HA PRO 61 4.416 -13.593 5.482 398 HB2 PRO 61 1HB PRO 61 2.485 -15.364 4.771 399 HB3 PRO 61 2HB PRO 61 2.368 -14.339 6.207 400 HG2 PRO 61 1HG PRO 61 1.131 -13.965 3.506 401 HG3 PRO 61 2HG PRO 61 0.411 -13.726 5.109 402 HD2 PRO 61 1HD PRO 61 1.324 -11.671 3.600 403 HD3 PRO 61 2HD PRO 61 1.384 -11.653 5.375 404 H SER 62 H SER 62 3.005 -13.225 2.273 405 HA SER 62 HA SER 62 4.829 -15.278 1.233 406 HB2 SER 62 1HB SER 62 2.240 -15.173 0.759 407 HB3 SER 62 2HB SER 62 2.717 -13.979 -0.448 408 HG SER 62 HG SER 62 4.342 -15.774 -0.994 409 H LYS 63 H LYS 63 6.642 -14.646 0.293 410 HA LYS 63 HA LYS 63 7.271 -11.927 -0.175 411 HB2 LYS 63 1HB LYS 63 8.826 -13.973 0.278 412 HB3 LYS 63 2HB LYS 63 8.769 -14.183 -1.467 413 HG2 LYS 63 1HG LYS 63 10.633 -12.892 -1.284 414 HG3 LYS 63 2HG LYS 63 9.410 -11.630 -1.459 415 HD2 LYS 63 1HD LYS 63 9.319 -11.422 0.999 416 HD3 LYS 63 2HD LYS 63 10.601 -12.628 1.129 417 HE2 LYS 63 1HE LYS 63 12.151 -11.195 0.001 418 HE3 LYS 63 2HE LYS 63 10.877 -10.042 -0.392 419 HZ1 LYS 63 3HZ LYS 63 10.839 -9.220 1.716 420 HZ2 LYS 63 1HZ LYS 63 12.468 -9.671 1.639 421 HZ3 LYS 63 2HZ LYS 63 11.351 -10.666 2.429 422 H VAL 64 H VAL 64 6.503 -10.714 -1.765 423 HA VAL 64 HA VAL 64 6.003 -11.975 -4.384 424 HB VAL 64 HB VAL 64 4.387 -10.096 -4.776 425 HG11 VAL 64 1HG1 VAL 64 2.606 -11.067 -3.330 426 HG12 VAL 64 2HG1 VAL 64 3.544 -12.271 -4.216 427 HG13 VAL 64 3HG1 VAL 64 3.852 -11.999 -2.500 428 HG21 VAL 64 3HG2 VAL 64 5.497 -8.812 -2.759 429 HG22 VAL 64 1HG2 VAL 64 3.793 -8.590 -3.156 430 HG23 VAL 64 2HG2 VAL 64 4.258 -9.660 -1.833 431 H LYS 65 H LYS 65 6.824 -11.037 -6.198 432 HA LYS 65 HA LYS 65 8.952 -9.125 -5.827 433 HB2 LYS 65 1HB LYS 65 7.951 -10.792 -8.099 434 HB3 LYS 65 2HB LYS 65 8.982 -9.412 -8.449 435 HG2 LYS 65 1HG LYS 65 10.640 -10.374 -6.822 436 HG3 LYS 65 2HG LYS 65 9.640 -11.828 -6.786 437 HD2 LYS 65 1HD LYS 65 10.543 -10.710 -9.407 438 HD3 LYS 65 2HD LYS 65 11.660 -11.668 -8.433 439 HE2 LYS 65 1HE LYS 65 8.939 -12.540 -9.403 440 HE3 LYS 65 2HE LYS 65 10.491 -13.064 -10.054 441 HZ1 LYS 65 3HZ LYS 65 9.091 -13.966 -7.712 442 HZ2 LYS 65 1HZ LYS 65 10.720 -13.617 -7.418 443 HZ3 LYS 65 2HZ LYS 65 10.298 -14.736 -8.613 444 H MET 66 H MET 66 8.120 -7.134 -5.356 445 HA MET 66 HA MET 66 5.894 -5.999 -6.723 446 HB2 MET 66 1HB MET 66 8.019 -4.593 -5.096 447 HB3 MET 66 2HB MET 66 6.435 -3.956 -5.519 448 HG2 MET 66 1HG MET 66 5.995 -4.653 -3.412 449 HG3 MET 66 2HG MET 66 5.622 -6.140 -4.280 450 HE1 MET 66 3HE MET 66 7.565 -4.171 -2.033 451 HE2 MET 66 1HE MET 66 8.314 -5.359 -0.966 452 HE3 MET 66 2HE MET 66 9.223 -4.698 -2.326 453 H ASP 67 H ASP 67 5.879 -5.223 -8.717 454 HA ASP 67 HA ASP 67 8.355 -4.034 -9.786 455 HB2 ASP 67 1HB ASP 67 7.662 -6.300 -10.761 456 HB3 ASP 67 2HB ASP 67 6.306 -5.443 -11.490 457 H CYS 68 H CYS 68 8.098 -1.921 -10.022 458 HA CYS 68 HA CYS 68 5.497 -0.921 -10.976 459 HB2 CYS 68 1HB CYS 68 5.753 1.053 -9.610 460 HB3 CYS 68 2HB CYS 68 5.919 -0.366 -8.583 461 HG CYS 68 HG CYS 68 8.370 1.774 -9.605 462 H GLN 69 H GLN 69 5.514 0.611 -12.569 463 HA GLN 69 HA GLN 69 8.157 1.301 -13.674 464 HB2 GLN 69 1HB GLN 69 6.996 1.448 -15.881 465 HB3 GLN 69 2HB GLN 69 7.020 -0.170 -15.191 466 HG2 GLN 69 1HG GLN 69 4.733 0.020 -14.509 467 HG3 GLN 69 2HG GLN 69 4.685 1.715 -14.991 468 HE21 GLN 69 1HE2 GLN 69 4.404 -1.539 -15.999 469 HE22 GLN 69 2HE2 GLN 69 4.050 -1.232 -17.662 470 H GLU 70 H GLU 70 7.736 3.252 -15.351 471 HA GLU 70 HA GLU 70 6.865 5.441 -13.659 472 HB2 GLU 70 1HB GLU 70 8.093 6.843 -15.034 473 HB3 GLU 70 2HB GLU 70 8.995 5.339 -15.153 474 HG2 GLU 70 1HG GLU 70 7.707 4.852 -17.252 475 HG3 GLU 70 2HG GLU 70 7.082 6.498 -17.158 476 H THR 71 H THR 71 5.150 6.766 -14.015 477 HA THR 71 HA THR 71 3.536 6.370 -16.428 478 HB THR 71 HB THR 71 1.453 6.326 -15.069 479 HG1 THR 71 1HG THR 71 3.353 6.321 -12.983 480 HG21 THR 71 3HG2 THR 71 3.173 4.243 -15.664 481 HG22 THR 71 1HG2 THR 71 1.488 4.090 -15.169 482 HG23 THR 71 2HG2 THR 71 2.773 3.980 -13.966 483 HA PRO 72 HA PRO 72 3.115 10.743 -16.340 484 HB2 PRO 72 1HB PRO 72 0.724 11.040 -17.591 485 HB3 PRO 72 2HB PRO 72 2.200 10.567 -18.441 486 HG2 PRO 72 1HG PRO 72 -0.052 8.856 -17.460 487 HG3 PRO 72 2HG PRO 72 0.820 8.782 -19.002 488 HD2 PRO 72 1HD PRO 72 1.346 7.096 -16.950 489 HD3 PRO 72 2HD PRO 72 2.598 7.636 -18.087 490 H GLU 73 H GLU 73 1.328 8.749 -14.413 491 HA GLU 73 HA GLU 73 -0.237 10.971 -13.279 492 HB2 GLU 73 1HB GLU 73 -0.735 8.029 -13.453 493 HB3 GLU 73 2HB GLU 73 -1.412 8.925 -12.101 494 HG2 GLU 73 1HG GLU 73 -3.142 9.065 -13.563 495 HG3 GLU 73 2HG GLU 73 -2.256 10.520 -14.015 496 H GLY 74 H GLY 74 2.172 8.545 -12.659 497 HA2 GLY 74 1HA GLY 74 3.401 9.755 -10.546 498 HA3 GLY 74 2HA GLY 74 2.116 8.819 -9.797 499 H TYR 75 H TYR 75 2.283 6.609 -9.668 500 HA TYR 75 HA TYR 75 4.360 5.181 -11.057 501 HB2 TYR 75 1HB TYR 75 4.538 5.527 -8.057 502 HB3 TYR 75 2HB TYR 75 5.515 4.412 -9.006 503 HD1 TYR 75 1HD TYR 75 7.146 5.332 -10.673 504 HD2 TYR 75 2HD TYR 75 5.119 7.816 -7.876 505 HE1 TYR 75 1HE TYR 75 8.811 7.103 -11.049 506 HE2 TYR 75 2HE TYR 75 6.778 9.594 -8.245 507 HH TYR 75 HH TYR 75 8.689 9.838 -10.744 508 H LYS 76 H LYS 76 3.238 3.467 -11.693 509 HA LYS 76 HA LYS 76 1.102 2.381 -10.065 510 HB2 LYS 76 1HB LYS 76 1.002 2.638 -12.587 511 HB3 LYS 76 2HB LYS 76 2.141 1.301 -12.685 512 HG2 LYS 76 1HG LYS 76 0.511 -0.105 -11.449 513 HG3 LYS 76 2HG LYS 76 -0.639 1.231 -11.534 514 HD2 LYS 76 1HD LYS 76 -1.281 0.058 -13.387 515 HD3 LYS 76 2HD LYS 76 -0.051 1.096 -14.111 516 HE2 LYS 76 1HE LYS 76 1.574 -0.830 -13.536 517 HE3 LYS 76 2HE LYS 76 0.114 -1.805 -13.376 518 HZ1 LYS 76 3HZ LYS 76 0.073 -0.282 -15.775 519 HZ2 LYS 76 1HZ LYS 76 -0.056 -1.956 -15.568 520 HZ3 LYS 76 2HZ LYS 76 1.468 -1.236 -15.698 521 H VAL 77 H VAL 77 1.227 0.645 -8.788 522 HA VAL 77 HA VAL 77 3.718 -0.926 -8.845 523 HB VAL 77 HB VAL 77 1.822 -0.437 -6.545 524 HG11 VAL 77 1HG1 VAL 77 4.292 -2.147 -6.753 525 HG12 VAL 77 2HG1 VAL 77 3.592 -1.630 -5.217 526 HG13 VAL 77 3HG1 VAL 77 2.660 -2.651 -6.314 527 HG21 VAL 77 3HG2 VAL 77 3.545 1.348 -7.397 528 HG22 VAL 77 1HG2 VAL 77 3.355 1.035 -5.672 529 HG23 VAL 77 2HG2 VAL 77 4.706 0.323 -6.554 530 H MET 78 H MET 78 3.631 -3.070 -9.170 531 HA MET 78 HA MET 78 0.968 -4.330 -9.251 532 HB2 MET 78 1HB MET 78 3.357 -5.116 -10.922 533 HB3 MET 78 2HB MET 78 1.711 -5.718 -11.070 534 HG2 MET 78 1HG MET 78 0.935 -3.644 -11.911 535 HG3 MET 78 2HG MET 78 2.448 -2.839 -11.502 536 HE1 MET 78 3HE MET 78 4.460 -2.831 -12.672 537 HE2 MET 78 1HE MET 78 4.667 -3.247 -14.373 538 HE3 MET 78 2HE MET 78 3.538 -1.975 -13.909 539 H TYR 79 H TYR 79 0.671 -6.159 -8.115 540 HA TYR 79 HA TYR 79 2.933 -7.751 -7.240 541 HB2 TYR 79 1HB TYR 79 2.682 -7.465 -4.940 542 HB3 TYR 79 2HB TYR 79 2.472 -5.829 -5.555 543 HD1 TYR 79 2HD TYR 79 0.289 -4.753 -5.512 544 HD2 TYR 79 1HD TYR 79 0.813 -8.696 -4.002 545 HE1 TYR 79 2HE TYR 79 -1.893 -4.605 -4.386 546 HE2 TYR 79 1HE TYR 79 -1.368 -8.560 -2.872 547 HH TYR 79 HH TYR 79 -3.527 -5.836 -3.369 548 H THR 80 H THR 80 2.413 -9.858 -6.895 549 HA THR 80 HA THR 80 -0.441 -10.579 -6.900 550 HB THR 80 HB THR 80 1.744 -11.812 -8.581 551 HG1 THR 80 1HG THR 80 0.788 -10.733 -10.127 552 HG21 THR 80 3HG2 THR 80 -0.227 -13.300 -9.346 553 HG22 THR 80 1HG2 THR 80 -0.955 -12.865 -7.800 554 HG23 THR 80 2HG2 THR 80 0.597 -13.703 -7.840 555 HA PRO 81 HA PRO 81 1.330 -12.669 -3.285 556 HB2 PRO 81 1HB PRO 81 -1.060 -12.974 -2.033 557 HB3 PRO 81 2HB PRO 81 -0.133 -11.470 -1.980 558 HG2 PRO 81 1HG PRO 81 -2.470 -12.195 -3.704 559 HG3 PRO 81 2HG PRO 81 -2.141 -10.679 -2.846 560 HD2 PRO 81 1HD PRO 81 -1.680 -10.981 -5.497 561 HD3 PRO 81 2HD PRO 81 -0.686 -9.929 -4.469 562 H MET 82 H MET 82 1.644 -14.801 -3.054 563 HA MET 82 HA MET 82 0.032 -16.621 -4.665 564 HB2 MET 82 1HB MET 82 2.715 -16.779 -3.351 565 HB3 MET 82 2HB MET 82 1.867 -18.266 -3.753 566 HG2 MET 82 1HG MET 82 2.405 -16.097 -5.758 567 HG3 MET 82 2HG MET 82 3.517 -17.430 -5.455 568 HE1 MET 82 3HE MET 82 1.501 -16.347 -8.113 569 HE2 MET 82 1HE MET 82 2.965 -17.315 -8.285 570 HE3 MET 82 2HE MET 82 1.436 -17.906 -8.935 571 H ALA 83 H ALA 83 0.567 -15.733 -1.369 572 HA ALA 83 HA ALA 83 -1.299 -17.851 -0.528 573 HB1 ALA 83 3HB ALA 83 1.300 -17.044 0.697 574 HB2 ALA 83 1HB ALA 83 0.002 -17.650 1.726 575 HB3 ALA 83 2HB ALA 83 0.637 -18.655 0.423 576 HA PRO 84 HA PRO 84 -3.720 -14.565 1.122 577 HB2 PRO 84 1HB PRO 84 -5.155 -15.964 2.953 578 HB3 PRO 84 2HB PRO 84 -5.443 -16.082 1.213 579 HG2 PRO 84 1HG PRO 84 -3.904 -17.920 3.007 580 HG3 PRO 84 2HG PRO 84 -5.047 -18.319 1.711 581 HD2 PRO 84 1HD PRO 84 -2.362 -18.424 1.371 582 HD3 PRO 84 2HD PRO 84 -3.476 -17.997 0.056 583 H GLY 85 H GLY 85 -4.376 -13.635 3.302 584 HA2 GLY 85 1HA GLY 85 -3.593 -13.916 5.759 585 HA3 GLY 85 2HA GLY 85 -2.008 -13.665 5.043 586 H ASN 86 H ASN 86 -1.627 -11.777 6.210 587 HA ASN 86 HA ASN 86 -3.336 -9.489 5.484 588 HB2 ASN 86 1HB ASN 86 -1.471 -9.370 7.817 589 HB3 ASN 86 2HB ASN 86 -3.012 -8.553 7.572 590 HD21 ASN 86 1HD2 ASN 86 -4.737 -9.353 8.548 591 HD22 ASN 86 2HD2 ASN 86 -4.845 -10.913 9.283 592 H TYR 87 H TYR 87 -2.461 -8.061 4.149 593 HA TYR 87 HA TYR 87 0.475 -7.942 3.945 594 HB2 TYR 87 1HB TYR 87 -1.699 -7.514 1.908 595 HB3 TYR 87 2HB TYR 87 -0.074 -6.888 1.656 596 HD1 TYR 87 1HD TYR 87 -1.559 -10.115 2.845 597 HD2 TYR 87 2HD TYR 87 1.210 -8.182 0.256 598 HE1 TYR 87 1HE TYR 87 -0.860 -12.304 1.968 599 HE2 TYR 87 2HE TYR 87 1.916 -10.365 -0.629 600 HH TYR 87 HH TYR 87 0.575 -13.389 0.655 601 H LEU 88 H LEU 88 1.441 -5.862 3.536 602 HA LEU 88 HA LEU 88 -0.198 -3.579 4.405 603 HB2 LEU 88 1HB LEU 88 1.352 -4.582 6.183 604 HB3 LEU 88 2HB LEU 88 2.671 -3.918 5.220 605 HG LEU 88 HG LEU 88 1.454 -1.665 5.491 606 HD11 LEU 88 1HD1 LEU 88 -0.439 -1.632 6.639 607 HD12 LEU 88 2HD1 LEU 88 0.412 -2.245 8.057 608 HD13 LEU 88 3HD1 LEU 88 -0.321 -3.370 6.914 609 HD21 LEU 88 3HD2 LEU 88 3.498 -2.858 6.834 610 HD22 LEU 88 1HD2 LEU 88 2.404 -2.439 8.153 611 HD23 LEU 88 2HD2 LEU 88 2.985 -1.184 7.058 612 H ILE 89 H ILE 89 0.040 -1.762 3.238 613 HA ILE 89 HA ILE 89 2.228 -1.689 1.262 614 HB ILE 89 HB ILE 89 -0.582 -0.628 0.944 615 HG12 ILE 89 1HG1 ILE 89 0.852 -2.848 -0.528 616 HG13 ILE 89 2HG1 ILE 89 -0.345 -3.094 0.739 617 HG21 ILE 89 1HG2 ILE 89 0.286 -0.292 -1.463 618 HG22 ILE 89 2HG2 ILE 89 0.726 0.889 -0.230 619 HG23 ILE 89 3HG2 ILE 89 1.887 -0.343 -0.724 620 HD11 ILE 89 3HD1 ILE 89 -1.977 -2.964 -0.741 621 HD12 ILE 89 1HD1 ILE 89 -1.431 -1.368 -1.255 622 HD13 ILE 89 2HD1 ILE 89 -0.771 -2.816 -2.019 623 H SER 90 H SER 90 3.636 -0.135 1.685 624 HA SER 90 HA SER 90 2.775 2.207 3.222 625 HB2 SER 90 1HB SER 90 4.750 0.884 4.004 626 HB3 SER 90 2HB SER 90 5.592 1.344 2.523 627 HG SER 90 HG SER 90 5.891 2.673 4.533 628 H VAL 91 H VAL 91 2.634 4.177 2.352 629 HA VAL 91 HA VAL 91 3.894 4.665 -0.261 630 HB VAL 91 HB VAL 91 1.095 5.534 0.474 631 HG11 VAL 91 1HG1 VAL 91 2.410 7.053 -1.021 632 HG12 VAL 91 2HG1 VAL 91 2.505 5.728 -2.182 633 HG13 VAL 91 3HG1 VAL 91 0.937 6.405 -1.741 634 HG21 VAL 91 3HG2 VAL 91 2.076 3.339 -1.343 635 HG22 VAL 91 1HG2 VAL 91 1.055 3.180 0.086 636 HG23 VAL 91 2HG2 VAL 91 0.428 3.966 -1.363 637 H LYS 92 H LYS 92 5.509 5.930 0.615 638 HA LYS 92 HA LYS 92 4.703 8.291 2.158 639 HB2 LYS 92 1HB LYS 92 7.285 6.805 1.829 640 HB3 LYS 92 2HB LYS 92 7.306 8.486 2.348 641 HG2 LYS 92 1HG LYS 92 5.680 7.774 4.172 642 HG3 LYS 92 2HG LYS 92 6.109 6.116 3.745 643 HD2 LYS 92 1HD LYS 92 8.510 6.742 4.109 644 HD3 LYS 92 2HD LYS 92 7.946 8.291 4.741 645 HE2 LYS 92 1HE LYS 92 8.115 7.117 6.692 646 HE3 LYS 92 2HE LYS 92 6.452 6.727 6.257 647 HZ1 LYS 92 3HZ LYS 92 8.638 4.982 6.598 648 HZ2 LYS 92 1HZ LYS 92 8.079 4.857 5.006 649 HZ3 LYS 92 2HZ LYS 92 7.017 4.602 6.298 650 H TYR 93 H TYR 93 5.105 10.357 1.470 651 HA TYR 93 HA TYR 93 6.520 10.774 -1.044 652 HB2 TYR 93 1HB TYR 93 4.351 10.506 -1.934 653 HB3 TYR 93 2HB TYR 93 3.605 11.387 -0.606 654 HD1 TYR 93 2HD TYR 93 3.902 13.872 -0.468 655 HD2 TYR 93 1HD TYR 93 5.116 11.630 -3.874 656 HE1 TYR 93 2HE TYR 93 3.961 15.939 -1.801 657 HE2 TYR 93 1HE TYR 93 5.178 13.690 -5.216 658 HH TYR 93 HH TYR 93 3.990 16.020 -5.068 659 H GLY 94 H GLY 94 7.276 12.890 -1.341 660 HA2 GLY 94 1HA GLY 94 8.201 14.857 -0.594 661 HA3 GLY 94 2HA GLY 94 6.609 15.158 0.087 662 H GLY 95 H GLY 95 9.183 12.823 0.890 663 HA2 GLY 95 1HA GLY 95 10.586 12.991 2.810 664 HA3 GLY 95 2HA GLY 95 9.419 14.092 3.528 665 HA PRO 96 HA PRO 96 8.860 9.965 5.532 666 HB2 PRO 96 1HB PRO 96 8.621 10.966 8.044 667 HB3 PRO 96 2HB PRO 96 10.182 10.590 7.304 668 HG2 PRO 96 1HG PRO 96 8.800 13.232 7.572 669 HG3 PRO 96 2HG PRO 96 10.509 12.833 7.824 670 HD2 PRO 96 1HD PRO 96 9.604 13.995 5.552 671 HD3 PRO 96 2HD PRO 96 10.981 12.876 5.568 672 H ASN 97 H ASN 97 7.191 13.037 6.166 673 HA ASN 97 HA ASN 97 4.891 12.252 7.360 674 HB2 ASN 97 1HB ASN 97 4.699 14.112 5.012 675 HB3 ASN 97 2HB ASN 97 3.887 14.208 6.572 676 HD21 ASN 97 1HD2 ASN 97 6.404 15.352 4.709 677 HD22 ASN 97 2HD2 ASN 97 7.312 16.144 5.947 678 H HIS 98 H HIS 98 3.571 10.614 6.957 679 HA HIS 98 HA HIS 98 3.381 9.376 4.390 680 HB2 HIS 98 1HB HIS 98 1.536 8.042 5.532 681 HB3 HIS 98 2HB HIS 98 3.138 7.935 6.255 682 HD2 HIS 98 2HD HIS 98 2.983 8.144 8.935 683 HE1 HIS 98 1HE HIS 98 -0.465 10.605 9.167 684 HE2 HIS 98 2HE HIS 98 1.349 9.437 10.467 685 H ILE 99 H ILE 99 1.100 8.864 3.512 686 HA ILE 99 HA ILE 99 -0.280 11.432 3.183 687 HB ILE 99 HB ILE 99 -1.229 10.518 1.145 688 HG12 ILE 99 1HG1 ILE 99 0.414 8.026 1.497 689 HG13 ILE 99 2HG1 ILE 99 -1.220 8.122 2.144 690 HG21 ILE 99 1HG2 ILE 99 1.611 9.715 0.865 691 HG22 ILE 99 2HG2 ILE 99 0.637 10.800 -0.125 692 HG23 ILE 99 3HG2 ILE 99 1.276 11.354 1.422 693 HD11 ILE 99 3HD1 ILE 99 -2.175 7.997 0.109 694 HD12 ILE 99 1HD1 ILE 99 -0.885 8.907 -0.677 695 HD13 ILE 99 2HD1 ILE 99 -0.654 7.201 -0.295 696 H VAL 100 H VAL 100 -2.704 11.149 2.661 697 HA VAL 100 HA VAL 100 -4.041 10.321 4.948 698 HB VAL 100 HB VAL 100 -5.048 10.779 2.146 699 HG11 VAL 100 1HG1 VAL 100 -6.656 9.300 2.983 700 HG12 VAL 100 2HG1 VAL 100 -6.561 9.976 4.611 701 HG13 VAL 100 3HG1 VAL 100 -7.324 10.898 3.314 702 HG21 VAL 100 3HG2 VAL 100 -4.283 12.776 3.207 703 HG22 VAL 100 1HG2 VAL 100 -6.046 12.797 3.245 704 HG23 VAL 100 2HG2 VAL 100 -5.137 12.380 4.698 705 H GLY 101 H GLY 101 -5.199 8.509 5.526 706 HA2 GLY 101 1HA GLY 101 -5.985 6.335 5.425 707 HA3 GLY 101 2HA GLY 101 -5.557 6.299 3.721 708 H SER 102 H SER 102 -2.882 6.746 3.729 709 HA SER 102 HA SER 102 -1.805 4.246 4.284 710 HB2 SER 102 1HB SER 102 -0.807 5.893 2.717 711 HB3 SER 102 2HB SER 102 -0.295 6.865 4.096 712 HG SER 102 HG SER 102 0.668 4.397 3.192 713 HA PRO 103 HA PRO 103 0.035 3.169 4.830 714 HB2 PRO 103 1HB PRO 103 -0.011 0.991 6.449 715 HB3 PRO 103 2HB PRO 103 1.334 2.136 6.419 716 HG2 PRO 103 1HG PRO 103 -0.947 1.944 8.347 717 HG3 PRO 103 2HG PRO 103 0.773 2.230 8.673 718 HD2 PRO 103 1HD PRO 103 -1.055 4.227 8.636 719 HD3 PRO 103 2HD PRO 103 0.632 4.467 8.136 720 H PHE 104 H PHE 104 -0.971 1.361 3.795 721 HA PHE 104 HA PHE 104 -3.867 1.246 4.283 722 HB2 PHE 104 1HB PHE 104 -2.356 0.455 1.785 723 HB3 PHE 104 2HB PHE 104 -4.104 0.562 1.966 724 HD1 PHE 104 2HD PHE 104 -5.177 2.779 2.252 725 HD2 PHE 104 1HD PHE 104 -1.044 2.365 1.324 726 HE1 PHE 104 2HE PHE 104 -5.109 5.128 1.526 727 HE2 PHE 104 1HE PHE 104 -0.969 4.715 0.597 728 HZ PHE 104 HZ PHE 104 -3.003 6.099 0.696 729 H LYS 105 H LYS 105 -4.582 -0.495 5.298 730 HA LYS 105 HA LYS 105 -2.996 -2.956 5.228 731 HB2 LYS 105 1HB LYS 105 -5.214 -2.001 7.035 732 HB3 LYS 105 2HB LYS 105 -4.600 -3.648 7.079 733 HG2 LYS 105 1HG LYS 105 -2.455 -2.926 7.780 734 HG3 LYS 105 2HG LYS 105 -2.847 -1.236 7.454 735 HD2 LYS 105 1HD LYS 105 -3.131 -1.303 9.731 736 HD3 LYS 105 2HD LYS 105 -4.768 -1.681 9.191 737 HE2 LYS 105 1HE LYS 105 -4.250 -3.242 10.892 738 HE3 LYS 105 2HE LYS 105 -4.133 -4.116 9.365 739 HZ1 LYS 105 3HZ LYS 105 -1.629 -3.311 9.625 740 HZ2 LYS 105 1HZ LYS 105 -2.190 -4.769 10.275 741 HZ3 LYS 105 2HZ LYS 105 -2.043 -3.404 11.262 742 H ALA 106 H ALA 106 -3.531 -4.445 3.784 743 HA ALA 106 HA ALA 106 -6.335 -4.624 2.904 744 HB1 ALA 106 3HB ALA 106 -4.036 -5.835 1.414 745 HB2 ALA 106 1HB ALA 106 -5.623 -5.350 0.814 746 HB3 ALA 106 2HB ALA 106 -4.429 -4.124 1.243 747 H LYS 107 H LYS 107 -7.189 -6.763 2.460 748 HA LYS 107 HA LYS 107 -5.944 -8.854 4.123 749 HB2 LYS 107 1HB LYS 107 -7.938 -8.021 5.226 750 HB3 LYS 107 2HB LYS 107 -8.880 -8.237 3.757 751 HG2 LYS 107 1HG LYS 107 -8.710 -10.613 3.912 752 HG3 LYS 107 2HG LYS 107 -7.558 -10.494 5.244 753 HD2 LYS 107 1HD LYS 107 -10.240 -9.224 5.536 754 HD3 LYS 107 2HD LYS 107 -10.103 -10.976 5.696 755 HE2 LYS 107 1HE LYS 107 -8.108 -10.335 7.290 756 HE3 LYS 107 2HE LYS 107 -8.985 -8.810 7.411 757 HZ1 LYS 107 3HZ LYS 107 -10.988 -10.236 7.953 758 HZ2 LYS 107 1HZ LYS 107 -9.792 -10.129 9.145 759 HZ3 LYS 107 2HZ LYS 107 -9.904 -11.514 8.180 760 H VAL 108 H VAL 108 -5.358 -10.595 3.021 761 HA VAL 108 HA VAL 108 -6.403 -11.011 0.330 762 HB VAL 108 HB VAL 108 -4.296 -12.716 1.621 763 HG11 VAL 108 1HG1 VAL 108 -4.296 -11.822 -1.219 764 HG12 VAL 108 2HG1 VAL 108 -3.731 -13.336 -0.511 765 HG13 VAL 108 3HG1 VAL 108 -5.459 -13.049 -0.717 766 HG21 VAL 108 3HG2 VAL 108 -2.598 -11.149 0.751 767 HG22 VAL 108 1HG2 VAL 108 -3.885 -10.014 0.345 768 HG23 VAL 108 2HG2 VAL 108 -3.583 -10.439 2.030 769 H THR 109 H THR 109 -7.595 -12.743 -0.301 770 HA THR 109 HA THR 109 -8.139 -14.864 1.647 771 HB THR 109 HB THR 109 -10.571 -14.777 1.050 772 HG1 THR 109 1HG THR 109 -11.260 -12.682 0.201 773 HG21 THR 109 3HG2 THR 109 -9.129 -12.730 2.629 774 HG22 THR 109 1HG2 THR 109 -10.348 -13.899 3.134 775 HG23 THR 109 2HG2 THR 109 -10.834 -12.421 2.304 776 H GLY 110 H GLY 110 -9.235 -16.750 0.659 777 HA2 GLY 110 1HA GLY 110 -9.939 -17.725 -1.534 778 HA3 GLY 110 2HA GLY 110 -8.468 -17.016 -2.183 779 H GLN 111 H GLN 111 -8.804 -19.622 -2.626 780 HA GLN 111 HA GLN 111 -7.701 -21.272 -0.563 781 HB2 GLN 111 1HB GLN 111 -7.781 -23.052 -2.171 782 HB3 GLN 111 2HB GLN 111 -9.249 -22.099 -2.340 783 HG2 GLN 111 1HG GLN 111 -8.054 -20.881 -4.223 784 HG3 GLN 111 2HG GLN 111 -6.859 -22.175 -4.148 785 HE21 GLN 111 1HE2 GLN 111 -7.191 -23.800 -5.472 786 HE22 GLN 111 2HE2 GLN 111 -8.713 -24.294 -6.124 787 H ARG 112 H ARG 112 -5.637 -21.445 -0.023 788 HA ARG 112 HA ARG 112 -3.536 -20.036 -1.008 789 HB2 ARG 112 1HB ARG 112 -3.648 -21.580 1.044 790 HB3 ARG 112 2HB ARG 112 -3.152 -22.864 -0.051 791 HG2 ARG 112 1HG ARG 112 -1.062 -21.900 -0.428 792 HG3 ARG 112 2HG ARG 112 -1.577 -20.328 0.186 793 HD2 ARG 112 1HD ARG 112 -1.795 -21.320 2.438 794 HD3 ARG 112 2HD ARG 112 -1.186 -22.846 1.799 795 HE ARG 112 HE ARG 112 0.588 -20.668 1.282 796 HH11 ARG 112 1HH1 ARG 112 -0.427 -22.959 3.699 797 HH12 ARG 112 2HH1 ARG 112 1.079 -22.922 4.554 798 HH21 ARG 112 1HH2 ARG 112 2.576 -20.611 2.398 799 HH22 ARG 112 2HH2 ARG 112 2.787 -21.586 3.814 800 H LEU 113 H LEU 113 -1.904 -20.322 -2.514 801 HA LEU 113 HA LEU 113 -2.562 -22.169 -4.692 802 HB2 LEU 113 1HB LEU 113 -0.732 -19.776 -4.615 803 HB3 LEU 113 2HB LEU 113 -1.016 -20.783 -6.032 804 HG LEU 113 HG LEU 113 -3.102 -19.108 -4.636 805 HD11 LEU 113 1HD1 LEU 113 -2.289 -18.505 -7.395 806 HD12 LEU 113 2HD1 LEU 113 -1.086 -18.149 -6.156 807 HD13 LEU 113 3HD1 LEU 113 -2.690 -17.421 -6.062 808 HD21 LEU 113 3HD2 LEU 113 -4.013 -19.700 -7.146 809 HD22 LEU 113 1HD2 LEU 113 -4.498 -20.522 -5.663 810 HD23 LEU 113 2HD2 LEU 113 -3.220 -21.202 -6.670 811 H VAL 114 H VAL 114 -1.585 -24.080 -4.497 812 HA VAL 114 HA VAL 114 1.287 -24.103 -3.832 813 HB VAL 114 HB VAL 114 0.965 -26.344 -2.840 814 HG11 VAL 114 1HG1 VAL 114 1.011 -25.018 -1.038 815 HG12 VAL 114 2HG1 VAL 114 -0.088 -23.842 -1.761 816 HG13 VAL 114 3HG1 VAL 114 -0.732 -25.282 -0.970 817 HG21 VAL 114 3HG2 VAL 114 -0.979 -27.154 -3.912 818 HG22 VAL 114 1HG2 VAL 114 -1.414 -26.950 -2.215 819 HG23 VAL 114 2HG2 VAL 114 -1.931 -25.758 -3.408 820 H SER 115 H SER 115 2.590 -25.583 -4.936 821 HA SER 115 HA SER 115 1.339 -26.840 -7.290 822 HB2 SER 115 1HB SER 115 2.683 -24.849 -7.902 823 HB3 SER 115 2HB SER 115 4.096 -25.594 -7.153 824 HG SER 115 HG SER 115 3.377 -25.867 -9.610 825 HA PRO 116 HA PRO 116 3.276 -30.239 -4.917 826 HB2 PRO 116 1HB PRO 116 1.497 -32.110 -5.756 827 HB3 PRO 116 2HB PRO 116 1.182 -31.026 -4.395 828 HG2 PRO 116 1HG PRO 116 0.254 -30.821 -7.234 829 HG3 PRO 116 2HG PRO 116 -0.653 -30.536 -5.738 830 HD2 PRO 116 1HD PRO 116 0.364 -28.519 -7.232 831 HD3 PRO 116 2HD PRO 116 0.217 -28.419 -5.466 832 H GLY 117 H GLY 117 2.239 -30.065 -8.285 833 HA2 GLY 117 1HA GLY 117 4.327 -30.540 -9.736 834 HA3 GLY 117 2HA GLY 117 4.210 -32.129 -8.995 835 H SER 118 H SER 118 4.144 -31.937 -11.703 836 HA SER 118 HA SER 118 1.418 -32.821 -12.274 837 HB2 SER 118 1HB SER 118 1.412 -31.556 -14.420 838 HB3 SER 118 2HB SER 118 1.413 -30.505 -13.004 839 HG SER 118 HG SER 118 3.803 -31.250 -14.314 840 H ALA 119 H ALA 119 1.436 -34.701 -13.310 841 HA ALA 119 HA ALA 119 3.902 -35.497 -14.713 842 HB1 ALA 119 3HB ALA 119 3.619 -37.681 -14.010 843 HB2 ALA 119 1HB ALA 119 3.060 -36.765 -12.610 844 HB3 ALA 119 2HB ALA 119 1.891 -37.476 -13.724 845 H ASN 120 H ASN 120 3.546 -35.032 -16.813 846 HA ASN 120 HA ASN 120 1.221 -36.305 -18.083 847 HB2 ASN 120 1HB ASN 120 2.179 -33.471 -18.416 848 HB3 ASN 120 2HB ASN 120 1.260 -34.278 -19.683 849 HD21 ASN 120 1HD2 ASN 120 -0.868 -35.041 -19.163 850 HD22 ASN 120 2HD2 ASN 120 -1.791 -34.246 -17.938 851 H GLU 121 H GLU 121 2.572 -38.002 -18.753 852 HA GLU 121 HA GLU 121 4.862 -37.380 -20.435 853 HB2 GLU 121 1HB GLU 121 4.907 -39.976 -20.577 854 HB3 GLU 121 2HB GLU 121 5.362 -39.189 -19.072 855 HG2 GLU 121 1HG GLU 121 3.239 -39.674 -18.094 856 HG3 GLU 121 2HG GLU 121 2.611 -40.266 -19.631 857 H THR 122 H THR 122 5.079 -38.100 -22.593 858 HA THR 122 HA THR 122 2.613 -38.910 -23.956 859 HB THR 122 HB THR 122 2.960 -37.287 -25.748 860 HG1 THR 122 1HG THR 122 5.220 -36.627 -24.190 861 HG21 THR 122 3HG2 THR 122 3.005 -35.290 -23.702 862 HG22 THR 122 1HG2 THR 122 2.110 -36.692 -23.118 863 HG23 THR 122 2HG2 THR 122 1.629 -35.903 -24.620 864 H SER 123 H SER 123 2.949 -39.876 -26.036 865 HA SER 123 HA SER 123 5.678 -40.939 -26.370 866 HB2 SER 123 1HB SER 123 4.537 -42.897 -27.484 867 HB3 SER 123 2HB SER 123 4.205 -42.732 -25.760 868 HG SER 123 HG SER 123 2.502 -42.578 -27.891 869 H SER 124 H SER 124 2.735 -40.017 -28.134 870 HA SER 124 HA SER 124 3.641 -40.234 -30.727 871 HB2 SER 124 1HB SER 124 1.311 -39.545 -29.836 872 HB3 SER 124 2HB SER 124 1.944 -37.899 -29.870 873 HG SER 124 HG SER 124 2.254 -39.496 -32.146 874 H ILE 125 H ILE 125 5.431 -39.455 -31.606 875 HA ILE 125 HA ILE 125 7.172 -37.607 -30.648 876 HB ILE 125 HB ILE 125 6.516 -38.006 -33.570 877 HG12 ILE 125 1HG1 ILE 125 7.068 -40.105 -32.422 878 HG13 ILE 125 2HG1 ILE 125 8.349 -39.639 -33.536 879 HG21 ILE 125 1HG2 ILE 125 8.878 -37.288 -33.911 880 HG22 ILE 125 2HG2 ILE 125 7.818 -36.016 -33.307 881 HG23 ILE 125 3HG2 ILE 125 8.932 -36.830 -32.209 882 HD11 ILE 125 3HD1 ILE 125 8.356 -39.341 -30.544 883 HD12 ILE 125 1HD1 ILE 125 9.323 -40.456 -31.510 884 HD13 ILE 125 2HD1 ILE 125 9.610 -38.719 -31.616 Start of MODEL 13 1 H1 GLY 1 H GLY 1 16.663 53.858 -27.836 2 HA2 GLY 1 1HA GLY 1 17.290 52.673 -25.231 3 HA3 GLY 1 2HA GLY 1 16.313 54.134 -25.251 4 H SER 2 H SER 2 14.587 52.993 -24.277 5 HA SER 2 HA SER 2 12.783 51.830 -26.163 6 HB2 SER 2 1HB SER 2 14.185 50.071 -24.171 7 HB3 SER 2 2HB SER 2 12.543 49.693 -24.692 8 HG SER 2 HG SER 2 13.591 50.030 -26.911 9 H SER 3 H SER 3 10.663 51.495 -25.284 10 HA SER 3 HA SER 3 10.261 52.846 -22.694 11 HB2 SER 3 1HB SER 3 8.386 52.877 -25.071 12 HB3 SER 3 2HB SER 3 8.172 53.750 -23.554 13 HG SER 3 HG SER 3 10.425 54.597 -24.247 14 H GLY 4 H GLY 4 7.858 52.351 -21.937 15 HA2 GLY 4 1HA GLY 4 6.841 49.752 -22.532 16 HA3 GLY 4 2HA GLY 4 7.771 49.744 -21.041 17 H SER 5 H SER 5 5.154 49.056 -20.933 18 HA SER 5 HA SER 5 4.102 51.066 -19.162 19 HB2 SER 5 1HB SER 5 3.371 51.614 -21.619 20 HB3 SER 5 2HB SER 5 2.239 50.283 -21.380 21 HG SER 5 HG SER 5 1.112 51.947 -20.628 22 H SER 6 H SER 6 1.987 50.327 -18.192 23 HA SER 6 HA SER 6 2.047 47.398 -17.907 24 HB2 SER 6 1HB SER 6 1.456 49.623 -15.990 25 HB3 SER 6 2HB SER 6 0.728 48.039 -15.723 26 HG SER 6 HG SER 6 2.819 48.399 -14.698 27 H GLY 7 H GLY 7 0.419 46.325 -18.794 28 HA2 GLY 7 1HA GLY 7 -2.181 47.708 -19.056 29 HA3 GLY 7 2HA GLY 7 -1.549 46.620 -20.283 30 H PHE 8 H PHE 8 -1.409 44.359 -19.797 31 HA PHE 8 HA PHE 8 -3.062 43.504 -17.521 32 HB2 PHE 8 1HB PHE 8 -4.185 43.524 -19.896 33 HB3 PHE 8 2HB PHE 8 -3.249 42.052 -20.133 34 HD1 PHE 8 1HD PHE 8 -5.500 43.583 -17.581 35 HD2 PHE 8 2HD PHE 8 -4.264 40.061 -19.627 36 HE1 PHE 8 1HE PHE 8 -7.240 42.296 -16.410 37 HE2 PHE 8 2HE PHE 8 -6.002 38.769 -18.459 38 HZ PHE 8 HZ PHE 8 -7.493 39.886 -16.849 39 H LYS 9 H LYS 9 -0.286 43.540 -17.524 40 HA LYS 9 HA LYS 9 0.508 40.755 -17.992 41 HB2 LYS 9 1HB LYS 9 2.064 43.298 -17.584 42 HB3 LYS 9 2HB LYS 9 2.830 41.722 -17.432 43 HG2 LYS 9 1HG LYS 9 3.281 42.259 -19.618 44 HG3 LYS 9 2HG LYS 9 1.812 41.294 -19.784 45 HD2 LYS 9 1HD LYS 9 1.403 43.145 -21.140 46 HD3 LYS 9 2HD LYS 9 0.573 43.549 -19.635 47 HE2 LYS 9 1HE LYS 9 2.145 45.132 -19.041 48 HE3 LYS 9 2HE LYS 9 3.408 44.400 -20.030 49 HZ1 LYS 9 3HZ LYS 9 2.816 45.608 -21.792 50 HZ2 LYS 9 1HZ LYS 9 1.952 46.577 -20.707 51 HZ3 LYS 9 2HZ LYS 9 1.162 45.346 -21.554 52 H VAL 10 H VAL 10 1.342 39.464 -16.365 53 HA VAL 10 HA VAL 10 0.842 40.431 -13.627 54 HB VAL 10 HB VAL 10 -0.614 38.576 -14.247 55 HG11 VAL 10 1HG1 VAL 10 1.888 36.941 -14.635 56 HG12 VAL 10 2HG1 VAL 10 0.220 36.411 -14.856 57 HG13 VAL 10 3HG1 VAL 10 0.920 37.604 -15.950 58 HG21 VAL 10 3HG2 VAL 10 0.201 38.770 -11.926 59 HG22 VAL 10 1HG2 VAL 10 -0.137 37.101 -12.386 60 HG23 VAL 10 2HG2 VAL 10 1.529 37.678 -12.320 61 H ARG 11 H ARG 11 2.436 40.365 -12.146 62 HA ARG 11 HA ARG 11 5.117 39.908 -13.034 63 HB2 ARG 11 1HB ARG 11 3.816 40.867 -10.536 64 HB3 ARG 11 2HB ARG 11 5.449 40.228 -10.403 65 HG2 ARG 11 1HG ARG 11 4.707 42.365 -12.378 66 HG3 ARG 11 2HG ARG 11 5.231 42.722 -10.731 67 HD2 ARG 11 1HD ARG 11 6.837 41.026 -12.627 68 HD3 ARG 11 2HD ARG 11 7.022 42.777 -12.522 69 HE ARG 11 HE ARG 11 7.246 41.518 -9.972 70 HH11 ARG 11 1HH1 ARG 11 8.971 42.229 -12.911 71 HH12 ARG 11 2HH1 ARG 11 10.531 42.188 -12.159 72 HH21 ARG 11 1HH2 ARG 11 9.294 41.461 -8.970 73 HH22 ARG 11 2HH2 ARG 11 10.714 41.750 -9.917 74 H VAL 12 H VAL 12 6.312 38.122 -12.875 75 HA VAL 12 HA VAL 12 5.531 36.039 -10.961 76 HB VAL 12 HB VAL 12 5.896 34.284 -12.635 77 HG11 VAL 12 1HG1 VAL 12 3.723 34.327 -13.122 78 HG12 VAL 12 2HG1 VAL 12 3.677 35.929 -12.382 79 HG13 VAL 12 3HG1 VAL 12 3.905 35.766 -14.124 80 HG21 VAL 12 3HG2 VAL 12 6.016 36.502 -14.673 81 HG22 VAL 12 1HG2 VAL 12 7.424 35.624 -14.075 82 HG23 VAL 12 2HG2 VAL 12 6.165 34.770 -14.969 83 H GLY 13 H GLY 13 7.205 34.962 -10.025 84 HA2 GLY 13 1HA GLY 13 9.906 35.398 -11.107 85 HA3 GLY 13 2HA GLY 13 9.574 35.812 -9.432 86 H GLU 14 H GLU 14 11.055 34.328 -8.617 87 HA GLU 14 HA GLU 14 11.318 31.660 -9.326 88 HB2 GLU 14 1HB GLU 14 12.466 31.339 -7.272 89 HB3 GLU 14 2HB GLU 14 12.804 32.989 -7.775 90 HG2 GLU 14 1HG GLU 14 10.625 32.312 -5.827 91 HG3 GLU 14 2HG GLU 14 12.287 32.623 -5.329 92 HA PRO 15 HA PRO 15 7.707 29.604 -7.907 93 HB2 PRO 15 1HB PRO 15 8.730 27.164 -7.301 94 HB3 PRO 15 2HB PRO 15 8.519 27.731 -8.961 95 HG2 PRO 15 1HG PRO 15 10.991 27.692 -7.273 96 HG3 PRO 15 2HG PRO 15 10.796 27.257 -8.981 97 HD2 PRO 15 1HD PRO 15 11.795 29.647 -8.191 98 HD3 PRO 15 2HD PRO 15 10.841 29.455 -9.676 99 H GLY 16 H GLY 16 6.593 29.116 -6.044 100 HA2 GLY 16 1HA GLY 16 7.879 29.865 -3.563 101 HA3 GLY 16 2HA GLY 16 6.178 29.488 -3.787 102 H GLN 17 H GLN 17 5.651 27.880 -2.468 103 HA GLN 17 HA GLN 17 7.547 25.652 -2.148 104 HB2 GLN 17 1HB GLN 17 5.356 26.657 -0.329 105 HB3 GLN 17 2HB GLN 17 6.226 25.152 -0.063 106 HG2 GLN 17 1HG GLN 17 7.729 27.712 -0.371 107 HG3 GLN 17 2HG GLN 17 6.964 27.309 1.165 108 HE21 GLN 17 1HE2 GLN 17 7.851 25.768 2.450 109 HE22 GLN 17 2HE2 GLN 17 9.343 24.969 2.105 110 H ALA 18 H ALA 18 6.807 23.519 -2.268 111 HA ALA 18 HA ALA 18 4.053 22.968 -2.944 112 HB1 ALA 18 3HB ALA 18 6.239 22.775 -4.991 113 HB2 ALA 18 1HB ALA 18 4.781 21.787 -5.093 114 HB3 ALA 18 2HB ALA 18 4.659 23.546 -5.128 115 H GLY 19 H GLY 19 3.787 20.559 -3.450 116 HA2 GLY 19 1HA GLY 19 4.486 18.321 -3.141 117 HA3 GLY 19 2HA GLY 19 5.866 18.904 -2.223 118 H ASN 20 H ASN 20 2.387 18.352 -2.112 119 HA ASN 20 HA ASN 20 2.567 18.295 0.830 120 HB2 ASN 20 1HB ASN 20 1.059 20.050 -0.347 121 HB3 ASN 20 2HB ASN 20 -0.013 18.689 -0.662 122 HD21 ASN 20 1HD2 ASN 20 -1.664 18.983 0.672 123 HD22 ASN 20 2HD2 ASN 20 -1.545 19.209 2.380 124 HA PRO 21 HA PRO 21 1.705 13.967 0.415 125 HB2 PRO 21 1HB PRO 21 1.315 13.464 3.054 126 HB3 PRO 21 2HB PRO 21 2.917 13.707 2.349 127 HG2 PRO 21 1HG PRO 21 1.192 15.643 3.845 128 HG3 PRO 21 2HG PRO 21 2.938 15.361 3.984 129 HD2 PRO 21 1HD PRO 21 1.903 17.437 2.586 130 HD3 PRO 21 2HD PRO 21 3.417 16.635 2.123 131 H ALA 22 H ALA 22 -0.324 15.797 2.715 132 HA ALA 22 HA ALA 22 -2.515 14.251 2.945 133 HB1 ALA 22 3HB ALA 22 -2.179 16.549 3.903 134 HB2 ALA 22 1HB ALA 22 -2.747 17.195 2.363 135 HB3 ALA 22 2HB ALA 22 -3.816 16.197 3.349 136 H LEU 23 H LEU 23 -1.920 16.450 0.210 137 HA LEU 23 HA LEU 23 -4.257 15.921 -1.216 138 HB2 LEU 23 1HB LEU 23 -1.524 16.852 -1.984 139 HB3 LEU 23 2HB LEU 23 -2.711 16.493 -3.237 140 HG LEU 23 HG LEU 23 -3.316 18.423 -1.018 141 HD11 LEU 23 1HD1 LEU 23 -1.427 19.455 -1.861 142 HD12 LEU 23 2HD1 LEU 23 -2.712 20.153 -2.847 143 HD13 LEU 23 3HD1 LEU 23 -1.704 18.860 -3.498 144 HD21 LEU 23 3HD2 LEU 23 -4.366 18.853 -3.708 145 HD22 LEU 23 1HD2 LEU 23 -5.197 18.842 -2.152 146 HD23 LEU 23 2HD2 LEU 23 -4.869 17.323 -2.987 147 H VAL 24 H VAL 24 -1.041 14.427 -1.572 148 HA VAL 24 HA VAL 24 -1.457 12.671 -3.599 149 HB VAL 24 HB VAL 24 -0.044 11.947 -1.029 150 HG11 VAL 24 1HG1 VAL 24 1.376 10.760 -2.964 151 HG12 VAL 24 2HG1 VAL 24 0.034 9.971 -2.133 152 HG13 VAL 24 3HG1 VAL 24 -0.220 10.718 -3.711 153 HG21 VAL 24 3HG2 VAL 24 0.888 14.001 -1.726 154 HG22 VAL 24 1HG2 VAL 24 1.988 12.755 -2.315 155 HG23 VAL 24 2HG2 VAL 24 0.856 13.528 -3.424 156 H SER 25 H SER 25 -2.527 10.801 -3.962 157 HA SER 25 HA SER 25 -3.871 9.477 -1.720 158 HB2 SER 25 1HB SER 25 -5.433 11.119 -2.869 159 HB3 SER 25 2HB SER 25 -5.322 10.092 -4.298 160 HG SER 25 HG SER 25 -5.966 8.908 -1.846 161 H ALA 26 H ALA 26 -4.909 7.369 -2.502 162 HA ALA 26 HA ALA 26 -3.487 6.162 -4.751 163 HB1 ALA 26 3HB ALA 26 -2.213 4.755 -3.572 164 HB2 ALA 26 1HB ALA 26 -2.507 5.837 -2.211 165 HB3 ALA 26 2HB ALA 26 -3.506 4.400 -2.427 166 H TYR 27 H TYR 27 -4.612 4.560 -5.767 167 HA TYR 27 HA TYR 27 -6.868 3.269 -4.529 168 HB2 TYR 27 1HB TYR 27 -8.529 4.075 -6.165 169 HB3 TYR 27 2HB TYR 27 -7.907 5.382 -5.164 170 HD1 TYR 27 1HD TYR 27 -6.033 6.834 -6.157 171 HD2 TYR 27 2HD TYR 27 -8.468 4.243 -8.493 172 HE1 TYR 27 1HE TYR 27 -5.434 8.102 -8.177 173 HE2 TYR 27 2HE TYR 27 -7.875 5.503 -10.520 174 HH TYR 27 HH TYR 27 -6.219 6.985 -11.348 175 H GLY 28 H GLY 28 -7.831 1.625 -5.912 176 HA2 GLY 28 1HA GLY 28 -7.216 0.918 -8.460 177 HA3 GLY 28 2HA GLY 28 -5.821 0.360 -7.549 178 H THR 29 H THR 29 -6.358 -1.792 -8.181 179 HA THR 29 HA THR 29 -8.762 -2.897 -6.898 180 HB THR 29 HB THR 29 -7.012 -4.309 -8.911 181 HG1 THR 29 1HG THR 29 -8.011 -3.251 -10.454 182 HG21 THR 29 3HG2 THR 29 -8.658 -5.911 -9.026 183 HG22 THR 29 1HG2 THR 29 -9.927 -4.800 -8.513 184 HG23 THR 29 2HG2 THR 29 -8.788 -5.445 -7.330 185 H GLY 30 H GLY 30 -5.319 -2.863 -6.779 186 HA2 GLY 30 1HA GLY 30 -5.110 -5.324 -5.258 187 HA3 GLY 30 2HA GLY 30 -3.796 -4.229 -5.661 188 H LEU 31 H LEU 31 -5.268 -1.891 -4.623 189 HA LEU 31 HA LEU 31 -4.382 -2.096 -1.903 190 HB2 LEU 31 1HB LEU 31 -5.627 0.066 -3.560 191 HB3 LEU 31 2HB LEU 31 -5.446 0.259 -1.817 192 HG LEU 31 HG LEU 31 -3.145 -0.289 -3.686 193 HD11 LEU 31 1HD1 LEU 31 -4.294 1.861 -4.189 194 HD12 LEU 31 2HD1 LEU 31 -2.634 2.047 -3.623 195 HD13 LEU 31 3HD1 LEU 31 -3.979 2.364 -2.528 196 HD21 LEU 31 3HD2 LEU 31 -3.305 0.616 -0.814 197 HD22 LEU 31 1HD2 LEU 31 -1.825 0.561 -1.771 198 HD23 LEU 31 2HD2 LEU 31 -2.696 -0.930 -1.408 199 H GLU 32 H GLU 32 -7.456 -2.173 -3.571 200 HA GLU 32 HA GLU 32 -9.113 -1.795 -1.307 201 HB2 GLU 32 1HB GLU 32 -10.893 -2.792 -2.740 202 HB3 GLU 32 2HB GLU 32 -10.027 -1.467 -3.506 203 HG2 GLU 32 1HG GLU 32 -8.659 -3.111 -4.732 204 HG3 GLU 32 2HG GLU 32 -9.618 -4.405 -4.015 205 H GLY 33 H GLY 33 -7.987 -4.723 -2.983 206 HA2 GLY 33 1HA GLY 33 -8.220 -6.205 -0.487 207 HA3 GLY 33 2HA GLY 33 -9.239 -6.759 -1.808 208 H GLY 34 H GLY 34 -7.539 -8.562 -0.843 209 HA2 GLY 34 1HA GLY 34 -5.183 -8.516 -2.611 210 HA3 GLY 34 2HA GLY 34 -5.345 -9.499 -1.164 211 H THR 35 H THR 35 -5.655 -9.409 -4.527 212 HA THR 35 HA THR 35 -7.386 -11.759 -4.639 213 HB THR 35 HB THR 35 -6.809 -11.384 -7.213 214 HG1 THR 35 1HG THR 35 -5.348 -9.644 -6.743 215 HG21 THR 35 3HG2 THR 35 -8.911 -10.516 -7.409 216 HG22 THR 35 1HG2 THR 35 -8.669 -9.348 -6.111 217 HG23 THR 35 2HG2 THR 35 -8.993 -11.039 -5.727 218 H THR 36 H THR 36 -6.363 -13.616 -4.226 219 HA THR 36 HA THR 36 -3.588 -14.022 -4.851 220 HB THR 36 HB THR 36 -5.363 -16.318 -4.160 221 HG1 THR 36 1HG THR 36 -5.008 -14.017 -2.623 222 HG21 THR 36 3HG2 THR 36 -2.578 -15.727 -4.161 223 HG22 THR 36 1HG2 THR 36 -3.379 -17.243 -3.752 224 HG23 THR 36 2HG2 THR 36 -3.076 -16.040 -2.499 225 H GLY 37 H GLY 37 -2.783 -14.709 -6.721 226 HA2 GLY 37 1HA GLY 37 -2.685 -16.309 -8.498 227 HA3 GLY 37 2HA GLY 37 -4.436 -16.446 -8.424 228 H ILE 38 H ILE 38 -4.493 -13.393 -8.217 229 HA ILE 38 HA ILE 38 -4.216 -12.913 -11.109 230 HB ILE 38 HB ILE 38 -5.988 -11.401 -9.192 231 HG12 ILE 38 1HG1 ILE 38 -6.717 -13.629 -11.106 232 HG13 ILE 38 2HG1 ILE 38 -6.690 -13.756 -9.350 233 HG21 ILE 38 1HG2 ILE 38 -6.977 -10.433 -11.123 234 HG22 ILE 38 2HG2 ILE 38 -5.231 -10.277 -11.306 235 HG23 ILE 38 3HG2 ILE 38 -6.102 -11.525 -12.196 236 HD11 ILE 38 3HD1 ILE 38 -8.553 -12.365 -9.112 237 HD12 ILE 38 1HD1 ILE 38 -8.423 -11.763 -10.765 238 HD13 ILE 38 2HD1 ILE 38 -8.943 -13.422 -10.469 239 H GLN 39 H GLN 39 -3.400 -10.915 -11.833 240 HA GLN 39 HA GLN 39 -1.498 -9.709 -9.985 241 HB2 GLN 39 1HB GLN 39 -0.508 -10.276 -12.051 242 HB3 GLN 39 2HB GLN 39 -1.850 -9.609 -12.972 243 HG2 GLN 39 1HG GLN 39 -1.201 -7.360 -12.328 244 HG3 GLN 39 2HG GLN 39 0.116 -8.007 -11.351 245 HE21 GLN 39 1HE2 GLN 39 1.533 -9.598 -12.679 246 HE22 GLN 39 2HE2 GLN 39 2.039 -9.005 -14.221 247 H SER 40 H SER 40 -2.349 -8.156 -8.746 248 HA SER 40 HA SER 40 -4.402 -6.384 -9.776 249 HB2 SER 40 1HB SER 40 -3.090 -6.634 -7.064 250 HB3 SER 40 2HB SER 40 -4.312 -5.420 -7.443 251 HG SER 40 HG SER 40 -5.810 -6.905 -7.370 252 H GLU 41 H GLU 41 -4.207 -4.028 -9.505 253 HA GLU 41 HA GLU 41 -1.544 -2.910 -9.388 254 HB2 GLU 41 1HB GLU 41 -1.613 -1.880 -11.593 255 HB3 GLU 41 2HB GLU 41 -1.702 -3.630 -11.735 256 HG2 GLU 41 1HG GLU 41 -4.293 -3.154 -11.742 257 HG3 GLU 41 2HG GLU 41 -3.761 -1.571 -12.307 258 H PHE 42 H PHE 42 -1.541 -0.792 -8.787 259 HA PHE 42 HA PHE 42 -4.116 0.623 -8.739 260 HB2 PHE 42 1HB PHE 42 -3.809 1.328 -6.477 261 HB3 PHE 42 2HB PHE 42 -3.578 -0.417 -6.503 262 HD1 PHE 42 1HD PHE 42 -1.661 2.768 -6.665 263 HD2 PHE 42 2HD PHE 42 -1.698 -1.333 -5.526 264 HE1 PHE 42 1HE PHE 42 0.536 3.049 -5.595 265 HE2 PHE 42 2HE PHE 42 0.499 -1.058 -4.454 266 HZ PHE 42 HZ PHE 42 1.619 1.135 -4.486 267 H PHE 43 H PHE 43 -4.023 2.806 -9.081 268 HA PHE 43 HA PHE 43 -1.430 3.835 -9.969 269 HB2 PHE 43 1HB PHE 43 -4.091 5.194 -10.354 270 HB3 PHE 43 2HB PHE 43 -2.611 5.406 -11.283 271 HD1 PHE 43 1HD PHE 43 -1.847 3.565 -12.794 272 HD2 PHE 43 2HD PHE 43 -5.678 3.565 -10.940 273 HE1 PHE 43 1HE PHE 43 -2.634 1.904 -14.430 274 HE2 PHE 43 2HE PHE 43 -6.471 1.904 -12.572 275 HZ PHE 43 HZ PHE 43 -4.949 1.071 -14.320 276 H ILE 44 H ILE 44 -0.863 6.074 -9.463 277 HA ILE 44 HA ILE 44 -1.831 6.867 -6.793 278 HB ILE 44 HB ILE 44 0.937 7.107 -7.966 279 HG12 ILE 44 1HG1 ILE 44 0.028 5.811 -5.393 280 HG13 ILE 44 2HG1 ILE 44 0.197 4.932 -6.908 281 HG21 ILE 44 1HG2 ILE 44 1.567 8.260 -5.897 282 HG22 ILE 44 2HG2 ILE 44 0.380 9.179 -6.822 283 HG23 ILE 44 3HG2 ILE 44 -0.123 8.273 -5.395 284 HD11 ILE 44 3HD1 ILE 44 2.285 4.532 -6.287 285 HD12 ILE 44 1HD1 ILE 44 2.615 6.230 -6.630 286 HD13 ILE 44 2HD1 ILE 44 2.208 5.724 -4.990 287 H ASN 45 H ASN 45 -2.934 8.701 -6.800 288 HA ASN 45 HA ASN 45 -2.887 10.478 -9.057 289 HB2 ASN 45 1HB ASN 45 -4.850 9.861 -7.394 290 HB3 ASN 45 2HB ASN 45 -4.207 11.223 -6.481 291 HD21 ASN 45 1HD2 ASN 45 -5.715 10.216 -9.451 292 HD22 ASN 45 2HD2 ASN 45 -6.214 11.788 -9.963 293 H THR 46 H THR 46 -0.384 10.577 -8.402 294 HA THR 46 HA THR 46 0.096 12.758 -6.519 295 HB THR 46 HB THR 46 1.583 10.830 -6.357 296 HG1 THR 46 1HG THR 46 2.619 13.316 -7.198 297 HG21 THR 46 3HG2 THR 46 3.291 10.624 -8.302 298 HG22 THR 46 1HG2 THR 46 2.036 11.406 -9.263 299 HG23 THR 46 2HG2 THR 46 1.708 9.865 -8.468 300 H THR 47 H THR 47 -1.313 13.519 -8.798 301 HA THR 47 HA THR 47 0.630 14.793 -10.570 302 HB THR 47 HB THR 47 -1.391 15.516 -11.862 303 HG1 THR 47 1HG THR 47 -3.087 15.468 -10.515 304 HG21 THR 47 3HG2 THR 47 -1.367 12.540 -11.389 305 HG22 THR 47 1HG2 THR 47 -0.102 13.381 -12.283 306 HG23 THR 47 2HG2 THR 47 -1.762 13.400 -12.877 307 H ARG 48 H ARG 48 -1.977 15.633 -8.326 308 HA ARG 48 HA ARG 48 -1.712 18.451 -8.703 309 HB2 ARG 48 1HB ARG 48 -3.150 18.601 -6.672 310 HB3 ARG 48 2HB ARG 48 -3.816 17.575 -7.935 311 HG2 ARG 48 1HG ARG 48 -2.532 15.710 -6.527 312 HG3 ARG 48 2HG ARG 48 -2.839 16.875 -5.237 313 HD2 ARG 48 1HD ARG 48 -5.183 16.787 -5.600 314 HD3 ARG 48 2HD ARG 48 -4.982 15.899 -7.110 315 HE ARG 48 HE ARG 48 -3.866 14.284 -5.214 316 HH11 ARG 48 1HH1 ARG 48 -6.976 15.786 -5.650 317 HH12 ARG 48 2HH1 ARG 48 -7.842 14.533 -4.824 318 HH21 ARG 48 1HH2 ARG 48 -4.995 12.629 -4.124 319 HH22 ARG 48 2HH2 ARG 48 -6.714 12.738 -3.956 320 H ALA 49 H ALA 49 -0.304 16.092 -6.536 321 HA ALA 49 HA ALA 49 0.786 17.956 -4.681 322 HB1 ALA 49 3HB ALA 49 2.379 15.798 -4.388 323 HB2 ALA 49 1HB ALA 49 0.779 15.949 -3.661 324 HB3 ALA 49 2HB ALA 49 0.982 15.060 -5.171 325 H GLY 50 H GLY 50 2.238 16.099 -7.361 326 HA2 GLY 50 1HA GLY 50 3.714 17.449 -8.851 327 HA3 GLY 50 2HA GLY 50 4.437 18.074 -7.377 328 HA PRO 51 HA PRO 51 6.758 14.298 -8.987 329 HB2 PRO 51 1HB PRO 51 9.096 15.567 -9.527 330 HB3 PRO 51 2HB PRO 51 7.798 15.399 -10.715 331 HG2 PRO 51 1HG PRO 51 8.488 17.740 -8.981 332 HG3 PRO 51 2HG PRO 51 8.032 17.713 -10.694 333 HD2 PRO 51 1HD PRO 51 6.283 18.361 -8.731 334 HD3 PRO 51 2HD PRO 51 5.783 17.537 -10.222 335 H GLY 52 H GLY 52 8.982 13.577 -8.149 336 HA2 GLY 52 1HA GLY 52 10.595 14.321 -6.272 337 HA3 GLY 52 2HA GLY 52 9.127 14.321 -5.305 338 H THR 53 H THR 53 11.463 12.748 -4.825 339 HA THR 53 HA THR 53 11.086 10.078 -5.727 340 HB THR 53 HB THR 53 12.677 9.477 -3.887 341 HG1 THR 53 1HG THR 53 13.017 12.245 -3.443 342 HG21 THR 53 3HG2 THR 53 13.453 10.138 -6.140 343 HG22 THR 53 1HG2 THR 53 14.597 10.585 -4.875 344 HG23 THR 53 2HG2 THR 53 13.552 11.812 -5.593 345 H LEU 54 H LEU 54 10.255 8.290 -4.638 346 HA LEU 54 HA LEU 54 8.716 8.827 -2.194 347 HB2 LEU 54 1HB LEU 54 6.789 7.743 -3.010 348 HB3 LEU 54 2HB LEU 54 7.276 8.894 -4.253 349 HG LEU 54 HG LEU 54 8.443 6.831 -5.330 350 HD11 LEU 54 1HD1 LEU 54 8.265 5.111 -3.825 351 HD12 LEU 54 2HD1 LEU 54 6.847 4.815 -4.831 352 HD13 LEU 54 3HD1 LEU 54 6.669 5.614 -3.269 353 HD21 LEU 54 3HD2 LEU 54 6.541 6.466 -6.676 354 HD22 LEU 54 1HD2 LEU 54 6.428 8.140 -6.133 355 HD23 LEU 54 2HD2 LEU 54 5.436 6.897 -5.370 356 H SER 55 H SER 55 8.086 6.835 -1.042 357 HA SER 55 HA SER 55 9.887 4.576 -1.596 358 HB2 SER 55 1HB SER 55 10.617 6.191 0.313 359 HB3 SER 55 2HB SER 55 9.314 5.434 1.228 360 HG SER 55 HG SER 55 10.440 3.391 0.424 361 H VAL 56 H VAL 56 8.793 2.750 -1.806 362 HA VAL 56 HA VAL 56 6.240 2.459 -0.359 363 HB VAL 56 HB VAL 56 5.673 2.652 -2.657 364 HG11 VAL 56 1HG1 VAL 56 8.145 1.105 -3.052 365 HG12 VAL 56 2HG1 VAL 56 6.820 0.714 -4.150 366 HG13 VAL 56 3HG1 VAL 56 7.423 2.368 -4.048 367 HG21 VAL 56 3HG2 VAL 56 5.018 0.469 -1.181 368 HG22 VAL 56 1HG2 VAL 56 4.321 0.858 -2.753 369 HG23 VAL 56 2HG2 VAL 56 5.660 -0.285 -2.640 370 H THR 57 H THR 57 6.128 0.800 1.000 371 HA THR 57 HA THR 57 7.952 -1.479 0.601 372 HB THR 57 HB THR 57 7.274 -0.136 3.223 373 HG1 THR 57 1HG THR 57 9.039 0.635 1.693 374 HG21 THR 57 3HG2 THR 57 8.499 -1.835 4.343 375 HG22 THR 57 1HG2 THR 57 9.053 -2.536 2.823 376 HG23 THR 57 2HG2 THR 57 7.356 -2.665 3.288 377 H ILE 58 H ILE 58 6.891 -3.326 0.370 378 HA ILE 58 HA ILE 58 4.167 -3.535 1.463 379 HB ILE 58 HB ILE 58 5.420 -5.169 -0.746 380 HG12 ILE 58 1HG1 ILE 58 3.342 -2.981 -0.944 381 HG13 ILE 58 2HG1 ILE 58 5.047 -2.764 -1.320 382 HG21 ILE 58 1HG2 ILE 58 2.543 -5.144 -0.657 383 HG22 ILE 58 2HG2 ILE 58 3.654 -6.512 -0.635 384 HG23 ILE 58 3HG2 ILE 58 3.212 -5.712 0.873 385 HD11 ILE 58 3HD1 ILE 58 2.914 -4.042 -2.872 386 HD12 ILE 58 1HD1 ILE 58 4.372 -3.207 -3.407 387 HD13 ILE 58 2HD1 ILE 58 4.461 -4.887 -2.877 388 H GLU 59 H GLU 59 3.820 -4.869 3.107 389 HA GLU 59 HA GLU 59 5.801 -6.988 3.630 390 HB2 GLU 59 1HB GLU 59 4.413 -5.074 5.439 391 HB3 GLU 59 2HB GLU 59 4.723 -6.693 6.049 392 HG2 GLU 59 1HG GLU 59 6.734 -4.679 5.089 393 HG3 GLU 59 2HG GLU 59 6.524 -5.303 6.724 394 H GLY 60 H GLY 60 4.974 -8.922 4.701 395 HA2 GLY 60 1HA GLY 60 2.316 -9.562 5.123 396 HA3 GLY 60 2HA GLY 60 2.620 -9.886 3.422 397 HA PRO 61 HA PRO 61 3.839 -13.545 6.136 398 HB2 PRO 61 1HB PRO 61 2.015 -15.297 5.148 399 HB3 PRO 61 2HB PRO 61 1.689 -14.249 6.534 400 HG2 PRO 61 1HG PRO 61 0.903 -13.897 3.667 401 HG3 PRO 61 2HG PRO 61 -0.057 -13.622 5.132 402 HD2 PRO 61 1HD PRO 61 1.120 -11.605 3.762 403 HD3 PRO 61 2HD PRO 61 0.897 -11.561 5.523 404 H SER 62 H SER 62 3.015 -13.148 2.742 405 HA SER 62 HA SER 62 5.223 -14.969 2.056 406 HB2 SER 62 1HB SER 62 2.423 -14.921 1.019 407 HB3 SER 62 2HB SER 62 3.721 -15.331 -0.103 408 HG SER 62 HG SER 62 2.777 -16.721 2.123 409 H LYS 63 H LYS 63 6.763 -13.562 1.452 410 HA LYS 63 HA LYS 63 6.599 -11.050 0.455 411 HB2 LYS 63 1HB LYS 63 8.800 -11.279 -0.346 412 HB3 LYS 63 2HB LYS 63 8.685 -12.434 0.976 413 HG2 LYS 63 1HG LYS 63 8.304 -13.190 -1.908 414 HG3 LYS 63 2HG LYS 63 9.863 -13.249 -1.082 415 HD2 LYS 63 1HD LYS 63 9.038 -14.865 0.488 416 HD3 LYS 63 2HD LYS 63 7.394 -14.700 -0.135 417 HE2 LYS 63 1HE LYS 63 7.976 -15.731 -2.189 418 HE3 LYS 63 2HE LYS 63 9.700 -15.626 -1.834 419 HZ1 LYS 63 3HZ LYS 63 9.406 -17.216 -0.051 420 HZ2 LYS 63 1HZ LYS 63 8.839 -17.867 -1.507 421 HZ3 LYS 63 2HZ LYS 63 7.743 -17.297 -0.351 422 H VAL 64 H VAL 64 6.717 -10.111 -1.661 423 HA VAL 64 HA VAL 64 5.702 -11.802 -3.838 424 HB VAL 64 HB VAL 64 4.183 -9.958 -4.536 425 HG11 VAL 64 1HG1 VAL 64 2.446 -10.423 -2.863 426 HG12 VAL 64 2HG1 VAL 64 3.308 -11.886 -3.343 427 HG13 VAL 64 3HG1 VAL 64 3.669 -11.115 -1.798 428 HG21 VAL 64 3HG2 VAL 64 4.469 -7.954 -3.608 429 HG22 VAL 64 1HG2 VAL 64 3.747 -8.606 -2.137 430 HG23 VAL 64 2HG2 VAL 64 5.499 -8.623 -2.342 431 H LYS 65 H LYS 65 6.253 -11.133 -5.926 432 HA LYS 65 HA LYS 65 8.625 -9.460 -6.043 433 HB2 LYS 65 1HB LYS 65 8.851 -10.283 -8.329 434 HB3 LYS 65 2HB LYS 65 8.607 -11.620 -7.214 435 HG2 LYS 65 1HG LYS 65 6.118 -11.407 -7.866 436 HG3 LYS 65 2HG LYS 65 6.728 -10.492 -9.246 437 HD2 LYS 65 1HD LYS 65 7.995 -13.111 -8.627 438 HD3 LYS 65 2HD LYS 65 6.386 -13.115 -9.354 439 HE2 LYS 65 1HE LYS 65 7.677 -13.118 -11.241 440 HE3 LYS 65 2HE LYS 65 7.497 -11.381 -10.998 441 HZ1 LYS 65 3HZ LYS 65 9.663 -11.688 -9.617 442 HZ2 LYS 65 1HZ LYS 65 9.742 -11.569 -11.303 443 HZ3 LYS 65 2HZ LYS 65 9.848 -13.083 -10.557 444 H MET 66 H MET 66 8.329 -7.335 -6.209 445 HA MET 66 HA MET 66 6.006 -6.285 -7.621 446 HB2 MET 66 1HB MET 66 8.127 -4.981 -5.916 447 HB3 MET 66 2HB MET 66 6.890 -4.069 -6.771 448 HG2 MET 66 1HG MET 66 5.944 -4.262 -4.701 449 HG3 MET 66 2HG MET 66 5.252 -5.661 -5.520 450 HE1 MET 66 3HE MET 66 8.611 -5.182 -2.735 451 HE2 MET 66 1HE MET 66 7.253 -4.103 -3.054 452 HE3 MET 66 2HE MET 66 7.155 -5.279 -1.743 453 H ASP 67 H ASP 67 6.096 -5.038 -9.453 454 HA ASP 67 HA ASP 67 8.731 -4.786 -10.746 455 HB2 ASP 67 1HB ASP 67 6.999 -6.553 -11.648 456 HB3 ASP 67 2HB ASP 67 6.251 -5.138 -12.383 457 H CYS 68 H CYS 68 9.010 -2.642 -10.189 458 HA CYS 68 HA CYS 68 7.207 -0.588 -10.176 459 HB2 CYS 68 1HB CYS 68 9.102 0.928 -10.613 460 HB3 CYS 68 2HB CYS 68 9.517 -0.315 -9.439 461 HG CYS 68 HG CYS 68 11.020 -1.843 -11.198 462 H GLN 69 H GLN 69 6.987 1.242 -11.737 463 HA GLN 69 HA GLN 69 7.470 0.871 -14.500 464 HB2 GLN 69 1HB GLN 69 5.504 -0.763 -13.819 465 HB3 GLN 69 2HB GLN 69 4.543 0.705 -13.939 466 HG2 GLN 69 1HG GLN 69 6.341 -0.230 -16.152 467 HG3 GLN 69 2HG GLN 69 4.666 -0.756 -15.998 468 HE21 GLN 69 1HE2 GLN 69 6.633 1.403 -17.469 469 HE22 GLN 69 2HE2 GLN 69 5.493 2.653 -17.819 470 H GLU 70 H GLU 70 7.784 2.896 -15.120 471 HA GLU 70 HA GLU 70 6.647 5.113 -13.710 472 HB2 GLU 70 1HB GLU 70 8.937 4.907 -14.970 473 HB3 GLU 70 2HB GLU 70 7.992 5.393 -16.371 474 HG2 GLU 70 1HG GLU 70 7.992 6.965 -13.816 475 HG3 GLU 70 2HG GLU 70 9.187 7.222 -15.087 476 H THR 71 H THR 71 4.799 6.132 -14.103 477 HA THR 71 HA THR 71 3.408 5.569 -16.638 478 HB THR 71 HB THR 71 1.351 6.369 -15.309 479 HG1 THR 71 1HG THR 71 1.542 6.227 -13.077 480 HG21 THR 71 3HG2 THR 71 2.323 3.907 -15.829 481 HG22 THR 71 1HG2 THR 71 0.808 4.195 -14.974 482 HG23 THR 71 2HG2 THR 71 2.282 3.857 -14.067 483 HA PRO 72 HA PRO 72 3.534 9.802 -17.797 484 HB2 PRO 72 1HB PRO 72 1.160 10.068 -19.087 485 HB3 PRO 72 2HB PRO 72 2.525 9.171 -19.763 486 HG2 PRO 72 1HG PRO 72 0.101 8.142 -18.341 487 HG3 PRO 72 2HG PRO 72 0.895 7.513 -19.796 488 HD2 PRO 72 1HD PRO 72 1.265 6.419 -17.347 489 HD3 PRO 72 2HD PRO 72 2.534 6.433 -18.588 490 H GLU 73 H GLU 73 1.315 8.644 -15.537 491 HA GLU 73 HA GLU 73 0.212 11.321 -15.031 492 HB2 GLU 73 1HB GLU 73 -0.743 8.554 -14.491 493 HB3 GLU 73 2HB GLU 73 -1.195 9.807 -13.343 494 HG2 GLU 73 1HG GLU 73 -1.840 9.660 -16.270 495 HG3 GLU 73 2HG GLU 73 -2.954 9.644 -14.905 496 H GLY 74 H GLY 74 1.573 8.527 -13.281 497 HA2 GLY 74 1HA GLY 74 3.129 10.274 -11.598 498 HA3 GLY 74 2HA GLY 74 1.793 9.504 -10.754 499 H TYR 75 H TYR 75 1.819 7.262 -10.425 500 HA TYR 75 HA TYR 75 4.080 5.707 -11.336 501 HB2 TYR 75 1HB TYR 75 5.150 6.695 -9.451 502 HB3 TYR 75 2HB TYR 75 3.732 6.462 -8.435 503 HD1 TYR 75 2HD TYR 75 5.611 4.130 -10.670 504 HD2 TYR 75 1HD TYR 75 4.288 5.012 -6.724 505 HE1 TYR 75 2HE TYR 75 6.528 1.986 -9.890 506 HE2 TYR 75 1HE TYR 75 5.203 2.871 -5.932 507 HH TYR 75 HH TYR 75 6.760 1.202 -6.526 508 H LYS 76 H LYS 76 3.453 3.679 -11.679 509 HA LYS 76 HA LYS 76 0.960 2.766 -10.408 510 HB2 LYS 76 1HB LYS 76 0.859 2.943 -12.857 511 HB3 LYS 76 2HB LYS 76 2.239 1.861 -12.995 512 HG2 LYS 76 1HG LYS 76 0.915 0.078 -11.931 513 HG3 LYS 76 2HG LYS 76 -0.473 1.168 -11.883 514 HD2 LYS 76 1HD LYS 76 -0.163 1.394 -14.407 515 HD3 LYS 76 2HD LYS 76 0.907 -0.005 -14.283 516 HE2 LYS 76 1HE LYS 76 -0.840 -1.393 -13.512 517 HE3 LYS 76 2HE LYS 76 -1.897 -0.018 -13.197 518 HZ1 LYS 76 3HZ LYS 76 -2.338 -1.378 -15.277 519 HZ2 LYS 76 1HZ LYS 76 -0.954 -0.652 -15.926 520 HZ3 LYS 76 2HZ LYS 76 -2.271 0.302 -15.463 521 H VAL 77 H VAL 77 0.925 0.922 -9.240 522 HA VAL 77 HA VAL 77 3.409 -0.662 -9.126 523 HB VAL 77 HB VAL 77 1.560 -0.153 -6.795 524 HG11 VAL 77 1HG1 VAL 77 2.991 -1.395 -5.499 525 HG12 VAL 77 2HG1 VAL 77 3.103 -2.261 -7.032 526 HG13 VAL 77 3HG1 VAL 77 4.368 -1.123 -6.566 527 HG21 VAL 77 3HG2 VAL 77 4.256 0.966 -6.666 528 HG22 VAL 77 1HG2 VAL 77 3.238 1.704 -7.903 529 HG23 VAL 77 2HG2 VAL 77 2.708 1.684 -6.221 530 H MET 78 H MET 78 3.219 -2.844 -9.188 531 HA MET 78 HA MET 78 0.526 -4.007 -9.038 532 HB2 MET 78 1HB MET 78 2.503 -4.966 -11.084 533 HB3 MET 78 2HB MET 78 0.763 -5.214 -11.031 534 HG2 MET 78 1HG MET 78 0.308 -3.065 -11.796 535 HG3 MET 78 2HG MET 78 1.920 -2.480 -11.388 536 HE1 MET 78 3HE MET 78 3.354 -1.911 -12.732 537 HE2 MET 78 1HE MET 78 4.009 -2.766 -14.129 538 HE3 MET 78 2HE MET 78 2.708 -1.595 -14.343 539 H TYR 79 H TYR 79 0.396 -5.935 -8.008 540 HA TYR 79 HA TYR 79 2.811 -7.477 -7.494 541 HB2 TYR 79 1HB TYR 79 2.665 -7.425 -5.134 542 HB3 TYR 79 2HB TYR 79 2.513 -5.747 -5.643 543 HD1 TYR 79 1HD TYR 79 0.718 -8.647 -4.271 544 HD2 TYR 79 2HD TYR 79 0.460 -4.532 -5.319 545 HE1 TYR 79 1HE TYR 79 -1.393 -8.467 -3.021 546 HE2 TYR 79 2HE TYR 79 -1.651 -4.340 -4.071 547 HH TYR 79 HH TYR 79 -3.109 -5.370 -2.750 548 H THR 80 H THR 80 2.434 -9.635 -7.119 549 HA THR 80 HA THR 80 -0.382 -10.500 -7.108 550 HB THR 80 HB THR 80 1.829 -11.948 -8.569 551 HG1 THR 80 1HG THR 80 1.445 -10.694 -10.229 552 HG21 THR 80 3HG2 THR 80 -0.896 -12.579 -7.879 553 HG22 THR 80 1HG2 THR 80 0.323 -13.591 -8.653 554 HG23 THR 80 2HG2 THR 80 -0.697 -12.535 -9.631 555 HA PRO 81 HA PRO 81 1.382 -12.454 -3.424 556 HB2 PRO 81 1HB PRO 81 -1.027 -12.932 -2.268 557 HB3 PRO 81 2HB PRO 81 -0.219 -11.362 -2.191 558 HG2 PRO 81 1HG PRO 81 -2.422 -12.272 -4.002 559 HG3 PRO 81 2HG PRO 81 -2.244 -10.730 -3.145 560 HD2 PRO 81 1HD PRO 81 -1.653 -11.013 -5.772 561 HD3 PRO 81 2HD PRO 81 -0.784 -9.882 -4.714 562 H MET 82 H MET 82 1.695 -14.577 -2.952 563 HA MET 82 HA MET 82 0.414 -16.521 -4.719 564 HB2 MET 82 1HB MET 82 2.987 -16.278 -4.237 565 HB3 MET 82 2HB MET 82 2.604 -17.227 -2.807 566 HG2 MET 82 1HG MET 82 1.560 -18.921 -4.332 567 HG3 MET 82 2HG MET 82 2.228 -18.008 -5.683 568 HE1 MET 82 3HE MET 82 2.741 -19.605 -2.444 569 HE2 MET 82 1HE MET 82 3.749 -20.965 -2.941 570 HE3 MET 82 2HE MET 82 4.485 -19.555 -2.179 571 H ALA 83 H ALA 83 0.592 -15.586 -1.377 572 HA ALA 83 HA ALA 83 -1.335 -17.713 -0.727 573 HB1 ALA 83 3HB ALA 83 0.351 -16.876 1.511 574 HB2 ALA 83 1HB ALA 83 -0.141 -18.491 0.999 575 HB3 ALA 83 2HB ALA 83 1.227 -17.696 0.219 576 HA PRO 84 HA PRO 84 -3.879 -14.494 0.850 577 HB2 PRO 84 1HB PRO 84 -5.308 -15.878 2.697 578 HB3 PRO 84 2HB PRO 84 -5.557 -16.060 0.957 579 HG2 PRO 84 1HG PRO 84 -4.000 -17.791 2.839 580 HG3 PRO 84 2HG PRO 84 -5.103 -18.266 1.534 581 HD2 PRO 84 1HD PRO 84 -2.410 -18.299 1.250 582 HD3 PRO 84 2HD PRO 84 -3.509 -17.948 -0.100 583 H GLY 85 H GLY 85 -4.448 -13.330 2.840 584 HA2 GLY 85 1HA GLY 85 -3.780 -13.543 5.375 585 HA3 GLY 85 2HA GLY 85 -2.178 -13.323 4.688 586 H ASN 86 H ASN 86 -2.073 -11.412 6.039 587 HA ASN 86 HA ASN 86 -3.596 -9.144 4.936 588 HB2 ASN 86 1HB ASN 86 -2.188 -8.977 7.570 589 HB3 ASN 86 2HB ASN 86 -3.637 -8.139 7.022 590 HD21 ASN 86 1HD2 ASN 86 -2.364 -10.903 8.586 591 HD22 ASN 86 2HD2 ASN 86 -3.870 -11.657 8.973 592 H TYR 87 H TYR 87 -2.456 -7.887 3.633 593 HA TYR 87 HA TYR 87 0.459 -7.746 3.982 594 HB2 TYR 87 1HB TYR 87 -1.324 -7.273 1.599 595 HB3 TYR 87 2HB TYR 87 0.358 -6.757 1.623 596 HD1 TYR 87 1HD TYR 87 -1.494 -9.858 2.614 597 HD2 TYR 87 2HD TYR 87 1.749 -8.159 0.447 598 HE1 TYR 87 1HE TYR 87 -0.801 -12.107 1.899 599 HE2 TYR 87 2HE TYR 87 2.451 -10.403 -0.275 600 HH TYR 87 HH TYR 87 0.556 -13.276 0.555 601 H LEU 88 H LEU 88 1.524 -5.776 4.071 602 HA LEU 88 HA LEU 88 -0.202 -3.446 4.594 603 HB2 LEU 88 1HB LEU 88 1.327 -4.545 6.425 604 HB3 LEU 88 2HB LEU 88 2.593 -3.622 5.617 605 HG LEU 88 HG LEU 88 0.931 -1.622 5.983 606 HD11 LEU 88 1HD1 LEU 88 -0.883 -3.031 6.857 607 HD12 LEU 88 2HD1 LEU 88 -0.358 -1.817 8.023 608 HD13 LEU 88 3HD1 LEU 88 0.148 -3.496 8.211 609 HD21 LEU 88 3HD2 LEU 88 2.160 -2.357 8.543 610 HD22 LEU 88 1HD2 LEU 88 2.410 -0.938 7.526 611 HD23 LEU 88 2HD2 LEU 88 3.242 -2.447 7.152 612 H ILE 89 H ILE 89 -0.061 -1.850 3.174 613 HA ILE 89 HA ILE 89 2.412 -1.592 1.590 614 HB ILE 89 HB ILE 89 -0.409 -0.901 0.761 615 HG12 ILE 89 1HG1 ILE 89 1.354 -2.891 -0.619 616 HG13 ILE 89 2HG1 ILE 89 0.490 -3.370 0.839 617 HG21 ILE 89 1HG2 ILE 89 0.463 0.441 -0.773 618 HG22 ILE 89 2HG2 ILE 89 2.079 0.120 -0.145 619 HG23 ILE 89 3HG2 ILE 89 1.407 -0.902 -1.416 620 HD11 ILE 89 3HD1 ILE 89 -0.564 -3.784 -1.489 621 HD12 ILE 89 1HD1 ILE 89 -1.569 -3.193 -0.167 622 HD13 ILE 89 2HD1 ILE 89 -0.988 -2.075 -1.402 623 H SER 90 H SER 90 3.532 0.194 1.961 624 HA SER 90 HA SER 90 2.153 2.503 3.153 625 HB2 SER 90 1HB SER 90 4.923 1.407 3.413 626 HB3 SER 90 2HB SER 90 4.678 3.141 3.623 627 HG SER 90 HG SER 90 3.018 1.322 4.976 628 H VAL 91 H VAL 91 2.694 4.624 2.437 629 HA VAL 91 HA VAL 91 4.105 4.836 -0.116 630 HB VAL 91 HB VAL 91 1.277 5.805 0.319 631 HG11 VAL 91 1HG1 VAL 91 2.176 7.544 -0.899 632 HG12 VAL 91 2HG1 VAL 91 3.332 6.503 -1.733 633 HG13 VAL 91 3HG1 VAL 91 1.626 6.464 -2.181 634 HG21 VAL 91 3HG2 VAL 91 1.344 3.474 -0.263 635 HG22 VAL 91 1HG2 VAL 91 0.818 4.391 -1.675 636 HG23 VAL 91 2HG2 VAL 91 2.473 3.790 -1.581 637 H LYS 92 H LYS 92 5.560 6.388 0.111 638 HA LYS 92 HA LYS 92 4.856 8.763 1.706 639 HB2 LYS 92 1HB LYS 92 7.532 7.365 1.554 640 HB3 LYS 92 2HB LYS 92 7.253 8.906 2.354 641 HG2 LYS 92 1HG LYS 92 5.445 7.553 3.674 642 HG3 LYS 92 2HG LYS 92 6.413 6.167 3.166 643 HD2 LYS 92 1HD LYS 92 7.777 8.528 4.381 644 HD3 LYS 92 2HD LYS 92 6.916 7.398 5.430 645 HE2 LYS 92 1HE LYS 92 9.068 6.642 3.455 646 HE3 LYS 92 2HE LYS 92 9.314 6.854 5.188 647 HZ1 LYS 92 3HZ LYS 92 8.646 4.785 5.519 648 HZ2 LYS 92 1HZ LYS 92 8.481 4.561 3.850 649 HZ3 LYS 92 2HZ LYS 92 7.163 5.092 4.767 650 H TYR 93 H TYR 93 5.143 10.681 0.741 651 HA TYR 93 HA TYR 93 6.717 10.756 -1.749 652 HB2 TYR 93 1HB TYR 93 4.531 10.902 -2.555 653 HB3 TYR 93 2HB TYR 93 3.979 11.844 -1.174 654 HD1 TYR 93 1HD TYR 93 6.252 12.069 -4.123 655 HD2 TYR 93 2HD TYR 93 3.746 14.145 -1.382 656 HE1 TYR 93 1HE TYR 93 6.553 14.136 -5.423 657 HE2 TYR 93 2HE TYR 93 4.039 16.217 -2.674 658 HH TYR 93 HH TYR 93 5.907 16.256 -5.686 659 H GLY 94 H GLY 94 8.180 12.349 -1.913 660 HA2 GLY 94 1HA GLY 94 9.240 14.373 -1.513 661 HA3 GLY 94 2HA GLY 94 7.916 14.820 -0.448 662 H GLY 95 H GLY 95 7.862 13.389 1.630 663 HA2 GLY 95 1HA GLY 95 10.614 12.940 2.582 664 HA3 GLY 95 2HA GLY 95 9.526 13.972 3.499 665 HA PRO 96 HA PRO 96 9.159 9.720 5.249 666 HB2 PRO 96 1HB PRO 96 9.080 10.553 7.831 667 HB3 PRO 96 2HB PRO 96 10.591 10.263 6.961 668 HG2 PRO 96 1HG PRO 96 9.179 12.848 7.497 669 HG3 PRO 96 2HG PRO 96 10.910 12.476 7.602 670 HD2 PRO 96 1HD PRO 96 9.822 13.758 5.480 671 HD3 PRO 96 2HD PRO 96 11.219 12.674 5.327 672 H ASN 97 H ASN 97 7.422 12.717 5.891 673 HA ASN 97 HA ASN 97 5.230 11.779 7.284 674 HB2 ASN 97 1HB ASN 97 5.261 13.922 5.146 675 HB3 ASN 97 2HB ASN 97 4.001 13.703 6.357 676 HD21 ASN 97 1HD2 ASN 97 6.614 15.482 5.598 677 HD22 ASN 97 2HD2 ASN 97 7.106 15.988 7.175 678 H HIS 98 H HIS 98 4.187 9.956 6.751 679 HA HIS 98 HA HIS 98 3.820 8.955 4.161 680 HB2 HIS 98 1HB HIS 98 2.096 7.485 5.201 681 HB3 HIS 98 2HB HIS 98 3.622 7.500 6.080 682 HD2 HIS 98 2HD HIS 98 3.168 7.643 8.729 683 HE1 HIS 98 1HE HIS 98 -0.440 9.872 8.622 684 HE2 HIS 98 2HE HIS 98 1.302 8.804 10.094 685 H ILE 99 H ILE 99 1.739 8.640 3.038 686 HA ILE 99 HA ILE 99 0.304 11.166 2.906 687 HB ILE 99 HB ILE 99 -0.701 10.291 0.860 688 HG12 ILE 99 1HG1 ILE 99 1.006 7.833 1.058 689 HG13 ILE 99 2HG1 ILE 99 -0.577 7.860 1.827 690 HG21 ILE 99 1HG2 ILE 99 1.258 10.281 -0.501 691 HG22 ILE 99 2HG2 ILE 99 1.561 11.357 0.862 692 HG23 ILE 99 3HG2 ILE 99 2.259 9.738 0.845 693 HD11 ILE 99 3HD1 ILE 99 0.148 7.731 -1.017 694 HD12 ILE 99 1HD1 ILE 99 -1.239 7.057 -0.161 695 HD13 ILE 99 2HD1 ILE 99 -1.228 8.760 -0.619 696 H VAL 100 H VAL 100 -2.144 10.845 2.294 697 HA VAL 100 HA VAL 100 -3.431 9.865 4.623 698 HB VAL 100 HB VAL 100 -4.195 11.738 3.007 699 HG11 VAL 100 1HG1 VAL 100 -5.526 11.190 1.181 700 HG12 VAL 100 2HG1 VAL 100 -4.203 10.027 1.075 701 HG13 VAL 100 3HG1 VAL 100 -5.764 9.531 1.728 702 HG21 VAL 100 3HG2 VAL 100 -6.342 9.834 3.899 703 HG22 VAL 100 1HG2 VAL 100 -5.391 10.787 5.039 704 HG23 VAL 100 2HG2 VAL 100 -6.395 11.595 3.835 705 H GLY 101 H GLY 101 -4.883 8.136 4.866 706 HA2 GLY 101 1HA GLY 101 -5.953 6.142 4.256 707 HA3 GLY 101 2HA GLY 101 -5.118 6.193 2.711 708 H SER 102 H SER 102 -2.492 6.346 3.463 709 HA SER 102 HA SER 102 -1.967 3.640 4.199 710 HB2 SER 102 1HB SER 102 -0.329 4.338 2.760 711 HB3 SER 102 2HB SER 102 -0.351 5.994 3.368 712 HG SER 102 HG SER 102 1.302 5.471 4.534 713 HA PRO 103 HA PRO 103 0.034 2.625 4.961 714 HB2 PRO 103 1HB PRO 103 -0.116 0.567 6.725 715 HB3 PRO 103 2HB PRO 103 1.200 1.747 6.735 716 HG2 PRO 103 1HG PRO 103 -1.247 1.627 8.454 717 HG3 PRO 103 2HG PRO 103 0.427 1.985 8.915 718 HD2 PRO 103 1HD PRO 103 -1.433 3.921 8.562 719 HD3 PRO 103 2HD PRO 103 0.288 4.173 8.203 720 H PHE 104 H PHE 104 -0.965 1.154 3.664 721 HA PHE 104 HA PHE 104 -3.839 0.894 3.941 722 HB2 PHE 104 1HB PHE 104 -1.923 0.024 1.771 723 HB3 PHE 104 2HB PHE 104 -3.663 -0.237 1.705 724 HD1 PHE 104 2HD PHE 104 -5.149 1.867 1.929 725 HD2 PHE 104 1HD PHE 104 -1.015 1.970 0.924 726 HE1 PHE 104 2HE PHE 104 -5.447 4.104 0.950 727 HE2 PHE 104 1HE PHE 104 -1.306 4.208 -0.056 728 HZ PHE 104 HZ PHE 104 -3.524 5.277 -0.045 729 H LYS 105 H LYS 105 -4.850 -0.810 4.766 730 HA LYS 105 HA LYS 105 -3.291 -3.262 5.237 731 HB2 LYS 105 1HB LYS 105 -4.057 -2.293 7.299 732 HB3 LYS 105 2HB LYS 105 -5.692 -2.123 6.673 733 HG2 LYS 105 1HG LYS 105 -5.810 -4.613 6.525 734 HG3 LYS 105 2HG LYS 105 -4.256 -4.676 7.360 735 HD2 LYS 105 1HD LYS 105 -6.638 -3.221 8.484 736 HD3 LYS 105 2HD LYS 105 -6.338 -4.933 8.797 737 HE2 LYS 105 1HE LYS 105 -4.179 -4.392 9.777 738 HE3 LYS 105 2HE LYS 105 -4.421 -2.685 9.411 739 HZ1 LYS 105 3HZ LYS 105 -6.645 -3.482 10.838 740 HZ2 LYS 105 1HZ LYS 105 -5.379 -2.502 11.384 741 HZ3 LYS 105 2HZ LYS 105 -5.327 -4.172 11.643 742 H ALA 106 H ALA 106 -3.674 -4.150 3.173 743 HA ALA 106 HA ALA 106 -6.403 -4.612 2.312 744 HB1 ALA 106 3HB ALA 106 -5.479 -5.477 0.308 745 HB2 ALA 106 1HB ALA 106 -4.507 -4.071 0.745 746 HB3 ALA 106 2HB ALA 106 -3.895 -5.697 1.052 747 H LYS 107 H LYS 107 -7.349 -6.661 2.026 748 HA LYS 107 HA LYS 107 -6.174 -8.772 3.713 749 HB2 LYS 107 1HB LYS 107 -8.269 -7.865 4.612 750 HB3 LYS 107 2HB LYS 107 -9.085 -8.230 3.098 751 HG2 LYS 107 1HG LYS 107 -8.873 -10.572 3.454 752 HG3 LYS 107 2HG LYS 107 -7.796 -10.324 4.830 753 HD2 LYS 107 1HD LYS 107 -10.504 -9.093 4.918 754 HD3 LYS 107 2HD LYS 107 -10.370 -10.837 5.157 755 HE2 LYS 107 1HE LYS 107 -8.960 -10.560 7.041 756 HE3 LYS 107 2HE LYS 107 -8.714 -8.849 6.692 757 HZ1 LYS 107 3HZ LYS 107 -10.269 -9.168 8.512 758 HZ2 LYS 107 1HZ LYS 107 -11.283 -10.089 7.519 759 HZ3 LYS 107 2HZ LYS 107 -11.042 -8.448 7.191 760 H VAL 108 H VAL 108 -5.350 -10.375 2.552 761 HA VAL 108 HA VAL 108 -6.339 -10.902 -0.137 762 HB VAL 108 HB VAL 108 -4.103 -12.381 1.230 763 HG11 VAL 108 1HG1 VAL 108 -3.324 -12.307 -1.258 764 HG12 VAL 108 2HG1 VAL 108 -4.561 -13.462 -0.755 765 HG13 VAL 108 3HG1 VAL 108 -5.025 -11.973 -1.581 766 HG21 VAL 108 3HG2 VAL 108 -2.888 -10.523 1.327 767 HG22 VAL 108 1HG2 VAL 108 -3.010 -10.393 -0.427 768 HG23 VAL 108 2HG2 VAL 108 -4.193 -9.585 0.601 769 H THR 109 H THR 109 -7.839 -12.380 -0.516 770 HA THR 109 HA THR 109 -8.080 -14.658 1.340 771 HB THR 109 HB THR 109 -10.499 -14.683 0.927 772 HG1 THR 109 1HG THR 109 -10.179 -12.175 -0.372 773 HG21 THR 109 3HG2 THR 109 -11.025 -13.040 2.454 774 HG22 THR 109 1HG2 THR 109 -9.927 -11.865 1.732 775 HG23 THR 109 2HG2 THR 109 -9.286 -13.185 2.711 776 H GLY 110 H GLY 110 -8.683 -16.666 0.447 777 HA2 GLY 110 1HA GLY 110 -9.527 -17.642 -1.786 778 HA3 GLY 110 2HA GLY 110 -8.083 -16.874 -2.428 779 H GLN 111 H GLN 111 -9.183 -19.766 -1.805 780 HA GLN 111 HA GLN 111 -7.660 -21.156 -0.056 781 HB2 GLN 111 1HB GLN 111 -7.859 -23.087 -1.491 782 HB3 GLN 111 2HB GLN 111 -9.343 -22.147 -1.588 783 HG2 GLN 111 1HG GLN 111 -8.192 -21.075 -3.666 784 HG3 GLN 111 2HG GLN 111 -7.213 -22.541 -3.632 785 HE21 GLN 111 1HE2 GLN 111 -8.906 -21.868 -5.741 786 HE22 GLN 111 2HE2 GLN 111 -10.183 -23.028 -5.816 787 H ARG 112 H ARG 112 -5.564 -21.241 0.362 788 HA ARG 112 HA ARG 112 -3.522 -20.018 -0.914 789 HB2 ARG 112 1HB ARG 112 -3.268 -21.109 1.257 790 HB3 ARG 112 2HB ARG 112 -3.372 -22.689 0.493 791 HG2 ARG 112 1HG ARG 112 -1.319 -21.763 -0.888 792 HG3 ARG 112 2HG ARG 112 -1.132 -20.746 0.542 793 HD2 ARG 112 1HD ARG 112 0.156 -22.595 1.070 794 HD3 ARG 112 2HD ARG 112 -1.381 -22.964 1.852 795 HE ARG 112 HE ARG 112 -1.488 -24.071 -0.685 796 HH11 ARG 112 1HH1 ARG 112 0.417 -24.429 2.207 797 HH12 ARG 112 2HH1 ARG 112 0.761 -26.105 1.929 798 HH21 ARG 112 1HH2 ARG 112 -1.042 -26.276 -1.061 799 HH22 ARG 112 2HH2 ARG 112 -0.068 -27.154 0.070 800 H LEU 113 H LEU 113 -2.368 -20.246 -2.730 801 HA LEU 113 HA LEU 113 -3.147 -22.235 -4.647 802 HB2 LEU 113 1HB LEU 113 -0.937 -20.189 -4.771 803 HB3 LEU 113 2HB LEU 113 -1.551 -21.132 -6.127 804 HG LEU 113 HG LEU 113 -3.140 -19.086 -4.579 805 HD11 LEU 113 1HD1 LEU 113 -2.325 -17.505 -5.904 806 HD12 LEU 113 2HD1 LEU 113 -2.653 -18.468 -7.344 807 HD13 LEU 113 3HD1 LEU 113 -1.131 -18.671 -6.476 808 HD21 LEU 113 3HD2 LEU 113 -4.624 -19.325 -6.640 809 HD22 LEU 113 1HD2 LEU 113 -4.665 -20.634 -5.459 810 HD23 LEU 113 2HD2 LEU 113 -3.746 -20.823 -6.953 811 H VAL 114 H VAL 114 -1.865 -23.858 -5.550 812 HA VAL 114 HA VAL 114 0.341 -24.749 -3.821 813 HB VAL 114 HB VAL 114 -1.465 -26.357 -3.975 814 HG11 VAL 114 1HG1 VAL 114 -1.336 -27.303 -6.611 815 HG12 VAL 114 2HG1 VAL 114 -2.684 -26.475 -5.830 816 HG13 VAL 114 3HG1 VAL 114 -1.483 -25.550 -6.731 817 HG21 VAL 114 3HG2 VAL 114 -0.059 -28.101 -4.059 818 HG22 VAL 114 1HG2 VAL 114 0.415 -27.758 -5.722 819 HG23 VAL 114 2HG2 VAL 114 1.184 -26.896 -4.390 820 H SER 115 H SER 115 -0.188 -23.235 -6.718 821 HA SER 115 HA SER 115 2.458 -24.040 -7.700 822 HB2 SER 115 1HB SER 115 1.042 -25.283 -9.136 823 HB3 SER 115 2HB SER 115 -0.105 -23.953 -9.289 824 HG SER 115 HG SER 115 2.443 -24.244 -10.456 825 HA PRO 116 HA PRO 116 3.099 -19.687 -7.922 826 HB2 PRO 116 1HB PRO 116 5.244 -19.678 -9.585 827 HB3 PRO 116 2HB PRO 116 5.344 -20.175 -7.892 828 HG2 PRO 116 1HG PRO 116 5.143 -21.866 -10.354 829 HG3 PRO 116 2HG PRO 116 6.170 -22.087 -8.925 830 HD2 PRO 116 1HD PRO 116 3.871 -23.470 -9.296 831 HD3 PRO 116 2HD PRO 116 4.461 -23.012 -7.685 832 H GLY 117 H GLY 117 3.226 -21.484 -10.998 833 HA2 GLY 117 1HA GLY 117 1.221 -19.972 -12.248 834 HA3 GLY 117 2HA GLY 117 2.775 -19.278 -12.685 835 H SER 118 H SER 118 3.281 -19.901 -14.673 836 HA SER 118 HA SER 118 3.725 -22.630 -15.306 837 HB2 SER 118 1HB SER 118 1.181 -21.360 -16.228 838 HB3 SER 118 2HB SER 118 2.023 -22.448 -17.331 839 HG SER 118 HG SER 118 0.404 -23.155 -15.451 840 H ALA 119 H ALA 119 4.733 -22.915 -17.358 841 HA ALA 119 HA ALA 119 5.171 -20.652 -19.081 842 HB1 ALA 119 3HB ALA 119 6.900 -20.914 -16.919 843 HB2 ALA 119 1HB ALA 119 7.790 -21.578 -18.290 844 HB3 ALA 119 2HB ALA 119 7.151 -19.936 -18.365 845 H ASN 120 H ASN 120 4.833 -21.642 -20.965 846 HA ASN 120 HA ASN 120 6.047 -24.283 -21.413 847 HB2 ASN 120 1HB ASN 120 4.408 -24.180 -23.464 848 HB3 ASN 120 2HB ASN 120 3.795 -24.577 -21.861 849 HD21 ASN 120 1HD2 ASN 120 1.732 -23.881 -22.564 850 HD22 ASN 120 2HD2 ASN 120 1.344 -22.199 -22.640 851 H GLU 121 H GLU 121 7.381 -24.653 -23.141 852 HA GLU 121 HA GLU 121 7.823 -22.603 -25.135 853 HB2 GLU 121 1HB GLU 121 9.268 -22.134 -23.015 854 HB3 GLU 121 2HB GLU 121 10.240 -23.480 -23.591 855 HG2 GLU 121 1HG GLU 121 11.079 -21.257 -24.284 856 HG3 GLU 121 2HG GLU 121 10.737 -22.345 -25.628 857 H THR 122 H THR 122 8.365 -23.488 -27.034 858 HA THR 122 HA THR 122 9.170 -26.322 -27.037 859 HB THR 122 HB THR 122 8.209 -26.421 -29.333 860 HG1 THR 122 1HG THR 122 7.640 -24.611 -30.252 861 HG21 THR 122 3HG2 THR 122 5.900 -26.520 -28.643 862 HG22 THR 122 1HG2 THR 122 6.225 -25.470 -27.265 863 HG23 THR 122 2HG2 THR 122 6.913 -27.093 -27.318 864 H SER 123 H SER 123 10.521 -27.003 -28.880 865 HA SER 123 HA SER 123 12.740 -25.200 -29.194 866 HB2 SER 123 1HB SER 123 12.720 -27.824 -28.951 867 HB3 SER 123 2HB SER 123 12.536 -27.778 -30.704 868 HG SER 123 HG SER 123 14.446 -26.503 -30.776 869 H SER 124 H SER 124 13.439 -24.185 -31.030 870 HA SER 124 HA SER 124 11.824 -24.473 -33.462 871 HB2 SER 124 1HB SER 124 11.169 -22.454 -31.961 872 HB3 SER 124 2HB SER 124 12.677 -21.743 -32.535 873 HG SER 124 HG SER 124 10.302 -22.176 -33.868 874 H ILE 125 H ILE 125 12.910 -23.061 -35.268 875 HA ILE 125 HA ILE 125 15.482 -24.143 -35.708 876 HB ILE 125 HB ILE 125 15.511 -22.968 -37.767 877 HG12 ILE 125 1HG1 ILE 125 15.007 -20.728 -36.933 878 HG13 ILE 125 2HG1 ILE 125 13.948 -21.128 -38.281 879 HG21 ILE 125 1HG2 ILE 125 13.878 -24.764 -37.658 880 HG22 ILE 125 2HG2 ILE 125 12.652 -23.636 -37.082 881 HG23 ILE 125 3HG2 ILE 125 13.304 -23.473 -38.712 882 HD11 ILE 125 3HD1 ILE 125 13.244 -21.143 -35.358 883 HD12 ILE 125 1HD1 ILE 125 12.677 -20.016 -36.591 884 HD13 ILE 125 2HD1 ILE 125 12.180 -21.707 -36.647 Start of MODEL 14 1 H1 GLY 1 H GLY 1 -6.056 50.780 -30.962 2 HA2 GLY 1 1HA GLY 1 -7.798 48.899 -29.689 3 HA3 GLY 1 2HA GLY 1 -6.305 49.119 -28.789 4 H SER 2 H SER 2 -6.439 50.558 -27.215 5 HA SER 2 HA SER 2 -7.069 52.352 -25.966 6 HB2 SER 2 1HB SER 2 -7.590 53.490 -28.718 7 HB3 SER 2 2HB SER 2 -7.716 54.438 -27.236 8 HG SER 2 HG SER 2 -5.441 53.294 -28.432 9 H SER 3 H SER 3 -8.927 50.317 -26.172 10 HA SER 3 HA SER 3 -11.442 51.827 -25.974 11 HB2 SER 3 1HB SER 3 -11.236 50.417 -28.107 12 HB3 SER 3 2HB SER 3 -11.345 49.011 -27.049 13 HG SER 3 HG SER 3 -13.258 51.065 -26.870 14 H GLY 4 H GLY 4 -13.059 50.813 -24.590 15 HA2 GLY 4 1HA GLY 4 -12.297 50.237 -22.071 16 HA3 GLY 4 2HA GLY 4 -13.756 49.555 -22.773 17 H SER 5 H SER 5 -11.370 48.645 -20.949 18 HA SER 5 HA SER 5 -11.323 45.938 -22.047 19 HB2 SER 5 1HB SER 5 -8.922 45.709 -21.783 20 HB3 SER 5 2HB SER 5 -9.253 47.080 -22.842 21 HG SER 5 HG SER 5 -7.806 47.857 -21.420 22 H SER 6 H SER 6 -11.935 44.588 -20.505 23 HA SER 6 HA SER 6 -11.631 45.395 -17.703 24 HB2 SER 6 1HB SER 6 -13.901 44.763 -18.588 25 HB3 SER 6 2HB SER 6 -13.293 43.123 -18.812 26 HG SER 6 HG SER 6 -13.767 44.540 -16.431 27 H GLY 7 H GLY 7 -11.495 42.333 -19.541 28 HA2 GLY 7 1HA GLY 7 -10.212 40.737 -17.749 29 HA3 GLY 7 2HA GLY 7 -9.932 40.636 -19.481 30 H PHE 8 H PHE 8 -7.957 39.979 -17.663 31 HA PHE 8 HA PHE 8 -5.861 41.742 -18.505 32 HB2 PHE 8 1HB PHE 8 -5.063 42.169 -16.131 33 HB3 PHE 8 2HB PHE 8 -6.481 43.078 -16.642 34 HD1 PHE 8 1HD PHE 8 -5.290 40.285 -14.571 35 HD2 PHE 8 2HD PHE 8 -8.599 42.755 -15.603 36 HE1 PHE 8 1HE PHE 8 -6.528 39.435 -12.622 37 HE2 PHE 8 2HE PHE 8 -9.842 41.911 -13.655 38 HZ PHE 8 HZ PHE 8 -8.806 40.249 -12.161 39 H LYS 9 H LYS 9 -3.756 40.896 -18.084 40 HA LYS 9 HA LYS 9 -3.778 38.054 -17.300 41 HB2 LYS 9 1HB LYS 9 -2.345 39.494 -19.504 42 HB3 LYS 9 2HB LYS 9 -1.645 38.034 -18.817 43 HG2 LYS 9 1HG LYS 9 -3.445 36.706 -19.524 44 HG3 LYS 9 2HG LYS 9 -4.461 38.113 -19.849 45 HD2 LYS 9 1HD LYS 9 -2.838 38.764 -21.640 46 HD3 LYS 9 2HD LYS 9 -2.021 37.221 -21.381 47 HE2 LYS 9 1HE LYS 9 -3.862 35.992 -22.148 48 HE3 LYS 9 2HE LYS 9 -4.960 37.360 -21.972 49 HZ1 LYS 9 3HZ LYS 9 -4.243 38.305 -23.909 50 HZ2 LYS 9 1HZ LYS 9 -4.063 36.670 -24.303 51 HZ3 LYS 9 2HZ LYS 9 -2.715 37.583 -23.847 52 H VAL 10 H VAL 10 -3.350 38.717 -15.112 53 HA VAL 10 HA VAL 10 -0.603 39.694 -14.685 54 HB VAL 10 HB VAL 10 -2.977 39.828 -12.822 55 HG11 VAL 10 1HG1 VAL 10 -0.132 40.753 -12.441 56 HG12 VAL 10 2HG1 VAL 10 -1.476 41.148 -11.367 57 HG13 VAL 10 3HG1 VAL 10 -0.955 39.473 -11.551 58 HG21 VAL 10 3HG2 VAL 10 -3.386 41.563 -14.248 59 HG22 VAL 10 1HG2 VAL 10 -2.281 42.365 -13.131 60 HG23 VAL 10 2HG2 VAL 10 -1.686 41.757 -14.676 61 H ARG 11 H ARG 11 0.813 38.489 -13.539 62 HA ARG 11 HA ARG 11 -0.081 35.818 -12.728 63 HB2 ARG 11 1HB ARG 11 2.614 36.968 -13.419 64 HB3 ARG 11 2HB ARG 11 2.455 35.416 -12.606 65 HG2 ARG 11 1HG ARG 11 1.034 35.989 -15.181 66 HG3 ARG 11 2HG ARG 11 2.703 35.418 -15.145 67 HD2 ARG 11 1HD ARG 11 0.323 34.025 -13.922 68 HD3 ARG 11 2HD ARG 11 1.134 33.566 -15.419 69 HE ARG 11 HE ARG 11 3.148 33.471 -13.663 70 HH11 ARG 11 1HH1 ARG 11 -0.090 32.198 -13.530 71 HH12 ARG 11 2HH1 ARG 11 0.341 30.852 -12.527 72 HH21 ARG 11 1HH2 ARG 11 3.728 31.703 -12.343 73 HH22 ARG 11 2HH2 ARG 11 2.513 30.572 -11.852 74 H VAL 12 H VAL 12 -0.033 35.138 -10.663 75 HA VAL 12 HA VAL 12 1.526 36.529 -8.658 76 HB VAL 12 HB VAL 12 -0.658 37.797 -8.861 77 HG11 VAL 12 1HG1 VAL 12 -1.786 35.324 -7.555 78 HG12 VAL 12 2HG1 VAL 12 -2.649 36.821 -7.911 79 HG13 VAL 12 3HG1 VAL 12 -2.073 35.800 -9.229 80 HG21 VAL 12 3HG2 VAL 12 -0.548 38.357 -6.662 81 HG22 VAL 12 1HG2 VAL 12 -0.577 36.679 -6.120 82 HG23 VAL 12 2HG2 VAL 12 0.917 37.379 -6.745 83 H GLY 13 H GLY 13 2.075 35.228 -6.978 84 HA2 GLY 13 1HA GLY 13 0.676 33.141 -5.862 85 HA3 GLY 13 2HA GLY 13 1.533 32.431 -7.222 86 H GLU 14 H GLU 14 2.870 31.148 -5.969 87 HA GLU 14 HA GLU 14 4.721 32.561 -4.172 88 HB2 GLU 14 1HB GLU 14 4.196 29.590 -4.316 89 HB3 GLU 14 2HB GLU 14 5.132 30.440 -3.094 90 HG2 GLU 14 1HG GLU 14 2.891 31.716 -2.687 91 HG3 GLU 14 2HG GLU 14 2.182 30.303 -3.466 92 HA PRO 15 HA PRO 15 8.107 31.881 -6.883 93 HB2 PRO 15 1HB PRO 15 10.138 31.630 -5.100 94 HB3 PRO 15 2HB PRO 15 9.350 33.174 -5.446 95 HG2 PRO 15 1HG PRO 15 8.907 31.291 -3.161 96 HG3 PRO 15 2HG PRO 15 9.027 33.060 -3.146 97 HD2 PRO 15 1HD PRO 15 6.653 31.760 -3.052 98 HD3 PRO 15 2HD PRO 15 6.847 33.339 -3.840 99 H GLY 16 H GLY 16 8.145 29.704 -4.051 100 HA2 GLY 16 1HA GLY 16 9.058 27.551 -5.858 101 HA3 GLY 16 2HA GLY 16 9.494 27.651 -4.159 102 H GLN 17 H GLN 17 7.810 25.817 -6.106 103 HA GLN 17 HA GLN 17 5.309 25.675 -4.650 104 HB2 GLN 17 1HB GLN 17 6.453 24.311 -7.051 105 HB3 GLN 17 2HB GLN 17 5.105 23.561 -6.207 106 HG2 GLN 17 1HG GLN 17 3.922 25.803 -6.450 107 HG3 GLN 17 2HG GLN 17 5.188 26.209 -7.607 108 HE21 GLN 17 1HE2 GLN 17 2.781 26.290 -8.607 109 HE22 GLN 17 2HE2 GLN 17 2.423 24.910 -9.582 110 H ALA 18 H ALA 18 5.081 24.572 -2.831 111 HA ALA 18 HA ALA 18 7.026 22.472 -2.184 112 HB1 ALA 18 3HB ALA 18 7.042 23.390 -0.166 113 HB2 ALA 18 1HB ALA 18 5.815 24.553 -0.670 114 HB3 ALA 18 2HB ALA 18 5.332 23.003 0.022 115 H GLY 19 H GLY 19 6.266 20.637 -3.144 116 HA2 GLY 19 1HA GLY 19 3.714 19.799 -3.603 117 HA3 GLY 19 2HA GLY 19 5.025 18.695 -3.216 118 H ASN 20 H ASN 20 2.369 18.179 -2.537 119 HA ASN 20 HA ASN 20 2.558 18.245 0.395 120 HB2 ASN 20 1HB ASN 20 0.907 19.903 -0.129 121 HB3 ASN 20 2HB ASN 20 0.115 18.834 -1.283 122 HD21 ASN 20 1HD2 ASN 20 -1.259 20.084 0.758 123 HD22 ASN 20 2HD2 ASN 20 -1.804 18.894 1.885 124 HA PRO 21 HA PRO 21 2.052 13.877 -0.090 125 HB2 PRO 21 1HB PRO 21 1.635 13.284 2.526 126 HB3 PRO 21 2HB PRO 21 3.228 13.689 1.875 127 HG2 PRO 21 1HG PRO 21 1.289 15.426 3.354 128 HG3 PRO 21 2HG PRO 21 3.048 15.302 3.540 129 HD2 PRO 21 1HD PRO 21 1.867 17.304 2.151 130 HD3 PRO 21 2HD PRO 21 3.461 16.654 1.719 131 H ALA 22 H ALA 22 -0.204 15.473 2.172 132 HA ALA 22 HA ALA 22 -2.250 13.617 2.101 133 HB1 ALA 22 3HB ALA 22 -3.633 15.246 3.042 134 HB2 ALA 22 1HB ALA 22 -2.009 15.720 3.542 135 HB3 ALA 22 2HB ALA 22 -2.804 16.563 2.211 136 H LEU 23 H LEU 23 -1.843 16.477 0.016 137 HA LEU 23 HA LEU 23 -4.084 16.358 -1.521 138 HB2 LEU 23 1HB LEU 23 -1.250 16.994 -2.279 139 HB3 LEU 23 2HB LEU 23 -2.575 17.140 -3.431 140 HG LEU 23 HG LEU 23 -2.212 18.698 -0.875 141 HD11 LEU 23 1HD1 LEU 23 -0.869 19.263 -2.978 142 HD12 LEU 23 2HD1 LEU 23 -1.793 20.559 -2.220 143 HD13 LEU 23 3HD1 LEU 23 -2.412 19.767 -3.669 144 HD21 LEU 23 3HD2 LEU 23 -4.255 19.924 -2.065 145 HD22 LEU 23 1HD2 LEU 23 -4.480 18.622 -0.896 146 HD23 LEU 23 2HD2 LEU 23 -4.566 18.280 -2.624 147 H VAL 24 H VAL 24 -1.218 14.323 -1.808 148 HA VAL 24 HA VAL 24 -1.759 13.048 -4.212 149 HB VAL 24 HB VAL 24 -0.501 11.840 -1.744 150 HG11 VAL 24 1HG1 VAL 24 -1.069 10.768 -4.383 151 HG12 VAL 24 2HG1 VAL 24 0.646 10.689 -3.977 152 HG13 VAL 24 3HG1 VAL 24 -0.548 9.942 -2.915 153 HG21 VAL 24 3HG2 VAL 24 1.191 12.693 -3.986 154 HG22 VAL 24 1HG2 VAL 24 0.386 14.005 -3.125 155 HG23 VAL 24 2HG2 VAL 24 1.426 12.883 -2.249 156 H SER 25 H SER 25 -2.888 11.214 -4.801 157 HA SER 25 HA SER 25 -4.767 10.144 -2.800 158 HB2 SER 25 1HB SER 25 -5.403 10.578 -5.726 159 HB3 SER 25 2HB SER 25 -6.515 10.057 -4.460 160 HG SER 25 HG SER 25 -5.167 12.477 -4.109 161 H ALA 26 H ALA 26 -5.509 7.969 -3.196 162 HA ALA 26 HA ALA 26 -3.889 6.398 -5.064 163 HB1 ALA 26 3HB ALA 26 -2.576 5.900 -3.278 164 HB2 ALA 26 1HB ALA 26 -3.863 6.190 -2.108 165 HB3 ALA 26 2HB ALA 26 -3.831 4.686 -3.030 166 H TYR 27 H TYR 27 -5.108 5.027 -6.182 167 HA TYR 27 HA TYR 27 -7.357 3.674 -4.978 168 HB2 TYR 27 1HB TYR 27 -8.968 4.459 -6.711 169 HB3 TYR 27 2HB TYR 27 -8.458 5.729 -5.604 170 HD1 TYR 27 2HD TYR 27 -8.078 4.410 -9.030 171 HD2 TYR 27 1HD TYR 27 -7.277 7.646 -6.386 172 HE1 TYR 27 2HE TYR 27 -7.407 5.801 -10.945 173 HE2 TYR 27 1HE TYR 27 -6.605 9.046 -8.293 174 HH TYR 27 HH TYR 27 -7.320 8.350 -11.426 175 H GLY 28 H GLY 28 -8.183 1.953 -6.287 176 HA2 GLY 28 1HA GLY 28 -7.505 1.293 -8.867 177 HA3 GLY 28 2HA GLY 28 -6.159 0.722 -7.892 178 H THR 29 H THR 29 -6.601 -1.438 -8.426 179 HA THR 29 HA THR 29 -9.069 -2.527 -7.239 180 HB THR 29 HB THR 29 -7.420 -4.062 -9.219 181 HG1 THR 29 1HG THR 29 -7.834 -2.469 -10.578 182 HG21 THR 29 3HG2 THR 29 -10.403 -4.034 -9.015 183 HG22 THR 29 1HG2 THR 29 -9.456 -4.910 -7.812 184 HG23 THR 29 2HG2 THR 29 -9.326 -5.337 -9.518 185 H GLY 30 H GLY 30 -5.655 -2.469 -7.078 186 HA2 GLY 30 1HA GLY 30 -5.341 -5.027 -5.786 187 HA3 GLY 30 2HA GLY 30 -4.110 -3.785 -5.959 188 H LEU 31 H LEU 31 -5.643 -1.675 -4.746 189 HA LEU 31 HA LEU 31 -4.984 -2.169 -2.022 190 HB2 LEU 31 1HB LEU 31 -6.517 0.088 -3.304 191 HB3 LEU 31 2HB LEU 31 -5.976 0.066 -1.627 192 HG LEU 31 HG LEU 31 -4.108 -0.054 -3.990 193 HD11 LEU 31 1HD1 LEU 31 -5.295 2.048 -4.063 194 HD12 LEU 31 2HD1 LEU 31 -3.646 2.316 -3.499 195 HD13 LEU 31 3HD1 LEU 31 -4.983 2.318 -2.349 196 HD21 LEU 31 3HD2 LEU 31 -3.277 0.937 -1.336 197 HD22 LEU 31 1HD2 LEU 31 -2.400 -0.043 -2.511 198 HD23 LEU 31 2HD2 LEU 31 -3.601 -0.793 -1.460 199 H GLU 32 H GLU 32 -7.868 -2.485 -3.908 200 HA GLU 32 HA GLU 32 -9.841 -2.289 -1.958 201 HB2 GLU 32 1HB GLU 32 -9.698 -4.050 -4.407 202 HB3 GLU 32 2HB GLU 32 -11.145 -3.859 -3.427 203 HG2 GLU 32 1HG GLU 32 -10.976 -1.384 -3.879 204 HG3 GLU 32 2HG GLU 32 -9.743 -1.778 -5.074 205 H GLY 33 H GLY 33 -7.809 -5.042 -2.860 206 HA2 GLY 33 1HA GLY 33 -7.901 -6.178 -0.276 207 HA3 GLY 33 2HA GLY 33 -9.047 -7.011 -1.316 208 H GLY 34 H GLY 34 -7.473 -8.786 -0.625 209 HA2 GLY 34 1HA GLY 34 -5.121 -8.819 -2.403 210 HA3 GLY 34 2HA GLY 34 -5.294 -9.784 -0.945 211 H THR 35 H THR 35 -5.583 -9.750 -4.293 212 HA THR 35 HA THR 35 -7.373 -12.072 -4.339 213 HB THR 35 HB THR 35 -6.943 -11.668 -6.939 214 HG1 THR 35 1HG THR 35 -5.828 -9.890 -7.204 215 HG21 THR 35 3HG2 THR 35 -8.757 -9.718 -5.574 216 HG22 THR 35 1HG2 THR 35 -9.069 -11.448 -5.448 217 HG23 THR 35 2HG2 THR 35 -9.034 -10.671 -7.031 218 H THR 36 H THR 36 -6.306 -13.918 -3.988 219 HA THR 36 HA THR 36 -3.571 -14.295 -4.794 220 HB THR 36 HB THR 36 -5.286 -16.594 -3.963 221 HG1 THR 36 1HG THR 36 -4.758 -14.299 -2.456 222 HG21 THR 36 3HG2 THR 36 -2.699 -16.493 -4.467 223 HG22 THR 36 1HG2 THR 36 -3.329 -17.481 -3.149 224 HG23 THR 36 2HG2 THR 36 -2.627 -15.899 -2.808 225 H GLY 37 H GLY 37 -3.222 -14.431 -6.941 226 HA2 GLY 37 1HA GLY 37 -3.140 -16.268 -8.640 227 HA3 GLY 37 2HA GLY 37 -4.886 -16.344 -8.460 228 H ILE 38 H ILE 38 -4.966 -13.347 -8.227 229 HA ILE 38 HA ILE 38 -4.780 -12.803 -11.112 230 HB ILE 38 HB ILE 38 -6.430 -11.307 -9.075 231 HG12 ILE 38 1HG1 ILE 38 -7.449 -13.308 -11.091 232 HG13 ILE 38 2HG1 ILE 38 -7.053 -13.755 -9.436 233 HG21 ILE 38 1HG2 ILE 38 -7.625 -10.537 -11.148 234 HG22 ILE 38 2HG2 ILE 38 -5.978 -9.936 -10.960 235 HG23 ILE 38 3HG2 ILE 38 -6.313 -11.255 -12.082 236 HD11 ILE 38 3HD1 ILE 38 -8.848 -12.655 -8.565 237 HD12 ILE 38 1HD1 ILE 38 -8.908 -11.480 -9.878 238 HD13 ILE 38 2HD1 ILE 38 -9.498 -13.122 -10.137 239 H GLN 39 H GLN 39 -4.264 -10.560 -11.732 240 HA GLN 39 HA GLN 39 -2.224 -9.437 -9.934 241 HB2 GLN 39 1HB GLN 39 -1.191 -10.139 -11.952 242 HB3 GLN 39 2HB GLN 39 -2.468 -9.437 -12.937 243 HG2 GLN 39 1HG GLN 39 -1.729 -7.187 -12.065 244 HG3 GLN 39 2HG GLN 39 -0.315 -8.011 -11.407 245 HE21 GLN 39 1HE2 GLN 39 1.092 -9.104 -12.900 246 HE22 GLN 39 2HE2 GLN 39 1.229 -8.535 -14.526 247 H SER 40 H SER 40 -2.574 -7.502 -9.075 248 HA SER 40 HA SER 40 -4.700 -5.828 -10.236 249 HB2 SER 40 1HB SER 40 -3.664 -5.806 -7.392 250 HB3 SER 40 2HB SER 40 -5.041 -4.898 -8.016 251 HG SER 40 HG SER 40 -5.789 -6.752 -7.004 252 H GLU 41 H GLU 41 -4.416 -3.464 -9.929 253 HA GLU 41 HA GLU 41 -1.637 -2.582 -9.761 254 HB2 GLU 41 1HB GLU 41 -2.104 -1.138 -11.847 255 HB3 GLU 41 2HB GLU 41 -1.713 -2.836 -12.079 256 HG2 GLU 41 1HG GLU 41 -4.565 -1.988 -11.879 257 HG3 GLU 41 2HG GLU 41 -3.679 -1.755 -13.385 258 H PHE 42 H PHE 42 -1.456 -0.743 -8.652 259 HA PHE 42 HA PHE 42 -3.848 0.951 -8.362 260 HB2 PHE 42 1HB PHE 42 -3.414 1.280 -6.068 261 HB3 PHE 42 2HB PHE 42 -3.180 -0.446 -6.321 262 HD1 PHE 42 1HD PHE 42 -1.417 2.773 -5.906 263 HD2 PHE 42 2HD PHE 42 -1.109 -1.472 -5.884 264 HE1 PHE 42 1HE PHE 42 0.842 2.945 -4.946 265 HE2 PHE 42 2HE PHE 42 1.149 -1.307 -4.923 266 HZ PHE 42 HZ PHE 42 2.128 0.904 -4.452 267 H PHE 43 H PHE 43 -3.569 2.937 -9.109 268 HA PHE 43 HA PHE 43 -0.853 3.929 -9.540 269 HB2 PHE 43 1HB PHE 43 -3.293 5.397 -10.459 270 HB3 PHE 43 2HB PHE 43 -1.702 5.296 -11.208 271 HD1 PHE 43 2HD PHE 43 -4.826 3.421 -10.584 272 HD2 PHE 43 1HD PHE 43 -1.231 3.683 -12.847 273 HE1 PHE 43 2HE PHE 43 -5.656 1.669 -12.099 274 HE2 PHE 43 1HE PHE 43 -2.055 1.931 -14.366 275 HZ PHE 43 HZ PHE 43 -4.270 0.921 -13.992 276 H ILE 44 H ILE 44 -0.295 6.121 -8.982 277 HA ILE 44 HA ILE 44 -1.781 7.106 -6.634 278 HB ILE 44 HB ILE 44 1.154 7.576 -7.120 279 HG12 ILE 44 1HG1 ILE 44 -0.036 5.454 -5.326 280 HG13 ILE 44 2HG1 ILE 44 0.597 5.123 -6.935 281 HG21 ILE 44 1HG2 ILE 44 1.082 8.792 -5.261 282 HG22 ILE 44 2HG2 ILE 44 -0.676 8.673 -5.331 283 HG23 ILE 44 3HG2 ILE 44 0.250 7.510 -4.382 284 HD11 ILE 44 3HD1 ILE 44 1.998 5.573 -4.414 285 HD12 ILE 44 1HD1 ILE 44 2.498 4.688 -5.854 286 HD13 ILE 44 2HD1 ILE 44 2.678 6.441 -5.790 287 H ASN 45 H ASN 45 -2.953 8.795 -7.303 288 HA ASN 45 HA ASN 45 -2.310 10.471 -9.471 289 HB2 ASN 45 1HB ASN 45 -4.584 10.077 -8.267 290 HB3 ASN 45 2HB ASN 45 -4.056 11.374 -7.199 291 HD21 ASN 45 1HD2 ASN 45 -4.644 10.554 -10.574 292 HD22 ASN 45 2HD2 ASN 45 -5.045 12.156 -11.081 293 H THR 46 H THR 46 -0.124 11.086 -9.105 294 HA THR 46 HA THR 46 0.281 13.038 -6.941 295 HB THR 46 HB THR 46 2.702 12.736 -7.343 296 HG1 THR 46 1HG THR 46 1.822 10.739 -9.180 297 HG21 THR 46 3HG2 THR 46 1.044 11.107 -5.952 298 HG22 THR 46 1HG2 THR 46 2.800 10.952 -5.959 299 HG23 THR 46 2HG2 THR 46 1.822 9.942 -7.024 300 H THR 47 H THR 47 -1.149 13.719 -9.333 301 HA THR 47 HA THR 47 0.675 15.245 -10.988 302 HB THR 47 HB THR 47 -1.316 15.921 -12.244 303 HG1 THR 47 1HG THR 47 -2.837 14.317 -10.456 304 HG21 THR 47 3HG2 THR 47 -0.685 13.969 -13.207 305 HG22 THR 47 1HG2 THR 47 -2.207 13.394 -12.527 306 HG23 THR 47 2HG2 THR 47 -0.690 13.090 -11.679 307 H ARG 48 H ARG 48 -2.012 15.940 -8.761 308 HA ARG 48 HA ARG 48 -1.554 18.778 -8.882 309 HB2 ARG 48 1HB ARG 48 -3.340 17.063 -7.154 310 HB3 ARG 48 2HB ARG 48 -3.261 18.815 -7.017 311 HG2 ARG 48 1HG ARG 48 -3.810 18.811 -9.537 312 HG3 ARG 48 2HG ARG 48 -4.324 17.146 -9.257 313 HD2 ARG 48 1HD ARG 48 -5.912 17.877 -7.590 314 HD3 ARG 48 2HD ARG 48 -5.336 19.538 -7.725 315 HE ARG 48 HE ARG 48 -6.590 19.789 -9.630 316 HH11 ARG 48 1HH1 ARG 48 -6.395 16.412 -8.805 317 HH12 ARG 48 2HH1 ARG 48 -7.577 15.924 -9.974 318 HH21 ARG 48 1HH2 ARG 48 -8.148 19.159 -11.173 319 HH22 ARG 48 2HH2 ARG 48 -8.572 17.487 -11.321 320 H ALA 49 H ALA 49 -0.288 16.168 -7.091 321 HA ALA 49 HA ALA 49 0.498 17.760 -4.801 322 HB1 ALA 49 3HB ALA 49 -0.119 15.415 -4.495 323 HB2 ALA 49 1HB ALA 49 1.219 14.925 -5.535 324 HB3 ALA 49 2HB ALA 49 1.545 15.712 -3.990 325 H GLY 50 H GLY 50 2.029 16.281 -7.633 326 HA2 GLY 50 1HA GLY 50 3.832 17.465 -8.733 327 HA3 GLY 50 2HA GLY 50 4.359 18.025 -7.152 328 HA PRO 51 HA PRO 51 6.432 13.939 -8.572 329 HB2 PRO 51 1HB PRO 51 8.704 14.926 -9.685 330 HB3 PRO 51 2HB PRO 51 7.241 14.595 -10.621 331 HG2 PRO 51 1HG PRO 51 8.248 17.197 -9.536 332 HG3 PRO 51 2HG PRO 51 7.545 16.845 -11.125 333 HD2 PRO 51 1HD PRO 51 6.124 17.989 -9.124 334 HD3 PRO 51 2HD PRO 51 5.385 16.907 -10.323 335 H GLY 52 H GLY 52 8.321 13.040 -7.579 336 HA2 GLY 52 1HA GLY 52 10.279 14.352 -6.153 337 HA3 GLY 52 2HA GLY 52 8.922 14.213 -5.045 338 H THR 53 H THR 53 10.640 12.964 -3.862 339 HA THR 53 HA THR 53 11.447 10.414 -4.824 340 HB THR 53 HB THR 53 11.315 11.244 -1.925 341 HG1 THR 53 1HG THR 53 12.569 12.819 -2.681 342 HG21 THR 53 3HG2 THR 53 13.161 9.711 -1.645 343 HG22 THR 53 1HG2 THR 53 13.216 9.404 -3.380 344 HG23 THR 53 2HG2 THR 53 11.828 8.868 -2.433 345 H LEU 54 H LEU 54 10.616 8.400 -4.468 346 HA LEU 54 HA LEU 54 8.086 8.224 -2.977 347 HB2 LEU 54 1HB LEU 54 7.778 8.288 -5.472 348 HB3 LEU 54 2HB LEU 54 8.654 6.761 -5.547 349 HG LEU 54 HG LEU 54 6.825 5.888 -3.949 350 HD11 LEU 54 1HD1 LEU 54 5.652 7.753 -3.257 351 HD12 LEU 54 2HD1 LEU 54 4.625 7.124 -4.545 352 HD13 LEU 54 3HD1 LEU 54 5.686 8.498 -4.855 353 HD21 LEU 54 3HD2 LEU 54 5.243 5.963 -6.169 354 HD22 LEU 54 1HD2 LEU 54 6.566 4.826 -5.904 355 HD23 LEU 54 2HD2 LEU 54 6.839 6.291 -6.848 356 H SER 55 H SER 55 8.114 6.716 -1.452 357 HA SER 55 HA SER 55 10.050 4.507 -1.703 358 HB2 SER 55 1HB SER 55 10.461 6.290 0.113 359 HB3 SER 55 2HB SER 55 9.072 5.581 0.937 360 HG SER 55 HG SER 55 11.519 4.329 0.252 361 H VAL 56 H VAL 56 9.041 2.657 -2.083 362 HA VAL 56 HA VAL 56 6.437 2.179 -0.783 363 HB VAL 56 HB VAL 56 7.429 1.071 -3.413 364 HG11 VAL 56 1HG1 VAL 56 5.028 0.250 -3.553 365 HG12 VAL 56 2HG1 VAL 56 6.096 -0.610 -2.443 366 HG13 VAL 56 3HG1 VAL 56 4.932 0.560 -1.820 367 HG21 VAL 56 3HG2 VAL 56 5.275 3.086 -2.783 368 HG22 VAL 56 1HG2 VAL 56 6.798 3.395 -3.616 369 HG23 VAL 56 2HG2 VAL 56 5.568 2.384 -4.374 370 H THR 57 H THR 57 6.413 0.609 0.675 371 HA THR 57 HA THR 57 8.242 -1.664 0.373 372 HB THR 57 HB THR 57 7.824 -0.250 3.011 373 HG1 THR 57 1HG THR 57 9.991 0.459 2.701 374 HG21 THR 57 3HG2 THR 57 9.956 -2.257 2.349 375 HG22 THR 57 1HG2 THR 57 8.357 -2.772 2.884 376 HG23 THR 57 2HG2 THR 57 9.354 -1.760 3.930 377 H ILE 58 H ILE 58 7.013 -3.418 0.271 378 HA ILE 58 HA ILE 58 4.461 -3.469 1.714 379 HB ILE 58 HB ILE 58 5.438 -5.421 -0.370 380 HG12 ILE 58 1HG1 ILE 58 3.399 -3.275 -0.876 381 HG13 ILE 58 2HG1 ILE 58 5.115 -2.924 -1.046 382 HG21 ILE 58 1HG2 ILE 58 3.728 -6.574 0.543 383 HG22 ILE 58 2HG2 ILE 58 2.990 -5.135 1.243 384 HG23 ILE 58 3HG2 ILE 58 2.748 -5.509 -0.464 385 HD11 ILE 58 3HD1 ILE 58 3.351 -4.179 -2.886 386 HD12 ILE 58 1HD1 ILE 58 5.046 -3.739 -3.095 387 HD13 ILE 58 2HD1 ILE 58 4.619 -5.321 -2.441 388 H GLU 59 H GLU 59 3.940 -5.062 3.175 389 HA GLU 59 HA GLU 59 6.110 -6.905 3.934 390 HB2 GLU 59 1HB GLU 59 4.326 -5.247 5.711 391 HB3 GLU 59 2HB GLU 59 5.216 -6.642 6.306 392 HG2 GLU 59 1HG GLU 59 7.288 -5.620 5.945 393 HG3 GLU 59 2HG GLU 59 6.593 -4.386 4.895 394 H GLY 60 H GLY 60 5.504 -8.947 4.690 395 HA2 GLY 60 1HA GLY 60 2.938 -9.829 5.284 396 HA3 GLY 60 2HA GLY 60 3.135 -10.011 3.547 397 HA PRO 61 HA PRO 61 4.836 -13.737 5.878 398 HB2 PRO 61 1HB PRO 61 3.103 -15.562 4.859 399 HB3 PRO 61 2HB PRO 61 2.781 -14.653 6.341 400 HG2 PRO 61 1HG PRO 61 1.787 -14.157 3.561 401 HG3 PRO 61 2HG PRO 61 0.903 -14.078 5.096 402 HD2 PRO 61 1HD PRO 61 1.819 -11.869 3.827 403 HD3 PRO 61 2HD PRO 61 1.707 -11.976 5.595 404 H SER 62 H SER 62 3.651 -13.313 2.572 405 HA SER 62 HA SER 62 5.938 -14.910 1.619 406 HB2 SER 62 1HB SER 62 3.164 -14.603 0.465 407 HB3 SER 62 2HB SER 62 4.512 -15.262 -0.462 408 HG SER 62 HG SER 62 2.950 -16.604 1.087 409 H LYS 63 H LYS 63 7.175 -14.114 -0.053 410 HA LYS 63 HA LYS 63 7.114 -11.251 -0.394 411 HB2 LYS 63 1HB LYS 63 8.952 -13.412 -1.422 412 HB3 LYS 63 2HB LYS 63 9.142 -11.717 -1.852 413 HG2 LYS 63 1HG LYS 63 8.973 -12.417 1.028 414 HG3 LYS 63 2HG LYS 63 10.459 -12.800 0.157 415 HD2 LYS 63 1HD LYS 63 10.765 -10.509 -0.464 416 HD3 LYS 63 2HD LYS 63 9.170 -10.074 0.155 417 HE2 LYS 63 1HE LYS 63 11.112 -11.333 2.023 418 HE3 LYS 63 2HE LYS 63 11.376 -9.654 1.556 419 HZ1 LYS 63 3HZ LYS 63 9.595 -8.961 2.714 420 HZ2 LYS 63 1HZ LYS 63 9.827 -10.392 3.586 421 HZ3 LYS 63 2HZ LYS 63 8.669 -10.330 2.355 422 H VAL 64 H VAL 64 5.556 -10.501 -1.707 423 HA VAL 64 HA VAL 64 4.597 -11.896 -3.995 424 HB VAL 64 HB VAL 64 3.468 -9.704 -4.532 425 HG11 VAL 64 1HG1 VAL 64 1.769 -10.169 -3.090 426 HG12 VAL 64 2HG1 VAL 64 2.728 -11.633 -2.864 427 HG13 VAL 64 3HG1 VAL 64 2.841 -10.314 -1.698 428 HG21 VAL 64 3HG2 VAL 64 5.411 -8.657 -2.860 429 HG22 VAL 64 1HG2 VAL 64 3.995 -7.809 -3.481 430 HG23 VAL 64 2HG2 VAL 64 3.935 -8.583 -1.898 431 H LYS 65 H LYS 65 4.638 -11.014 -6.206 432 HA LYS 65 HA LYS 65 7.352 -10.300 -6.938 433 HB2 LYS 65 1HB LYS 65 4.920 -11.181 -8.465 434 HB3 LYS 65 2HB LYS 65 6.309 -10.504 -9.305 435 HG2 LYS 65 1HG LYS 65 7.727 -12.257 -8.515 436 HG3 LYS 65 2HG LYS 65 6.457 -12.873 -7.456 437 HD2 LYS 65 1HD LYS 65 5.079 -13.344 -9.465 438 HD3 LYS 65 2HD LYS 65 6.437 -12.839 -10.474 439 HE2 LYS 65 1HE LYS 65 6.729 -14.995 -8.406 440 HE3 LYS 65 2HE LYS 65 6.127 -15.348 -10.025 441 HZ1 LYS 65 3HZ LYS 65 8.222 -14.169 -10.818 442 HZ2 LYS 65 1HZ LYS 65 8.406 -15.714 -10.154 443 HZ3 LYS 65 2HZ LYS 65 8.792 -14.347 -9.235 444 H MET 66 H MET 66 7.705 -8.171 -6.502 445 HA MET 66 HA MET 66 5.771 -6.159 -7.264 446 HB2 MET 66 1HB MET 66 8.370 -6.180 -5.803 447 HB3 MET 66 2HB MET 66 7.844 -4.670 -6.535 448 HG2 MET 66 1HG MET 66 5.951 -4.534 -5.185 449 HG3 MET 66 2HG MET 66 6.031 -6.238 -4.745 450 HE1 MET 66 3HE MET 66 8.391 -2.767 -4.010 451 HE2 MET 66 1HE MET 66 6.631 -2.821 -4.106 452 HE3 MET 66 2HE MET 66 7.425 -2.734 -2.534 453 H ASP 67 H ASP 67 5.691 -5.189 -9.175 454 HA ASP 67 HA ASP 67 8.091 -5.267 -10.887 455 HB2 ASP 67 1HB ASP 67 5.172 -5.454 -11.648 456 HB3 ASP 67 2HB ASP 67 6.465 -5.186 -12.815 457 H CYS 68 H CYS 68 8.983 -3.321 -11.000 458 HA CYS 68 HA CYS 68 7.479 -0.925 -10.491 459 HB2 CYS 68 1HB CYS 68 9.622 0.231 -10.831 460 HB3 CYS 68 2HB CYS 68 9.793 -1.123 -9.720 461 HG CYS 68 HG CYS 68 11.530 -0.482 -12.375 462 H GLN 69 H GLN 69 7.144 0.804 -11.931 463 HA GLN 69 HA GLN 69 7.853 0.709 -14.674 464 HB2 GLN 69 1HB GLN 69 6.096 -1.083 -14.577 465 HB3 GLN 69 2HB GLN 69 4.940 0.153 -14.097 466 HG2 GLN 69 1HG GLN 69 4.670 -0.206 -16.420 467 HG3 GLN 69 2HG GLN 69 5.464 1.355 -16.220 468 HE21 GLN 69 1HE2 GLN 69 6.899 1.673 -17.749 469 HE22 GLN 69 2HE2 GLN 69 7.977 0.492 -18.403 470 H GLU 70 H GLU 70 8.199 2.804 -14.975 471 HA GLU 70 HA GLU 70 6.887 4.843 -13.495 472 HB2 GLU 70 1HB GLU 70 8.159 6.398 -14.821 473 HB3 GLU 70 2HB GLU 70 9.193 5.036 -14.412 474 HG2 GLU 70 1HG GLU 70 9.018 4.137 -16.603 475 HG3 GLU 70 2HG GLU 70 7.746 5.278 -17.034 476 H THR 71 H THR 71 5.510 6.508 -14.285 477 HA THR 71 HA THR 71 4.127 5.994 -16.809 478 HB THR 71 HB THR 71 1.912 6.404 -15.614 479 HG1 THR 71 1HG THR 71 1.876 6.341 -13.468 480 HG21 THR 71 3HG2 THR 71 3.195 4.101 -16.276 481 HG22 THR 71 1HG2 THR 71 1.544 4.179 -15.662 482 HG23 THR 71 2HG2 THR 71 2.880 3.834 -14.562 483 HA PRO 72 HA PRO 72 4.121 10.370 -17.181 484 HB2 PRO 72 1HB PRO 72 1.885 10.761 -18.670 485 HB3 PRO 72 2HB PRO 72 3.369 10.064 -19.330 486 HG2 PRO 72 1HG PRO 72 0.879 8.685 -18.402 487 HG3 PRO 72 2HG PRO 72 1.862 8.369 -19.843 488 HD2 PRO 72 1HD PRO 72 2.040 6.864 -17.599 489 HD3 PRO 72 2HD PRO 72 3.431 7.161 -18.663 490 H GLU 73 H GLU 73 1.448 8.729 -15.723 491 HA GLU 73 HA GLU 73 0.174 11.186 -14.837 492 HB2 GLU 73 1HB GLU 73 -1.255 9.324 -15.483 493 HB3 GLU 73 2HB GLU 73 -0.482 8.287 -14.293 494 HG2 GLU 73 1HG GLU 73 -1.476 9.392 -12.501 495 HG3 GLU 73 2HG GLU 73 -1.874 10.806 -13.476 496 H GLY 74 H GLY 74 2.006 8.485 -13.473 497 HA2 GLY 74 1HA GLY 74 3.191 10.017 -11.448 498 HA3 GLY 74 2HA GLY 74 1.781 9.222 -10.765 499 H TYR 75 H TYR 75 2.198 7.364 -9.794 500 HA TYR 75 HA TYR 75 4.380 5.689 -10.845 501 HB2 TYR 75 1HB TYR 75 3.683 6.124 -7.934 502 HB3 TYR 75 2HB TYR 75 4.928 5.038 -8.539 503 HD1 TYR 75 1HD TYR 75 6.541 6.382 -10.338 504 HD2 TYR 75 2HD TYR 75 4.502 8.056 -7.000 505 HE1 TYR 75 1HE TYR 75 8.180 8.215 -10.264 506 HE2 TYR 75 2HE TYR 75 6.135 9.894 -6.917 507 HH TYR 75 HH TYR 75 7.731 11.002 -8.274 508 H LYS 76 H LYS 76 3.564 3.872 -11.625 509 HA LYS 76 HA LYS 76 1.143 2.751 -10.387 510 HB2 LYS 76 1HB LYS 76 0.873 3.253 -12.744 511 HB3 LYS 76 2HB LYS 76 2.323 2.340 -13.140 512 HG2 LYS 76 1HG LYS 76 1.013 0.371 -12.008 513 HG3 LYS 76 2HG LYS 76 -0.390 1.369 -12.398 514 HD2 LYS 76 1HD LYS 76 0.111 1.321 -14.717 515 HD3 LYS 76 2HD LYS 76 1.712 0.637 -14.427 516 HE2 LYS 76 1HE LYS 76 0.886 -1.468 -14.019 517 HE3 LYS 76 2HE LYS 76 -0.685 -0.866 -13.491 518 HZ1 LYS 76 3HZ LYS 76 -0.996 -1.887 -15.583 519 HZ2 LYS 76 1HZ LYS 76 0.325 -1.082 -16.269 520 HZ3 LYS 76 2HZ LYS 76 -1.072 -0.220 -15.861 521 H VAL 77 H VAL 77 1.362 1.004 -9.166 522 HA VAL 77 HA VAL 77 3.707 -0.731 -9.598 523 HB VAL 77 HB VAL 77 2.266 -0.194 -6.997 524 HG11 VAL 77 1HG1 VAL 77 3.058 -2.446 -7.000 525 HG12 VAL 77 2HG1 VAL 77 4.619 -1.954 -7.661 526 HG13 VAL 77 3HG1 VAL 77 4.169 -1.489 -6.020 527 HG21 VAL 77 3HG2 VAL 77 3.742 1.644 -7.932 528 HG22 VAL 77 1HG2 VAL 77 4.146 1.063 -6.317 529 HG23 VAL 77 2HG2 VAL 77 5.097 0.538 -7.706 530 H MET 78 H MET 78 3.428 -2.991 -9.211 531 HA MET 78 HA MET 78 0.653 -3.936 -9.123 532 HB2 MET 78 1HB MET 78 2.699 -4.908 -11.125 533 HB3 MET 78 2HB MET 78 1.049 -5.491 -10.957 534 HG2 MET 78 1HG MET 78 0.137 -3.571 -11.863 535 HG3 MET 78 2HG MET 78 1.572 -2.607 -11.521 536 HE1 MET 78 3HE MET 78 3.834 -2.932 -12.688 537 HE2 MET 78 1HE MET 78 3.828 -3.005 -14.451 538 HE3 MET 78 2HE MET 78 2.902 -1.756 -13.617 539 H TYR 79 H TYR 79 0.355 -5.904 -8.131 540 HA TYR 79 HA TYR 79 2.628 -7.540 -7.400 541 HB2 TYR 79 1HB TYR 79 2.473 -7.320 -5.063 542 HB3 TYR 79 2HB TYR 79 2.392 -5.666 -5.660 543 HD1 TYR 79 1HD TYR 79 0.195 -8.494 -4.620 544 HD2 TYR 79 2HD TYR 79 0.663 -4.279 -4.963 545 HE1 TYR 79 1HE TYR 79 -1.919 -8.167 -3.406 546 HE2 TYR 79 2HE TYR 79 -1.449 -3.940 -3.748 547 HH TYR 79 HH TYR 79 -3.560 -5.254 -3.326 548 H THR 80 H THR 80 2.074 -9.635 -6.896 549 HA THR 80 HA THR 80 -0.797 -10.281 -6.842 550 HB THR 80 HB THR 80 1.329 -11.633 -8.509 551 HG1 THR 80 1HG THR 80 -0.275 -11.135 -10.165 552 HG21 THR 80 3HG2 THR 80 -1.161 -12.798 -9.037 553 HG22 THR 80 1HG2 THR 80 -1.025 -12.759 -7.280 554 HG23 THR 80 2HG2 THR 80 0.221 -13.551 -8.244 555 HA PRO 81 HA PRO 81 0.809 -12.342 -3.176 556 HB2 PRO 81 1HB PRO 81 -1.638 -12.854 -2.118 557 HB3 PRO 81 2HB PRO 81 -0.850 -11.276 -1.997 558 HG2 PRO 81 1HG PRO 81 -2.971 -12.193 -3.900 559 HG3 PRO 81 2HG PRO 81 -2.842 -10.657 -3.023 560 HD2 PRO 81 1HD PRO 81 -2.147 -10.911 -5.628 561 HD3 PRO 81 2HD PRO 81 -1.332 -9.781 -4.528 562 H MET 82 H MET 82 1.479 -14.385 -3.265 563 HA MET 82 HA MET 82 0.020 -16.346 -4.827 564 HB2 MET 82 1HB MET 82 2.593 -16.006 -4.737 565 HB3 MET 82 2HB MET 82 2.503 -16.926 -3.241 566 HG2 MET 82 1HG MET 82 1.501 -18.794 -4.433 567 HG3 MET 82 2HG MET 82 1.546 -17.871 -5.933 568 HE1 MET 82 3HE MET 82 2.535 -19.258 -7.281 569 HE2 MET 82 1HE MET 82 3.996 -18.340 -7.649 570 HE3 MET 82 2HE MET 82 4.115 -20.038 -7.188 571 H ALA 83 H ALA 83 0.525 -15.506 -1.505 572 HA ALA 83 HA ALA 83 -1.160 -17.784 -0.713 573 HB1 ALA 83 3HB ALA 83 0.912 -16.805 1.185 574 HB2 ALA 83 1HB ALA 83 0.187 -18.405 1.029 575 HB3 ALA 83 2HB ALA 83 1.404 -17.871 -0.131 576 HA PRO 84 HA PRO 84 -3.684 -14.749 1.231 577 HB2 PRO 84 1HB PRO 84 -4.916 -16.311 3.078 578 HB3 PRO 84 2HB PRO 84 -5.296 -16.381 1.353 579 HG2 PRO 84 1HG PRO 84 -3.540 -18.178 2.979 580 HG3 PRO 84 2HG PRO 84 -4.727 -18.603 1.733 581 HD2 PRO 84 1HD PRO 84 -2.066 -18.515 1.240 582 HD3 PRO 84 2HD PRO 84 -3.279 -18.112 0.008 583 H GLY 85 H GLY 85 -4.091 -13.704 3.302 584 HA2 GLY 85 1HA GLY 85 -3.208 -14.100 5.769 585 HA3 GLY 85 2HA GLY 85 -1.691 -13.730 4.963 586 H ASN 86 H ASN 86 -1.289 -11.828 6.043 587 HA ASN 86 HA ASN 86 -3.118 -9.613 5.396 588 HB2 ASN 86 1HB ASN 86 -2.161 -8.628 7.630 589 HB3 ASN 86 2HB ASN 86 -3.491 -9.781 7.677 590 HD21 ASN 86 1HD2 ASN 86 -0.512 -9.023 8.907 591 HD22 ASN 86 2HD2 ASN 86 -0.096 -10.556 9.587 592 H TYR 87 H TYR 87 -2.128 -8.333 3.989 593 HA TYR 87 HA TYR 87 0.784 -7.978 4.196 594 HB2 TYR 87 1HB TYR 87 -1.104 -7.599 1.868 595 HB3 TYR 87 2HB TYR 87 0.590 -7.123 1.834 596 HD1 TYR 87 1HD TYR 87 -1.493 -10.122 2.643 597 HD2 TYR 87 2HD TYR 87 2.101 -8.616 0.936 598 HE1 TYR 87 1HE TYR 87 -0.875 -12.400 1.950 599 HE2 TYR 87 2HE TYR 87 2.729 -10.889 0.237 600 HH TYR 87 HH TYR 87 0.667 -13.386 0.035 601 H LEU 88 H LEU 88 1.693 -5.916 4.142 602 HA LEU 88 HA LEU 88 -0.189 -3.700 4.617 603 HB2 LEU 88 1HB LEU 88 1.251 -4.631 6.571 604 HB3 LEU 88 2HB LEU 88 2.562 -3.753 5.787 605 HG LEU 88 HG LEU 88 1.676 -2.408 7.562 606 HD11 LEU 88 1HD1 LEU 88 1.619 -0.465 6.409 607 HD12 LEU 88 2HD1 LEU 88 0.398 -1.043 5.276 608 HD13 LEU 88 3HD1 LEU 88 2.084 -1.516 5.072 609 HD21 LEU 88 3HD2 LEU 88 -0.599 -1.811 7.799 610 HD22 LEU 88 1HD2 LEU 88 -0.573 -3.557 7.551 611 HD23 LEU 88 2HD2 LEU 88 -1.017 -2.485 6.223 612 H ILE 89 H ILE 89 0.114 -1.860 3.489 613 HA ILE 89 HA ILE 89 2.466 -1.745 1.716 614 HB ILE 89 HB ILE 89 -0.156 -0.369 1.177 615 HG12 ILE 89 1HG1 ILE 89 0.724 -3.032 0.051 616 HG13 ILE 89 2HG1 ILE 89 -0.431 -2.864 1.368 617 HG21 ILE 89 1HG2 ILE 89 0.773 -0.566 -1.195 618 HG22 ILE 89 2HG2 ILE 89 1.544 0.591 -0.112 619 HG23 ILE 89 3HG2 ILE 89 2.309 -0.966 -0.426 620 HD11 ILE 89 3HD1 ILE 89 -1.854 -3.054 -0.391 621 HD12 ILE 89 1HD1 ILE 89 -1.651 -1.302 -0.363 622 HD13 ILE 89 2HD1 ILE 89 -0.743 -2.277 -1.520 623 H SER 90 H SER 90 3.886 -0.298 2.418 624 HA SER 90 HA SER 90 2.957 2.051 3.892 625 HB2 SER 90 1HB SER 90 5.543 0.582 3.680 626 HB3 SER 90 2HB SER 90 5.606 2.305 4.047 627 HG SER 90 HG SER 90 4.999 1.850 5.996 628 H VAL 91 H VAL 91 2.639 3.890 2.849 629 HA VAL 91 HA VAL 91 4.214 4.424 0.413 630 HB VAL 91 HB VAL 91 1.396 5.287 1.070 631 HG11 VAL 91 1HG1 VAL 91 2.073 7.130 -0.084 632 HG12 VAL 91 2HG1 VAL 91 3.350 6.263 -0.940 633 HG13 VAL 91 3HG1 VAL 91 1.669 6.085 -1.446 634 HG21 VAL 91 3HG2 VAL 91 1.929 2.917 0.204 635 HG22 VAL 91 1HG2 VAL 91 0.671 3.847 -0.610 636 HG23 VAL 91 2HG2 VAL 91 2.277 3.719 -1.328 637 H LYS 92 H LYS 92 5.424 6.211 0.376 638 HA LYS 92 HA LYS 92 4.813 8.412 2.204 639 HB2 LYS 92 1HB LYS 92 7.367 6.834 2.128 640 HB3 LYS 92 2HB LYS 92 7.371 8.519 2.631 641 HG2 LYS 92 1HG LYS 92 5.978 8.066 4.488 642 HG3 LYS 92 2HG LYS 92 5.610 6.442 3.901 643 HD2 LYS 92 1HD LYS 92 8.455 7.159 4.412 644 HD3 LYS 92 2HD LYS 92 7.403 6.848 5.796 645 HE2 LYS 92 1HE LYS 92 6.781 4.676 4.745 646 HE3 LYS 92 2HE LYS 92 7.986 4.987 3.496 647 HZ1 LYS 92 3HZ LYS 92 8.619 4.875 6.392 648 HZ2 LYS 92 1HZ LYS 92 9.714 4.926 5.103 649 HZ3 LYS 92 2HZ LYS 92 8.763 3.550 5.350 650 H TYR 93 H TYR 93 5.079 10.360 1.293 651 HA TYR 93 HA TYR 93 6.548 10.486 -1.260 652 HB2 TYR 93 1HB TYR 93 4.254 10.795 -1.778 653 HB3 TYR 93 2HB TYR 93 4.006 11.861 -0.399 654 HD1 TYR 93 2HD TYR 93 4.955 14.169 -0.445 655 HD2 TYR 93 1HD TYR 93 5.015 11.639 -3.866 656 HE1 TYR 93 2HE TYR 93 5.365 16.125 -1.878 657 HE2 TYR 93 1HE TYR 93 5.426 13.588 -5.308 658 HH TYR 93 HH TYR 93 6.349 15.862 -5.110 659 H GLY 94 H GLY 94 8.158 11.922 -1.412 660 HA2 GLY 94 1HA GLY 94 9.485 13.755 -0.963 661 HA3 GLY 94 2HA GLY 94 8.196 14.381 0.054 662 H GLY 95 H GLY 95 7.903 12.917 2.129 663 HA2 GLY 95 1HA GLY 95 10.565 12.227 3.184 664 HA3 GLY 95 2HA GLY 95 9.540 13.351 4.064 665 HA PRO 96 HA PRO 96 8.726 9.144 5.773 666 HB2 PRO 96 1HB PRO 96 8.633 9.971 8.357 667 HB3 PRO 96 2HB PRO 96 10.141 9.547 7.538 668 HG2 PRO 96 1HG PRO 96 8.954 12.249 8.042 669 HG3 PRO 96 2HG PRO 96 10.638 11.719 8.205 670 HD2 PRO 96 1HD PRO 96 9.748 13.103 6.055 671 HD3 PRO 96 2HD PRO 96 11.044 11.895 5.943 672 H ASN 97 H ASN 97 7.183 12.235 5.959 673 HA ASN 97 HA ASN 97 4.867 11.507 7.398 674 HB2 ASN 97 1HB ASN 97 5.232 13.664 5.306 675 HB3 ASN 97 2HB ASN 97 3.868 13.542 6.414 676 HD21 ASN 97 1HD2 ASN 97 7.206 14.360 6.055 677 HD22 ASN 97 2HD2 ASN 97 7.413 15.081 7.611 678 H HIS 98 H HIS 98 3.610 9.860 6.802 679 HA HIS 98 HA HIS 98 3.318 8.937 4.146 680 HB2 HIS 98 1HB HIS 98 1.634 7.440 5.027 681 HB3 HIS 98 2HB HIS 98 2.970 7.532 6.171 682 HD2 HIS 98 2HD HIS 98 2.315 8.485 8.679 683 HE1 HIS 98 1HE HIS 98 -1.778 9.240 7.856 684 HE2 HIS 98 2HE HIS 98 0.017 9.207 9.622 685 H ILE 99 H ILE 99 1.147 8.734 3.060 686 HA ILE 99 HA ILE 99 -0.060 11.384 2.930 687 HB ILE 99 HB ILE 99 -1.164 10.556 0.881 688 HG12 ILE 99 1HG1 ILE 99 0.534 8.091 1.004 689 HG13 ILE 99 2HG1 ILE 99 -1.028 8.105 1.816 690 HG21 ILE 99 1HG2 ILE 99 1.820 10.138 0.992 691 HG22 ILE 99 2HG2 ILE 99 0.879 10.359 -0.482 692 HG23 ILE 99 3HG2 ILE 99 0.980 11.661 0.703 693 HD11 ILE 99 3HD1 ILE 99 -0.729 8.852 -1.071 694 HD12 ILE 99 1HD1 ILE 99 -0.947 7.183 -0.544 695 HD13 ILE 99 2HD1 ILE 99 -2.189 8.387 -0.197 696 H VAL 100 H VAL 100 -2.541 11.151 2.197 697 HA VAL 100 HA VAL 100 -3.992 10.555 4.493 698 HB VAL 100 HB VAL 100 -4.675 11.965 2.437 699 HG11 VAL 100 1HG1 VAL 100 -6.069 10.856 0.806 700 HG12 VAL 100 2HG1 VAL 100 -4.472 10.106 0.820 701 HG13 VAL 100 3HG1 VAL 100 -5.831 9.305 1.610 702 HG21 VAL 100 3HG2 VAL 100 -6.014 11.275 4.572 703 HG22 VAL 100 1HG2 VAL 100 -6.845 12.023 3.209 704 HG23 VAL 100 2HG2 VAL 100 -6.925 10.277 3.440 705 H GLY 101 H GLY 101 -5.388 8.868 5.063 706 HA2 GLY 101 1HA GLY 101 -6.267 6.727 5.046 707 HA3 GLY 101 2HA GLY 101 -5.624 6.514 3.424 708 H SER 102 H SER 102 -2.972 6.795 3.689 709 HA SER 102 HA SER 102 -2.027 4.373 4.483 710 HB2 SER 102 1HB SER 102 -0.842 6.450 3.346 711 HB3 SER 102 2HB SER 102 -0.257 6.729 4.986 712 HG SER 102 HG SER 102 0.486 4.836 3.172 713 HA PRO 103 HA PRO 103 -0.326 3.266 5.358 714 HB2 PRO 103 1HB PRO 103 -0.701 1.025 6.844 715 HB3 PRO 103 2HB PRO 103 0.617 2.165 7.141 716 HG2 PRO 103 1HG PRO 103 -2.016 1.908 8.542 717 HG3 PRO 103 2HG PRO 103 -0.404 2.172 9.230 718 HD2 PRO 103 1HD PRO 103 -2.190 4.179 8.891 719 HD3 PRO 103 2HD PRO 103 -0.437 4.429 8.764 720 H PHE 104 H PHE 104 -1.099 1.015 4.541 721 HA PHE 104 HA PHE 104 -4.031 1.031 4.275 722 HB2 PHE 104 1HB PHE 104 -2.066 0.393 2.066 723 HB3 PHE 104 2HB PHE 104 -3.820 0.428 1.929 724 HD1 PHE 104 2HD PHE 104 -4.975 2.677 2.438 725 HD2 PHE 104 1HD PHE 104 -0.825 2.280 1.576 726 HE1 PHE 104 2HE PHE 104 -4.879 5.057 1.821 727 HE2 PHE 104 1HE PHE 104 -0.723 4.660 0.958 728 HZ PHE 104 HZ PHE 104 -2.751 6.051 1.079 729 H LYS 105 H LYS 105 -4.777 -0.735 5.235 730 HA LYS 105 HA LYS 105 -3.154 -3.161 5.300 731 HB2 LYS 105 1HB LYS 105 -4.136 -2.418 7.404 732 HB3 LYS 105 2HB LYS 105 -5.744 -2.457 6.694 733 HG2 LYS 105 1HG LYS 105 -5.733 -4.815 6.560 734 HG3 LYS 105 2HG LYS 105 -4.004 -4.897 6.908 735 HD2 LYS 105 1HD LYS 105 -4.665 -3.725 9.134 736 HD3 LYS 105 2HD LYS 105 -6.286 -4.315 8.756 737 HE2 LYS 105 1HE LYS 105 -5.472 -6.592 8.670 738 HE3 LYS 105 2HE LYS 105 -3.816 -6.040 8.919 739 HZ1 LYS 105 3HZ LYS 105 -4.139 -6.104 11.094 740 HZ2 LYS 105 1HZ LYS 105 -5.702 -6.705 10.854 741 HZ3 LYS 105 2HZ LYS 105 -5.448 -5.038 10.980 742 H ALA 106 H ALA 106 -3.468 -4.777 3.927 743 HA ALA 106 HA ALA 106 -6.072 -4.969 2.557 744 HB1 ALA 106 3HB ALA 106 -4.978 -5.728 0.583 745 HB2 ALA 106 1HB ALA 106 -4.148 -4.265 1.115 746 HB3 ALA 106 2HB ALA 106 -3.427 -5.846 1.416 747 H LYS 107 H LYS 107 -7.165 -6.801 2.832 748 HA LYS 107 HA LYS 107 -5.804 -9.053 4.129 749 HB2 LYS 107 1HB LYS 107 -7.839 -8.055 5.200 750 HB3 LYS 107 2HB LYS 107 -8.773 -8.588 3.809 751 HG2 LYS 107 1HG LYS 107 -8.547 -10.834 4.357 752 HG3 LYS 107 2HG LYS 107 -7.156 -10.537 5.403 753 HD2 LYS 107 1HD LYS 107 -8.780 -10.835 6.986 754 HD3 LYS 107 2HD LYS 107 -8.916 -9.092 6.742 755 HE2 LYS 107 1HE LYS 107 -10.816 -9.350 5.345 756 HE3 LYS 107 2HE LYS 107 -10.577 -11.092 5.226 757 HZ1 LYS 107 3HZ LYS 107 -11.841 -11.365 7.005 758 HZ2 LYS 107 1HZ LYS 107 -12.112 -9.697 7.086 759 HZ3 LYS 107 2HZ LYS 107 -10.821 -10.386 7.933 760 H VAL 108 H VAL 108 -5.218 -10.712 2.909 761 HA VAL 108 HA VAL 108 -6.393 -11.065 0.268 762 HB VAL 108 HB VAL 108 -4.174 -12.690 1.506 763 HG11 VAL 108 1HG1 VAL 108 -3.672 -13.400 -0.668 764 HG12 VAL 108 2HG1 VAL 108 -5.433 -13.468 -0.582 765 HG13 VAL 108 3HG1 VAL 108 -4.641 -12.124 -1.404 766 HG21 VAL 108 3HG2 VAL 108 -2.812 -10.942 1.361 767 HG22 VAL 108 1HG2 VAL 108 -3.163 -10.816 -0.362 768 HG23 VAL 108 2HG2 VAL 108 -4.147 -9.932 0.805 769 H THR 109 H THR 109 -7.422 -12.928 -0.431 770 HA THR 109 HA THR 109 -7.999 -15.008 1.546 771 HB THR 109 HB THR 109 -10.417 -14.983 0.873 772 HG1 THR 109 1HG THR 109 -11.201 -13.227 -0.233 773 HG21 THR 109 3HG2 THR 109 -10.040 -12.307 2.028 774 HG22 THR 109 1HG2 THR 109 -9.154 -13.594 2.843 775 HG23 THR 109 2HG2 THR 109 -10.905 -13.705 2.665 776 H GLY 110 H GLY 110 -8.154 -17.023 0.699 777 HA2 GLY 110 1HA GLY 110 -9.063 -18.089 -1.523 778 HA3 GLY 110 2HA GLY 110 -7.654 -17.266 -2.176 779 H GLN 111 H GLN 111 -8.641 -20.193 -1.437 780 HA GLN 111 HA GLN 111 -6.918 -21.382 0.334 781 HB2 GLN 111 1HB GLN 111 -7.174 -23.446 -1.005 782 HB3 GLN 111 2HB GLN 111 -8.704 -22.621 -0.737 783 HG2 GLN 111 1HG GLN 111 -8.373 -21.576 -3.023 784 HG3 GLN 111 2HG GLN 111 -7.080 -22.751 -3.254 785 HE21 GLN 111 1HE2 GLN 111 -9.928 -22.262 -4.341 786 HE22 GLN 111 2HE2 GLN 111 -10.627 -23.841 -4.322 787 H ARG 112 H ARG 112 -4.789 -21.614 0.465 788 HA ARG 112 HA ARG 112 -2.902 -20.438 -1.057 789 HB2 ARG 112 1HB ARG 112 -2.644 -23.129 0.297 790 HB3 ARG 112 2HB ARG 112 -1.292 -22.146 -0.248 791 HG2 ARG 112 1HG ARG 112 -1.523 -20.635 1.443 792 HG3 ARG 112 2HG ARG 112 -3.258 -20.912 1.601 793 HD2 ARG 112 1HD ARG 112 -2.855 -23.043 2.674 794 HD3 ARG 112 2HD ARG 112 -1.118 -22.868 2.428 795 HE ARG 112 HE ARG 112 -1.854 -20.656 3.864 796 HH11 ARG 112 1HH1 ARG 112 -2.112 -24.101 4.298 797 HH12 ARG 112 2HH1 ARG 112 -2.035 -24.020 6.027 798 HH21 ARG 112 1HH2 ARG 112 -1.751 -20.537 6.139 799 HH22 ARG 112 2HH2 ARG 112 -1.831 -21.992 7.073 800 H LEU 113 H LEU 113 -2.490 -20.499 -3.158 801 HA LEU 113 HA LEU 113 -3.395 -22.530 -4.893 802 HB2 LEU 113 1HB LEU 113 -1.234 -20.491 -5.395 803 HB3 LEU 113 2HB LEU 113 -2.137 -21.385 -6.617 804 HG LEU 113 HG LEU 113 -3.289 -19.323 -4.738 805 HD11 LEU 113 1HD1 LEU 113 -1.726 -18.866 -6.933 806 HD12 LEU 113 2HD1 LEU 113 -2.931 -17.753 -6.287 807 HD13 LEU 113 3HD1 LEU 113 -3.353 -18.833 -7.616 808 HD21 LEU 113 3HD2 LEU 113 -4.576 -20.683 -7.098 809 HD22 LEU 113 1HD2 LEU 113 -5.325 -19.553 -5.969 810 HD23 LEU 113 2HD2 LEU 113 -4.837 -21.157 -5.419 811 H VAL 114 H VAL 114 -2.342 -24.204 -5.912 812 HA VAL 114 HA VAL 114 0.004 -25.223 -4.535 813 HB VAL 114 HB VAL 114 -1.665 -26.468 -6.725 814 HG11 VAL 114 1HG1 VAL 114 -0.415 -28.385 -6.571 815 HG12 VAL 114 2HG1 VAL 114 0.834 -27.165 -6.315 816 HG13 VAL 114 3HG1 VAL 114 0.142 -28.023 -4.938 817 HG21 VAL 114 3HG2 VAL 114 -2.742 -27.735 -5.032 818 HG22 VAL 114 1HG2 VAL 114 -1.616 -27.170 -3.798 819 HG23 VAL 114 2HG2 VAL 114 -2.785 -26.054 -4.502 820 H SER 115 H SER 115 2.014 -25.407 -5.371 821 HA SER 115 HA SER 115 3.012 -23.724 -7.253 822 HB2 SER 115 1HB SER 115 3.936 -26.393 -6.263 823 HB3 SER 115 2HB SER 115 4.806 -25.627 -7.592 824 HG SER 115 HG SER 115 4.736 -23.706 -6.061 825 HA PRO 116 HA PRO 116 1.696 -25.045 -11.231 826 HB2 PRO 116 1HB PRO 116 3.765 -24.145 -12.740 827 HB3 PRO 116 2HB PRO 116 2.561 -23.069 -12.021 828 HG2 PRO 116 1HG PRO 116 5.316 -23.740 -11.061 829 HG3 PRO 116 2HG PRO 116 4.504 -22.165 -11.118 830 HD2 PRO 116 1HD PRO 116 4.705 -23.618 -8.843 831 HD3 PRO 116 2HD PRO 116 3.317 -22.565 -9.184 832 H GLY 117 H GLY 117 5.063 -25.778 -10.362 833 HA2 GLY 117 1HA GLY 117 4.786 -28.313 -11.858 834 HA3 GLY 117 2HA GLY 117 6.282 -27.391 -11.838 835 H SER 118 H SER 118 7.619 -27.468 -10.044 836 HA SER 118 HA SER 118 8.641 -28.455 -8.266 837 HB2 SER 118 1HB SER 118 6.612 -27.348 -7.167 838 HB3 SER 118 2HB SER 118 5.886 -28.955 -7.142 839 HG SER 118 HG SER 118 8.294 -28.131 -5.890 840 H ALA 119 H ALA 119 8.254 -30.119 -10.451 841 HA ALA 119 HA ALA 119 8.391 -32.700 -9.165 842 HB1 ALA 119 3HB ALA 119 6.346 -32.328 -11.345 843 HB2 ALA 119 1HB ALA 119 6.661 -33.781 -10.396 844 HB3 ALA 119 2HB ALA 119 5.954 -32.360 -9.626 845 H ASN 120 H ASN 120 9.851 -33.957 -10.156 846 HA ASN 120 HA ASN 120 10.363 -33.736 -12.991 847 HB2 ASN 120 1HB ASN 120 12.685 -33.115 -12.824 848 HB3 ASN 120 2HB ASN 120 11.733 -31.903 -11.971 849 HD21 ASN 120 1HD2 ASN 120 14.555 -32.731 -11.709 850 HD22 ASN 120 2HD2 ASN 120 14.760 -33.135 -10.042 851 H GLU 121 H GLU 121 11.922 -35.361 -13.744 852 HA GLU 121 HA GLU 121 12.004 -37.678 -11.925 853 HB2 GLU 121 1HB GLU 121 10.553 -37.757 -14.061 854 HB3 GLU 121 2HB GLU 121 12.079 -37.882 -14.924 855 HG2 GLU 121 1HG GLU 121 12.622 -39.922 -13.777 856 HG3 GLU 121 2HG GLU 121 11.193 -39.770 -12.756 857 H THR 122 H THR 122 13.955 -38.292 -11.299 858 HA THR 122 HA THR 122 16.293 -37.345 -12.789 859 HB THR 122 HB THR 122 17.596 -37.950 -10.792 860 HG1 THR 122 1HG THR 122 16.675 -38.939 -9.092 861 HG21 THR 122 3HG2 THR 122 15.247 -36.121 -10.581 862 HG22 THR 122 1HG2 THR 122 16.967 -35.739 -10.635 863 HG23 THR 122 2HG2 THR 122 16.254 -36.389 -9.159 864 H SER 123 H SER 123 16.660 -38.763 -14.421 865 HA SER 123 HA SER 123 16.806 -41.623 -13.753 866 HB2 SER 123 1HB SER 123 15.328 -40.732 -15.682 867 HB3 SER 123 2HB SER 123 16.847 -40.517 -16.552 868 HG SER 123 HG SER 123 17.162 -42.853 -15.820 869 H SER 124 H SER 124 18.861 -41.655 -12.845 870 HA SER 124 HA SER 124 21.166 -40.449 -13.604 871 HB2 SER 124 1HB SER 124 22.372 -42.478 -12.770 872 HB3 SER 124 2HB SER 124 21.107 -41.913 -11.680 873 HG SER 124 HG SER 124 19.786 -43.542 -12.993 874 H ILE 125 H ILE 125 22.997 -41.104 -14.894 875 HA ILE 125 HA ILE 125 22.543 -41.451 -17.544 876 HB ILE 125 HB ILE 125 24.750 -40.903 -16.537 877 HG12 ILE 125 1HG1 ILE 125 24.929 -43.220 -18.468 878 HG13 ILE 125 2HG1 ILE 125 24.426 -41.601 -18.941 879 HG21 ILE 125 1HG2 ILE 125 25.635 -43.675 -16.371 880 HG22 ILE 125 2HG2 ILE 125 25.922 -42.325 -15.275 881 HG23 ILE 125 3HG2 ILE 125 24.427 -43.253 -15.157 882 HD11 ILE 125 3HD1 ILE 125 26.990 -42.572 -18.956 883 HD12 ILE 125 1HD1 ILE 125 26.523 -40.873 -19.024 884 HD13 ILE 125 2HD1 ILE 125 26.933 -41.614 -17.477 Start of MODEL 15 1 H1 GLY 1 H GLY 1 -30.577 21.455 25.725 2 HA2 GLY 1 1HA GLY 1 -32.652 20.116 24.545 3 HA3 GLY 1 2HA GLY 1 -32.616 21.667 23.719 4 H SER 2 H SER 2 -32.170 20.362 21.807 5 HA SER 2 HA SER 2 -29.652 18.981 21.629 6 HB2 SER 2 1HB SER 2 -30.255 18.767 19.206 7 HB3 SER 2 2HB SER 2 -31.493 18.155 20.303 8 HG SER 2 HG SER 2 -32.801 19.508 19.394 9 H SER 3 H SER 3 -30.993 21.980 20.269 10 HA SER 3 HA SER 3 -28.470 22.737 19.108 11 HB2 SER 3 1HB SER 3 -29.656 24.837 18.512 12 HB3 SER 3 2HB SER 3 -30.534 23.397 17.997 13 HG SER 3 HG SER 3 -31.855 25.002 19.045 14 H GLY 4 H GLY 4 -27.151 24.471 19.732 15 HA2 GLY 4 1HA GLY 4 -27.391 26.356 21.629 16 HA3 GLY 4 2HA GLY 4 -27.101 24.919 22.598 17 H SER 5 H SER 5 -25.728 25.830 19.457 18 HA SER 5 HA SER 5 -23.122 26.245 20.709 19 HB2 SER 5 1HB SER 5 -23.792 24.061 18.765 20 HB3 SER 5 2HB SER 5 -22.179 24.773 18.756 21 HG SER 5 HG SER 5 -22.239 22.993 20.146 22 H SER 6 H SER 6 -21.624 27.386 19.395 23 HA SER 6 HA SER 6 -22.940 28.987 17.321 24 HB2 SER 6 1HB SER 6 -20.705 29.472 19.233 25 HB3 SER 6 2HB SER 6 -20.652 30.313 17.684 26 HG SER 6 HG SER 6 -22.522 30.523 19.766 27 H GLY 7 H GLY 7 -21.268 29.822 15.614 28 HA2 GLY 7 1HA GLY 7 -20.151 27.418 14.378 29 HA3 GLY 7 2HA GLY 7 -20.463 28.949 13.573 30 H PHE 8 H PHE 8 -18.263 28.452 12.713 31 HA PHE 8 HA PHE 8 -16.244 29.629 14.496 32 HB2 PHE 8 1HB PHE 8 -14.554 28.100 13.433 33 HB3 PHE 8 2HB PHE 8 -15.728 27.288 14.463 34 HD1 PHE 8 2HD PHE 8 -17.899 26.469 13.152 35 HD2 PHE 8 1HD PHE 8 -14.073 27.141 11.412 36 HE1 PHE 8 2HE PHE 8 -18.480 24.958 11.299 37 HE2 PHE 8 1HE PHE 8 -14.648 25.632 9.556 38 HZ PHE 8 HZ PHE 8 -16.853 24.537 9.499 39 H LYS 9 H LYS 9 -16.756 28.644 11.106 40 HA LYS 9 HA LYS 9 -15.978 29.599 9.161 41 HB2 LYS 9 1HB LYS 9 -18.096 30.892 10.065 42 HB3 LYS 9 2HB LYS 9 -16.949 32.216 10.230 43 HG2 LYS 9 1HG LYS 9 -16.386 31.984 7.840 44 HG3 LYS 9 2HG LYS 9 -17.617 30.727 7.699 45 HD2 LYS 9 1HD LYS 9 -19.361 32.266 8.210 46 HD3 LYS 9 2HD LYS 9 -18.205 33.513 8.683 47 HE2 LYS 9 1HE LYS 9 -17.626 33.991 6.503 48 HE3 LYS 9 2HE LYS 9 -18.103 32.398 5.917 49 HZ1 LYS 9 3HZ LYS 9 -19.570 34.691 5.726 50 HZ2 LYS 9 1HZ LYS 9 -20.309 33.857 6.998 51 HZ3 LYS 9 2HZ LYS 9 -20.146 33.119 5.485 52 H VAL 10 H VAL 10 -13.900 29.440 11.031 53 HA VAL 10 HA VAL 10 -12.493 32.003 10.759 54 HB VAL 10 HB VAL 10 -10.880 31.082 12.395 55 HG11 VAL 10 1HG1 VAL 10 -13.452 30.685 13.777 56 HG12 VAL 10 2HG1 VAL 10 -12.125 31.790 14.138 57 HG13 VAL 10 3HG1 VAL 10 -13.289 32.192 12.876 58 HG21 VAL 10 3HG2 VAL 10 -12.437 28.954 13.461 59 HG22 VAL 10 1HG2 VAL 10 -12.167 28.642 11.746 60 HG23 VAL 10 2HG2 VAL 10 -10.794 28.904 12.822 61 H ARG 11 H ARG 11 -10.589 32.185 9.661 62 HA ARG 11 HA ARG 11 -9.954 30.026 7.826 63 HB2 ARG 11 1HB ARG 11 -9.222 32.922 8.029 64 HB3 ARG 11 2HB ARG 11 -8.233 31.848 7.048 65 HG2 ARG 11 1HG ARG 11 -9.686 32.571 5.462 66 HG3 ARG 11 2HG ARG 11 -10.586 31.173 6.054 67 HD2 ARG 11 1HD ARG 11 -12.029 32.517 7.338 68 HD3 ARG 11 2HD ARG 11 -10.974 33.923 7.199 69 HE ARG 11 HE ARG 11 -12.922 33.007 5.275 70 HH11 ARG 11 1HH1 ARG 11 -10.092 34.956 5.832 71 HH12 ARG 11 2HH1 ARG 11 -10.371 35.984 4.466 72 HH21 ARG 11 1HH2 ARG 11 -13.301 34.353 3.473 73 HH22 ARG 11 2HH2 ARG 11 -12.197 35.641 3.125 74 H VAL 12 H VAL 12 -8.468 28.552 8.275 75 HA VAL 12 HA VAL 12 -6.158 29.324 9.929 76 HB VAL 12 HB VAL 12 -6.180 26.994 10.866 77 HG11 VAL 12 1HG1 VAL 12 -8.610 28.662 11.507 78 HG12 VAL 12 2HG1 VAL 12 -7.837 27.477 12.563 79 HG13 VAL 12 3HG1 VAL 12 -6.984 28.958 12.123 80 HG21 VAL 12 3HG2 VAL 12 -8.194 25.681 10.747 81 HG22 VAL 12 1HG2 VAL 12 -8.999 26.931 9.798 82 HG23 VAL 12 2HG2 VAL 12 -7.647 26.033 9.108 83 H GLY 13 H GLY 13 -4.193 28.329 9.436 84 HA2 GLY 13 1HA GLY 13 -2.610 27.373 8.077 85 HA3 GLY 13 2HA GLY 13 -3.850 26.214 7.620 86 H GLU 14 H GLU 14 -1.883 28.711 6.552 87 HA GLU 14 HA GLU 14 -3.554 29.726 4.462 88 HB2 GLU 14 1HB GLU 14 -1.782 31.097 3.896 89 HB3 GLU 14 2HB GLU 14 -1.460 30.799 5.598 90 HG2 GLU 14 1HG GLU 14 0.002 28.851 4.732 91 HG3 GLU 14 2HG GLU 14 -0.063 29.710 3.195 92 HA PRO 15 HA PRO 15 -2.981 26.693 1.340 93 HB2 PRO 15 1HB PRO 15 -3.028 28.235 -0.894 94 HB3 PRO 15 2HB PRO 15 -4.470 27.898 0.071 95 HG2 PRO 15 1HG PRO 15 -2.713 30.322 0.073 96 HG3 PRO 15 2HG PRO 15 -4.483 30.223 0.121 97 HD2 PRO 15 1HD PRO 15 -2.989 30.670 2.334 98 HD3 PRO 15 2HD PRO 15 -4.523 29.777 2.382 99 H GLY 16 H GLY 16 -1.023 29.621 0.735 100 HA2 GLY 16 1HA GLY 16 0.882 28.643 -0.953 101 HA3 GLY 16 2HA GLY 16 1.231 29.829 0.295 102 H GLN 17 H GLN 17 1.409 26.483 -0.620 103 HA GLN 17 HA GLN 17 3.186 26.008 1.679 104 HB2 GLN 17 1HB GLN 17 0.962 24.321 0.607 105 HB3 GLN 17 2HB GLN 17 2.361 23.533 1.323 106 HG2 GLN 17 1HG GLN 17 0.711 25.627 2.716 107 HG3 GLN 17 2HG GLN 17 0.458 23.890 2.882 108 HE21 GLN 17 1HE2 GLN 17 1.800 26.474 4.322 109 HE22 GLN 17 2HE2 GLN 17 3.049 25.704 5.233 110 H ALA 18 H ALA 18 4.538 23.934 1.247 111 HA ALA 18 HA ALA 18 5.424 23.929 -1.563 112 HB1 ALA 18 3HB ALA 18 7.735 23.403 -0.307 113 HB2 ALA 18 1HB ALA 18 7.220 25.031 -0.749 114 HB3 ALA 18 2HB ALA 18 6.974 24.443 0.896 115 H GLY 19 H GLY 19 4.581 21.995 -2.187 116 HA2 GLY 19 1HA GLY 19 4.495 19.713 -2.439 117 HA3 GLY 19 2HA GLY 19 5.923 19.624 -1.419 118 H ASN 20 H ASN 20 2.539 19.177 -1.609 119 HA ASN 20 HA ASN 20 2.422 18.599 1.278 120 HB2 ASN 20 1HB ASN 20 0.862 20.362 0.552 121 HB3 ASN 20 2HB ASN 20 0.148 19.249 -0.611 122 HD21 ASN 20 1HD2 ASN 20 -1.798 19.898 0.626 123 HD22 ASN 20 2HD2 ASN 20 -2.206 18.971 2.026 124 HA PRO 21 HA PRO 21 2.195 14.354 -0.067 125 HB2 PRO 21 1HB PRO 21 1.983 13.294 2.423 126 HB3 PRO 21 2HB PRO 21 3.514 13.869 1.751 127 HG2 PRO 21 1HG PRO 21 1.640 15.240 3.640 128 HG3 PRO 21 2HG PRO 21 3.411 15.156 3.685 129 HD2 PRO 21 1HD PRO 21 2.078 17.323 2.756 130 HD3 PRO 21 2HD PRO 21 3.655 16.823 2.111 131 H ALA 22 H ALA 22 -0.039 15.800 2.270 132 HA ALA 22 HA ALA 22 -2.007 13.880 2.384 133 HB1 ALA 22 3HB ALA 22 -1.746 16.401 3.349 134 HB2 ALA 22 1HB ALA 22 -3.034 16.621 2.164 135 HB3 ALA 22 2HB ALA 22 -3.219 15.437 3.458 136 H LEU 23 H LEU 23 -1.586 16.418 -0.060 137 HA LEU 23 HA LEU 23 -3.894 16.025 -1.535 138 HB2 LEU 23 1HB LEU 23 -1.168 17.027 -2.148 139 HB3 LEU 23 2HB LEU 23 -2.229 16.659 -3.505 140 HG LEU 23 HG LEU 23 -3.045 18.516 -1.285 141 HD11 LEU 23 1HD1 LEU 23 -2.481 20.245 -3.186 142 HD12 LEU 23 2HD1 LEU 23 -1.310 19.011 -3.649 143 HD13 LEU 23 3HD1 LEU 23 -1.253 19.719 -2.034 144 HD21 LEU 23 3HD2 LEU 23 -4.791 17.544 -2.759 145 HD22 LEU 23 1HD2 LEU 23 -3.979 18.279 -4.142 146 HD23 LEU 23 2HD2 LEU 23 -4.665 19.300 -2.878 147 H VAL 24 H VAL 24 -0.901 14.191 -1.536 148 HA VAL 24 HA VAL 24 -1.410 12.660 -3.860 149 HB VAL 24 HB VAL 24 0.310 12.066 -1.451 150 HG11 VAL 24 1HG1 VAL 24 0.566 9.991 -2.195 151 HG12 VAL 24 2HG1 VAL 24 -0.540 10.311 -3.533 152 HG13 VAL 24 3HG1 VAL 24 1.185 10.627 -3.718 153 HG21 VAL 24 3HG2 VAL 24 0.915 14.031 -2.867 154 HG22 VAL 24 1HG2 VAL 24 2.146 12.769 -2.818 155 HG23 VAL 24 2HG2 VAL 24 1.101 12.927 -4.230 156 H SER 25 H SER 25 -2.703 10.971 -4.199 157 HA SER 25 HA SER 25 -3.785 9.535 -1.868 158 HB2 SER 25 1HB SER 25 -5.313 10.439 -4.320 159 HB3 SER 25 2HB SER 25 -5.956 9.362 -3.080 160 HG SER 25 HG SER 25 -5.253 11.228 -1.626 161 H ALA 26 H ALA 26 -4.864 7.427 -2.594 162 HA ALA 26 HA ALA 26 -3.474 6.227 -4.882 163 HB1 ALA 26 3HB ALA 26 -3.679 4.617 -2.386 164 HB2 ALA 26 1HB ALA 26 -2.509 4.519 -3.702 165 HB3 ALA 26 2HB ALA 26 -2.397 5.821 -2.517 166 H TYR 27 H TYR 27 -4.535 4.473 -5.837 167 HA TYR 27 HA TYR 27 -6.955 3.396 -4.747 168 HB2 TYR 27 1HB TYR 27 -8.504 4.246 -6.392 169 HB3 TYR 27 2HB TYR 27 -7.725 5.610 -5.598 170 HD1 TYR 27 2HD TYR 27 -7.945 3.673 -8.717 171 HD2 TYR 27 1HD TYR 27 -6.283 7.098 -6.816 172 HE1 TYR 27 2HE TYR 27 -7.277 4.560 -10.911 173 HE2 TYR 27 1HE TYR 27 -5.612 7.995 -9.006 174 HH TYR 27 HH TYR 27 -6.255 7.762 -11.365 175 H GLY 28 H GLY 28 -7.964 1.810 -6.228 176 HA2 GLY 28 1HA GLY 28 -7.337 0.893 -8.626 177 HA3 GLY 28 2HA GLY 28 -5.873 0.458 -7.757 178 H THR 29 H THR 29 -6.819 -1.670 -8.692 179 HA THR 29 HA THR 29 -8.963 -2.829 -7.145 180 HB THR 29 HB THR 29 -7.104 -4.131 -9.144 181 HG1 THR 29 1HG THR 29 -8.626 -2.386 -9.848 182 HG21 THR 29 3HG2 THR 29 -9.644 -5.405 -8.923 183 HG22 THR 29 1HG2 THR 29 -8.946 -5.267 -7.310 184 HG23 THR 29 2HG2 THR 29 -8.046 -6.073 -8.594 185 H GLY 30 H GLY 30 -5.493 -2.753 -7.060 186 HA2 GLY 30 1HA GLY 30 -5.175 -5.068 -5.395 187 HA3 GLY 30 2HA GLY 30 -3.949 -3.859 -5.745 188 H LEU 31 H LEU 31 -6.377 -2.010 -4.772 189 HA LEU 31 HA LEU 31 -5.472 -2.052 -1.978 190 HB2 LEU 31 1HB LEU 31 -6.747 0.133 -3.615 191 HB3 LEU 31 2HB LEU 31 -6.369 0.267 -1.899 192 HG LEU 31 HG LEU 31 -4.258 -0.281 -3.970 193 HD11 LEU 31 1HD1 LEU 31 -4.950 1.755 -4.758 194 HD12 LEU 31 2HD1 LEU 31 -3.811 2.261 -3.511 195 HD13 LEU 31 3HD1 LEU 31 -5.544 2.288 -3.186 196 HD21 LEU 31 3HD2 LEU 31 -2.943 -0.431 -2.191 197 HD22 LEU 31 1HD2 LEU 31 -4.314 -0.120 -1.126 198 HD23 LEU 31 2HD2 LEU 31 -3.361 1.226 -1.753 199 H GLU 32 H GLU 32 -8.216 -2.493 -4.011 200 HA GLU 32 HA GLU 32 -10.183 -2.109 -1.947 201 HB2 GLU 32 1HB GLU 32 -11.786 -2.569 -3.569 202 HB3 GLU 32 2HB GLU 32 -10.479 -1.862 -4.509 203 HG2 GLU 32 1HG GLU 32 -9.792 -3.982 -5.314 204 HG3 GLU 32 2HG GLU 32 -10.843 -4.825 -4.177 205 H GLY 33 H GLY 33 -7.963 -4.500 -2.559 206 HA2 GLY 33 1HA GLY 33 -8.686 -6.217 -0.560 207 HA3 GLY 33 2HA GLY 33 -9.573 -6.803 -1.959 208 H GLY 34 H GLY 34 -7.922 -8.576 -0.955 209 HA2 GLY 34 1HA GLY 34 -5.440 -8.395 -2.543 210 HA3 GLY 34 2HA GLY 34 -5.626 -9.363 -1.088 211 H THR 35 H THR 35 -5.782 -9.334 -4.468 212 HA THR 35 HA THR 35 -7.338 -11.806 -4.605 213 HB THR 35 HB THR 35 -6.729 -11.398 -7.170 214 HG1 THR 35 1HG THR 35 -6.810 -8.744 -6.159 215 HG21 THR 35 3HG2 THR 35 -8.783 -9.541 -6.072 216 HG22 THR 35 1HG2 THR 35 -8.974 -11.269 -5.781 217 HG23 THR 35 2HG2 THR 35 -8.885 -10.657 -7.433 218 H THR 36 H THR 36 -6.173 -13.568 -4.146 219 HA THR 36 HA THR 36 -3.363 -13.752 -4.725 220 HB THR 36 HB THR 36 -5.137 -16.042 -3.892 221 HG1 THR 36 1HG THR 36 -5.065 -13.881 -2.572 222 HG21 THR 36 3HG2 THR 36 -2.473 -15.788 -2.736 223 HG22 THR 36 1HG2 THR 36 -2.448 -15.919 -4.494 224 HG23 THR 36 2HG2 THR 36 -3.234 -17.168 -3.527 225 H GLY 37 H GLY 37 -2.482 -14.404 -6.573 226 HA2 GLY 37 1HA GLY 37 -2.243 -16.050 -8.305 227 HA3 GLY 37 2HA GLY 37 -3.985 -16.283 -8.270 228 H ILE 38 H ILE 38 -4.248 -13.250 -8.132 229 HA ILE 38 HA ILE 38 -3.904 -12.799 -11.021 230 HB ILE 38 HB ILE 38 -5.831 -11.370 -9.191 231 HG12 ILE 38 1HG1 ILE 38 -6.218 -13.790 -10.954 232 HG13 ILE 38 2HG1 ILE 38 -6.531 -13.654 -9.227 233 HG21 ILE 38 1HG2 ILE 38 -4.908 -10.629 -11.645 234 HG22 ILE 38 2HG2 ILE 38 -6.366 -11.528 -12.064 235 HG23 ILE 38 3HG2 ILE 38 -6.463 -10.153 -10.964 236 HD11 ILE 38 3HD1 ILE 38 -8.346 -13.332 -11.314 237 HD12 ILE 38 1HD1 ILE 38 -8.608 -12.998 -9.603 238 HD13 ILE 38 2HD1 ILE 38 -8.065 -11.711 -10.680 239 H GLN 39 H GLN 39 -3.031 -10.884 -11.766 240 HA GLN 39 HA GLN 39 -1.352 -9.475 -9.861 241 HB2 GLN 39 1HB GLN 39 -0.212 -10.063 -11.841 242 HB3 GLN 39 2HB GLN 39 -1.531 -9.509 -12.864 243 HG2 GLN 39 1HG GLN 39 -1.046 -7.191 -12.176 244 HG3 GLN 39 2HG GLN 39 0.330 -7.784 -11.247 245 HE21 GLN 39 1HE2 GLN 39 1.886 -9.144 -12.546 246 HE22 GLN 39 2HE2 GLN 39 2.271 -8.578 -14.132 247 H SER 40 H SER 40 -2.257 -7.861 -8.766 248 HA SER 40 HA SER 40 -4.417 -6.302 -9.902 249 HB2 SER 40 1HB SER 40 -3.120 -6.495 -7.209 250 HB3 SER 40 2HB SER 40 -4.081 -5.069 -7.600 251 HG SER 40 HG SER 40 -5.107 -7.650 -8.059 252 H GLU 41 H GLU 41 -4.360 -3.905 -9.770 253 HA GLU 41 HA GLU 41 -1.702 -2.727 -10.025 254 HB2 GLU 41 1HB GLU 41 -2.326 -1.594 -12.136 255 HB3 GLU 41 2HB GLU 41 -2.232 -3.342 -12.304 256 HG2 GLU 41 1HG GLU 41 -4.781 -1.786 -11.934 257 HG3 GLU 41 2HG GLU 41 -4.153 -2.350 -13.482 258 H PHE 42 H PHE 42 -1.600 -0.813 -9.046 259 HA PHE 42 HA PHE 42 -4.077 0.730 -8.691 260 HB2 PHE 42 1HB PHE 42 -3.682 1.100 -6.402 261 HB3 PHE 42 2HB PHE 42 -3.349 -0.614 -6.625 262 HD1 PHE 42 1HD PHE 42 -1.662 2.697 -6.503 263 HD2 PHE 42 2HD PHE 42 -1.338 -1.505 -5.906 264 HE1 PHE 42 1HE PHE 42 0.576 3.011 -5.531 265 HE2 PHE 42 2HE PHE 42 0.900 -1.197 -4.932 266 HZ PHE 42 HZ PHE 42 1.860 1.063 -4.743 267 H PHE 43 H PHE 43 -3.897 2.872 -9.034 268 HA PHE 43 HA PHE 43 -1.232 3.887 -9.729 269 HB2 PHE 43 1HB PHE 43 -3.872 5.198 -10.369 270 HB3 PHE 43 2HB PHE 43 -2.304 5.504 -11.109 271 HD1 PHE 43 2HD PHE 43 -5.073 3.086 -10.850 272 HD2 PHE 43 1HD PHE 43 -1.517 4.191 -12.912 273 HE1 PHE 43 2HE PHE 43 -5.592 1.452 -12.614 274 HE2 PHE 43 1HE PHE 43 -2.031 2.559 -14.681 275 HZ PHE 43 HZ PHE 43 -4.071 1.186 -14.532 276 H ILE 44 H ILE 44 -0.729 6.132 -9.163 277 HA ILE 44 HA ILE 44 -1.933 6.890 -6.581 278 HB ILE 44 HB ILE 44 0.909 7.308 -7.513 279 HG12 ILE 44 1HG1 ILE 44 -0.034 5.712 -5.137 280 HG13 ILE 44 2HG1 ILE 44 0.145 4.986 -6.730 281 HG21 ILE 44 1HG2 ILE 44 1.242 8.153 -5.173 282 HG22 ILE 44 2HG2 ILE 44 0.285 9.202 -6.218 283 HG23 ILE 44 3HG2 ILE 44 -0.514 8.194 -5.013 284 HD11 ILE 44 3HD1 ILE 44 2.104 5.334 -4.757 285 HD12 ILE 44 1HD1 ILE 44 2.310 4.712 -6.393 286 HD13 ILE 44 2HD1 ILE 44 2.517 6.434 -6.072 287 H ASN 45 H ASN 45 -2.757 8.881 -6.387 288 HA ASN 45 HA ASN 45 -2.846 10.584 -8.708 289 HB2 ASN 45 1HB ASN 45 -4.699 10.113 -6.898 290 HB3 ASN 45 2HB ASN 45 -3.903 11.427 -6.036 291 HD21 ASN 45 1HD2 ASN 45 -4.120 13.495 -6.751 292 HD22 ASN 45 2HD2 ASN 45 -5.170 13.953 -8.045 293 H THR 46 H THR 46 -0.368 10.735 -8.497 294 HA THR 46 HA THR 46 0.433 12.842 -6.623 295 HB THR 46 HB THR 46 1.898 10.922 -6.617 296 HG1 THR 46 1HG THR 46 3.867 12.027 -7.265 297 HG21 THR 46 3HG2 THR 46 3.256 10.533 -8.789 298 HG22 THR 46 1HG2 THR 46 1.903 11.334 -9.587 299 HG23 THR 46 2HG2 THR 46 1.633 9.853 -8.669 300 H THR 47 H THR 47 -1.229 13.692 -8.669 301 HA THR 47 HA THR 47 0.543 14.970 -10.626 302 HB THR 47 HB THR 47 -1.621 15.665 -11.732 303 HG1 THR 47 1HG THR 47 -2.853 15.243 -9.707 304 HG21 THR 47 3HG2 THR 47 -0.718 13.905 -12.870 305 HG22 THR 47 1HG2 THR 47 -2.176 13.116 -12.271 306 HG23 THR 47 2HG2 THR 47 -0.640 12.877 -11.439 307 H ARG 48 H ARG 48 -1.295 15.613 -7.802 308 HA ARG 48 HA ARG 48 -1.250 18.503 -8.286 309 HB2 ARG 48 1HB ARG 48 -2.625 16.843 -6.169 310 HB3 ARG 48 2HB ARG 48 -2.646 18.601 -6.203 311 HG2 ARG 48 1HG ARG 48 -3.572 17.031 -8.572 312 HG3 ARG 48 2HG ARG 48 -4.638 17.294 -7.190 313 HD2 ARG 48 1HD ARG 48 -5.184 19.112 -8.463 314 HD3 ARG 48 2HD ARG 48 -3.868 19.794 -7.507 315 HE ARG 48 HE ARG 48 -3.049 18.625 -10.014 316 HH11 ARG 48 1HH1 ARG 48 -4.142 21.500 -8.383 317 HH12 ARG 48 2HH1 ARG 48 -3.471 22.580 -9.560 318 HH21 ARG 48 1HH2 ARG 48 -2.162 20.036 -11.570 319 HH22 ARG 48 2HH2 ARG 48 -2.346 21.746 -11.373 320 H ALA 49 H ALA 49 0.171 16.005 -6.326 321 HA ALA 49 HA ALA 49 1.311 17.743 -4.364 322 HB1 ALA 49 3HB ALA 49 0.998 14.994 -4.651 323 HB2 ALA 49 1HB ALA 49 2.742 15.255 -4.685 324 HB3 ALA 49 2HB ALA 49 1.789 15.839 -3.320 325 H GLY 50 H GLY 50 2.461 16.266 -7.366 326 HA2 GLY 50 1HA GLY 50 4.005 17.707 -8.672 327 HA3 GLY 50 2HA GLY 50 4.870 17.968 -7.164 328 HA PRO 51 HA PRO 51 6.348 14.126 -9.623 329 HB2 PRO 51 1HB PRO 51 8.428 15.215 -10.987 330 HB3 PRO 51 2HB PRO 51 6.794 15.106 -11.653 331 HG2 PRO 51 1HG PRO 51 8.166 17.439 -10.373 332 HG3 PRO 51 2HG PRO 51 7.150 17.398 -11.826 333 HD2 PRO 51 1HD PRO 51 6.217 18.217 -9.420 334 HD3 PRO 51 2HD PRO 51 5.192 17.391 -10.610 335 H GLY 52 H GLY 52 8.132 12.919 -8.977 336 HA2 GLY 52 1HA GLY 52 10.550 13.603 -8.020 337 HA3 GLY 52 2HA GLY 52 9.513 13.940 -6.642 338 H THR 53 H THR 53 11.452 12.139 -6.266 339 HA THR 53 HA THR 53 10.512 9.460 -6.800 340 HB THR 53 HB THR 53 12.770 10.243 -4.957 341 HG1 THR 53 1HG THR 53 14.058 9.861 -6.921 342 HG21 THR 53 3HG2 THR 53 13.514 8.056 -5.156 343 HG22 THR 53 1HG2 THR 53 12.624 7.780 -6.653 344 HG23 THR 53 2HG2 THR 53 11.763 7.847 -5.115 345 H LEU 54 H LEU 54 9.449 8.128 -5.442 346 HA LEU 54 HA LEU 54 8.865 9.138 -2.735 347 HB2 LEU 54 1HB LEU 54 6.718 7.903 -2.911 348 HB3 LEU 54 2HB LEU 54 6.871 9.254 -4.032 349 HG LEU 54 HG LEU 54 7.442 7.602 -5.821 350 HD11 LEU 54 1HD1 LEU 54 8.086 5.597 -5.059 351 HD12 LEU 54 2HD1 LEU 54 6.358 5.257 -4.973 352 HD13 LEU 54 3HD1 LEU 54 7.225 5.787 -3.532 353 HD21 LEU 54 3HD2 LEU 54 4.806 6.712 -4.866 354 HD22 LEU 54 1HD2 LEU 54 5.270 7.467 -6.391 355 HD23 LEU 54 2HD2 LEU 54 5.028 8.461 -4.954 356 H SER 55 H SER 55 8.222 7.373 -1.191 357 HA SER 55 HA SER 55 9.956 5.031 -1.618 358 HB2 SER 55 1HB SER 55 9.066 6.230 1.015 359 HB3 SER 55 2HB SER 55 10.216 4.911 0.798 360 HG SER 55 HG SER 55 11.709 6.344 0.496 361 H VAL 56 H VAL 56 8.739 3.373 -2.271 362 HA VAL 56 HA VAL 56 6.174 2.896 -0.899 363 HB VAL 56 HB VAL 56 5.676 3.178 -3.180 364 HG11 VAL 56 1HG1 VAL 56 6.884 2.065 -4.995 365 HG12 VAL 56 2HG1 VAL 56 7.955 3.096 -4.043 366 HG13 VAL 56 3HG1 VAL 56 7.986 1.346 -3.821 367 HG21 VAL 56 3HG2 VAL 56 4.678 1.153 -3.756 368 HG22 VAL 56 1HG2 VAL 56 5.995 0.199 -3.072 369 HG23 VAL 56 2HG2 VAL 56 4.862 1.031 -2.007 370 H THR 57 H THR 57 5.885 1.050 0.200 371 HA THR 57 HA THR 57 7.677 -1.212 -0.252 372 HB THR 57 HB THR 57 7.313 0.064 2.466 373 HG1 THR 57 1HG THR 57 8.882 1.140 1.261 374 HG21 THR 57 3HG2 THR 57 7.350 -2.418 2.519 375 HG22 THR 57 1HG2 THR 57 8.741 -1.689 3.320 376 HG23 THR 57 2HG2 THR 57 8.914 -2.381 1.706 377 H ILE 58 H ILE 58 6.775 -3.183 0.196 378 HA ILE 58 HA ILE 58 4.031 -3.162 1.272 379 HB ILE 58 HB ILE 58 5.092 -4.952 -0.918 380 HG12 ILE 58 1HG1 ILE 58 2.900 -2.907 -1.183 381 HG13 ILE 58 2HG1 ILE 58 4.587 -2.471 -1.429 382 HG21 ILE 58 1HG2 ILE 58 2.911 -5.893 -1.050 383 HG22 ILE 58 2HG2 ILE 58 3.403 -5.954 0.642 384 HG23 ILE 58 3HG2 ILE 58 2.268 -4.719 0.098 385 HD11 ILE 58 3HD1 ILE 58 3.216 -3.054 -3.481 386 HD12 ILE 58 1HD1 ILE 58 4.780 -3.849 -3.308 387 HD13 ILE 58 2HD1 ILE 58 3.298 -4.725 -2.924 388 H GLU 59 H GLU 59 3.549 -4.625 2.816 389 HA GLU 59 HA GLU 59 5.633 -6.593 3.505 390 HB2 GLU 59 1HB GLU 59 5.065 -4.547 5.079 391 HB3 GLU 59 2HB GLU 59 3.723 -5.574 5.563 392 HG2 GLU 59 1HG GLU 59 5.209 -7.293 6.294 393 HG3 GLU 59 2HG GLU 59 6.600 -6.443 5.624 394 H GLY 60 H GLY 60 4.837 -8.531 4.643 395 HA2 GLY 60 1HA GLY 60 2.209 -9.325 4.900 396 HA3 GLY 60 2HA GLY 60 2.636 -9.676 3.232 397 HA PRO 61 HA PRO 61 3.907 -13.170 6.141 398 HB2 PRO 61 1HB PRO 61 2.227 -15.053 5.142 399 HB3 PRO 61 2HB PRO 61 1.782 -13.976 6.471 400 HG2 PRO 61 1HG PRO 61 1.110 -13.770 3.561 401 HG3 PRO 61 2HG PRO 61 0.070 -13.497 4.972 402 HD2 PRO 61 1HD PRO 61 1.199 -11.468 3.579 403 HD3 PRO 61 2HD PRO 61 0.894 -11.374 5.325 404 H SER 62 H SER 62 3.225 -12.931 2.702 405 HA SER 62 HA SER 62 5.554 -14.655 2.183 406 HB2 SER 62 1HB SER 62 2.820 -14.758 0.959 407 HB3 SER 62 2HB SER 62 4.220 -15.228 -0.005 408 HG SER 62 HG SER 62 3.074 -16.472 2.202 409 H LYS 63 H LYS 63 7.072 -13.717 0.991 410 HA LYS 63 HA LYS 63 6.940 -11.065 0.137 411 HB2 LYS 63 1HB LYS 63 8.789 -13.341 -0.512 412 HB3 LYS 63 2HB LYS 63 8.977 -11.782 -1.304 413 HG2 LYS 63 1HG LYS 63 8.902 -12.063 1.684 414 HG3 LYS 63 2HG LYS 63 10.394 -12.207 0.751 415 HD2 LYS 63 1HD LYS 63 10.101 -9.965 -0.121 416 HD3 LYS 63 2HD LYS 63 8.547 -9.820 0.705 417 HE2 LYS 63 1HE LYS 63 10.041 -10.408 2.815 418 HE3 LYS 63 2HE LYS 63 11.309 -9.719 1.801 419 HZ1 LYS 63 3HZ LYS 63 10.607 -7.720 2.394 420 HZ2 LYS 63 1HZ LYS 63 9.335 -8.381 3.293 421 HZ3 LYS 63 2HZ LYS 63 9.114 -8.016 1.657 422 H VAL 64 H VAL 64 7.055 -10.197 -2.038 423 HA VAL 64 HA VAL 64 5.869 -11.878 -4.124 424 HB VAL 64 HB VAL 64 4.273 -10.120 -4.747 425 HG11 VAL 64 1HG1 VAL 64 3.626 -11.976 -3.227 426 HG12 VAL 64 2HG1 VAL 64 3.942 -10.911 -1.856 427 HG13 VAL 64 3HG1 VAL 64 2.664 -10.515 -3.006 428 HG21 VAL 64 3HG2 VAL 64 5.018 -8.765 -2.160 429 HG22 VAL 64 1HG2 VAL 64 5.587 -8.245 -3.747 430 HG23 VAL 64 2HG2 VAL 64 3.864 -8.206 -3.371 431 H LYS 65 H LYS 65 6.357 -11.259 -6.229 432 HA LYS 65 HA LYS 65 8.739 -9.654 -6.498 433 HB2 LYS 65 1HB LYS 65 8.386 -11.789 -7.744 434 HB3 LYS 65 2HB LYS 65 7.102 -11.002 -8.653 435 HG2 LYS 65 1HG LYS 65 8.935 -10.866 -10.065 436 HG3 LYS 65 2HG LYS 65 8.892 -9.277 -9.297 437 HD2 LYS 65 1HD LYS 65 10.486 -10.473 -7.557 438 HD3 LYS 65 2HD LYS 65 10.820 -11.517 -8.940 439 HE2 LYS 65 1HE LYS 65 10.882 -8.562 -9.317 440 HE3 LYS 65 2HE LYS 65 12.235 -9.342 -8.498 441 HZ1 LYS 65 3HZ LYS 65 12.787 -10.544 -10.376 442 HZ2 LYS 65 1HZ LYS 65 12.318 -9.058 -11.035 443 HZ3 LYS 65 2HZ LYS 65 11.258 -10.375 -11.080 444 H MET 66 H MET 66 8.241 -7.522 -6.174 445 HA MET 66 HA MET 66 5.969 -6.237 -7.290 446 HB2 MET 66 1HB MET 66 8.488 -5.298 -5.969 447 HB3 MET 66 2HB MET 66 7.436 -4.135 -6.764 448 HG2 MET 66 1HG MET 66 5.654 -4.586 -5.301 449 HG3 MET 66 2HG MET 66 6.421 -6.052 -4.695 450 HE1 MET 66 3HE MET 66 8.002 -2.547 -5.384 451 HE2 MET 66 1HE MET 66 6.463 -2.100 -4.649 452 HE3 MET 66 2HE MET 66 7.971 -1.802 -3.785 453 H ASP 67 H ASP 67 5.699 -5.142 -9.165 454 HA ASP 67 HA ASP 67 8.016 -4.940 -10.972 455 HB2 ASP 67 1HB ASP 67 6.162 -6.774 -11.424 456 HB3 ASP 67 2HB ASP 67 5.287 -5.401 -12.098 457 H CYS 68 H CYS 68 7.060 -2.902 -9.255 458 HA CYS 68 HA CYS 68 5.247 -1.097 -10.165 459 HB2 CYS 68 1HB CYS 68 6.553 0.648 -9.100 460 HB3 CYS 68 2HB CYS 68 6.628 -0.815 -8.125 461 HG CYS 68 HG CYS 68 9.106 0.733 -8.321 462 H GLN 69 H GLN 69 4.899 -0.259 -12.103 463 HA GLN 69 HA GLN 69 7.217 0.306 -13.830 464 HB2 GLN 69 1HB GLN 69 4.473 -0.714 -14.416 465 HB3 GLN 69 2HB GLN 69 5.285 0.263 -15.633 466 HG2 GLN 69 1HG GLN 69 6.688 -2.072 -14.412 467 HG3 GLN 69 2HG GLN 69 5.499 -2.318 -15.690 468 HE21 GLN 69 1HE2 GLN 69 8.596 -2.376 -15.329 469 HE22 GLN 69 2HE2 GLN 69 9.154 -1.609 -16.772 470 H GLU 70 H GLU 70 7.641 2.376 -14.181 471 HA GLU 70 HA GLU 70 6.211 4.501 -13.135 472 HB2 GLU 70 1HB GLU 70 7.627 5.941 -14.399 473 HB3 GLU 70 2HB GLU 70 8.588 4.534 -13.965 474 HG2 GLU 70 1HG GLU 70 8.626 3.724 -16.125 475 HG3 GLU 70 2HG GLU 70 7.187 4.626 -16.598 476 H THR 71 H THR 71 4.837 6.067 -14.031 477 HA THR 71 HA THR 71 3.644 5.474 -16.638 478 HB THR 71 HB THR 71 1.357 5.966 -15.570 479 HG1 THR 71 1HG THR 71 1.289 6.094 -13.460 480 HG21 THR 71 3HG2 THR 71 1.118 3.571 -14.830 481 HG22 THR 71 1HG2 THR 71 2.855 3.397 -15.072 482 HG23 THR 71 2HG2 THR 71 1.810 3.790 -16.437 483 HA PRO 72 HA PRO 72 3.660 9.832 -17.178 484 HB2 PRO 72 1HB PRO 72 1.513 10.165 -18.806 485 HB3 PRO 72 2HB PRO 72 3.031 9.443 -19.353 486 HG2 PRO 72 1HG PRO 72 0.489 8.102 -18.517 487 HG3 PRO 72 2HG PRO 72 1.552 7.730 -19.887 488 HD2 PRO 72 1HD PRO 72 1.598 6.312 -17.580 489 HD3 PRO 72 2HD PRO 72 3.048 6.568 -18.573 490 H GLU 73 H GLU 73 1.193 8.252 -15.506 491 HA GLU 73 HA GLU 73 -0.297 10.700 -14.936 492 HB2 GLU 73 1HB GLU 73 -1.409 8.448 -15.413 493 HB3 GLU 73 2HB GLU 73 -0.856 7.959 -13.818 494 HG2 GLU 73 1HG GLU 73 -2.284 9.393 -12.730 495 HG3 GLU 73 2HG GLU 73 -2.421 10.476 -14.114 496 H GLY 74 H GLY 74 1.392 8.114 -13.156 497 HA2 GLY 74 1HA GLY 74 2.523 9.983 -11.309 498 HA3 GLY 74 2HA GLY 74 1.195 9.083 -10.591 499 H TYR 75 H TYR 75 1.363 6.742 -10.533 500 HA TYR 75 HA TYR 75 3.823 5.436 -11.139 501 HB2 TYR 75 1HB TYR 75 3.288 6.294 -8.306 502 HB3 TYR 75 2HB TYR 75 4.251 4.862 -8.654 503 HD1 TYR 75 1HD TYR 75 6.308 5.158 -10.156 504 HD2 TYR 75 2HD TYR 75 4.271 8.415 -8.325 505 HE1 TYR 75 1HE TYR 75 8.301 6.567 -10.457 506 HE2 TYR 75 2HE TYR 75 6.259 9.832 -8.623 507 HH TYR 75 HH TYR 75 8.307 9.977 -9.469 508 H LYS 76 H LYS 76 2.938 3.632 -11.908 509 HA LYS 76 HA LYS 76 0.677 2.412 -10.509 510 HB2 LYS 76 1HB LYS 76 0.320 2.654 -12.859 511 HB3 LYS 76 2HB LYS 76 1.887 1.949 -13.234 512 HG2 LYS 76 1HG LYS 76 1.008 -0.177 -12.141 513 HG3 LYS 76 2HG LYS 76 -0.585 0.579 -12.230 514 HD2 LYS 76 1HD LYS 76 0.018 0.960 -14.727 515 HD3 LYS 76 2HD LYS 76 1.224 -0.299 -14.450 516 HE2 LYS 76 1HE LYS 76 -0.703 -1.679 -13.493 517 HE3 LYS 76 2HE LYS 76 -1.767 -0.486 -14.236 518 HZ1 LYS 76 3HZ LYS 76 -0.461 -0.985 -16.353 519 HZ2 LYS 76 1HZ LYS 76 -1.570 -2.150 -15.825 520 HZ3 LYS 76 2HZ LYS 76 0.084 -2.372 -15.553 521 H VAL 77 H VAL 77 0.905 0.682 -9.253 522 HA VAL 77 HA VAL 77 3.352 -0.940 -9.527 523 HB VAL 77 HB VAL 77 1.970 -0.128 -6.966 524 HG11 VAL 77 1HG1 VAL 77 3.573 -1.467 -5.786 525 HG12 VAL 77 2HG1 VAL 77 2.761 -2.490 -6.972 526 HG13 VAL 77 3HG1 VAL 77 4.391 -1.895 -7.288 527 HG21 VAL 77 3HG2 VAL 77 3.330 1.659 -7.665 528 HG22 VAL 77 1HG2 VAL 77 4.303 0.777 -6.488 529 HG23 VAL 77 2HG2 VAL 77 4.612 0.579 -8.213 530 H MET 78 H MET 78 3.137 -3.136 -9.373 531 HA MET 78 HA MET 78 0.455 -4.206 -8.833 532 HB2 MET 78 1HB MET 78 2.230 -5.127 -11.098 533 HB3 MET 78 2HB MET 78 0.619 -5.720 -10.718 534 HG2 MET 78 1HG MET 78 -0.417 -3.816 -11.506 535 HG3 MET 78 2HG MET 78 1.034 -2.831 -11.331 536 HE1 MET 78 3HE MET 78 3.059 -3.405 -14.450 537 HE2 MET 78 1HE MET 78 2.393 -2.113 -13.449 538 HE3 MET 78 2HE MET 78 3.254 -3.457 -12.697 539 H TYR 79 H TYR 79 0.389 -6.135 -7.757 540 HA TYR 79 HA TYR 79 2.885 -7.586 -7.302 541 HB2 TYR 79 1HB TYR 79 2.620 -7.598 -4.900 542 HB3 TYR 79 2HB TYR 79 2.649 -5.929 -5.458 543 HD1 TYR 79 2HD TYR 79 0.529 -4.625 -5.548 544 HD2 TYR 79 1HD TYR 79 0.714 -8.497 -3.794 545 HE1 TYR 79 2HE TYR 79 -1.603 -4.199 -4.396 546 HE2 TYR 79 1HE TYR 79 -1.418 -8.083 -2.639 547 HH TYR 79 HH TYR 79 -3.494 -5.612 -3.445 548 H THR 80 H THR 80 2.624 -9.747 -7.124 549 HA THR 80 HA THR 80 -0.144 -10.762 -7.071 550 HB THR 80 HB THR 80 2.260 -11.863 -8.532 551 HG1 THR 80 1HG THR 80 -0.226 -11.305 -9.713 552 HG21 THR 80 3HG2 THR 80 0.042 -13.273 -7.443 553 HG22 THR 80 1HG2 THR 80 1.337 -13.889 -8.469 554 HG23 THR 80 2HG2 THR 80 -0.133 -13.243 -9.198 555 HA PRO 81 HA PRO 81 1.674 -12.472 -3.260 556 HB2 PRO 81 1HB PRO 81 -0.720 -12.788 -2.019 557 HB3 PRO 81 2HB PRO 81 0.148 -11.249 -2.053 558 HG2 PRO 81 1HG PRO 81 -2.135 -12.175 -3.754 559 HG3 PRO 81 2HG PRO 81 -1.876 -10.594 -2.992 560 HD2 PRO 81 1HD PRO 81 -1.366 -11.051 -5.612 561 HD3 PRO 81 2HD PRO 81 -0.428 -9.896 -4.644 562 H MET 82 H MET 82 2.247 -14.546 -3.276 563 HA MET 82 HA MET 82 0.793 -16.530 -4.724 564 HB2 MET 82 1HB MET 82 3.334 -16.394 -4.267 565 HB3 MET 82 2HB MET 82 2.949 -17.133 -2.719 566 HG2 MET 82 1HG MET 82 2.278 -19.122 -3.685 567 HG3 MET 82 2HG MET 82 1.994 -18.378 -5.257 568 HE1 MET 82 3HE MET 82 4.750 -18.041 -2.754 569 HE2 MET 82 1HE MET 82 5.141 -19.757 -2.876 570 HE3 MET 82 2HE MET 82 6.224 -18.554 -3.578 571 H ALA 83 H ALA 83 1.058 -15.612 -1.351 572 HA ALA 83 HA ALA 83 -1.045 -17.577 -0.720 573 HB1 ALA 83 3HB ALA 83 1.207 -16.781 1.121 574 HB2 ALA 83 1HB ALA 83 -0.065 -17.957 1.453 575 HB3 ALA 83 2HB ALA 83 1.135 -18.284 0.202 576 HA PRO 84 HA PRO 84 -3.345 -14.123 0.754 577 HB2 PRO 84 1HB PRO 84 -5.060 -15.427 2.406 578 HB3 PRO 84 2HB PRO 84 -5.185 -15.494 0.644 579 HG2 PRO 84 1HG PRO 84 -3.981 -17.478 2.536 580 HG3 PRO 84 2HG PRO 84 -5.020 -17.763 1.127 581 HD2 PRO 84 1HD PRO 84 -2.332 -18.084 1.044 582 HD3 PRO 84 2HD PRO 84 -3.273 -17.546 -0.362 583 H GLY 85 H GLY 85 -4.272 -13.344 2.984 584 HA2 GLY 85 1HA GLY 85 -3.617 -13.777 5.463 585 HA3 GLY 85 2HA GLY 85 -2.009 -13.411 4.856 586 H ASN 86 H ASN 86 -1.521 -11.493 5.733 587 HA ASN 86 HA ASN 86 -3.388 -9.271 5.235 588 HB2 ASN 86 1HB ASN 86 -2.346 -8.290 7.400 589 HB3 ASN 86 2HB ASN 86 -3.588 -9.530 7.548 590 HD21 ASN 86 1HD2 ASN 86 -2.949 -10.298 9.508 591 HD22 ASN 86 2HD2 ASN 86 -1.458 -11.131 9.767 592 H TYR 87 H TYR 87 -2.476 -8.062 3.708 593 HA TYR 87 HA TYR 87 0.435 -7.656 3.770 594 HB2 TYR 87 1HB TYR 87 -1.587 -7.424 1.542 595 HB3 TYR 87 2HB TYR 87 0.056 -6.809 1.397 596 HD1 TYR 87 1HD TYR 87 -1.552 -9.966 2.613 597 HD2 TYR 87 2HD TYR 87 1.472 -8.178 0.213 598 HE1 TYR 87 1HE TYR 87 -0.784 -12.199 1.927 599 HE2 TYR 87 2HE TYR 87 2.248 -10.406 -0.480 600 HH TYR 87 HH TYR 87 0.660 -13.356 0.706 601 H LEU 88 H LEU 88 1.308 -5.647 3.922 602 HA LEU 88 HA LEU 88 -0.578 -3.418 4.318 603 HB2 LEU 88 1HB LEU 88 0.918 -4.328 6.245 604 HB3 LEU 88 2HB LEU 88 2.198 -3.435 5.428 605 HG LEU 88 HG LEU 88 0.506 -1.440 5.615 606 HD11 LEU 88 1HD1 LEU 88 -0.805 -1.565 7.697 607 HD12 LEU 88 2HD1 LEU 88 -0.394 -3.275 7.831 608 HD13 LEU 88 3HD1 LEU 88 -1.364 -2.705 6.473 609 HD21 LEU 88 3HD2 LEU 88 1.580 -0.759 7.645 610 HD22 LEU 88 1HD2 LEU 88 2.750 -1.651 6.673 611 HD23 LEU 88 2HD2 LEU 88 1.976 -2.429 8.054 612 H ILE 89 H ILE 89 -0.210 -1.490 3.304 613 HA ILE 89 HA ILE 89 2.132 -1.339 1.525 614 HB ILE 89 HB ILE 89 -0.624 -0.335 0.813 615 HG12 ILE 89 1HG1 ILE 89 0.805 -2.777 -0.256 616 HG13 ILE 89 2HG1 ILE 89 -0.484 -2.831 0.941 617 HG21 ILE 89 1HG2 ILE 89 0.311 0.647 -0.952 618 HG22 ILE 89 2HG2 ILE 89 1.867 0.368 -0.171 619 HG23 ILE 89 3HG2 ILE 89 1.250 -0.792 -1.347 620 HD11 ILE 89 3HD1 ILE 89 -0.697 -2.823 -1.867 621 HD12 ILE 89 1HD1 ILE 89 -1.992 -2.836 -0.670 622 HD13 ILE 89 2HD1 ILE 89 -1.374 -1.302 -1.285 623 H SER 90 H SER 90 3.374 0.247 2.270 624 HA SER 90 HA SER 90 2.088 2.669 3.339 625 HB2 SER 90 1HB SER 90 4.038 3.050 4.654 626 HB3 SER 90 2HB SER 90 3.663 1.335 4.825 627 HG SER 90 HG SER 90 5.945 2.140 4.264 628 H VAL 91 H VAL 91 2.230 4.495 2.219 629 HA VAL 91 HA VAL 91 4.311 4.707 0.141 630 HB VAL 91 HB VAL 91 1.546 5.918 0.032 631 HG11 VAL 91 1HG1 VAL 91 2.185 6.306 -2.365 632 HG12 VAL 91 2HG1 VAL 91 3.078 7.272 -1.188 633 HG13 VAL 91 3HG1 VAL 91 3.833 5.858 -1.926 634 HG21 VAL 91 3HG2 VAL 91 2.629 3.330 -0.917 635 HG22 VAL 91 1HG2 VAL 91 0.999 3.757 -0.398 636 HG23 VAL 91 2HG2 VAL 91 1.555 4.201 -2.012 637 H LYS 92 H LYS 92 5.803 5.990 1.077 638 HA LYS 92 HA LYS 92 4.893 8.476 2.359 639 HB2 LYS 92 1HB LYS 92 7.530 7.015 2.573 640 HB3 LYS 92 2HB LYS 92 7.176 8.553 3.348 641 HG2 LYS 92 1HG LYS 92 5.150 7.202 4.347 642 HG3 LYS 92 2HG LYS 92 6.200 5.825 4.005 643 HD2 LYS 92 1HD LYS 92 7.262 8.216 5.462 644 HD3 LYS 92 2HD LYS 92 6.336 6.983 6.323 645 HE2 LYS 92 1HE LYS 92 7.907 5.278 5.647 646 HE3 LYS 92 2HE LYS 92 8.786 6.436 4.650 647 HZ1 LYS 92 3HZ LYS 92 9.725 5.906 6.934 648 HZ2 LYS 92 1HZ LYS 92 8.458 6.837 7.560 649 HZ3 LYS 92 2HZ LYS 92 9.592 7.541 6.522 650 H TYR 93 H TYR 93 4.959 10.207 1.097 651 HA TYR 93 HA TYR 93 7.091 10.390 -0.929 652 HB2 TYR 93 1HB TYR 93 4.970 10.267 -2.036 653 HB3 TYR 93 2HB TYR 93 4.271 11.472 -0.959 654 HD1 TYR 93 1HD TYR 93 7.112 11.133 -3.368 655 HD2 TYR 93 2HD TYR 93 4.066 13.627 -1.754 656 HE1 TYR 93 1HE TYR 93 7.726 12.903 -4.961 657 HE2 TYR 93 2HE TYR 93 4.671 15.404 -3.344 658 HH TYR 93 HH TYR 93 6.415 16.111 -4.738 659 H GLY 94 H GLY 94 8.511 11.996 -0.730 660 HA2 GLY 94 1HA GLY 94 9.142 14.249 -0.342 661 HA3 GLY 94 2HA GLY 94 7.732 14.440 0.689 662 H GLY 95 H GLY 95 7.803 12.918 2.687 663 HA2 GLY 95 1HA GLY 95 10.542 12.649 3.706 664 HA3 GLY 95 2HA GLY 95 9.416 13.660 4.599 665 HA PRO 96 HA PRO 96 9.150 9.396 6.358 666 HB2 PRO 96 1HB PRO 96 9.093 10.224 8.942 667 HB3 PRO 96 2HB PRO 96 10.597 9.954 8.053 668 HG2 PRO 96 1HG PRO 96 9.161 12.521 8.611 669 HG3 PRO 96 2HG PRO 96 10.897 12.169 8.693 670 HD2 PRO 96 1HD PRO 96 9.768 13.441 6.587 671 HD3 PRO 96 2HD PRO 96 11.175 12.374 6.414 672 H ASN 97 H ASN 97 7.170 11.997 5.951 673 HA ASN 97 HA ASN 97 5.019 11.064 7.681 674 HB2 ASN 97 1HB ASN 97 4.887 13.338 5.702 675 HB3 ASN 97 2HB ASN 97 3.869 13.069 7.114 676 HD21 ASN 97 1HD2 ASN 97 5.300 15.439 6.514 677 HD22 ASN 97 2HD2 ASN 97 6.457 15.685 7.774 678 H HIS 98 H HIS 98 3.784 9.454 6.992 679 HA HIS 98 HA HIS 98 3.637 8.627 4.282 680 HB2 HIS 98 1HB HIS 98 1.887 7.065 5.090 681 HB3 HIS 98 2HB HIS 98 3.345 7.020 6.077 682 HD2 HIS 98 2HD HIS 98 2.931 7.458 8.737 683 HE1 HIS 98 1HE HIS 98 -1.096 8.764 8.460 684 HE2 HIS 98 2HE HIS 98 0.814 8.224 10.010 685 H ILE 99 H ILE 99 1.771 8.578 2.913 686 HA ILE 99 HA ILE 99 0.353 11.073 2.905 687 HB ILE 99 HB ILE 99 -0.599 10.364 0.811 688 HG12 ILE 99 1HG1 ILE 99 0.723 7.680 1.038 689 HG13 ILE 99 2HG1 ILE 99 -0.877 7.933 1.726 690 HG21 ILE 99 1HG2 ILE 99 2.116 9.221 0.522 691 HG22 ILE 99 2HG2 ILE 99 1.314 10.491 -0.402 692 HG23 ILE 99 3HG2 ILE 99 1.995 10.851 1.185 693 HD11 ILE 99 3HD1 ILE 99 -1.858 7.859 -0.267 694 HD12 ILE 99 1HD1 ILE 99 -0.641 8.898 -1.008 695 HD13 ILE 99 2HD1 ILE 99 -0.340 7.168 -0.840 696 H VAL 100 H VAL 100 -2.056 11.080 2.467 697 HA VAL 100 HA VAL 100 -3.439 10.091 4.680 698 HB VAL 100 HB VAL 100 -4.426 11.100 2.019 699 HG11 VAL 100 1HG1 VAL 100 -6.302 9.932 2.521 700 HG12 VAL 100 2HG1 VAL 100 -5.924 9.852 4.243 701 HG13 VAL 100 3HG1 VAL 100 -6.604 11.328 3.556 702 HG21 VAL 100 3HG2 VAL 100 -3.438 12.827 3.303 703 HG22 VAL 100 1HG2 VAL 100 -5.182 13.004 3.499 704 HG23 VAL 100 2HG2 VAL 100 -4.221 12.272 4.784 705 H GLY 101 H GLY 101 -4.601 8.282 5.087 706 HA2 GLY 101 1HA GLY 101 -5.858 6.360 4.480 707 HA3 GLY 101 2HA GLY 101 -5.099 6.397 2.896 708 H SER 102 H SER 102 -2.472 6.389 3.366 709 HA SER 102 HA SER 102 -1.992 3.703 4.186 710 HB2 SER 102 1HB SER 102 0.352 4.171 3.660 711 HB3 SER 102 2HB SER 102 -0.697 4.800 2.389 712 HG SER 102 HG SER 102 0.946 6.288 3.058 713 HA PRO 103 HA PRO 103 -0.019 2.593 4.811 714 HB2 PRO 103 1HB PRO 103 -0.130 0.633 6.687 715 HB3 PRO 103 2HB PRO 103 1.256 1.715 6.510 716 HG2 PRO 103 1HG PRO 103 -1.014 1.846 8.457 717 HG3 PRO 103 2HG PRO 103 0.718 2.106 8.738 718 HD2 PRO 103 1HD PRO 103 -1.037 4.151 8.463 719 HD3 PRO 103 2HD PRO 103 0.653 4.264 7.930 720 H PHE 104 H PHE 104 -1.222 1.104 3.712 721 HA PHE 104 HA PHE 104 -4.067 1.009 4.356 722 HB2 PHE 104 1HB PHE 104 -2.553 0.102 1.899 723 HB3 PHE 104 2HB PHE 104 -4.301 0.021 2.088 724 HD1 PHE 104 2HD PHE 104 -5.426 2.321 2.753 725 HD2 PHE 104 1HD PHE 104 -1.660 1.912 0.812 726 HE1 PHE 104 2HE PHE 104 -5.626 4.616 1.888 727 HE2 PHE 104 1HE PHE 104 -1.854 4.206 -0.055 728 HZ PHE 104 HZ PHE 104 -3.839 5.561 0.481 729 H LYS 105 H LYS 105 -5.200 -0.855 4.759 730 HA LYS 105 HA LYS 105 -3.577 -3.271 5.218 731 HB2 LYS 105 1HB LYS 105 -5.880 -2.098 6.747 732 HB3 LYS 105 2HB LYS 105 -5.516 -3.815 6.858 733 HG2 LYS 105 1HG LYS 105 -3.336 -3.360 7.737 734 HG3 LYS 105 2HG LYS 105 -3.538 -1.628 7.461 735 HD2 LYS 105 1HD LYS 105 -3.989 -1.847 9.728 736 HD3 LYS 105 2HD LYS 105 -5.600 -1.864 9.006 737 HE2 LYS 105 1HE LYS 105 -5.694 -4.265 9.159 738 HE3 LYS 105 2HE LYS 105 -4.022 -4.335 9.714 739 HZ1 LYS 105 3HZ LYS 105 -6.431 -3.523 11.171 740 HZ2 LYS 105 1HZ LYS 105 -4.964 -2.789 11.583 741 HZ3 LYS 105 2HZ LYS 105 -5.127 -4.469 11.686 742 H ALA 106 H ALA 106 -3.906 -4.378 3.344 743 HA ALA 106 HA ALA 106 -6.673 -4.812 2.461 744 HB1 ALA 106 3HB ALA 106 -5.186 -3.978 0.743 745 HB2 ALA 106 1HB ALA 106 -4.068 -5.313 1.027 746 HB3 ALA 106 2HB ALA 106 -5.673 -5.631 0.366 747 H LYS 107 H LYS 107 -7.645 -6.699 2.800 748 HA LYS 107 HA LYS 107 -6.124 -8.879 3.985 749 HB2 LYS 107 1HB LYS 107 -8.281 -8.132 4.977 750 HB3 LYS 107 2HB LYS 107 -9.102 -8.651 3.511 751 HG2 LYS 107 1HG LYS 107 -8.457 -10.945 3.918 752 HG3 LYS 107 2HG LYS 107 -7.525 -10.457 5.335 753 HD2 LYS 107 1HD LYS 107 -9.477 -11.139 6.331 754 HD3 LYS 107 2HD LYS 107 -9.824 -9.426 6.089 755 HE2 LYS 107 1HE LYS 107 -11.297 -9.829 4.370 756 HE3 LYS 107 2HE LYS 107 -10.541 -11.362 3.940 757 HZ1 LYS 107 3HZ LYS 107 -12.801 -10.987 5.485 758 HZ2 LYS 107 1HZ LYS 107 -11.597 -11.488 6.562 759 HZ3 LYS 107 2HZ LYS 107 -11.976 -12.439 5.216 760 H VAL 108 H VAL 108 -5.264 -10.392 2.737 761 HA VAL 108 HA VAL 108 -6.317 -10.851 0.058 762 HB VAL 108 HB VAL 108 -3.951 -12.280 1.233 763 HG11 VAL 108 1HG1 VAL 108 -5.112 -11.833 -1.435 764 HG12 VAL 108 2HG1 VAL 108 -3.354 -11.720 -1.339 765 HG13 VAL 108 3HG1 VAL 108 -4.174 -13.191 -0.816 766 HG21 VAL 108 3HG2 VAL 108 -2.540 -10.436 0.326 767 HG22 VAL 108 1HG2 VAL 108 -4.010 -9.488 0.097 768 HG23 VAL 108 2HG2 VAL 108 -3.515 -9.971 1.720 769 H THR 109 H THR 109 -7.595 -12.501 -0.448 770 HA THR 109 HA THR 109 -7.617 -14.871 1.294 771 HB THR 109 HB THR 109 -10.102 -15.018 0.912 772 HG1 THR 109 1HG THR 109 -10.644 -13.637 -0.650 773 HG21 THR 109 3HG2 THR 109 -9.743 -12.464 2.343 774 HG22 THR 109 1HG2 THR 109 -8.728 -13.796 2.893 775 HG23 THR 109 2HG2 THR 109 -10.483 -13.970 2.882 776 H GLY 110 H GLY 110 -8.135 -16.839 0.284 777 HA2 GLY 110 1HA GLY 110 -9.131 -17.512 -2.084 778 HA3 GLY 110 2HA GLY 110 -7.582 -16.845 -2.580 779 H GLN 111 H GLN 111 -8.245 -19.462 -3.139 780 HA GLN 111 HA GLN 111 -7.382 -21.336 -1.226 781 HB2 GLN 111 1HB GLN 111 -7.796 -21.356 -4.178 782 HB3 GLN 111 2HB GLN 111 -6.876 -22.674 -3.465 783 HG2 GLN 111 1HG GLN 111 -8.707 -23.327 -2.102 784 HG3 GLN 111 2HG GLN 111 -9.610 -21.870 -2.514 785 HE21 GLN 111 1HE2 GLN 111 -10.989 -21.961 -4.152 786 HE22 GLN 111 2HE2 GLN 111 -11.095 -23.243 -5.305 787 H ARG 112 H ARG 112 -5.423 -21.870 -0.519 788 HA ARG 112 HA ARG 112 -3.125 -20.442 -1.083 789 HB2 ARG 112 1HB ARG 112 -3.351 -23.281 -0.068 790 HB3 ARG 112 2HB ARG 112 -1.898 -22.293 0.015 791 HG2 ARG 112 1HG ARG 112 -3.041 -20.707 1.465 792 HG3 ARG 112 2HG ARG 112 -4.517 -21.669 1.363 793 HD2 ARG 112 1HD ARG 112 -3.090 -23.600 2.257 794 HD3 ARG 112 2HD ARG 112 -1.911 -22.360 2.683 795 HE ARG 112 HE ARG 112 -4.160 -21.416 3.806 796 HH11 ARG 112 1HH1 ARG 112 -2.640 -24.547 3.890 797 HH12 ARG 112 2HH1 ARG 112 -3.223 -24.932 5.475 798 HH21 ARG 112 1HH2 ARG 112 -4.933 -21.911 5.894 799 HH22 ARG 112 2HH2 ARG 112 -4.528 -23.433 6.614 800 H LEU 113 H LEU 113 -2.506 -20.205 -3.172 801 HA LEU 113 HA LEU 113 -2.584 -22.162 -5.165 802 HB2 LEU 113 1HB LEU 113 -0.793 -19.756 -4.885 803 HB3 LEU 113 2HB LEU 113 -0.942 -20.721 -6.352 804 HG LEU 113 HG LEU 113 -3.203 -19.184 -5.076 805 HD11 LEU 113 1HD1 LEU 113 -1.086 -18.391 -6.954 806 HD12 LEU 113 2HD1 LEU 113 -2.091 -17.409 -5.889 807 HD13 LEU 113 3HD1 LEU 113 -2.726 -17.963 -7.439 808 HD21 LEU 113 3HD2 LEU 113 -2.947 -20.967 -7.440 809 HD22 LEU 113 1HD2 LEU 113 -3.997 -19.556 -7.570 810 HD23 LEU 113 2HD2 LEU 113 -4.291 -20.761 -6.315 811 H VAL 114 H VAL 114 -1.145 -23.660 -5.907 812 HA VAL 114 HA VAL 114 1.392 -23.956 -4.448 813 HB VAL 114 HB VAL 114 -0.549 -26.184 -5.080 814 HG11 VAL 114 1HG1 VAL 114 1.688 -26.929 -3.427 815 HG12 VAL 114 2HG1 VAL 114 1.114 -27.652 -4.932 816 HG13 VAL 114 3HG1 VAL 114 2.241 -26.296 -4.977 817 HG21 VAL 114 3HG2 VAL 114 0.442 -25.794 -2.342 818 HG22 VAL 114 1HG2 VAL 114 -0.600 -24.508 -2.949 819 HG23 VAL 114 2HG2 VAL 114 -1.180 -26.173 -2.920 820 H SER 115 H SER 115 -0.465 -25.274 -7.195 821 HA SER 115 HA SER 115 1.799 -26.108 -8.659 822 HB2 SER 115 1HB SER 115 -0.561 -26.908 -9.013 823 HB3 SER 115 2HB SER 115 -0.905 -25.365 -9.795 824 HG SER 115 HG SER 115 1.301 -26.831 -10.683 825 HA PRO 116 HA PRO 116 3.237 -22.139 -10.033 826 HB2 PRO 116 1HB PRO 116 5.149 -23.077 -11.716 827 HB3 PRO 116 2HB PRO 116 5.341 -23.057 -9.959 828 HG2 PRO 116 1HG PRO 116 4.559 -25.322 -11.752 829 HG3 PRO 116 2HG PRO 116 5.679 -25.319 -10.377 830 HD2 PRO 116 1HD PRO 116 3.137 -26.233 -10.184 831 HD3 PRO 116 2HD PRO 116 3.976 -25.451 -8.829 832 H GLY 117 H GLY 117 3.926 -21.276 -12.336 833 HA2 GLY 117 1HA GLY 117 2.203 -22.363 -14.439 834 HA3 GLY 117 2HA GLY 117 1.902 -20.712 -13.916 835 H SER 118 H SER 118 3.479 -22.576 -16.146 836 HA SER 118 HA SER 118 4.847 -20.342 -17.269 837 HB2 SER 118 1HB SER 118 7.131 -21.185 -17.119 838 HB3 SER 118 2HB SER 118 6.467 -20.971 -15.499 839 HG SER 118 HG SER 118 5.850 -23.359 -15.919 840 H ALA 119 H ALA 119 5.975 -20.924 -19.298 841 HA ALA 119 HA ALA 119 4.408 -22.477 -20.970 842 HB1 ALA 119 3HB ALA 119 6.610 -20.822 -21.271 843 HB2 ALA 119 1HB ALA 119 7.154 -22.384 -21.883 844 HB3 ALA 119 2HB ALA 119 5.712 -21.625 -22.559 845 H ASN 120 H ASN 120 7.555 -23.329 -19.530 846 HA ASN 120 HA ASN 120 8.614 -25.331 -19.269 847 HB2 ASN 120 1HB ASN 120 6.405 -25.460 -17.836 848 HB3 ASN 120 2HB ASN 120 5.959 -26.687 -19.018 849 HD21 ASN 120 1HD2 ASN 120 6.785 -28.677 -18.841 850 HD22 ASN 120 2HD2 ASN 120 7.955 -29.157 -17.664 851 H GLU 121 H GLU 121 8.345 -24.689 -21.916 852 HA GLU 121 HA GLU 121 7.487 -27.164 -23.242 853 HB2 GLU 121 1HB GLU 121 8.215 -24.491 -24.455 854 HB3 GLU 121 2HB GLU 121 7.588 -25.884 -25.326 855 HG2 GLU 121 1HG GLU 121 5.467 -25.675 -24.371 856 HG3 GLU 121 2HG GLU 121 6.052 -24.620 -23.087 857 H THR 122 H THR 122 8.874 -28.401 -24.446 858 HA THR 122 HA THR 122 11.732 -27.708 -24.239 859 HB THR 122 HB THR 122 11.059 -29.708 -22.915 860 HG1 THR 122 1HG THR 122 13.179 -29.633 -23.650 861 HG21 THR 122 3HG2 THR 122 10.218 -31.652 -23.881 862 HG22 THR 122 1HG2 THR 122 10.698 -31.169 -25.507 863 HG23 THR 122 2HG2 THR 122 9.329 -30.383 -24.722 864 H SER 123 H SER 123 12.966 -27.738 -26.042 865 HA SER 123 HA SER 123 11.596 -28.354 -28.571 866 HB2 SER 123 1HB SER 123 13.063 -26.783 -29.647 867 HB3 SER 123 2HB SER 123 12.421 -26.003 -28.202 868 HG SER 123 HG SER 123 14.350 -26.110 -27.260 869 H SER 124 H SER 124 12.531 -29.677 -30.087 870 HA SER 124 HA SER 124 15.019 -31.038 -29.286 871 HB2 SER 124 1HB SER 124 12.845 -32.383 -29.021 872 HB3 SER 124 2HB SER 124 12.790 -32.411 -30.784 873 HG SER 124 HG SER 124 13.856 -34.246 -30.008 874 H ILE 125 H ILE 125 15.967 -32.285 -31.218 875 HA ILE 125 HA ILE 125 16.483 -30.390 -33.288 876 HB ILE 125 HB ILE 125 17.679 -32.489 -34.313 877 HG12 ILE 125 1HG1 ILE 125 17.625 -33.368 -31.440 878 HG13 ILE 125 2HG1 ILE 125 16.404 -33.940 -32.572 879 HG21 ILE 125 1HG2 ILE 125 19.303 -31.118 -33.642 880 HG22 ILE 125 2HG2 ILE 125 18.382 -30.591 -32.234 881 HG23 ILE 125 3HG2 ILE 125 19.347 -32.065 -32.155 882 HD11 ILE 125 3HD1 ILE 125 19.236 -34.655 -32.321 883 HD12 ILE 125 1HD1 ILE 125 17.866 -35.603 -32.898 884 HD13 ILE 125 2HD1 ILE 125 18.653 -34.445 -33.972 Start of MODEL 16 1 H1 GLY 1 H GLY 1 13.880 33.689 -40.936 2 HA2 GLY 1 1HA GLY 1 14.330 34.829 -38.280 3 HA3 GLY 1 2HA GLY 1 13.146 35.625 -39.306 4 H SER 2 H SER 2 12.679 34.373 -36.757 5 HA SER 2 HA SER 2 10.356 32.879 -37.411 6 HB2 SER 2 1HB SER 2 11.823 31.031 -37.815 7 HB3 SER 2 2HB SER 2 12.741 31.358 -36.346 8 HG SER 2 HG SER 2 11.395 30.091 -35.371 9 H SER 3 H SER 3 9.061 32.394 -35.570 10 HA SER 3 HA SER 3 9.522 34.211 -33.383 11 HB2 SER 3 1HB SER 3 7.297 33.711 -32.697 12 HB3 SER 3 2HB SER 3 7.264 33.745 -34.460 13 HG SER 3 HG SER 3 7.259 31.512 -34.480 14 H GLY 4 H GLY 4 9.960 33.722 -31.268 15 HA2 GLY 4 1HA GLY 4 10.130 30.940 -30.429 16 HA3 GLY 4 2HA GLY 4 11.655 31.811 -30.496 17 H SER 5 H SER 5 8.903 31.118 -28.648 18 HA SER 5 HA SER 5 9.241 33.397 -26.867 19 HB2 SER 5 1HB SER 5 6.979 32.340 -27.554 20 HB3 SER 5 2HB SER 5 7.376 31.085 -26.381 21 HG SER 5 HG SER 5 6.784 33.789 -25.974 22 H SER 6 H SER 6 9.639 33.145 -24.603 23 HA SER 6 HA SER 6 10.817 30.604 -23.761 24 HB2 SER 6 1HB SER 6 12.876 31.560 -23.054 25 HB3 SER 6 2HB SER 6 12.615 32.155 -24.693 26 HG SER 6 HG SER 6 11.530 33.990 -23.425 27 H GLY 7 H GLY 7 10.846 30.276 -21.517 28 HA2 GLY 7 1HA GLY 7 10.578 31.204 -19.268 29 HA3 GLY 7 2HA GLY 7 9.392 32.311 -19.944 30 H PHE 8 H PHE 8 8.606 30.987 -17.786 31 HA PHE 8 HA PHE 8 6.785 28.934 -18.853 32 HB2 PHE 8 1HB PHE 8 8.050 28.939 -16.104 33 HB3 PHE 8 2HB PHE 8 6.926 27.735 -16.726 34 HD1 PHE 8 1HD PHE 8 10.346 29.025 -16.882 35 HD2 PHE 8 2HD PHE 8 7.641 26.060 -18.299 36 HE1 PHE 8 1HE PHE 8 12.239 27.724 -17.764 37 HE2 PHE 8 2HE PHE 8 9.529 24.754 -19.182 38 HZ PHE 8 HZ PHE 8 11.832 25.585 -18.915 39 H LYS 9 H LYS 9 4.938 28.561 -17.164 40 HA LYS 9 HA LYS 9 3.887 31.222 -16.485 41 HB2 LYS 9 1HB LYS 9 1.668 30.245 -16.658 42 HB3 LYS 9 2HB LYS 9 2.580 29.925 -18.127 43 HG2 LYS 9 1HG LYS 9 3.075 27.657 -17.282 44 HG3 LYS 9 2HG LYS 9 2.057 27.990 -15.879 45 HD2 LYS 9 1HD LYS 9 1.035 28.253 -18.695 46 HD3 LYS 9 2HD LYS 9 0.995 26.719 -17.822 47 HE2 LYS 9 1HE LYS 9 -0.242 27.927 -15.990 48 HE3 LYS 9 2HE LYS 9 -0.374 29.300 -17.088 49 HZ1 LYS 9 3HZ LYS 9 -2.220 27.432 -16.933 50 HZ2 LYS 9 1HZ LYS 9 -1.235 26.703 -18.099 51 HZ3 LYS 9 2HZ LYS 9 -1.880 28.241 -18.380 52 H VAL 10 H VAL 10 5.695 30.052 -14.712 53 HA VAL 10 HA VAL 10 3.944 29.616 -12.396 54 HB VAL 10 HB VAL 10 6.426 27.998 -12.990 55 HG11 VAL 10 1HG1 VAL 10 5.180 26.813 -10.865 56 HG12 VAL 10 2HG1 VAL 10 6.573 27.891 -10.756 57 HG13 VAL 10 3HG1 VAL 10 4.943 28.527 -10.525 58 HG21 VAL 10 3HG2 VAL 10 4.906 26.857 -14.222 59 HG22 VAL 10 1HG2 VAL 10 4.480 26.184 -12.649 60 HG23 VAL 10 2HG2 VAL 10 3.531 27.506 -13.329 61 H ARG 11 H ARG 11 4.530 30.705 -10.600 62 HA ARG 11 HA ARG 11 6.888 32.422 -10.799 63 HB2 ARG 11 1HB ARG 11 4.368 32.504 -9.175 64 HB3 ARG 11 2HB ARG 11 5.778 33.417 -8.656 65 HG2 ARG 11 1HG ARG 11 5.788 34.663 -10.719 66 HG3 ARG 11 2HG ARG 11 4.465 33.682 -11.351 67 HD2 ARG 11 1HD ARG 11 3.093 34.480 -9.393 68 HD3 ARG 11 2HD ARG 11 4.392 35.623 -9.051 69 HE ARG 11 HE ARG 11 3.632 36.922 -10.766 70 HH11 ARG 11 1HH1 ARG 11 2.369 33.701 -11.158 71 HH12 ARG 11 2HH1 ARG 11 1.352 34.123 -12.496 72 HH21 ARG 11 1HH2 ARG 11 2.297 37.489 -12.526 73 HH22 ARG 11 2HH2 ARG 11 1.312 36.277 -13.274 74 H VAL 12 H VAL 12 8.665 31.388 -10.099 75 HA VAL 12 HA VAL 12 8.637 29.468 -7.984 76 HB VAL 12 HB VAL 12 10.293 29.305 -9.758 77 HG11 VAL 12 1HG1 VAL 12 11.881 31.586 -8.737 78 HG12 VAL 12 2HG1 VAL 12 11.746 30.938 -10.373 79 HG13 VAL 12 3HG1 VAL 12 10.469 31.966 -9.722 80 HG21 VAL 12 3HG2 VAL 12 10.751 28.568 -7.348 81 HG22 VAL 12 1HG2 VAL 12 12.130 28.704 -8.439 82 HG23 VAL 12 2HG2 VAL 12 11.812 29.973 -7.256 83 H GLY 13 H GLY 13 9.186 29.679 -5.864 84 HA2 GLY 13 1HA GLY 13 10.169 32.273 -4.915 85 HA3 GLY 13 2HA GLY 13 8.648 31.680 -4.265 86 H GLU 14 H GLU 14 9.530 28.882 -4.314 87 HA GLU 14 HA GLU 14 11.277 28.991 -1.950 88 HB2 GLU 14 1HB GLU 14 9.354 26.817 -2.798 89 HB3 GLU 14 2HB GLU 14 10.311 26.828 -1.323 90 HG2 GLU 14 1HG GLU 14 8.121 27.477 -0.729 91 HG3 GLU 14 2HG GLU 14 9.117 28.930 -0.671 92 HA PRO 15 HA PRO 15 14.484 26.819 -4.016 93 HB2 PRO 15 1HB PRO 15 15.545 25.398 -1.960 94 HB3 PRO 15 2HB PRO 15 15.750 27.146 -2.126 95 HG2 PRO 15 1HG PRO 15 13.827 25.618 -0.415 96 HG3 PRO 15 2HG PRO 15 14.792 27.049 -0.010 97 HD2 PRO 15 1HD PRO 15 12.167 27.198 -0.656 98 HD3 PRO 15 2HD PRO 15 13.321 28.490 -1.045 99 H GLY 16 H GLY 16 13.740 25.338 -5.456 100 HA2 GLY 16 1HA GLY 16 13.625 23.110 -6.182 101 HA3 GLY 16 2HA GLY 16 13.476 22.595 -4.508 102 H GLN 17 H GLN 17 11.852 21.306 -6.067 103 HA GLN 17 HA GLN 17 9.319 22.695 -6.351 104 HB2 GLN 17 1HB GLN 17 10.219 21.042 -8.045 105 HB3 GLN 17 2HB GLN 17 9.883 19.777 -6.871 106 HG2 GLN 17 1HG GLN 17 7.609 19.982 -7.091 107 HG3 GLN 17 2HG GLN 17 7.705 21.654 -7.641 108 HE21 GLN 17 1HE2 GLN 17 9.065 18.549 -8.703 109 HE22 GLN 17 2HE2 GLN 17 8.581 18.709 -10.354 110 H ALA 18 H ALA 18 7.621 22.533 -5.013 111 HA ALA 18 HA ALA 18 7.982 21.172 -2.492 112 HB1 ALA 18 3HB ALA 18 6.752 22.879 -1.792 113 HB2 ALA 18 1HB ALA 18 6.430 23.369 -3.456 114 HB3 ALA 18 2HB ALA 18 5.369 22.208 -2.657 115 H GLY 19 H GLY 19 6.769 19.476 -1.687 116 HA2 GLY 19 1HA GLY 19 4.867 18.198 -3.536 117 HA3 GLY 19 2HA GLY 19 6.190 17.257 -2.864 118 H ASN 20 H ASN 20 3.024 18.383 -2.398 119 HA ASN 20 HA ASN 20 3.024 17.896 0.470 120 HB2 ASN 20 1HB ASN 20 1.715 19.777 -0.303 121 HB3 ASN 20 2HB ASN 20 0.835 18.752 -1.433 122 HD21 ASN 20 1HD2 ASN 20 -0.853 19.991 -0.070 123 HD22 ASN 20 2HD2 ASN 20 -1.478 19.123 1.286 124 HA PRO 21 HA PRO 21 1.982 13.618 -0.151 125 HB2 PRO 21 1HB PRO 21 1.607 13.027 2.471 126 HB3 PRO 21 2HB PRO 21 3.209 13.209 1.747 127 HG2 PRO 21 1HG PRO 21 1.622 15.173 3.355 128 HG3 PRO 21 2HG PRO 21 3.350 14.789 3.448 129 HD2 PRO 21 1HD PRO 21 2.413 16.977 2.158 130 HD3 PRO 21 2HD PRO 21 3.871 16.111 1.634 131 H ALA 22 H ALA 22 0.078 15.633 2.085 132 HA ALA 22 HA ALA 22 -2.194 14.167 2.377 133 HB1 ALA 22 3HB ALA 22 -3.306 16.123 2.956 134 HB2 ALA 22 1HB ALA 22 -1.613 16.525 3.245 135 HB3 ALA 22 2HB ALA 22 -2.418 17.094 1.782 136 H LEU 23 H LEU 23 -1.483 16.344 -0.348 137 HA LEU 23 HA LEU 23 -3.860 15.978 -1.758 138 HB2 LEU 23 1HB LEU 23 -1.069 16.653 -2.629 139 HB3 LEU 23 2HB LEU 23 -2.393 16.526 -3.785 140 HG LEU 23 HG LEU 23 -2.405 18.418 -1.439 141 HD11 LEU 23 1HD1 LEU 23 -1.919 19.291 -4.249 142 HD12 LEU 23 2HD1 LEU 23 -0.572 18.708 -3.272 143 HD13 LEU 23 3HD1 LEU 23 -1.516 20.097 -2.733 144 HD21 LEU 23 3HD2 LEU 23 -4.406 19.136 -2.172 145 HD22 LEU 23 1HD2 LEU 23 -4.488 17.548 -2.935 146 HD23 LEU 23 2HD2 LEU 23 -3.968 18.950 -3.871 147 H VAL 24 H VAL 24 -0.793 14.200 -1.986 148 HA VAL 24 HA VAL 24 -1.324 12.505 -4.075 149 HB VAL 24 HB VAL 24 0.105 11.829 -1.500 150 HG11 VAL 24 1HG1 VAL 24 -0.593 9.821 -2.746 151 HG12 VAL 24 2HG1 VAL 24 0.252 10.432 -4.170 152 HG13 VAL 24 3HG1 VAL 24 1.159 10.019 -2.715 153 HG21 VAL 24 3HG2 VAL 24 1.369 12.536 -4.128 154 HG22 VAL 24 1HG2 VAL 24 0.896 13.780 -2.970 155 HG23 VAL 24 2HG2 VAL 24 2.081 12.555 -2.514 156 H SER 25 H SER 25 -2.629 10.820 -4.456 157 HA SER 25 HA SER 25 -4.062 9.614 -2.187 158 HB2 SER 25 1HB SER 25 -5.419 10.051 -4.835 159 HB3 SER 25 2HB SER 25 -6.145 9.755 -3.256 160 HG SER 25 HG SER 25 -6.392 11.880 -3.464 161 H ALA 26 H ALA 26 -5.131 7.515 -2.832 162 HA ALA 26 HA ALA 26 -3.711 6.111 -4.974 163 HB1 ALA 26 3HB ALA 26 -3.132 5.791 -2.205 164 HB2 ALA 26 1HB ALA 26 -3.871 4.305 -2.803 165 HB3 ALA 26 2HB ALA 26 -2.429 4.950 -3.587 166 H TYR 27 H TYR 27 -4.969 4.723 -6.071 167 HA TYR 27 HA TYR 27 -7.311 3.530 -4.866 168 HB2 TYR 27 1HB TYR 27 -8.783 4.414 -6.754 169 HB3 TYR 27 2HB TYR 27 -8.368 5.553 -5.479 170 HD1 TYR 27 2HD TYR 27 -7.761 4.611 -8.982 171 HD2 TYR 27 1HD TYR 27 -6.989 7.471 -5.928 172 HE1 TYR 27 2HE TYR 27 -6.880 6.167 -10.670 173 HE2 TYR 27 1HE TYR 27 -6.107 9.036 -7.608 174 HH TYR 27 HH TYR 27 -5.910 8.131 -11.037 175 H GLY 28 H GLY 28 -8.336 1.942 -6.271 176 HA2 GLY 28 1HA GLY 28 -7.834 1.135 -8.763 177 HA3 GLY 28 2HA GLY 28 -6.348 0.649 -7.960 178 H THR 29 H THR 29 -6.721 -1.543 -8.330 179 HA THR 29 HA THR 29 -9.049 -2.710 -6.964 180 HB THR 29 HB THR 29 -7.224 -4.037 -8.977 181 HG1 THR 29 1HG THR 29 -9.865 -3.033 -9.356 182 HG21 THR 29 3HG2 THR 29 -8.220 -5.921 -8.327 183 HG22 THR 29 1HG2 THR 29 -9.758 -5.253 -8.871 184 HG23 THR 29 2HG2 THR 29 -9.244 -5.035 -7.197 185 H GLY 30 H GLY 30 -5.560 -2.655 -7.065 186 HA2 GLY 30 1HA GLY 30 -4.982 -4.944 -5.567 187 HA3 GLY 30 2HA GLY 30 -3.977 -3.504 -5.638 188 H LEU 31 H LEU 31 -5.828 -1.682 -4.502 189 HA LEU 31 HA LEU 31 -5.390 -2.259 -1.729 190 HB2 LEU 31 1HB LEU 31 -6.831 0.003 -3.102 191 HB3 LEU 31 2HB LEU 31 -6.532 -0.080 -1.367 192 HG LEU 31 HG LEU 31 -4.305 -0.095 -3.389 193 HD11 LEU 31 1HD1 LEU 31 -4.781 2.021 -3.869 194 HD12 LEU 31 2HD1 LEU 31 -4.375 2.411 -2.198 195 HD13 LEU 31 3HD1 LEU 31 -6.050 2.086 -2.645 196 HD21 LEU 31 3HD2 LEU 31 -4.194 -0.754 -0.812 197 HD22 LEU 31 1HD2 LEU 31 -4.067 0.997 -0.644 198 HD23 LEU 31 2HD2 LEU 31 -2.892 0.118 -1.622 199 H GLU 32 H GLU 32 -8.104 -2.384 -3.927 200 HA GLU 32 HA GLU 32 -10.264 -2.398 -2.231 201 HB2 GLU 32 1HB GLU 32 -9.763 -4.059 -4.702 202 HB3 GLU 32 2HB GLU 32 -11.320 -3.985 -3.888 203 HG2 GLU 32 1HG GLU 32 -9.945 -1.495 -4.814 204 HG3 GLU 32 2HG GLU 32 -10.912 -2.470 -5.919 205 H GLY 33 H GLY 33 -7.958 -4.987 -2.845 206 HA2 GLY 33 1HA GLY 33 -8.311 -6.220 -0.365 207 HA3 GLY 33 2HA GLY 33 -9.357 -7.047 -1.509 208 H GLY 34 H GLY 34 -7.761 -8.774 -0.641 209 HA2 GLY 34 1HA GLY 34 -5.327 -8.779 -2.308 210 HA3 GLY 34 2HA GLY 34 -5.529 -9.699 -0.824 211 H THR 35 H THR 35 -5.805 -9.724 -4.207 212 HA THR 35 HA THR 35 -7.386 -12.198 -4.184 213 HB THR 35 HB THR 35 -7.119 -11.759 -6.798 214 HG1 THR 35 1HG THR 35 -7.250 -9.093 -5.895 215 HG21 THR 35 3HG2 THR 35 -9.297 -10.952 -6.793 216 HG22 THR 35 1HG2 THR 35 -9.048 -9.997 -5.332 217 HG23 THR 35 2HG2 THR 35 -9.187 -11.752 -5.225 218 H THR 36 H THR 36 -6.122 -13.927 -3.885 219 HA THR 36 HA THR 36 -3.398 -14.038 -4.763 220 HB THR 36 HB THR 36 -4.874 -16.522 -4.016 221 HG1 THR 36 1HG THR 36 -4.614 -14.241 -2.432 222 HG21 THR 36 3HG2 THR 36 -2.284 -16.052 -4.480 223 HG22 THR 36 1HG2 THR 36 -2.835 -17.257 -3.318 224 HG23 THR 36 2HG2 THR 36 -2.329 -15.662 -2.761 225 H GLY 37 H GLY 37 -2.637 -14.680 -6.673 226 HA2 GLY 37 1HA GLY 37 -2.568 -16.264 -8.480 227 HA3 GLY 37 2HA GLY 37 -4.312 -16.432 -8.344 228 H ILE 38 H ILE 38 -4.599 -13.466 -8.100 229 HA ILE 38 HA ILE 38 -4.393 -12.889 -10.973 230 HB ILE 38 HB ILE 38 -6.055 -11.369 -8.973 231 HG12 ILE 38 1HG1 ILE 38 -7.035 -13.599 -10.759 232 HG13 ILE 38 2HG1 ILE 38 -6.617 -13.838 -9.066 233 HG21 ILE 38 1HG2 ILE 38 -5.890 -11.496 -11.959 234 HG22 ILE 38 2HG2 ILE 38 -7.370 -10.969 -11.159 235 HG23 ILE 38 3HG2 ILE 38 -5.866 -10.087 -10.899 236 HD11 ILE 38 3HD1 ILE 38 -8.505 -11.653 -9.621 237 HD12 ILE 38 1HD1 ILE 38 -9.092 -13.286 -9.934 238 HD13 ILE 38 2HD1 ILE 38 -8.498 -12.854 -8.330 239 H GLN 39 H GLN 39 -3.947 -10.632 -11.590 240 HA GLN 39 HA GLN 39 -1.920 -9.462 -9.808 241 HB2 GLN 39 1HB GLN 39 -0.807 -9.980 -11.780 242 HB3 GLN 39 2HB GLN 39 -2.196 -9.590 -12.786 243 HG2 GLN 39 1HG GLN 39 -1.853 -7.230 -12.412 244 HG3 GLN 39 2HG GLN 39 -0.526 -7.573 -11.304 245 HE21 GLN 39 1HE2 GLN 39 1.393 -8.529 -12.164 246 HE22 GLN 39 2HE2 GLN 39 1.823 -8.280 -13.819 247 H SER 40 H SER 40 -2.463 -7.655 -8.801 248 HA SER 40 HA SER 40 -4.628 -6.009 -9.909 249 HB2 SER 40 1HB SER 40 -3.573 -6.410 -7.122 250 HB3 SER 40 2HB SER 40 -4.532 -4.987 -7.525 251 HG SER 40 HG SER 40 -5.622 -7.027 -6.736 252 H GLU 41 H GLU 41 -4.438 -3.653 -9.654 253 HA GLU 41 HA GLU 41 -1.744 -2.588 -9.425 254 HB2 GLU 41 1HB GLU 41 -1.761 -1.503 -11.590 255 HB3 GLU 41 2HB GLU 41 -1.949 -3.238 -11.802 256 HG2 GLU 41 1HG GLU 41 -4.019 -1.091 -12.095 257 HG3 GLU 41 2HG GLU 41 -3.452 -2.244 -13.301 258 H PHE 42 H PHE 42 -1.759 -0.648 -8.478 259 HA PHE 42 HA PHE 42 -4.256 0.910 -8.518 260 HB2 PHE 42 1HB PHE 42 -4.141 1.352 -6.213 261 HB3 PHE 42 2HB PHE 42 -3.759 -0.362 -6.337 262 HD1 PHE 42 1HD PHE 42 -2.233 2.996 -5.987 263 HD2 PHE 42 2HD PHE 42 -1.749 -1.205 -5.499 264 HE1 PHE 42 1HE PHE 42 -0.131 3.383 -4.769 265 HE2 PHE 42 2HE PHE 42 0.354 -0.824 -4.279 266 HZ PHE 42 HZ PHE 42 1.165 1.472 -3.912 267 H PHE 43 H PHE 43 -3.997 2.914 -9.234 268 HA PHE 43 HA PHE 43 -1.328 3.948 -9.671 269 HB2 PHE 43 1HB PHE 43 -4.051 5.061 -10.373 270 HB3 PHE 43 2HB PHE 43 -2.522 5.810 -10.824 271 HD1 PHE 43 2HD PHE 43 -4.372 2.593 -11.128 272 HD2 PHE 43 1HD PHE 43 -1.561 5.284 -12.852 273 HE1 PHE 43 2HE PHE 43 -4.303 1.211 -13.162 274 HE2 PHE 43 1HE PHE 43 -1.487 3.907 -14.890 275 HZ PHE 43 HZ PHE 43 -2.858 1.867 -15.046 276 H ILE 44 H ILE 44 -0.804 6.211 -9.108 277 HA ILE 44 HA ILE 44 -2.066 7.054 -6.584 278 HB ILE 44 HB ILE 44 0.893 7.054 -7.190 279 HG12 ILE 44 1HG1 ILE 44 -0.757 5.506 -5.182 280 HG13 ILE 44 2HG1 ILE 44 0.065 4.843 -6.589 281 HG21 ILE 44 1HG2 ILE 44 1.163 7.940 -4.920 282 HG22 ILE 44 2HG2 ILE 44 0.251 9.043 -5.949 283 HG23 ILE 44 3HG2 ILE 44 -0.590 8.049 -4.761 284 HD11 ILE 44 3HD1 ILE 44 2.085 6.112 -5.226 285 HD12 ILE 44 1HD1 ILE 44 1.085 5.436 -3.940 286 HD13 ILE 44 2HD1 ILE 44 1.733 4.384 -5.199 287 H ASN 45 H ASN 45 -3.141 8.844 -7.172 288 HA ASN 45 HA ASN 45 -2.402 10.604 -9.230 289 HB2 ASN 45 1HB ASN 45 -4.690 10.346 -8.140 290 HB3 ASN 45 2HB ASN 45 -4.079 11.364 -6.839 291 HD21 ASN 45 1HD2 ASN 45 -6.060 11.551 -9.244 292 HD22 ASN 45 2HD2 ASN 45 -5.742 13.134 -9.861 293 H THR 46 H THR 46 -0.343 11.382 -9.109 294 HA THR 46 HA THR 46 0.261 13.119 -6.805 295 HB THR 46 HB THR 46 1.707 11.167 -6.705 296 HG1 THR 46 1HG THR 46 3.061 12.656 -6.051 297 HG21 THR 46 3HG2 THR 46 1.573 10.653 -9.160 298 HG22 THR 46 1HG2 THR 46 3.191 10.534 -8.470 299 HG23 THR 46 2HG2 THR 46 2.743 11.944 -9.429 300 H THR 47 H THR 47 -0.873 13.515 -9.622 301 HA THR 47 HA THR 47 1.046 14.951 -11.128 302 HB THR 47 HB THR 47 -0.891 15.857 -12.379 303 HG1 THR 47 1HG THR 47 -2.982 14.848 -11.665 304 HG21 THR 47 3HG2 THR 47 -0.039 13.713 -13.057 305 HG22 THR 47 1HG2 THR 47 -1.800 13.657 -13.128 306 HG23 THR 47 2HG2 THR 47 -0.947 12.898 -11.784 307 H ARG 48 H ARG 48 -1.069 15.819 -8.502 308 HA ARG 48 HA ARG 48 -0.581 18.667 -8.871 309 HB2 ARG 48 1HB ARG 48 -2.398 17.021 -7.181 310 HB3 ARG 48 2HB ARG 48 -1.939 18.608 -6.577 311 HG2 ARG 48 1HG ARG 48 -2.964 18.328 -9.365 312 HG3 ARG 48 2HG ARG 48 -4.089 18.326 -8.005 313 HD2 ARG 48 1HD ARG 48 -3.145 20.477 -7.258 314 HD3 ARG 48 2HD ARG 48 -2.083 20.480 -8.665 315 HE ARG 48 HE ARG 48 -4.823 20.220 -9.404 316 HH11 ARG 48 1HH1 ARG 48 -2.399 22.512 -8.408 317 HH12 ARG 48 2HH1 ARG 48 -3.167 23.858 -9.183 318 HH21 ARG 48 1HH2 ARG 48 -5.843 21.984 -10.429 319 HH22 ARG 48 2HH2 ARG 48 -5.126 23.556 -10.332 320 H ALA 49 H ALA 49 0.417 16.011 -6.834 321 HA ALA 49 HA ALA 49 1.647 17.554 -4.795 322 HB1 ALA 49 3HB ALA 49 2.913 15.362 -4.385 323 HB2 ALA 49 1HB ALA 49 1.159 15.351 -4.201 324 HB3 ALA 49 2HB ALA 49 1.897 14.695 -5.663 325 H GLY 50 H GLY 50 2.814 16.153 -7.824 326 HA2 GLY 50 1HA GLY 50 4.522 17.323 -9.072 327 HA3 GLY 50 2HA GLY 50 5.234 17.813 -7.542 328 HA PRO 51 HA PRO 51 6.918 13.648 -9.285 329 HB2 PRO 51 1HB PRO 51 8.934 14.517 -10.881 330 HB3 PRO 51 2HB PRO 51 7.303 14.198 -11.482 331 HG2 PRO 51 1HG PRO 51 8.572 16.806 -10.744 332 HG3 PRO 51 2HG PRO 51 7.550 16.415 -12.138 333 HD2 PRO 51 1HD PRO 51 6.597 17.680 -9.942 334 HD3 PRO 51 2HD PRO 51 5.603 16.577 -10.915 335 H GLY 52 H GLY 52 9.239 12.893 -9.018 336 HA2 GLY 52 1HA GLY 52 11.364 14.150 -7.971 337 HA3 GLY 52 2HA GLY 52 10.286 14.081 -6.584 338 H THR 53 H THR 53 10.590 12.411 -5.285 339 HA THR 53 HA THR 53 11.810 9.973 -6.404 340 HB THR 53 HB THR 53 11.923 10.938 -3.540 341 HG1 THR 53 1HG THR 53 13.193 12.006 -5.427 342 HG21 THR 53 3HG2 THR 53 12.252 8.681 -3.323 343 HG22 THR 53 1HG2 THR 53 13.902 9.186 -3.685 344 HG23 THR 53 2HG2 THR 53 12.889 8.504 -4.958 345 H LEU 54 H LEU 54 10.865 8.022 -6.061 346 HA LEU 54 HA LEU 54 8.235 8.057 -4.755 347 HB2 LEU 54 1HB LEU 54 9.422 6.533 -7.004 348 HB3 LEU 54 2HB LEU 54 8.229 5.705 -6.006 349 HG LEU 54 HG LEU 54 7.159 6.634 -7.955 350 HD11 LEU 54 1HD1 LEU 54 5.375 7.067 -6.716 351 HD12 LEU 54 2HD1 LEU 54 6.046 8.623 -6.229 352 HD13 LEU 54 3HD1 LEU 54 6.418 7.173 -5.297 353 HD21 LEU 54 3HD2 LEU 54 7.271 8.869 -8.617 354 HD22 LEU 54 1HD2 LEU 54 8.932 8.475 -8.177 355 HD23 LEU 54 2HD2 LEU 54 7.921 9.395 -7.064 356 H SER 55 H SER 55 7.743 6.711 -3.091 357 HA SER 55 HA SER 55 9.756 4.752 -2.241 358 HB2 SER 55 1HB SER 55 8.656 7.038 -0.635 359 HB3 SER 55 2HB SER 55 9.154 5.552 0.172 360 HG SER 55 HG SER 55 11.220 5.839 -0.621 361 H VAL 56 H VAL 56 8.758 2.856 -2.249 362 HA VAL 56 HA VAL 56 6.109 2.653 -0.999 363 HB VAL 56 HB VAL 56 5.528 2.608 -3.286 364 HG11 VAL 56 1HG1 VAL 56 7.400 2.392 -4.570 365 HG12 VAL 56 2HG1 VAL 56 8.059 1.083 -3.588 366 HG13 VAL 56 3HG1 VAL 56 6.754 0.759 -4.730 367 HG21 VAL 56 3HG2 VAL 56 4.803 0.266 -3.657 368 HG22 VAL 56 1HG2 VAL 56 5.812 -0.227 -2.296 369 HG23 VAL 56 2HG2 VAL 56 4.444 0.855 -2.034 370 H THR 57 H THR 57 6.039 1.117 0.500 371 HA THR 57 HA THR 57 7.906 -1.150 0.298 372 HB THR 57 HB THR 57 7.211 -0.058 2.993 373 HG1 THR 57 1HG THR 57 8.036 1.724 1.763 374 HG21 THR 57 3HG2 THR 57 8.831 -2.126 1.977 375 HG22 THR 57 1HG2 THR 57 8.684 -1.595 3.651 376 HG23 THR 57 2HG2 THR 57 9.926 -0.898 2.611 377 H ILE 58 H ILE 58 6.874 -3.029 0.316 378 HA ILE 58 HA ILE 58 4.238 -3.172 1.628 379 HB ILE 58 HB ILE 58 5.157 -4.942 -0.632 380 HG12 ILE 58 1HG1 ILE 58 3.349 -2.527 -0.834 381 HG13 ILE 58 2HG1 ILE 58 5.047 -2.523 -1.296 382 HG21 ILE 58 1HG2 ILE 58 2.588 -5.144 -0.825 383 HG22 ILE 58 2HG2 ILE 58 3.419 -6.022 0.459 384 HG23 ILE 58 3HG2 ILE 58 2.577 -4.516 0.823 385 HD11 ILE 58 3HD1 ILE 58 4.492 -3.245 -3.305 386 HD12 ILE 58 1HD1 ILE 58 3.801 -4.705 -2.597 387 HD13 ILE 58 2HD1 ILE 58 2.794 -3.276 -2.832 388 H GLU 59 H GLU 59 3.682 -5.128 2.697 389 HA GLU 59 HA GLU 59 5.922 -6.932 3.291 390 HB2 GLU 59 1HB GLU 59 5.790 -6.679 5.562 391 HB3 GLU 59 2HB GLU 59 5.342 -5.054 5.064 392 HG2 GLU 59 1HG GLU 59 2.935 -5.825 5.196 393 HG3 GLU 59 2HG GLU 59 3.547 -7.263 6.011 394 H GLY 60 H GLY 60 4.939 -8.788 4.807 395 HA2 GLY 60 1HA GLY 60 2.457 -9.732 4.905 396 HA3 GLY 60 2HA GLY 60 2.805 -9.951 3.197 397 HA PRO 61 HA PRO 61 4.321 -13.586 5.834 398 HB2 PRO 61 1HB PRO 61 2.519 -15.425 4.973 399 HB3 PRO 61 2HB PRO 61 2.244 -14.400 6.386 400 HG2 PRO 61 1HG PRO 61 1.230 -14.079 3.588 401 HG3 PRO 61 2HG PRO 61 0.369 -13.858 5.123 402 HD2 PRO 61 1HD PRO 61 1.337 -11.779 3.682 403 HD3 PRO 61 2HD PRO 61 1.244 -11.752 5.455 404 H SER 62 H SER 62 3.009 -13.511 2.533 405 HA SER 62 HA SER 62 5.070 -15.401 1.669 406 HB2 SER 62 1HB SER 62 2.489 -15.422 1.031 407 HB3 SER 62 2HB SER 62 3.036 -14.311 -0.225 408 HG SER 62 HG SER 62 3.807 -15.962 -1.250 409 H LYS 63 H LYS 63 6.683 -14.883 0.272 410 HA LYS 63 HA LYS 63 7.356 -12.108 0.001 411 HB2 LYS 63 1HB LYS 63 9.143 -13.659 0.392 412 HB3 LYS 63 2HB LYS 63 8.671 -14.637 -0.992 413 HG2 LYS 63 1HG LYS 63 10.496 -13.485 -1.796 414 HG3 LYS 63 2HG LYS 63 9.149 -12.494 -2.362 415 HD2 LYS 63 1HD LYS 63 9.451 -11.048 -0.361 416 HD3 LYS 63 2HD LYS 63 10.882 -11.992 0.057 417 HE2 LYS 63 1HE LYS 63 11.878 -11.382 -2.117 418 HE3 LYS 63 2HE LYS 63 10.466 -10.385 -2.463 419 HZ1 LYS 63 3HZ LYS 63 11.013 -9.135 -0.387 420 HZ2 LYS 63 1HZ LYS 63 12.147 -8.966 -1.632 421 HZ3 LYS 63 2HZ LYS 63 12.476 -9.982 -0.321 422 H VAL 64 H VAL 64 6.401 -10.867 -1.470 423 HA VAL 64 HA VAL 64 5.622 -12.035 -4.047 424 HB VAL 64 HB VAL 64 4.170 -10.152 -4.358 425 HG11 VAL 64 1HG1 VAL 64 2.682 -10.371 -2.411 426 HG12 VAL 64 2HG1 VAL 64 3.291 -11.933 -2.964 427 HG13 VAL 64 3HG1 VAL 64 3.979 -11.175 -1.527 428 HG21 VAL 64 3HG2 VAL 64 5.834 -8.968 -2.231 429 HG22 VAL 64 1HG2 VAL 64 5.051 -8.210 -3.617 430 HG23 VAL 64 2HG2 VAL 64 4.115 -8.579 -2.169 431 H LYS 65 H LYS 65 6.715 -11.587 -5.843 432 HA LYS 65 HA LYS 65 8.948 -9.746 -5.730 433 HB2 LYS 65 1HB LYS 65 7.992 -11.813 -7.674 434 HB3 LYS 65 2HB LYS 65 9.142 -10.593 -8.208 435 HG2 LYS 65 1HG LYS 65 10.724 -11.291 -6.522 436 HG3 LYS 65 2HG LYS 65 9.560 -12.447 -5.872 437 HD2 LYS 65 1HD LYS 65 9.557 -13.574 -8.106 438 HD3 LYS 65 2HD LYS 65 10.876 -12.502 -8.585 439 HE2 LYS 65 1HE LYS 65 12.287 -13.387 -6.843 440 HE3 LYS 65 2HE LYS 65 10.959 -14.356 -6.208 441 HZ1 LYS 65 3HZ LYS 65 12.811 -15.081 -8.145 442 HZ2 LYS 65 1HZ LYS 65 11.325 -14.934 -8.941 443 HZ3 LYS 65 2HZ LYS 65 11.473 -15.969 -7.612 444 H MET 66 H MET 66 6.150 -8.748 -5.688 445 HA MET 66 HA MET 66 5.126 -7.686 -7.940 446 HB2 MET 66 1HB MET 66 4.149 -5.997 -6.653 447 HB3 MET 66 2HB MET 66 4.454 -7.278 -5.488 448 HG2 MET 66 1HG MET 66 6.078 -4.782 -5.903 449 HG3 MET 66 2HG MET 66 5.053 -5.172 -4.523 450 HE1 MET 66 3HE MET 66 6.262 -6.901 -2.302 451 HE2 MET 66 1HE MET 66 7.642 -5.806 -2.206 452 HE3 MET 66 2HE MET 66 6.059 -5.189 -2.677 453 H ASP 67 H ASP 67 5.411 -5.808 -9.196 454 HA ASP 67 HA ASP 67 7.951 -4.382 -8.903 455 HB2 ASP 67 1HB ASP 67 8.002 -6.400 -10.585 456 HB3 ASP 67 2HB ASP 67 7.139 -5.285 -11.641 457 H CYS 68 H CYS 68 7.780 -2.257 -9.287 458 HA CYS 68 HA CYS 68 5.384 -1.292 -10.701 459 HB2 CYS 68 1HB CYS 68 5.191 0.545 -9.128 460 HB3 CYS 68 2HB CYS 68 5.165 -0.979 -8.251 461 HG CYS 68 HG CYS 68 8.015 0.878 -8.557 462 H GLN 69 H GLN 69 5.654 0.411 -12.084 463 HA GLN 69 HA GLN 69 8.394 1.455 -12.371 464 HB2 GLN 69 1HB GLN 69 8.081 1.504 -14.787 465 HB3 GLN 69 2HB GLN 69 7.861 -0.129 -14.172 466 HG2 GLN 69 1HG GLN 69 5.520 1.681 -14.613 467 HG3 GLN 69 2HG GLN 69 6.226 0.758 -15.938 468 HE21 GLN 69 1HE2 GLN 69 3.968 -0.097 -15.900 469 HE22 GLN 69 2HE2 GLN 69 3.658 -1.471 -14.900 470 H GLU 70 H GLU 70 8.467 3.550 -13.594 471 HA GLU 70 HA GLU 70 6.651 5.398 -12.376 472 HB2 GLU 70 1HB GLU 70 7.988 7.122 -13.392 473 HB3 GLU 70 2HB GLU 70 9.063 5.883 -12.760 474 HG2 GLU 70 1HG GLU 70 8.207 5.975 -15.635 475 HG3 GLU 70 2HG GLU 70 9.632 6.818 -15.031 476 H THR 71 H THR 71 5.238 6.847 -13.427 477 HA THR 71 HA THR 71 4.475 6.124 -16.173 478 HB THR 71 HB THR 71 2.112 6.258 -15.622 479 HG1 THR 71 1HG THR 71 3.127 7.029 -13.116 480 HG21 THR 71 3HG2 THR 71 1.932 4.139 -14.796 481 HG22 THR 71 1HG2 THR 71 3.075 4.434 -13.487 482 HG23 THR 71 2HG2 THR 71 3.664 4.147 -15.124 483 HA PRO 72 HA PRO 72 4.428 10.447 -16.955 484 HB2 PRO 72 1HB PRO 72 2.570 10.577 -18.931 485 HB3 PRO 72 2HB PRO 72 4.189 9.911 -19.177 486 HG2 PRO 72 1HG PRO 72 1.606 8.479 -18.688 487 HG3 PRO 72 2HG PRO 72 2.899 8.094 -19.840 488 HD2 PRO 72 1HD PRO 72 2.623 6.804 -17.475 489 HD3 PRO 72 2HD PRO 72 4.205 7.086 -18.231 490 H GLU 73 H GLU 73 1.879 8.857 -15.501 491 HA GLU 73 HA GLU 73 0.240 11.288 -15.306 492 HB2 GLU 73 1HB GLU 73 -0.941 9.273 -16.057 493 HB3 GLU 73 2HB GLU 73 -0.443 8.429 -14.597 494 HG2 GLU 73 1HG GLU 73 -2.644 9.070 -14.188 495 HG3 GLU 73 2HG GLU 73 -1.669 10.251 -13.316 496 H GLY 74 H GLY 74 1.757 8.750 -13.346 497 HA2 GLY 74 1HA GLY 74 2.474 10.522 -11.272 498 HA3 GLY 74 2HA GLY 74 0.997 9.683 -10.822 499 H TYR 75 H TYR 75 1.051 7.328 -10.775 500 HA TYR 75 HA TYR 75 3.538 5.935 -10.887 501 HB2 TYR 75 1HB TYR 75 3.483 7.315 -8.649 502 HB3 TYR 75 2HB TYR 75 2.416 6.022 -8.113 503 HD1 TYR 75 2HD TYR 75 5.490 5.978 -10.235 504 HD2 TYR 75 1HD TYR 75 3.603 4.679 -6.649 505 HE1 TYR 75 2HE TYR 75 7.449 4.584 -9.715 506 HE2 TYR 75 1HE TYR 75 5.557 3.283 -6.119 507 HH TYR 75 HH TYR 75 7.670 2.785 -6.676 508 H LYS 76 H LYS 76 3.233 3.763 -11.012 509 HA LYS 76 HA LYS 76 0.574 2.706 -10.339 510 HB2 LYS 76 1HB LYS 76 0.749 3.162 -12.787 511 HB3 LYS 76 2HB LYS 76 2.098 2.037 -12.862 512 HG2 LYS 76 1HG LYS 76 0.608 0.240 -12.070 513 HG3 LYS 76 2HG LYS 76 -0.739 1.381 -12.096 514 HD2 LYS 76 1HD LYS 76 -0.367 1.723 -14.509 515 HD3 LYS 76 2HD LYS 76 0.929 0.527 -14.462 516 HE2 LYS 76 1HE LYS 76 -0.738 -1.134 -13.630 517 HE3 LYS 76 2HE LYS 76 -1.996 0.072 -13.893 518 HZ1 LYS 76 3HZ LYS 76 -1.981 -1.268 -15.799 519 HZ2 LYS 76 1HZ LYS 76 -0.293 -1.254 -15.917 520 HZ3 LYS 76 2HZ LYS 76 -1.176 0.146 -16.262 521 H VAL 77 H VAL 77 0.676 0.967 -9.085 522 HA VAL 77 HA VAL 77 3.118 -0.683 -9.161 523 HB VAL 77 HB VAL 77 1.522 0.106 -6.721 524 HG11 VAL 77 1HG1 VAL 77 3.566 -2.014 -7.174 525 HG12 VAL 77 2HG1 VAL 77 3.537 -1.168 -5.626 526 HG13 VAL 77 3HG1 VAL 77 2.111 -2.045 -6.180 527 HG21 VAL 77 3HG2 VAL 77 3.123 1.607 -6.241 528 HG22 VAL 77 1HG2 VAL 77 4.419 0.547 -6.797 529 HG23 VAL 77 2HG2 VAL 77 3.503 1.505 -7.960 530 H MET 78 H MET 78 2.848 -2.855 -9.205 531 HA MET 78 HA MET 78 0.156 -3.938 -8.770 532 HB2 MET 78 1HB MET 78 1.852 -4.872 -11.071 533 HB3 MET 78 2HB MET 78 0.139 -5.150 -10.791 534 HG2 MET 78 1HG MET 78 0.097 -3.575 -12.457 535 HG3 MET 78 2HG MET 78 -0.054 -2.576 -11.013 536 HE1 MET 78 3HE MET 78 3.686 -3.133 -13.590 537 HE2 MET 78 1HE MET 78 3.622 -4.097 -12.114 538 HE3 MET 78 2HE MET 78 2.369 -4.281 -13.341 539 H TYR 79 H TYR 79 0.139 -5.735 -7.572 540 HA TYR 79 HA TYR 79 2.604 -7.322 -7.366 541 HB2 TYR 79 1HB TYR 79 2.399 -7.472 -4.968 542 HB3 TYR 79 2HB TYR 79 2.411 -5.771 -5.420 543 HD1 TYR 79 2HD TYR 79 0.320 -4.451 -5.324 544 HD2 TYR 79 1HD TYR 79 0.488 -8.467 -3.928 545 HE1 TYR 79 2HE TYR 79 -1.783 -4.106 -4.097 546 HE2 TYR 79 1HE TYR 79 -1.616 -8.134 -2.698 547 HH TYR 79 HH TYR 79 -3.434 -5.112 -2.954 548 H THR 80 H THR 80 2.327 -9.512 -7.052 549 HA THR 80 HA THR 80 -0.453 -10.491 -7.072 550 HB THR 80 HB THR 80 1.837 -11.764 -8.578 551 HG1 THR 80 1HG THR 80 1.399 -10.007 -9.779 552 HG21 THR 80 3HG2 THR 80 -0.826 -12.411 -9.471 553 HG22 THR 80 1HG2 THR 80 -0.639 -12.782 -7.757 554 HG23 THR 80 2HG2 THR 80 0.466 -13.486 -8.938 555 HA PRO 81 HA PRO 81 1.409 -12.467 -3.437 556 HB2 PRO 81 1HB PRO 81 -0.973 -12.998 -2.249 557 HB3 PRO 81 2HB PRO 81 -0.183 -11.419 -2.154 558 HG2 PRO 81 1HG PRO 81 -2.407 -12.321 -3.944 559 HG3 PRO 81 2HG PRO 81 -2.232 -10.794 -3.059 560 HD2 PRO 81 1HD PRO 81 -1.684 -11.017 -5.702 561 HD3 PRO 81 2HD PRO 81 -0.810 -9.897 -4.637 562 H MET 82 H MET 82 1.819 -14.585 -3.097 563 HA MET 82 HA MET 82 0.513 -16.509 -4.855 564 HB2 MET 82 1HB MET 82 3.035 -16.338 -4.600 565 HB3 MET 82 2HB MET 82 2.830 -17.020 -2.992 566 HG2 MET 82 1HG MET 82 1.955 -19.050 -3.888 567 HG3 MET 82 2HG MET 82 1.889 -18.365 -5.510 568 HE1 MET 82 3HE MET 82 3.266 -18.411 -7.051 569 HE2 MET 82 1HE MET 82 5.027 -18.328 -6.997 570 HE3 MET 82 2HE MET 82 4.221 -19.894 -7.085 571 H ALA 83 H ALA 83 0.776 -15.686 -1.479 572 HA ALA 83 HA ALA 83 -1.197 -17.778 -0.868 573 HB1 ALA 83 3HB ALA 83 0.575 -17.246 1.367 574 HB2 ALA 83 1HB ALA 83 0.073 -18.783 0.661 575 HB3 ALA 83 2HB ALA 83 1.433 -17.896 -0.030 576 HA PRO 84 HA PRO 84 -3.466 -14.552 1.070 577 HB2 PRO 84 1HB PRO 84 -4.876 -15.988 2.892 578 HB3 PRO 84 2HB PRO 84 -5.224 -16.029 1.160 579 HG2 PRO 84 1HG PRO 84 -3.675 -17.974 2.827 580 HG3 PRO 84 2HG PRO 84 -4.869 -18.293 1.555 581 HD2 PRO 84 1HD PRO 84 -2.201 -18.450 1.121 582 HD3 PRO 84 2HD PRO 84 -3.345 -17.942 -0.138 583 H GLY 85 H GLY 85 -4.111 -13.822 3.389 584 HA2 GLY 85 1HA GLY 85 -3.152 -14.257 5.767 585 HA3 GLY 85 2HA GLY 85 -1.639 -13.838 4.977 586 H ASN 86 H ASN 86 -1.191 -11.971 6.056 587 HA ASN 86 HA ASN 86 -3.059 -9.745 5.589 588 HB2 ASN 86 1HB ASN 86 -2.166 -8.832 7.825 589 HB3 ASN 86 2HB ASN 86 -3.341 -10.141 7.889 590 HD21 ASN 86 1HD2 ASN 86 -0.637 -9.062 9.268 591 HD22 ASN 86 2HD2 ASN 86 0.078 -10.550 9.775 592 H TYR 87 H TYR 87 -2.093 -8.457 4.165 593 HA TYR 87 HA TYR 87 0.817 -8.109 4.290 594 HB2 TYR 87 1HB TYR 87 -1.203 -7.573 2.114 595 HB3 TYR 87 2HB TYR 87 0.463 -7.012 2.021 596 HD1 TYR 87 1HD TYR 87 -1.273 -10.210 2.909 597 HD2 TYR 87 2HD TYR 87 1.824 -8.308 0.698 598 HE1 TYR 87 1HE TYR 87 -0.598 -12.390 1.992 599 HE2 TYR 87 2HE TYR 87 2.507 -10.482 -0.227 600 HH TYR 87 HH TYR 87 0.626 -13.384 0.319 601 H LEU 88 H LEU 88 1.621 -5.882 3.751 602 HA LEU 88 HA LEU 88 -0.141 -3.762 4.755 603 HB2 LEU 88 1HB LEU 88 1.599 -4.836 6.437 604 HB3 LEU 88 2HB LEU 88 2.707 -3.745 5.609 605 HG LEU 88 HG LEU 88 1.166 -1.863 6.218 606 HD11 LEU 88 1HD1 LEU 88 -0.091 -3.003 8.458 607 HD12 LEU 88 2HD1 LEU 88 -0.458 -4.050 7.088 608 HD13 LEU 88 3HD1 LEU 88 -0.847 -2.332 7.013 609 HD21 LEU 88 3HD2 LEU 88 3.000 -1.850 7.573 610 HD22 LEU 88 1HD2 LEU 88 2.729 -3.496 8.145 611 HD23 LEU 88 2HD2 LEU 88 1.755 -2.170 8.781 612 H ILE 89 H ILE 89 0.123 -1.800 3.795 613 HA ILE 89 HA ILE 89 2.349 -1.506 1.892 614 HB ILE 89 HB ILE 89 -0.438 -0.520 1.311 615 HG12 ILE 89 1HG1 ILE 89 0.883 -3.105 0.464 616 HG13 ILE 89 2HG1 ILE 89 -0.584 -2.929 1.421 617 HG21 ILE 89 1HG2 ILE 89 1.390 -1.103 -0.889 618 HG22 ILE 89 2HG2 ILE 89 0.405 0.326 -0.579 619 HG23 ILE 89 3HG2 ILE 89 1.975 0.151 0.205 620 HD11 ILE 89 3HD1 ILE 89 -0.211 -2.892 -1.461 621 HD12 ILE 89 1HD1 ILE 89 -1.658 -3.213 -0.505 622 HD13 ILE 89 2HD1 ILE 89 -1.190 -1.551 -0.866 623 H SER 90 H SER 90 3.544 0.159 2.509 624 HA SER 90 HA SER 90 2.230 2.441 3.822 625 HB2 SER 90 1HB SER 90 4.958 1.230 4.071 626 HB3 SER 90 2HB SER 90 4.743 2.943 4.431 627 HG SER 90 HG SER 90 3.001 1.052 5.564 628 H VAL 91 H VAL 91 2.283 4.410 2.917 629 HA VAL 91 HA VAL 91 3.970 4.781 0.527 630 HB VAL 91 HB VAL 91 1.200 5.894 0.995 631 HG11 VAL 91 1HG1 VAL 91 2.932 6.136 -1.459 632 HG12 VAL 91 2HG1 VAL 91 1.360 6.887 -1.176 633 HG13 VAL 91 3HG1 VAL 91 2.764 7.398 -0.239 634 HG21 VAL 91 3HG2 VAL 91 2.246 3.565 -0.524 635 HG22 VAL 91 1HG2 VAL 91 0.731 3.753 0.359 636 HG23 VAL 91 2HG2 VAL 91 0.922 4.489 -1.233 637 H LYS 92 H LYS 92 5.309 6.465 0.568 638 HA LYS 92 HA LYS 92 4.811 8.601 2.537 639 HB2 LYS 92 1HB LYS 92 7.308 7.088 1.895 640 HB3 LYS 92 2HB LYS 92 7.441 8.769 2.395 641 HG2 LYS 92 1HG LYS 92 6.158 8.204 4.443 642 HG3 LYS 92 2HG LYS 92 6.205 6.509 3.952 643 HD2 LYS 92 1HD LYS 92 8.774 6.898 3.815 644 HD3 LYS 92 2HD LYS 92 8.439 8.289 4.849 645 HE2 LYS 92 1HE LYS 92 7.612 6.939 6.581 646 HE3 LYS 92 2HE LYS 92 7.426 5.543 5.520 647 HZ1 LYS 92 3HZ LYS 92 10.123 6.596 5.812 648 HZ2 LYS 92 1HZ LYS 92 9.589 4.993 5.717 649 HZ3 LYS 92 2HZ LYS 92 9.468 5.839 7.176 650 H TYR 93 H TYR 93 5.238 10.702 1.918 651 HA TYR 93 HA TYR 93 6.341 11.220 -0.722 652 HB2 TYR 93 1HB TYR 93 3.475 11.612 0.004 653 HB3 TYR 93 2HB TYR 93 4.243 12.825 -1.015 654 HD1 TYR 93 1HD TYR 93 3.256 9.283 -0.786 655 HD2 TYR 93 2HD TYR 93 4.804 12.350 -3.295 656 HE1 TYR 93 1HE TYR 93 2.888 7.852 -2.753 657 HE2 TYR 93 2HE TYR 93 4.440 10.929 -5.269 658 HH TYR 93 HH TYR 93 3.534 7.584 -4.982 659 H GLY 94 H GLY 94 7.472 13.074 -0.779 660 HA2 GLY 94 1HA GLY 94 8.180 15.203 -0.200 661 HA3 GLY 94 2HA GLY 94 6.843 15.303 0.936 662 H GLY 95 H GLY 95 7.147 13.631 2.836 663 HA2 GLY 95 1HA GLY 95 9.966 13.626 3.680 664 HA3 GLY 95 2HA GLY 95 8.753 14.351 4.724 665 HA PRO 96 HA PRO 96 9.212 9.969 6.064 666 HB2 PRO 96 1HB PRO 96 9.029 10.534 8.714 667 HB3 PRO 96 2HB PRO 96 10.549 10.619 7.816 668 HG2 PRO 96 1HG PRO 96 8.683 12.826 8.594 669 HG3 PRO 96 2HG PRO 96 10.455 12.784 8.658 670 HD2 PRO 96 1HD PRO 96 9.099 14.022 6.668 671 HD3 PRO 96 2HD PRO 96 10.673 13.243 6.410 672 H ASN 97 H ASN 97 6.881 12.475 6.586 673 HA ASN 97 HA ASN 97 4.941 11.032 8.028 674 HB2 ASN 97 1HB ASN 97 4.817 13.436 6.224 675 HB3 ASN 97 2HB ASN 97 3.351 12.743 6.909 676 HD21 ASN 97 1HD2 ASN 97 3.474 15.095 7.707 677 HD22 ASN 97 2HD2 ASN 97 4.181 15.310 9.269 678 H HIS 98 H HIS 98 2.757 10.454 7.120 679 HA HIS 98 HA HIS 98 3.115 9.002 4.583 680 HB2 HIS 98 1HB HIS 98 1.301 7.499 5.430 681 HB3 HIS 98 2HB HIS 98 2.769 7.466 6.402 682 HD2 HIS 98 2HD HIS 98 2.520 8.607 8.976 683 HE1 HIS 98 1HE HIS 98 -1.707 8.929 8.820 684 HE2 HIS 98 2HE HIS 98 0.343 9.141 10.267 685 H ILE 99 H ILE 99 1.433 8.985 3.064 686 HA ILE 99 HA ILE 99 -0.044 11.413 2.890 687 HB ILE 99 HB ILE 99 -0.919 10.567 0.805 688 HG12 ILE 99 1HG1 ILE 99 0.457 7.934 1.221 689 HG13 ILE 99 2HG1 ILE 99 -1.166 8.182 1.854 690 HG21 ILE 99 1HG2 ILE 99 1.371 11.402 0.805 691 HG22 ILE 99 2HG2 ILE 99 1.971 9.783 1.165 692 HG23 ILE 99 3HG2 ILE 99 1.174 10.106 -0.375 693 HD11 ILE 99 3HD1 ILE 99 -0.478 8.695 -1.018 694 HD12 ILE 99 1HD1 ILE 99 -0.963 7.106 -0.428 695 HD13 ILE 99 2HD1 ILE 99 -2.068 8.474 -0.289 696 H VAL 100 H VAL 100 -2.443 11.328 2.285 697 HA VAL 100 HA VAL 100 -3.931 10.527 4.504 698 HB VAL 100 HB VAL 100 -4.747 11.291 1.712 699 HG11 VAL 100 1HG1 VAL 100 -6.443 10.246 3.937 700 HG12 VAL 100 2HG1 VAL 100 -7.085 11.479 2.850 701 HG13 VAL 100 3HG1 VAL 100 -6.542 9.929 2.206 702 HG21 VAL 100 3HG2 VAL 100 -4.911 12.627 4.408 703 HG22 VAL 100 1HG2 VAL 100 -3.936 13.112 3.021 704 HG23 VAL 100 2HG2 VAL 100 -5.692 13.253 2.955 705 H GLY 101 H GLY 101 -5.125 8.753 5.007 706 HA2 GLY 101 1HA GLY 101 -6.240 6.722 4.620 707 HA3 GLY 101 2HA GLY 101 -5.544 6.672 3.007 708 H SER 102 H SER 102 -2.900 6.786 3.377 709 HA SER 102 HA SER 102 -2.211 4.191 4.135 710 HB2 SER 102 1HB SER 102 -0.656 5.126 2.703 711 HB3 SER 102 2HB SER 102 -0.664 6.679 3.538 712 HG SER 102 HG SER 102 0.491 5.673 5.241 713 HA PRO 103 HA PRO 103 -0.259 3.156 4.869 714 HB2 PRO 103 1HB PRO 103 -0.415 1.014 6.529 715 HB3 PRO 103 2HB PRO 103 0.897 2.196 6.606 716 HG2 PRO 103 1HG PRO 103 -1.562 1.985 8.299 717 HG3 PRO 103 2HG PRO 103 0.107 2.325 8.789 718 HD2 PRO 103 1HD PRO 103 -1.756 4.270 8.517 719 HD3 PRO 103 2HD PRO 103 -0.034 4.544 8.184 720 H PHE 104 H PHE 104 -1.137 1.410 3.696 721 HA PHE 104 HA PHE 104 -4.051 1.156 3.961 722 HB2 PHE 104 1HB PHE 104 -2.315 0.490 1.576 723 HB3 PHE 104 2HB PHE 104 -4.075 0.511 1.619 724 HD1 PHE 104 2HD PHE 104 -5.242 2.712 2.020 725 HD2 PHE 104 1HD PHE 104 -1.096 2.426 1.103 726 HE1 PHE 104 2HE PHE 104 -5.231 5.079 1.350 727 HE2 PHE 104 1HE PHE 104 -1.077 4.793 0.432 728 HZ PHE 104 HZ PHE 104 -3.147 6.123 0.554 729 H LYS 105 H LYS 105 -4.872 -0.682 4.693 730 HA LYS 105 HA LYS 105 -3.151 -3.061 4.771 731 HB2 LYS 105 1HB LYS 105 -4.743 -3.884 6.495 732 HB3 LYS 105 2HB LYS 105 -3.942 -2.385 6.946 733 HG2 LYS 105 1HG LYS 105 -5.954 -1.139 6.247 734 HG3 LYS 105 2HG LYS 105 -6.753 -2.676 5.907 735 HD2 LYS 105 1HD LYS 105 -7.488 -2.125 8.055 736 HD3 LYS 105 2HD LYS 105 -6.182 -3.278 8.339 737 HE2 LYS 105 1HE LYS 105 -4.694 -1.149 8.473 738 HE3 LYS 105 2HE LYS 105 -6.222 -0.315 8.751 739 HZ1 LYS 105 3HZ LYS 105 -6.183 -2.554 10.404 740 HZ2 LYS 105 1HZ LYS 105 -6.099 -0.927 10.860 741 HZ3 LYS 105 2HZ LYS 105 -4.678 -1.799 10.573 742 H ALA 106 H ALA 106 -3.627 -4.825 3.617 743 HA ALA 106 HA ALA 106 -6.299 -5.009 2.390 744 HB1 ALA 106 3HB ALA 106 -5.472 -5.350 0.312 745 HB2 ALA 106 1HB ALA 106 -4.124 -4.407 0.948 746 HB3 ALA 106 2HB ALA 106 -4.025 -6.168 0.902 747 H LYS 107 H LYS 107 -7.245 -7.005 2.331 748 HA LYS 107 HA LYS 107 -5.874 -9.113 3.847 749 HB2 LYS 107 1HB LYS 107 -7.993 -8.428 4.800 750 HB3 LYS 107 2HB LYS 107 -8.806 -8.671 3.260 751 HG2 LYS 107 1HG LYS 107 -8.792 -10.959 3.455 752 HG3 LYS 107 2HG LYS 107 -7.396 -10.965 4.536 753 HD2 LYS 107 1HD LYS 107 -9.023 -9.710 6.157 754 HD3 LYS 107 2HD LYS 107 -10.273 -10.438 5.145 755 HE2 LYS 107 1HE LYS 107 -9.056 -12.647 5.532 756 HE3 LYS 107 2HE LYS 107 -8.175 -11.807 6.807 757 HZ1 LYS 107 3HZ LYS 107 -11.066 -12.399 6.657 758 HZ2 LYS 107 1HZ LYS 107 -10.467 -11.196 7.685 759 HZ3 LYS 107 2HZ LYS 107 -9.969 -12.800 7.881 760 H VAL 108 H VAL 108 -5.148 -10.853 2.823 761 HA VAL 108 HA VAL 108 -6.110 -11.379 0.094 762 HB VAL 108 HB VAL 108 -3.621 -12.566 1.290 763 HG11 VAL 108 1HG1 VAL 108 -4.873 -12.395 -1.375 764 HG12 VAL 108 2HG1 VAL 108 -3.120 -12.198 -1.326 765 HG13 VAL 108 3HG1 VAL 108 -3.863 -13.658 -0.673 766 HG21 VAL 108 3HG2 VAL 108 -2.730 -10.525 1.429 767 HG22 VAL 108 1HG2 VAL 108 -2.790 -10.484 -0.333 768 HG23 VAL 108 2HG2 VAL 108 -4.106 -9.786 0.611 769 H THR 109 H THR 109 -7.589 -12.927 -0.023 770 HA THR 109 HA THR 109 -7.134 -15.435 1.408 771 HB THR 109 HB THR 109 -9.504 -15.578 2.092 772 HG1 THR 109 1HG THR 109 -10.625 -13.454 2.096 773 HG21 THR 109 3HG2 THR 109 -8.112 -14.917 3.848 774 HG22 THR 109 1HG2 THR 109 -9.371 -13.684 3.840 775 HG23 THR 109 2HG2 THR 109 -7.795 -13.339 3.128 776 H GLY 110 H GLY 110 -8.113 -17.256 0.450 777 HA2 GLY 110 1HA GLY 110 -9.418 -18.361 -1.182 778 HA3 GLY 110 2HA GLY 110 -9.575 -16.841 -2.051 779 H GLN 111 H GLN 111 -8.987 -19.107 -3.439 780 HA GLN 111 HA GLN 111 -7.353 -20.242 -4.634 781 HB2 GLN 111 1HB GLN 111 -6.632 -17.381 -5.282 782 HB3 GLN 111 2HB GLN 111 -6.401 -18.790 -6.308 783 HG2 GLN 111 1HG GLN 111 -9.082 -17.754 -5.422 784 HG3 GLN 111 2HG GLN 111 -8.316 -17.367 -6.962 785 HE21 GLN 111 1HE2 GLN 111 -10.785 -18.926 -6.060 786 HE22 GLN 111 2HE2 GLN 111 -10.688 -20.394 -6.965 787 H ARG 112 H ARG 112 -6.424 -20.292 -2.116 788 HA ARG 112 HA ARG 112 -3.916 -19.041 -1.719 789 HB2 ARG 112 1HB ARG 112 -3.637 -20.825 0.059 790 HB3 ARG 112 2HB ARG 112 -5.060 -19.803 0.211 791 HG2 ARG 112 1HG ARG 112 -6.505 -21.500 -0.276 792 HG3 ARG 112 2HG ARG 112 -5.326 -22.368 -1.261 793 HD2 ARG 112 1HD ARG 112 -4.096 -22.968 0.787 794 HD3 ARG 112 2HD ARG 112 -5.325 -22.146 1.747 795 HE ARG 112 HE ARG 112 -6.438 -24.143 0.036 796 HH11 ARG 112 1HH1 ARG 112 -4.815 -23.622 3.071 797 HH12 ARG 112 2HH1 ARG 112 -5.456 -25.053 3.808 798 HH21 ARG 112 1HH2 ARG 112 -7.288 -26.030 0.996 799 HH22 ARG 112 2HH2 ARG 112 -6.861 -26.422 2.627 800 H LEU 113 H LEU 113 -2.407 -19.349 -3.271 801 HA LEU 113 HA LEU 113 -1.942 -21.949 -4.434 802 HB2 LEU 113 1HB LEU 113 -0.137 -19.582 -4.755 803 HB3 LEU 113 2HB LEU 113 -0.455 -20.894 -5.888 804 HG LEU 113 HG LEU 113 -2.686 -19.045 -5.198 805 HD11 LEU 113 1HD1 LEU 113 -0.244 -18.024 -6.038 806 HD12 LEU 113 2HD1 LEU 113 -1.814 -17.226 -6.127 807 HD13 LEU 113 3HD1 LEU 113 -1.209 -18.139 -7.509 808 HD21 LEU 113 3HD2 LEU 113 -1.839 -20.387 -7.763 809 HD22 LEU 113 1HD2 LEU 113 -3.346 -19.516 -7.476 810 HD23 LEU 113 2HD2 LEU 113 -3.025 -21.027 -6.624 811 H VAL 114 H VAL 114 -1.554 -22.730 -2.098 812 HA VAL 114 HA VAL 114 0.899 -22.116 -0.818 813 HB VAL 114 HB VAL 114 0.501 -24.129 0.530 814 HG11 VAL 114 1HG1 VAL 114 -1.978 -23.479 1.152 815 HG12 VAL 114 2HG1 VAL 114 -0.634 -22.382 1.479 816 HG13 VAL 114 3HG1 VAL 114 -1.655 -22.132 0.062 817 HG21 VAL 114 3HG2 VAL 114 -1.026 -25.759 0.040 818 HG22 VAL 114 1HG2 VAL 114 -2.056 -24.669 -0.888 819 HG23 VAL 114 2HG2 VAL 114 -0.562 -25.284 -1.594 820 H SER 115 H SER 115 2.624 -23.760 -0.420 821 HA SER 115 HA SER 115 3.060 -25.810 -2.370 822 HB2 SER 115 1HB SER 115 4.385 -23.145 -2.671 823 HB3 SER 115 2HB SER 115 5.302 -24.598 -3.070 824 HG SER 115 HG SER 115 4.285 -24.043 -4.924 825 HA PRO 116 HA PRO 116 5.563 -27.322 0.912 826 HB2 PRO 116 1HB PRO 116 7.106 -29.084 -0.461 827 HB3 PRO 116 2HB PRO 116 5.400 -29.377 -0.103 828 HG2 PRO 116 1HG PRO 116 6.661 -28.377 -2.627 829 HG3 PRO 116 2HG PRO 116 5.367 -29.572 -2.420 830 HD2 PRO 116 1HD PRO 116 4.879 -27.001 -3.116 831 HD3 PRO 116 2HD PRO 116 3.749 -27.956 -2.134 832 H GLY 117 H GLY 117 6.977 -25.842 -1.901 833 HA2 GLY 117 1HA GLY 117 8.837 -24.297 -0.657 834 HA3 GLY 117 2HA GLY 117 9.669 -25.829 -0.873 835 H SER 118 H SER 118 8.987 -22.868 -2.256 836 HA SER 118 HA SER 118 9.515 -23.851 -4.977 837 HB2 SER 118 1HB SER 118 7.479 -22.444 -4.635 838 HB3 SER 118 2HB SER 118 8.526 -21.115 -4.139 839 HG SER 118 HG SER 118 8.437 -22.391 -6.669 840 H ALA 119 H ALA 119 11.619 -23.874 -5.420 841 HA ALA 119 HA ALA 119 13.153 -21.427 -5.093 842 HB1 ALA 119 3HB ALA 119 15.060 -22.649 -4.053 843 HB2 ALA 119 1HB ALA 119 13.644 -22.500 -3.012 844 HB3 ALA 119 2HB ALA 119 13.986 -24.029 -3.822 845 H ASN 120 H ASN 120 14.736 -21.174 -6.619 846 HA ASN 120 HA ASN 120 15.830 -23.303 -8.143 847 HB2 ASN 120 1HB ASN 120 13.682 -23.394 -9.221 848 HB3 ASN 120 2HB ASN 120 13.656 -21.645 -9.432 849 HD21 ASN 120 1HD2 ASN 120 14.459 -24.600 -10.809 850 HD22 ASN 120 2HD2 ASN 120 15.332 -24.013 -12.179 851 H GLU 121 H GLU 121 17.831 -22.557 -8.345 852 HA GLU 121 HA GLU 121 18.208 -19.816 -9.343 853 HB2 GLU 121 1HB GLU 121 20.202 -19.605 -7.889 854 HB3 GLU 121 2HB GLU 121 18.706 -19.756 -6.978 855 HG2 GLU 121 1HG GLU 121 19.212 -22.186 -6.705 856 HG3 GLU 121 2HG GLU 121 20.787 -21.876 -7.433 857 H THR 122 H THR 122 19.755 -19.553 -10.880 858 HA THR 122 HA THR 122 20.752 -21.935 -12.156 859 HB THR 122 HB THR 122 19.942 -20.028 -13.494 860 HG1 THR 122 1HG THR 122 22.713 -20.264 -14.003 861 HG21 THR 122 3HG2 THR 122 20.602 -18.137 -12.219 862 HG22 THR 122 1HG2 THR 122 21.519 -18.061 -13.723 863 HG23 THR 122 2HG2 THR 122 22.296 -18.624 -12.243 864 H SER 123 H SER 123 22.832 -22.651 -12.281 865 HA SER 123 HA SER 123 24.700 -21.503 -10.345 866 HB2 SER 123 1HB SER 123 25.832 -23.590 -10.368 867 HB3 SER 123 2HB SER 123 24.115 -23.990 -10.402 868 HG SER 123 HG SER 123 24.668 -25.118 -12.091 869 H SER 124 H SER 124 27.031 -21.466 -10.955 870 HA SER 124 HA SER 124 27.657 -21.202 -13.762 871 HB2 SER 124 1HB SER 124 28.221 -18.895 -13.776 872 HB3 SER 124 2HB SER 124 26.625 -18.983 -13.032 873 HG SER 124 HG SER 124 29.066 -18.280 -11.930 874 H ILE 125 H ILE 125 30.026 -20.149 -13.853 875 HA ILE 125 HA ILE 125 31.687 -21.983 -12.428 876 HB ILE 125 HB ILE 125 32.271 -19.714 -14.311 877 HG12 ILE 125 1HG1 ILE 125 33.369 -21.811 -15.473 878 HG13 ILE 125 2HG1 ILE 125 32.284 -22.705 -14.414 879 HG21 ILE 125 1HG2 ILE 125 34.671 -20.728 -14.182 880 HG22 ILE 125 2HG2 ILE 125 34.156 -19.523 -13.004 881 HG23 ILE 125 3HG2 ILE 125 34.161 -21.232 -12.572 882 HD11 ILE 125 3HD1 ILE 125 31.726 -21.304 -16.867 883 HD12 ILE 125 1HD1 ILE 125 30.735 -22.459 -15.975 884 HD13 ILE 125 2HD1 ILE 125 30.687 -20.746 -15.556 Start of MODEL 17 1 H1 GLY 1 H GLY 1 -36.585 27.881 -14.150 2 HA2 GLY 1 1HA GLY 1 -35.765 30.309 -14.900 3 HA3 GLY 1 2HA GLY 1 -35.178 29.581 -13.412 4 H SER 2 H SER 2 -33.094 28.797 -13.302 5 HA SER 2 HA SER 2 -31.378 29.538 -15.575 6 HB2 SER 2 1HB SER 2 -30.604 29.199 -12.668 7 HB3 SER 2 2HB SER 2 -29.564 29.784 -13.966 8 HG SER 2 HG SER 2 -30.991 31.566 -14.187 9 H SER 3 H SER 3 -31.094 27.765 -16.791 10 HA SER 3 HA SER 3 -30.485 25.223 -15.449 11 HB2 SER 3 1HB SER 3 -32.371 25.511 -17.240 12 HB3 SER 3 2HB SER 3 -31.035 25.450 -18.390 13 HG SER 3 HG SER 3 -30.523 23.468 -16.891 14 H GLY 4 H GLY 4 -28.477 27.166 -15.508 15 HA2 GLY 4 1HA GLY 4 -26.591 25.979 -17.451 16 HA3 GLY 4 2HA GLY 4 -26.558 27.681 -17.016 17 H SER 5 H SER 5 -26.525 24.516 -15.371 18 HA SER 5 HA SER 5 -25.086 25.486 -13.125 19 HB2 SER 5 1HB SER 5 -26.405 23.546 -12.773 20 HB3 SER 5 2HB SER 5 -25.681 22.711 -14.148 21 HG SER 5 HG SER 5 -23.790 22.489 -12.999 22 H SER 6 H SER 6 -22.933 25.296 -12.580 23 HA SER 6 HA SER 6 -21.034 24.002 -14.297 24 HB2 SER 6 1HB SER 6 -19.824 25.949 -15.038 25 HB3 SER 6 2HB SER 6 -21.510 26.148 -15.514 26 HG SER 6 HG SER 6 -21.337 27.983 -14.504 27 H GLY 7 H GLY 7 -18.750 24.430 -13.523 28 HA2 GLY 7 1HA GLY 7 -18.674 25.202 -10.686 29 HA3 GLY 7 2HA GLY 7 -18.075 23.620 -11.160 30 H PHE 8 H PHE 8 -16.069 24.393 -10.167 31 HA PHE 8 HA PHE 8 -14.207 25.222 -12.119 32 HB2 PHE 8 1HB PHE 8 -13.515 27.373 -11.067 33 HB3 PHE 8 2HB PHE 8 -15.118 27.437 -11.792 34 HD1 PHE 8 2HD PHE 8 -17.121 27.476 -10.370 35 HD2 PHE 8 1HD PHE 8 -13.200 27.633 -8.721 36 HE1 PHE 8 2HE PHE 8 -18.053 28.276 -8.239 37 HE2 PHE 8 1HE PHE 8 -14.126 28.433 -6.587 38 HZ PHE 8 HZ PHE 8 -16.555 28.756 -6.344 39 H LYS 9 H LYS 9 -12.012 25.306 -11.294 40 HA LYS 9 HA LYS 9 -11.506 23.324 -9.362 41 HB2 LYS 9 1HB LYS 9 -9.128 24.131 -9.525 42 HB3 LYS 9 2HB LYS 9 -9.874 23.706 -11.060 43 HG2 LYS 9 1HG LYS 9 -10.194 26.009 -11.617 44 HG3 LYS 9 2HG LYS 9 -9.670 26.519 -10.011 45 HD2 LYS 9 1HD LYS 9 -7.747 26.859 -11.224 46 HD3 LYS 9 2HD LYS 9 -7.488 25.210 -10.648 47 HE2 LYS 9 1HE LYS 9 -8.345 24.345 -12.777 48 HE3 LYS 9 2HE LYS 9 -8.584 25.996 -13.348 49 HZ1 LYS 9 3HZ LYS 9 -6.092 24.501 -12.972 50 HZ2 LYS 9 1HZ LYS 9 -6.059 26.178 -12.748 51 HZ3 LYS 9 2HZ LYS 9 -6.551 25.533 -14.232 52 H VAL 10 H VAL 10 -11.340 23.401 -7.215 53 HA VAL 10 HA VAL 10 -11.270 26.051 -5.927 54 HB VAL 10 HB VAL 10 -12.398 23.471 -4.831 55 HG11 VAL 10 1HG1 VAL 10 -12.304 24.420 -2.828 56 HG12 VAL 10 2HG1 VAL 10 -11.531 25.845 -3.525 57 HG13 VAL 10 3HG1 VAL 10 -13.289 25.758 -3.417 58 HG21 VAL 10 3HG2 VAL 10 -13.995 24.098 -6.359 59 HG22 VAL 10 1HG2 VAL 10 -14.530 24.997 -4.939 60 HG23 VAL 10 2HG2 VAL 10 -13.621 25.815 -6.210 61 H ARG 11 H ARG 11 -9.803 26.460 -4.333 62 HA ARG 11 HA ARG 11 -7.463 24.825 -4.250 63 HB2 ARG 11 1HB ARG 11 -8.321 27.372 -2.927 64 HB3 ARG 11 2HB ARG 11 -6.896 26.526 -2.338 65 HG2 ARG 11 1HG ARG 11 -5.912 27.919 -3.835 66 HG3 ARG 11 2HG ARG 11 -6.259 26.556 -4.902 67 HD2 ARG 11 1HD ARG 11 -7.053 28.341 -6.132 68 HD3 ARG 11 2HD ARG 11 -8.510 27.787 -5.308 69 HE ARG 11 HE ARG 11 -7.560 29.660 -3.623 70 HH11 ARG 11 1HH1 ARG 11 -8.168 29.661 -7.051 71 HH12 ARG 11 2HH1 ARG 11 -8.532 31.354 -7.118 72 HH21 ARG 11 1HH2 ARG 11 -8.036 31.889 -3.698 73 HH22 ARG 11 2HH2 ARG 11 -8.456 32.621 -5.210 74 H VAL 12 H VAL 12 -7.181 23.080 -3.044 75 HA VAL 12 HA VAL 12 -8.609 22.899 -0.470 76 HB VAL 12 HB VAL 12 -7.929 20.641 -2.359 77 HG11 VAL 12 1HG1 VAL 12 -9.571 20.378 0.132 78 HG12 VAL 12 2HG1 VAL 12 -8.749 19.125 -0.801 79 HG13 VAL 12 3HG1 VAL 12 -7.813 20.245 0.190 80 HG21 VAL 12 3HG2 VAL 12 -9.926 22.268 -2.790 81 HG22 VAL 12 1HG2 VAL 12 -10.156 20.526 -2.941 82 HG23 VAL 12 2HG2 VAL 12 -10.692 21.363 -1.485 83 H GLY 13 H GLY 13 -6.975 23.565 0.869 84 HA2 GLY 13 1HA GLY 13 -5.126 23.283 2.207 85 HA3 GLY 13 2HA GLY 13 -4.981 21.661 1.546 86 H GLU 14 H GLU 14 -3.304 24.378 1.952 87 HA GLU 14 HA GLU 14 -2.108 24.605 -0.670 88 HB2 GLU 14 1HB GLU 14 -1.452 25.894 1.981 89 HB3 GLU 14 2HB GLU 14 -0.571 26.219 0.495 90 HG2 GLU 14 1HG GLU 14 -2.806 26.888 -0.506 91 HG3 GLU 14 2HG GLU 14 -3.425 26.869 1.144 92 HA PRO 15 HA PRO 15 1.166 21.722 -0.193 93 HB2 PRO 15 1HB PRO 15 3.153 22.948 -1.579 94 HB3 PRO 15 2HB PRO 15 1.750 22.209 -2.361 95 HG2 PRO 15 1HG PRO 15 2.263 25.087 -1.715 96 HG3 PRO 15 2HG PRO 15 1.584 24.375 -3.191 97 HD2 PRO 15 1HD PRO 15 0.040 25.511 -1.277 98 HD3 PRO 15 2HD PRO 15 -0.514 24.143 -2.264 99 H GLY 16 H GLY 16 1.939 21.519 1.842 100 HA2 GLY 16 1HA GLY 16 2.879 23.349 3.598 101 HA3 GLY 16 2HA GLY 16 3.533 21.721 3.506 102 H GLN 17 H GLN 17 5.422 21.347 2.242 103 HA GLN 17 HA GLN 17 6.834 23.560 1.072 104 HB2 GLN 17 1HB GLN 17 8.769 23.476 2.572 105 HB3 GLN 17 2HB GLN 17 7.315 23.961 3.435 106 HG2 GLN 17 1HG GLN 17 7.121 21.464 4.048 107 HG3 GLN 17 2HG GLN 17 8.818 21.382 3.575 108 HE21 GLN 17 1HE2 GLN 17 10.341 22.651 4.732 109 HE22 GLN 17 2HE2 GLN 17 10.019 23.152 6.354 110 H ALA 18 H ALA 18 7.919 22.784 -0.606 111 HA ALA 18 HA ALA 18 9.020 21.373 -2.012 112 HB1 ALA 18 3HB ALA 18 10.530 21.272 0.042 113 HB2 ALA 18 1HB ALA 18 9.781 19.708 0.367 114 HB3 ALA 18 2HB ALA 18 10.674 19.965 -1.133 115 H GLY 19 H GLY 19 6.278 20.932 -1.652 116 HA2 GLY 19 1HA GLY 19 4.861 19.333 -2.614 117 HA3 GLY 19 2HA GLY 19 6.137 18.136 -2.450 118 H ASN 20 H ASN 20 3.158 18.470 -1.594 119 HA ASN 20 HA ASN 20 3.512 17.743 1.233 120 HB2 ASN 20 1HB ASN 20 1.964 19.501 1.145 121 HB3 ASN 20 2HB ASN 20 1.197 18.878 -0.313 122 HD21 ASN 20 1HD2 ASN 20 -0.799 19.154 0.820 123 HD22 ASN 20 2HD2 ASN 20 -1.328 17.956 1.948 124 HA PRO 21 HA PRO 21 2.719 13.539 0.070 125 HB2 PRO 21 1HB PRO 21 2.485 12.552 2.588 126 HB3 PRO 21 2HB PRO 21 4.041 12.966 1.860 127 HG2 PRO 21 1HG PRO 21 2.364 14.545 3.771 128 HG3 PRO 21 2HG PRO 21 4.119 14.294 3.767 129 HD2 PRO 21 1HD PRO 21 2.969 16.559 2.829 130 HD3 PRO 21 2HD PRO 21 4.471 15.900 2.150 131 H ALA 22 H ALA 22 0.714 15.190 2.486 132 HA ALA 22 HA ALA 22 -1.427 13.459 2.637 133 HB1 ALA 22 3HB ALA 22 -0.927 16.223 3.271 134 HB2 ALA 22 1HB ALA 22 -2.570 16.006 2.665 135 HB3 ALA 22 2HB ALA 22 -2.009 15.070 4.051 136 H LEU 23 H LEU 23 -0.771 15.940 0.201 137 HA LEU 23 HA LEU 23 -3.186 15.847 -1.182 138 HB2 LEU 23 1HB LEU 23 -0.376 16.454 -2.035 139 HB3 LEU 23 2HB LEU 23 -1.710 16.492 -3.186 140 HG LEU 23 HG LEU 23 -1.723 18.145 -0.674 141 HD11 LEU 23 1HD1 LEU 23 -0.765 19.967 -1.843 142 HD12 LEU 23 2HD1 LEU 23 -0.792 19.092 -3.374 143 HD13 LEU 23 3HD1 LEU 23 0.311 18.592 -2.091 144 HD21 LEU 23 3HD2 LEU 23 -3.528 17.692 -2.858 145 HD22 LEU 23 1HD2 LEU 23 -3.032 19.384 -2.823 146 HD23 LEU 23 2HD2 LEU 23 -3.760 18.650 -1.394 147 H VAL 24 H VAL 24 -0.246 13.910 -1.639 148 HA VAL 24 HA VAL 24 -1.035 12.453 -3.871 149 HB VAL 24 HB VAL 24 0.668 11.490 -1.568 150 HG11 VAL 24 1HG1 VAL 24 0.466 10.494 -4.409 151 HG12 VAL 24 2HG1 VAL 24 1.620 9.929 -3.199 152 HG13 VAL 24 3HG1 VAL 24 -0.107 9.653 -2.969 153 HG21 VAL 24 3HG2 VAL 24 1.969 12.318 -4.054 154 HG22 VAL 24 1HG2 VAL 24 1.155 13.628 -3.198 155 HG23 VAL 24 2HG2 VAL 24 2.391 12.674 -2.379 156 H SER 25 H SER 25 -2.465 10.877 -4.220 157 HA SER 25 HA SER 25 -3.640 9.516 -1.885 158 HB2 SER 25 1HB SER 25 -5.082 11.283 -3.159 159 HB3 SER 25 2HB SER 25 -5.233 10.020 -4.380 160 HG SER 25 HG SER 25 -6.894 9.620 -3.054 161 H ALA 26 H ALA 26 -4.838 7.467 -2.588 162 HA ALA 26 HA ALA 26 -3.503 6.134 -4.833 163 HB1 ALA 26 3HB ALA 26 -2.749 4.320 -3.591 164 HB2 ALA 26 1HB ALA 26 -2.377 5.699 -2.557 165 HB3 ALA 26 2HB ALA 26 -3.790 4.699 -2.220 166 H TYR 27 H TYR 27 -4.759 4.703 -5.927 167 HA TYR 27 HA TYR 27 -7.133 3.553 -4.809 168 HB2 TYR 27 1HB TYR 27 -8.710 4.625 -6.396 169 HB3 TYR 27 2HB TYR 27 -8.022 5.767 -5.248 170 HD1 TYR 27 2HD TYR 27 -7.509 4.467 -8.707 171 HD2 TYR 27 1HD TYR 27 -7.102 7.749 -6.031 172 HE1 TYR 27 2HE TYR 27 -6.778 5.891 -10.574 173 HE2 TYR 27 1HE TYR 27 -6.371 9.183 -7.890 174 HH TYR 27 HH TYR 27 -5.260 8.794 -10.187 175 H GLY 28 H GLY 28 -8.137 2.022 -6.219 176 HA2 GLY 28 1HA GLY 28 -7.680 1.485 -8.844 177 HA3 GLY 28 2HA GLY 28 -6.258 0.825 -8.049 178 H THR 29 H THR 29 -7.093 -1.195 -9.014 179 HA THR 29 HA THR 29 -9.440 -2.333 -7.719 180 HB THR 29 HB THR 29 -7.602 -3.631 -9.738 181 HG1 THR 29 1HG THR 29 -10.141 -2.558 -10.347 182 HG21 THR 29 3HG2 THR 29 -9.767 -4.950 -10.159 183 HG22 THR 29 1HG2 THR 29 -10.286 -4.339 -8.589 184 HG23 THR 29 2HG2 THR 29 -8.837 -5.337 -8.711 185 H GLY 30 H GLY 30 -5.946 -2.640 -7.697 186 HA2 GLY 30 1HA GLY 30 -5.708 -5.075 -6.331 187 HA3 GLY 30 2HA GLY 30 -4.523 -3.777 -6.302 188 H LEU 31 H LEU 31 -6.154 -1.792 -5.100 189 HA LEU 31 HA LEU 31 -5.750 -2.403 -2.376 190 HB2 LEU 31 1HB LEU 31 -7.415 -0.220 -3.622 191 HB3 LEU 31 2HB LEU 31 -6.910 -0.284 -1.934 192 HG LEU 31 HG LEU 31 -4.909 -0.207 -4.173 193 HD11 LEU 31 1HD1 LEU 31 -6.376 1.714 -4.470 194 HD12 LEU 31 2HD1 LEU 31 -4.792 2.215 -3.878 195 HD13 LEU 31 3HD1 LEU 31 -6.166 2.151 -2.774 196 HD21 LEU 31 3HD2 LEU 31 -3.631 -0.597 -2.366 197 HD22 LEU 31 1HD2 LEU 31 -4.881 -0.071 -1.239 198 HD23 LEU 31 2HD2 LEU 31 -3.869 1.123 -2.052 199 H GLU 32 H GLU 32 -8.602 -2.479 -4.440 200 HA GLU 32 HA GLU 32 -10.698 -2.638 -2.767 201 HB2 GLU 32 1HB GLU 32 -10.105 -4.472 -5.091 202 HB3 GLU 32 2HB GLU 32 -11.669 -4.387 -4.293 203 HG2 GLU 32 1HG GLU 32 -10.361 -1.965 -5.478 204 HG3 GLU 32 2HG GLU 32 -11.363 -3.054 -6.435 205 H GLY 33 H GLY 33 -8.239 -5.123 -3.184 206 HA2 GLY 33 1HA GLY 33 -8.588 -6.186 -0.607 207 HA3 GLY 33 2HA GLY 33 -9.485 -7.185 -1.741 208 H GLY 34 H GLY 34 -7.932 -8.826 -0.906 209 HA2 GLY 34 1HA GLY 34 -5.312 -8.618 -2.249 210 HA3 GLY 34 2HA GLY 34 -5.635 -9.610 -0.835 211 H THR 35 H THR 35 -5.437 -9.535 -4.206 212 HA THR 35 HA THR 35 -6.937 -12.036 -4.511 213 HB THR 35 HB THR 35 -6.269 -11.573 -7.018 214 HG1 THR 35 1HG THR 35 -5.731 -9.521 -7.452 215 HG21 THR 35 3HG2 THR 35 -8.305 -9.697 -5.872 216 HG22 THR 35 1HG2 THR 35 -8.555 -11.440 -5.786 217 HG23 THR 35 2HG2 THR 35 -8.376 -10.651 -7.354 218 H THR 36 H THR 36 -5.794 -13.824 -4.181 219 HA THR 36 HA THR 36 -2.928 -13.873 -4.539 220 HB THR 36 HB THR 36 -4.588 -16.308 -3.959 221 HG1 THR 36 1HG THR 36 -4.649 -14.069 -2.528 222 HG21 THR 36 3HG2 THR 36 -1.910 -15.969 -4.237 223 HG22 THR 36 1HG2 THR 36 -2.652 -17.226 -3.248 224 HG23 THR 36 2HG2 THR 36 -2.097 -15.728 -2.500 225 H GLY 37 H GLY 37 -2.071 -14.142 -6.493 226 HA2 GLY 37 1HA GLY 37 -1.597 -15.747 -8.256 227 HA3 GLY 37 2HA GLY 37 -3.312 -16.133 -8.283 228 H ILE 38 H ILE 38 -4.231 -13.409 -8.183 229 HA ILE 38 HA ILE 38 -3.899 -12.771 -10.991 230 HB ILE 38 HB ILE 38 -5.576 -11.264 -8.992 231 HG12 ILE 38 1HG1 ILE 38 -6.314 -13.702 -10.625 232 HG13 ILE 38 2HG1 ILE 38 -6.202 -13.618 -8.871 233 HG21 ILE 38 1HG2 ILE 38 -6.136 -11.636 -11.910 234 HG22 ILE 38 2HG2 ILE 38 -6.707 -10.375 -10.819 235 HG23 ILE 38 3HG2 ILE 38 -5.026 -10.385 -11.352 236 HD11 ILE 38 3HD1 ILE 38 -8.210 -12.622 -8.659 237 HD12 ILE 38 1HD1 ILE 38 -8.039 -11.705 -10.156 238 HD13 ILE 38 2HD1 ILE 38 -8.499 -13.407 -10.211 239 H GLN 39 H GLN 39 -3.215 -10.764 -11.800 240 HA GLN 39 HA GLN 39 -1.360 -9.356 -10.022 241 HB2 GLN 39 1HB GLN 39 -0.251 -10.112 -11.967 242 HB3 GLN 39 2HB GLN 39 -1.562 -9.587 -13.016 243 HG2 GLN 39 1HG GLN 39 -1.003 -7.280 -12.649 244 HG3 GLN 39 2HG GLN 39 0.216 -7.728 -11.456 245 HE21 GLN 39 1HE2 GLN 39 -0.629 -7.787 -14.849 246 HE22 GLN 39 2HE2 GLN 39 0.977 -8.014 -15.444 247 H SER 40 H SER 40 -2.388 -7.749 -8.989 248 HA SER 40 HA SER 40 -4.385 -6.149 -10.370 249 HB2 SER 40 1HB SER 40 -3.376 -6.027 -7.517 250 HB3 SER 40 2HB SER 40 -4.712 -5.074 -8.164 251 HG SER 40 HG SER 40 -4.831 -7.833 -8.512 252 H GLU 41 H GLU 41 -4.290 -3.759 -10.190 253 HA GLU 41 HA GLU 41 -1.621 -2.617 -9.989 254 HB2 GLU 41 1HB GLU 41 -1.767 -1.536 -12.192 255 HB3 GLU 41 2HB GLU 41 -1.737 -3.289 -12.326 256 HG2 GLU 41 1HG GLU 41 -3.387 -2.785 -13.814 257 HG3 GLU 41 2HG GLU 41 -4.341 -3.026 -12.352 258 H PHE 42 H PHE 42 -1.746 -0.773 -8.906 259 HA PHE 42 HA PHE 42 -4.245 0.781 -9.058 260 HB2 PHE 42 1HB PHE 42 -4.219 1.197 -6.760 261 HB3 PHE 42 2HB PHE 42 -3.726 -0.490 -6.859 262 HD1 PHE 42 1HD PHE 42 -2.523 2.955 -6.341 263 HD2 PHE 42 2HD PHE 42 -1.592 -1.193 -6.121 264 HE1 PHE 42 1HE PHE 42 -0.481 3.484 -5.074 265 HE2 PHE 42 2HE PHE 42 0.450 -0.670 -4.852 266 HZ PHE 42 HZ PHE 42 1.008 1.670 -4.326 267 H PHE 43 H PHE 43 -4.066 2.919 -9.437 268 HA PHE 43 HA PHE 43 -1.399 3.952 -9.993 269 HB2 PHE 43 1HB PHE 43 -4.167 4.981 -10.622 270 HB3 PHE 43 2HB PHE 43 -2.703 5.897 -10.965 271 HD1 PHE 43 1HD PHE 43 -0.872 4.530 -12.312 272 HD2 PHE 43 2HD PHE 43 -5.044 3.688 -12.297 273 HE1 PHE 43 1HE PHE 43 -0.639 3.355 -14.461 274 HE2 PHE 43 2HE PHE 43 -4.818 2.511 -14.446 275 HZ PHE 43 HZ PHE 43 -2.613 2.342 -15.530 276 H ILE 44 H ILE 44 -0.660 5.972 -9.189 277 HA ILE 44 HA ILE 44 -1.850 6.687 -6.591 278 HB ILE 44 HB ILE 44 1.006 6.970 -7.531 279 HG12 ILE 44 1HG1 ILE 44 0.163 5.420 -5.121 280 HG13 ILE 44 2HG1 ILE 44 -0.094 4.702 -6.707 281 HG21 ILE 44 1HG2 ILE 44 1.199 7.533 -4.953 282 HG22 ILE 44 2HG2 ILE 44 0.867 8.781 -6.153 283 HG23 ILE 44 3HG2 ILE 44 -0.452 8.098 -5.203 284 HD11 ILE 44 3HD1 ILE 44 2.565 5.735 -5.763 285 HD12 ILE 44 1HD1 ILE 44 2.037 4.063 -5.580 286 HD13 ILE 44 2HD1 ILE 44 2.230 4.756 -7.191 287 H ASN 45 H ASN 45 -2.910 8.547 -6.583 288 HA ASN 45 HA ASN 45 -2.804 10.430 -8.683 289 HB2 ASN 45 1HB ASN 45 -4.827 10.403 -7.509 290 HB3 ASN 45 2HB ASN 45 -4.027 10.426 -5.940 291 HD21 ASN 45 1HD2 ASN 45 -3.918 12.294 -4.918 292 HD22 ASN 45 2HD2 ASN 45 -4.169 13.850 -5.626 293 H THR 46 H THR 46 -0.633 11.034 -8.941 294 HA THR 46 HA THR 46 0.355 12.890 -6.876 295 HB THR 46 HB THR 46 1.699 10.795 -6.947 296 HG1 THR 46 1HG THR 46 3.138 13.059 -7.908 297 HG21 THR 46 3HG2 THR 46 1.778 11.494 -9.806 298 HG22 THR 46 1HG2 THR 46 1.922 9.923 -9.019 299 HG23 THR 46 2HG2 THR 46 3.320 10.995 -9.112 300 H THR 47 H THR 47 -1.261 13.739 -8.957 301 HA THR 47 HA THR 47 0.493 14.830 -11.016 302 HB THR 47 HB THR 47 -1.654 15.785 -11.942 303 HG1 THR 47 1HG THR 47 -2.586 15.156 -9.589 304 HG21 THR 47 3HG2 THR 47 -2.581 13.266 -12.265 305 HG22 THR 47 1HG2 THR 47 -0.945 12.932 -11.700 306 HG23 THR 47 2HG2 THR 47 -1.196 13.920 -13.139 307 H ARG 48 H ARG 48 -0.900 15.739 -8.033 308 HA ARG 48 HA ARG 48 -0.465 18.591 -8.602 309 HB2 ARG 48 1HB ARG 48 -2.185 17.137 -6.621 310 HB3 ARG 48 2HB ARG 48 -1.700 18.799 -6.317 311 HG2 ARG 48 1HG ARG 48 -2.646 19.318 -8.628 312 HG3 ARG 48 2HG ARG 48 -3.402 17.725 -8.538 313 HD2 ARG 48 1HD ARG 48 -4.494 18.388 -6.435 314 HD3 ARG 48 2HD ARG 48 -3.770 19.989 -6.579 315 HE ARG 48 HE ARG 48 -5.322 19.226 -8.871 316 HH11 ARG 48 1HH1 ARG 48 -5.433 20.630 -5.687 317 HH12 ARG 48 2HH1 ARG 48 -6.892 21.515 -5.986 318 HH21 ARG 48 1HH2 ARG 48 -7.243 20.386 -9.276 319 HH22 ARG 48 2HH2 ARG 48 -7.921 21.375 -8.028 320 H ALA 49 H ALA 49 0.479 15.930 -6.542 321 HA ALA 49 HA ALA 49 1.995 17.497 -4.696 322 HB1 ALA 49 3HB ALA 49 2.891 14.764 -4.879 323 HB2 ALA 49 1HB ALA 49 2.080 15.595 -3.551 324 HB3 ALA 49 2HB ALA 49 1.130 14.851 -4.839 325 H GLY 50 H GLY 50 2.964 15.266 -7.313 326 HA2 GLY 50 1HA GLY 50 4.654 16.223 -8.890 327 HA3 GLY 50 2HA GLY 50 5.522 16.739 -7.452 328 HA PRO 51 HA PRO 51 6.804 12.408 -8.926 329 HB2 PRO 51 1HB PRO 51 9.239 13.059 -9.935 330 HB3 PRO 51 2HB PRO 51 7.766 13.047 -10.912 331 HG2 PRO 51 1HG PRO 51 9.174 15.361 -9.637 332 HG3 PRO 51 2HG PRO 51 8.463 15.239 -11.257 333 HD2 PRO 51 1HD PRO 51 7.206 16.477 -9.204 334 HD3 PRO 51 2HD PRO 51 6.325 15.619 -10.485 335 H GLY 52 H GLY 52 9.035 14.959 -7.784 336 HA2 GLY 52 1HA GLY 52 10.778 14.785 -6.253 337 HA3 GLY 52 2HA GLY 52 9.435 14.312 -5.222 338 H THR 53 H THR 53 9.819 12.526 -4.116 339 HA THR 53 HA THR 53 11.382 10.385 -5.403 340 HB THR 53 HB THR 53 12.320 9.797 -3.211 341 HG1 THR 53 1HG THR 53 10.711 11.969 -2.388 342 HG21 THR 53 3HG2 THR 53 13.966 11.077 -4.036 343 HG22 THR 53 1HG2 THR 53 13.382 12.322 -2.931 344 HG23 THR 53 2HG2 THR 53 12.838 12.306 -4.609 345 H LEU 54 H LEU 54 9.954 8.832 -5.865 346 HA LEU 54 HA LEU 54 7.645 8.353 -4.199 347 HB2 LEU 54 1HB LEU 54 7.957 8.132 -6.809 348 HB3 LEU 54 2HB LEU 54 8.455 6.497 -6.380 349 HG LEU 54 HG LEU 54 6.052 6.757 -7.061 350 HD11 LEU 54 1HD1 LEU 54 5.213 5.282 -5.322 351 HD12 LEU 54 2HD1 LEU 54 6.559 5.726 -4.273 352 HD13 LEU 54 3HD1 LEU 54 6.861 4.840 -5.768 353 HD21 LEU 54 3HD2 LEU 54 5.316 7.722 -4.388 354 HD22 LEU 54 1HD2 LEU 54 4.604 8.075 -5.963 355 HD23 LEU 54 2HD2 LEU 54 6.054 8.932 -5.439 356 H SER 55 H SER 55 7.812 7.224 -2.385 357 HA SER 55 HA SER 55 9.635 4.907 -2.340 358 HB2 SER 55 1HB SER 55 8.965 6.887 -0.163 359 HB3 SER 55 2HB SER 55 9.702 5.322 0.179 360 HG SER 55 HG SER 55 11.476 5.915 -1.035 361 H VAL 56 H VAL 56 8.359 3.183 -2.629 362 HA VAL 56 HA VAL 56 5.868 3.013 -1.066 363 HB VAL 56 HB VAL 56 5.518 2.884 -3.490 364 HG11 VAL 56 1HG1 VAL 56 6.974 0.270 -3.551 365 HG12 VAL 56 2HG1 VAL 56 6.515 1.327 -4.888 366 HG13 VAL 56 3HG1 VAL 56 7.840 1.783 -3.816 367 HG21 VAL 56 3HG2 VAL 56 3.885 1.350 -3.271 368 HG22 VAL 56 1HG2 VAL 56 5.000 0.088 -2.748 369 HG23 VAL 56 2HG2 VAL 56 4.421 1.288 -1.592 370 H THR 57 H THR 57 5.385 1.117 0.061 371 HA THR 57 HA THR 57 7.428 -0.964 0.207 372 HB THR 57 HB THR 57 6.452 0.482 2.678 373 HG1 THR 57 1HG THR 57 8.728 0.746 1.076 374 HG21 THR 57 3HG2 THR 57 7.982 -0.926 3.896 375 HG22 THR 57 1HG2 THR 57 8.558 -1.665 2.402 376 HG23 THR 57 2HG2 THR 57 6.906 -1.953 2.949 377 H ILE 58 H ILE 58 6.685 -2.939 1.068 378 HA ILE 58 HA ILE 58 3.860 -3.133 1.779 379 HB ILE 58 HB ILE 58 5.091 -4.736 -0.466 380 HG12 ILE 58 1HG1 ILE 58 2.732 -2.851 -0.563 381 HG13 ILE 58 2HG1 ILE 58 4.374 -2.354 -0.956 382 HG21 ILE 58 1HG2 ILE 58 3.611 -6.105 0.892 383 HG22 ILE 58 2HG2 ILE 58 2.339 -4.892 0.755 384 HG23 ILE 58 3HG2 ILE 58 2.877 -5.769 -0.676 385 HD11 ILE 58 3HD1 ILE 58 2.483 -4.038 -2.474 386 HD12 ILE 58 1HD1 ILE 58 3.650 -2.842 -3.038 387 HD13 ILE 58 2HD1 ILE 58 4.194 -4.455 -2.573 388 H GLU 59 H GLU 59 3.425 -4.722 3.224 389 HA GLU 59 HA GLU 59 5.586 -6.623 3.847 390 HB2 GLU 59 1HB GLU 59 4.040 -4.829 5.673 391 HB3 GLU 59 2HB GLU 59 4.580 -6.392 6.268 392 HG2 GLU 59 1HG GLU 59 6.889 -5.800 5.703 393 HG3 GLU 59 2HG GLU 59 6.337 -4.224 5.140 394 H GLY 60 H GLY 60 4.941 -8.657 4.668 395 HA2 GLY 60 1HA GLY 60 2.282 -9.417 5.174 396 HA3 GLY 60 2HA GLY 60 2.641 -9.746 3.486 397 HA PRO 61 HA PRO 61 4.058 -13.255 6.324 398 HB2 PRO 61 1HB PRO 61 2.286 -15.123 5.464 399 HB3 PRO 61 2HB PRO 61 1.955 -14.037 6.818 400 HG2 PRO 61 1HG PRO 61 1.066 -13.834 3.967 401 HG3 PRO 61 2HG PRO 61 0.139 -13.545 5.451 402 HD2 PRO 61 1HD PRO 61 1.180 -11.533 3.967 403 HD3 PRO 61 2HD PRO 61 1.010 -11.429 5.731 404 H SER 62 H SER 62 3.509 -12.657 2.995 405 HA SER 62 HA SER 62 5.602 -14.583 2.302 406 HB2 SER 62 1HB SER 62 2.847 -14.453 1.105 407 HB3 SER 62 2HB SER 62 4.211 -15.047 0.158 408 HG SER 62 HG SER 62 3.525 -16.061 2.714 409 H LYS 63 H LYS 63 7.178 -13.416 1.444 410 HA LYS 63 HA LYS 63 7.138 -10.820 0.616 411 HB2 LYS 63 1HB LYS 63 8.838 -13.061 -0.492 412 HB3 LYS 63 2HB LYS 63 9.161 -11.350 -0.736 413 HG2 LYS 63 1HG LYS 63 8.922 -12.480 2.023 414 HG3 LYS 63 2HG LYS 63 10.430 -12.609 1.115 415 HD2 LYS 63 1HD LYS 63 10.360 -10.131 0.799 416 HD3 LYS 63 2HD LYS 63 8.971 -10.084 1.887 417 HE2 LYS 63 1HE LYS 63 11.569 -11.352 2.696 418 HE3 LYS 63 2HE LYS 63 11.292 -9.620 2.875 419 HZ1 LYS 63 3HZ LYS 63 10.698 -11.380 4.759 420 HZ2 LYS 63 1HZ LYS 63 9.224 -11.374 3.928 421 HZ3 LYS 63 2HZ LYS 63 9.845 -9.933 4.557 422 H VAL 64 H VAL 64 6.885 -9.711 -1.318 423 HA VAL 64 HA VAL 64 5.743 -11.224 -3.567 424 HB VAL 64 HB VAL 64 4.090 -9.463 -3.952 425 HG11 VAL 64 1HG1 VAL 64 3.466 -11.410 -2.610 426 HG12 VAL 64 2HG1 VAL 64 3.968 -10.563 -1.145 427 HG13 VAL 64 3HG1 VAL 64 2.601 -9.965 -2.087 428 HG21 VAL 64 3HG2 VAL 64 4.965 -8.296 -1.313 429 HG22 VAL 64 1HG2 VAL 64 5.410 -7.639 -2.888 430 HG23 VAL 64 2HG2 VAL 64 3.717 -7.676 -2.394 431 H LYS 65 H LYS 65 6.157 -10.406 -5.615 432 HA LYS 65 HA LYS 65 8.451 -8.632 -5.770 433 HB2 LYS 65 1HB LYS 65 8.502 -9.264 -8.146 434 HB3 LYS 65 2HB LYS 65 8.471 -10.676 -7.098 435 HG2 LYS 65 1HG LYS 65 6.928 -11.324 -8.627 436 HG3 LYS 65 2HG LYS 65 5.865 -10.469 -7.507 437 HD2 LYS 65 1HD LYS 65 5.200 -9.501 -9.465 438 HD3 LYS 65 2HD LYS 65 6.519 -8.408 -9.040 439 HE2 LYS 65 1HE LYS 65 8.029 -9.819 -10.446 440 HE3 LYS 65 2HE LYS 65 6.609 -10.721 -10.972 441 HZ1 LYS 65 3HZ LYS 65 6.024 -8.037 -11.332 442 HZ2 LYS 65 1HZ LYS 65 6.321 -9.194 -12.530 443 HZ3 LYS 65 2HZ LYS 65 7.592 -8.254 -11.929 444 H MET 66 H MET 66 8.429 -6.576 -6.468 445 HA MET 66 HA MET 66 5.833 -5.459 -7.281 446 HB2 MET 66 1HB MET 66 8.167 -4.348 -5.778 447 HB3 MET 66 2HB MET 66 7.143 -3.250 -6.694 448 HG2 MET 66 1HG MET 66 5.206 -3.942 -5.433 449 HG3 MET 66 2HG MET 66 6.165 -5.142 -4.570 450 HE1 MET 66 3HE MET 66 6.158 -4.618 -2.172 451 HE2 MET 66 1HE MET 66 7.859 -4.598 -2.641 452 HE3 MET 66 2HE MET 66 7.233 -3.370 -1.540 453 H ASP 67 H ASP 67 5.652 -4.183 -9.098 454 HA ASP 67 HA ASP 67 7.975 -4.227 -10.909 455 HB2 ASP 67 1HB ASP 67 5.797 -5.526 -11.482 456 HB3 ASP 67 2HB ASP 67 5.139 -3.935 -11.855 457 H CYS 68 H CYS 68 8.658 -2.223 -9.864 458 HA CYS 68 HA CYS 68 7.154 0.131 -9.830 459 HB2 CYS 68 1HB CYS 68 9.311 -0.216 -8.631 460 HB3 CYS 68 2HB CYS 68 10.150 -0.102 -10.173 461 HG CYS 68 HG CYS 68 8.938 2.571 -10.544 462 H GLN 69 H GLN 69 6.074 0.692 -11.648 463 HA GLN 69 HA GLN 69 7.704 1.243 -14.038 464 HB2 GLN 69 1HB GLN 69 6.204 -0.724 -14.340 465 HB3 GLN 69 2HB GLN 69 4.825 0.322 -14.030 466 HG2 GLN 69 1HG GLN 69 4.915 0.175 -16.344 467 HG3 GLN 69 2HG GLN 69 5.677 1.724 -15.986 468 HE21 GLN 69 1HE2 GLN 69 7.719 2.074 -16.624 469 HE22 GLN 69 2HE2 GLN 69 8.718 0.905 -17.412 470 H GLU 70 H GLU 70 7.785 3.335 -14.478 471 HA GLU 70 HA GLU 70 6.099 5.234 -13.195 472 HB2 GLU 70 1HB GLU 70 7.311 6.905 -14.474 473 HB3 GLU 70 2HB GLU 70 8.435 5.721 -13.822 474 HG2 GLU 70 1HG GLU 70 8.062 4.592 -16.177 475 HG3 GLU 70 2HG GLU 70 7.643 6.243 -16.632 476 H THR 71 H THR 71 4.714 6.789 -14.249 477 HA THR 71 HA THR 71 3.658 6.033 -16.863 478 HB THR 71 HB THR 71 1.292 6.301 -15.900 479 HG1 THR 71 1HG THR 71 1.102 5.839 -13.695 480 HG21 THR 71 3HG2 THR 71 2.045 4.173 -16.717 481 HG22 THR 71 1HG2 THR 71 1.230 3.909 -15.176 482 HG23 THR 71 2HG2 THR 71 2.992 3.892 -15.257 483 HA PRO 72 HA PRO 72 3.268 10.368 -17.442 484 HB2 PRO 72 1HB PRO 72 1.160 10.483 -19.150 485 HB3 PRO 72 2HB PRO 72 2.760 9.909 -19.635 486 HG2 PRO 72 1HG PRO 72 0.330 8.332 -18.879 487 HG3 PRO 72 2HG PRO 72 1.473 8.057 -20.206 488 HD2 PRO 72 1HD PRO 72 1.572 6.664 -17.886 489 HD3 PRO 72 2HD PRO 72 3.025 7.053 -18.829 490 H GLU 73 H GLU 73 1.055 8.616 -15.694 491 HA GLU 73 HA GLU 73 -0.649 10.959 -15.177 492 HB2 GLU 73 1HB GLU 73 -1.938 9.043 -15.865 493 HB3 GLU 73 2HB GLU 73 -1.129 8.018 -14.688 494 HG2 GLU 73 1HG GLU 73 -3.176 8.447 -13.706 495 HG3 GLU 73 2HG GLU 73 -2.104 9.611 -12.930 496 H GLY 74 H GLY 74 0.943 8.252 -13.487 497 HA2 GLY 74 1HA GLY 74 1.865 10.010 -11.405 498 HA3 GLY 74 2HA GLY 74 0.567 8.949 -10.878 499 H TYR 75 H TYR 75 0.918 6.687 -10.838 500 HA TYR 75 HA TYR 75 3.453 5.555 -11.510 501 HB2 TYR 75 1HB TYR 75 2.922 6.429 -8.716 502 HB3 TYR 75 2HB TYR 75 3.704 4.868 -8.938 503 HD1 TYR 75 1HD TYR 75 5.717 4.940 -10.706 504 HD2 TYR 75 2HD TYR 75 4.287 8.270 -8.477 505 HE1 TYR 75 1HE TYR 75 7.885 6.063 -11.004 506 HE2 TYR 75 2HE TYR 75 6.450 9.403 -8.771 507 HH TYR 75 HH TYR 75 8.573 9.168 -9.457 508 H LYS 76 H LYS 76 2.913 3.608 -12.206 509 HA LYS 76 HA LYS 76 0.525 2.297 -11.173 510 HB2 LYS 76 1HB LYS 76 1.319 2.529 -13.684 511 HB3 LYS 76 2HB LYS 76 2.249 1.088 -13.293 512 HG2 LYS 76 1HG LYS 76 0.275 -0.139 -12.777 513 HG3 LYS 76 2HG LYS 76 -0.721 1.314 -12.875 514 HD2 LYS 76 1HD LYS 76 -0.532 1.430 -15.201 515 HD3 LYS 76 2HD LYS 76 0.880 0.371 -15.230 516 HE2 LYS 76 1HE LYS 76 -0.670 -1.445 -14.342 517 HE3 LYS 76 2HE LYS 76 -1.997 -0.360 -14.753 518 HZ1 LYS 76 3HZ LYS 76 -1.838 -0.930 -16.876 519 HZ2 LYS 76 1HZ LYS 76 -0.734 -2.133 -16.433 520 HZ3 LYS 76 2HZ LYS 76 -0.177 -0.612 -16.919 521 H VAL 77 H VAL 77 0.813 1.166 -9.359 522 HA VAL 77 HA VAL 77 3.261 -0.442 -9.071 523 HB VAL 77 HB VAL 77 1.316 0.482 -6.952 524 HG11 VAL 77 1HG1 VAL 77 3.556 -1.456 -6.924 525 HG12 VAL 77 2HG1 VAL 77 3.419 -0.359 -5.548 526 HG13 VAL 77 3HG1 VAL 77 2.074 -1.421 -5.970 527 HG21 VAL 77 3HG2 VAL 77 3.687 1.666 -8.121 528 HG22 VAL 77 1HG2 VAL 77 2.500 2.368 -7.022 529 HG23 VAL 77 2HG2 VAL 77 3.856 1.441 -6.380 530 H MET 78 H MET 78 3.000 -2.494 -9.646 531 HA MET 78 HA MET 78 0.413 -3.791 -9.101 532 HB2 MET 78 1HB MET 78 2.517 -4.622 -11.106 533 HB3 MET 78 2HB MET 78 0.924 -5.338 -10.902 534 HG2 MET 78 1HG MET 78 0.559 -3.993 -12.707 535 HG3 MET 78 2HG MET 78 0.098 -2.910 -11.396 536 HE1 MET 78 3HE MET 78 2.788 -3.094 -14.542 537 HE2 MET 78 1HE MET 78 4.161 -2.967 -13.442 538 HE3 MET 78 2HE MET 78 3.006 -4.288 -13.261 539 H TYR 79 H TYR 79 0.384 -5.878 -8.212 540 HA TYR 79 HA TYR 79 2.817 -7.195 -7.435 541 HB2 TYR 79 1HB TYR 79 2.531 -7.030 -5.039 542 HB3 TYR 79 2HB TYR 79 2.625 -5.408 -5.716 543 HD1 TYR 79 1HD TYR 79 0.271 -7.956 -4.406 544 HD2 TYR 79 2HD TYR 79 0.867 -3.864 -5.407 545 HE1 TYR 79 1HE TYR 79 -1.854 -7.384 -3.308 546 HE2 TYR 79 2HE TYR 79 -1.256 -3.280 -4.311 547 HH TYR 79 HH TYR 79 -3.098 -5.654 -2.492 548 H THR 80 H THR 80 2.496 -9.325 -6.917 549 HA THR 80 HA THR 80 -0.295 -10.256 -6.773 550 HB THR 80 HB THR 80 1.943 -11.571 -8.326 551 HG1 THR 80 1HG THR 80 0.027 -11.121 -9.949 552 HG21 THR 80 3HG2 THR 80 0.612 -13.388 -8.683 553 HG22 THR 80 1HG2 THR 80 -0.881 -12.461 -8.538 554 HG23 THR 80 2HG2 THR 80 0.011 -12.930 -7.090 555 HA PRO 81 HA PRO 81 1.564 -11.982 -3.044 556 HB2 PRO 81 1HB PRO 81 -0.810 -12.624 -1.894 557 HB3 PRO 81 2HB PRO 81 -0.141 -10.988 -1.869 558 HG2 PRO 81 1HG PRO 81 -2.234 -12.150 -3.666 559 HG3 PRO 81 2HG PRO 81 -2.200 -10.568 -2.866 560 HD2 PRO 81 1HD PRO 81 -1.552 -10.895 -5.474 561 HD3 PRO 81 2HD PRO 81 -0.798 -9.656 -4.451 562 H MET 82 H MET 82 2.427 -13.952 -3.186 563 HA MET 82 HA MET 82 1.254 -16.069 -4.681 564 HB2 MET 82 1HB MET 82 3.663 -15.801 -2.923 565 HB3 MET 82 2HB MET 82 3.132 -17.400 -3.427 566 HG2 MET 82 1HG MET 82 4.637 -16.913 -5.069 567 HG3 MET 82 2HG MET 82 3.148 -16.328 -5.808 568 HE1 MET 82 3HE MET 82 5.403 -13.630 -7.223 569 HE2 MET 82 1HE MET 82 6.141 -15.190 -6.858 570 HE3 MET 82 2HE MET 82 4.495 -15.120 -7.486 571 H ALA 83 H ALA 83 1.392 -15.251 -1.267 572 HA ALA 83 HA ALA 83 -0.450 -17.488 -0.727 573 HB1 ALA 83 3HB ALA 83 1.448 -16.426 1.338 574 HB2 ALA 83 1HB ALA 83 0.576 -17.959 1.317 575 HB3 ALA 83 2HB ALA 83 1.926 -17.696 0.212 576 HA PRO 84 HA PRO 84 -3.264 -14.487 0.826 577 HB2 PRO 84 1HB PRO 84 -4.665 -16.022 2.572 578 HB3 PRO 84 2HB PRO 84 -4.835 -16.163 0.819 579 HG2 PRO 84 1HG PRO 84 -3.238 -17.848 2.708 580 HG3 PRO 84 2HG PRO 84 -4.256 -18.352 1.347 581 HD2 PRO 84 1HD PRO 84 -1.559 -18.198 1.169 582 HD3 PRO 84 2HD PRO 84 -2.627 -17.876 -0.212 583 H GLY 85 H GLY 85 -4.217 -13.771 3.045 584 HA2 GLY 85 1HA GLY 85 -3.594 -13.883 5.502 585 HA3 GLY 85 2HA GLY 85 -1.955 -13.600 4.934 586 H ASN 86 H ASN 86 -2.112 -11.756 6.441 587 HA ASN 86 HA ASN 86 -3.677 -9.508 5.396 588 HB2 ASN 86 1HB ASN 86 -2.110 -9.634 7.979 589 HB3 ASN 86 2HB ASN 86 -3.314 -8.433 7.519 590 HD21 ASN 86 1HD2 ASN 86 -5.431 -8.843 7.850 591 HD22 ASN 86 2HD2 ASN 86 -6.035 -10.283 8.589 592 H TYR 87 H TYR 87 -2.727 -8.059 4.140 593 HA TYR 87 HA TYR 87 0.204 -7.794 4.265 594 HB2 TYR 87 1HB TYR 87 -1.740 -7.514 1.985 595 HB3 TYR 87 2HB TYR 87 -0.133 -6.800 1.907 596 HD1 TYR 87 1HD TYR 87 -1.836 -10.056 2.555 597 HD2 TYR 87 2HD TYR 87 1.643 -8.072 1.117 598 HE1 TYR 87 1HE TYR 87 -0.922 -12.213 1.807 599 HE2 TYR 87 2HE TYR 87 2.566 -10.224 0.364 600 HH TYR 87 HH TYR 87 0.863 -13.270 0.981 601 H LEU 88 H LEU 88 1.128 -5.711 4.100 602 HA LEU 88 HA LEU 88 -0.721 -3.483 4.635 603 HB2 LEU 88 1HB LEU 88 0.518 -4.360 6.662 604 HB3 LEU 88 2HB LEU 88 1.993 -3.769 5.899 605 HG LEU 88 HG LEU 88 0.636 -1.501 5.845 606 HD11 LEU 88 1HD1 LEU 88 -0.435 -2.605 8.402 607 HD12 LEU 88 2HD1 LEU 88 -1.333 -2.839 6.903 608 HD13 LEU 88 3HD1 LEU 88 -0.969 -1.208 7.467 609 HD21 LEU 88 3HD2 LEU 88 1.598 -1.030 8.145 610 HD22 LEU 88 1HD2 LEU 88 2.727 -1.619 6.924 611 HD23 LEU 88 2HD2 LEU 88 2.117 -2.717 8.162 612 H ILE 89 H ILE 89 -0.499 -1.836 3.277 613 HA ILE 89 HA ILE 89 1.965 -1.667 1.678 614 HB ILE 89 HB ILE 89 -0.760 -0.523 1.055 615 HG12 ILE 89 1HG1 ILE 89 0.643 -2.826 -0.303 616 HG13 ILE 89 2HG1 ILE 89 -0.529 -3.049 0.990 617 HG21 ILE 89 1HG2 ILE 89 0.110 0.127 -1.048 618 HG22 ILE 89 2HG2 ILE 89 1.258 0.697 0.162 619 HG23 ILE 89 3HG2 ILE 89 1.614 -0.753 -0.777 620 HD11 ILE 89 3HD1 ILE 89 -0.974 -2.674 -1.795 621 HD12 ILE 89 1HD1 ILE 89 -2.140 -3.018 -0.518 622 HD13 ILE 89 2HD1 ILE 89 -1.723 -1.349 -0.906 623 H SER 90 H SER 90 3.334 -0.193 2.426 624 HA SER 90 HA SER 90 2.258 2.271 3.619 625 HB2 SER 90 1HB SER 90 3.926 0.659 4.848 626 HB3 SER 90 2HB SER 90 5.137 1.466 3.851 627 HG SER 90 HG SER 90 3.368 2.646 5.726 628 H VAL 91 H VAL 91 2.643 4.206 2.717 629 HA VAL 91 HA VAL 91 4.618 4.374 0.544 630 HB VAL 91 HB VAL 91 1.848 5.579 0.455 631 HG11 VAL 91 1HG1 VAL 91 4.206 5.726 -1.401 632 HG12 VAL 91 2HG1 VAL 91 2.558 6.038 -1.950 633 HG13 VAL 91 3HG1 VAL 91 3.277 7.048 -0.695 634 HG21 VAL 91 3HG2 VAL 91 1.263 3.969 -1.152 635 HG22 VAL 91 1HG2 VAL 91 2.935 3.451 -1.365 636 HG23 VAL 91 2HG2 VAL 91 2.073 3.059 0.123 637 H LYS 92 H LYS 92 5.779 6.240 0.439 638 HA LYS 92 HA LYS 92 5.025 8.457 2.204 639 HB2 LYS 92 1HB LYS 92 7.762 7.174 2.124 640 HB3 LYS 92 2HB LYS 92 7.363 8.653 2.988 641 HG2 LYS 92 1HG LYS 92 5.804 7.407 4.400 642 HG3 LYS 92 2HG LYS 92 6.212 5.923 3.535 643 HD2 LYS 92 1HD LYS 92 8.326 7.583 4.870 644 HD3 LYS 92 2HD LYS 92 7.388 6.391 5.774 645 HE2 LYS 92 1HE LYS 92 8.306 4.614 4.642 646 HE3 LYS 92 2HE LYS 92 8.668 5.575 3.210 647 HZ1 LYS 92 3HZ LYS 92 10.724 5.811 3.954 648 HZ2 LYS 92 1HZ LYS 92 10.360 4.934 5.355 649 HZ3 LYS 92 2HZ LYS 92 10.153 6.613 5.330 650 H TYR 93 H TYR 93 5.621 10.476 1.489 651 HA TYR 93 HA TYR 93 7.223 10.652 -0.958 652 HB2 TYR 93 1HB TYR 93 4.961 10.618 -1.779 653 HB3 TYR 93 2HB TYR 93 4.457 11.813 -0.588 654 HD1 TYR 93 1HD TYR 93 6.625 11.335 -3.567 655 HD2 TYR 93 2HD TYR 93 4.573 14.106 -1.075 656 HE1 TYR 93 1HE TYR 93 7.106 13.130 -5.178 657 HE2 TYR 93 2HE TYR 93 5.047 15.909 -2.679 658 HH TYR 93 HH TYR 93 5.762 15.575 -5.663 659 H GLY 94 H GLY 94 8.893 11.853 -0.302 660 HA2 GLY 94 1HA GLY 94 10.036 13.745 0.349 661 HA3 GLY 94 2HA GLY 94 8.492 14.578 0.449 662 H GLY 95 H GLY 95 10.519 12.226 2.182 663 HA2 GLY 95 1HA GLY 95 11.162 12.632 4.464 664 HA3 GLY 95 2HA GLY 95 9.651 13.500 4.691 665 HA PRO 96 HA PRO 96 9.364 9.026 6.186 666 HB2 PRO 96 1HB PRO 96 9.080 9.576 8.830 667 HB3 PRO 96 2HB PRO 96 10.653 9.319 8.065 668 HG2 PRO 96 1HG PRO 96 9.284 11.887 8.765 669 HG3 PRO 96 2HG PRO 96 10.985 11.433 8.975 670 HD2 PRO 96 1HD PRO 96 10.134 12.983 6.925 671 HD3 PRO 96 2HD PRO 96 11.503 11.864 6.771 672 H ASN 97 H ASN 97 7.584 11.877 6.129 673 HA ASN 97 HA ASN 97 5.266 11.087 7.563 674 HB2 ASN 97 1HB ASN 97 4.218 12.901 5.963 675 HB3 ASN 97 2HB ASN 97 5.324 13.374 7.249 676 HD21 ASN 97 1HD2 ASN 97 5.740 12.033 3.989 677 HD22 ASN 97 2HD2 ASN 97 6.836 13.252 3.445 678 H HIS 98 H HIS 98 3.446 10.041 6.925 679 HA HIS 98 HA HIS 98 3.594 8.590 4.403 680 HB2 HIS 98 1HB HIS 98 1.709 7.276 5.305 681 HB3 HIS 98 2HB HIS 98 3.079 7.306 6.411 682 HD2 HIS 98 2HD HIS 98 2.251 7.714 8.940 683 HE1 HIS 98 1HE HIS 98 -1.227 9.992 8.093 684 HE2 HIS 98 2HE HIS 98 0.240 9.028 9.900 685 H ILE 99 H ILE 99 1.453 8.266 3.230 686 HA ILE 99 HA ILE 99 0.330 10.909 2.709 687 HB ILE 99 HB ILE 99 -0.598 9.945 0.678 688 HG12 ILE 99 1HG1 ILE 99 0.775 7.339 1.208 689 HG13 ILE 99 2HG1 ILE 99 -0.817 7.621 1.904 690 HG21 ILE 99 1HG2 ILE 99 1.368 9.895 -0.490 691 HG22 ILE 99 2HG2 ILE 99 1.933 10.582 1.032 692 HG23 ILE 99 3HG2 ILE 99 2.175 8.868 0.696 693 HD11 ILE 99 3HD1 ILE 99 -1.857 7.603 -0.126 694 HD12 ILE 99 1HD1 ILE 99 -0.418 8.136 -0.995 695 HD13 ILE 99 2HD1 ILE 99 -0.540 6.470 -0.428 696 H VAL 100 H VAL 100 -2.066 10.892 2.060 697 HA VAL 100 HA VAL 100 -3.604 10.246 4.322 698 HB VAL 100 HB VAL 100 -4.401 11.019 1.521 699 HG11 VAL 100 1HG1 VAL 100 -6.032 9.821 3.557 700 HG12 VAL 100 2HG1 VAL 100 -6.559 11.477 3.250 701 HG13 VAL 100 3HG1 VAL 100 -6.470 10.318 1.923 702 HG21 VAL 100 3HG2 VAL 100 -5.023 13.136 2.620 703 HG22 VAL 100 1HG2 VAL 100 -4.424 12.497 4.151 704 HG23 VAL 100 2HG2 VAL 100 -3.310 12.759 2.809 705 H GLY 101 H GLY 101 -4.866 8.539 4.845 706 HA2 GLY 101 1HA GLY 101 -6.133 6.596 4.464 707 HA3 GLY 101 2HA GLY 101 -5.474 6.512 2.837 708 H SER 102 H SER 102 -2.745 6.634 3.421 709 HA SER 102 HA SER 102 -2.252 3.917 4.102 710 HB2 SER 102 1HB SER 102 -0.688 4.690 2.586 711 HB3 SER 102 2HB SER 102 -0.563 6.270 3.360 712 HG SER 102 HG SER 102 0.948 5.527 4.634 713 HA PRO 103 HA PRO 103 -0.341 2.776 4.796 714 HB2 PRO 103 1HB PRO 103 -0.574 0.700 6.531 715 HB3 PRO 103 2HB PRO 103 0.816 1.793 6.521 716 HG2 PRO 103 1HG PRO 103 -1.586 1.798 8.308 717 HG3 PRO 103 2HG PRO 103 0.120 2.041 8.726 718 HD2 PRO 103 1HD PRO 103 -1.621 4.097 8.459 719 HD3 PRO 103 2HD PRO 103 0.102 4.245 8.054 720 H PHE 104 H PHE 104 -1.312 0.628 4.143 721 HA PHE 104 HA PHE 104 -4.251 0.777 4.300 722 HB2 PHE 104 1HB PHE 104 -2.561 -0.289 2.028 723 HB3 PHE 104 2HB PHE 104 -4.320 -0.216 2.061 724 HD1 PHE 104 2HD PHE 104 -5.483 1.907 1.838 725 HD2 PHE 104 1HD PHE 104 -1.237 1.679 1.648 726 HE1 PHE 104 2HE PHE 104 -5.408 4.167 0.868 727 HE2 PHE 104 1HE PHE 104 -1.155 3.939 0.679 728 HZ PHE 104 HZ PHE 104 -3.243 5.186 0.287 729 H LYS 105 H LYS 105 -5.244 -0.890 5.213 730 HA LYS 105 HA LYS 105 -3.721 -3.362 5.649 731 HB2 LYS 105 1HB LYS 105 -6.178 -2.294 7.049 732 HB3 LYS 105 2HB LYS 105 -5.406 -3.831 7.415 733 HG2 LYS 105 1HG LYS 105 -3.529 -2.812 8.334 734 HG3 LYS 105 2HG LYS 105 -3.866 -1.268 7.547 735 HD2 LYS 105 1HD LYS 105 -4.450 -0.919 9.788 736 HD3 LYS 105 2HD LYS 105 -5.990 -1.215 8.978 737 HE2 LYS 105 1HE LYS 105 -6.002 -3.501 9.750 738 HE3 LYS 105 2HE LYS 105 -4.394 -3.311 10.446 739 HZ1 LYS 105 3HZ LYS 105 -5.415 -1.516 11.867 740 HZ2 LYS 105 1HZ LYS 105 -5.897 -3.100 12.217 741 HZ3 LYS 105 2HZ LYS 105 -6.926 -2.075 11.352 742 H ALA 106 H ALA 106 -4.083 -4.358 3.660 743 HA ALA 106 HA ALA 106 -6.867 -4.916 2.926 744 HB1 ALA 106 3HB ALA 106 -5.468 -5.984 0.900 745 HB2 ALA 106 1HB ALA 106 -5.953 -4.289 0.958 746 HB3 ALA 106 2HB ALA 106 -4.322 -4.757 1.440 747 H LYS 107 H LYS 107 -7.715 -6.938 2.921 748 HA LYS 107 HA LYS 107 -6.067 -9.048 4.126 749 HB2 LYS 107 1HB LYS 107 -8.212 -8.354 5.239 750 HB3 LYS 107 2HB LYS 107 -9.074 -8.973 3.836 751 HG2 LYS 107 1HG LYS 107 -8.129 -11.204 4.269 752 HG3 LYS 107 2HG LYS 107 -7.342 -10.566 5.715 753 HD2 LYS 107 1HD LYS 107 -9.319 -11.580 6.487 754 HD3 LYS 107 2HD LYS 107 -9.667 -9.849 6.469 755 HE2 LYS 107 1HE LYS 107 -11.558 -10.916 5.532 756 HE3 LYS 107 2HE LYS 107 -10.677 -10.202 4.183 757 HZ1 LYS 107 3HZ LYS 107 -10.260 -12.198 3.303 758 HZ2 LYS 107 1HZ LYS 107 -11.515 -12.756 4.292 759 HZ3 LYS 107 2HZ LYS 107 -9.908 -12.913 4.796 760 H VAL 108 H VAL 108 -5.478 -10.780 2.990 761 HA VAL 108 HA VAL 108 -6.483 -11.063 0.260 762 HB VAL 108 HB VAL 108 -4.211 -12.556 1.573 763 HG11 VAL 108 1HG1 VAL 108 -4.936 -13.756 -0.323 764 HG12 VAL 108 2HG1 VAL 108 -5.151 -12.283 -1.270 765 HG13 VAL 108 3HG1 VAL 108 -3.528 -12.835 -0.853 766 HG21 VAL 108 3HG2 VAL 108 -3.786 -10.325 -0.359 767 HG22 VAL 108 1HG2 VAL 108 -4.105 -9.946 1.333 768 HG23 VAL 108 2HG2 VAL 108 -2.717 -10.944 0.899 769 H THR 109 H THR 109 -7.482 -12.883 -0.514 770 HA THR 109 HA THR 109 -8.513 -14.722 1.526 771 HB THR 109 HB THR 109 -10.140 -15.384 -0.310 772 HG1 THR 109 1HG THR 109 -9.545 -12.933 -1.543 773 HG21 THR 109 3HG2 THR 109 -10.278 -12.465 0.422 774 HG22 THR 109 1HG2 THR 109 -10.588 -13.756 1.582 775 HG23 THR 109 2HG2 THR 109 -11.613 -13.586 0.157 776 H GLY 110 H GLY 110 -9.094 -16.970 0.428 777 HA2 GLY 110 1HA GLY 110 -8.372 -18.780 -0.910 778 HA3 GLY 110 2HA GLY 110 -6.913 -17.880 -1.298 779 H GLN 111 H GLN 111 -6.313 -20.308 -0.760 780 HA GLN 111 HA GLN 111 -5.501 -20.359 2.072 781 HB2 GLN 111 1HB GLN 111 -5.518 -22.842 1.889 782 HB3 GLN 111 2HB GLN 111 -7.108 -22.113 1.707 783 HG2 GLN 111 1HG GLN 111 -6.460 -22.219 -0.854 784 HG3 GLN 111 2HG GLN 111 -5.425 -23.526 -0.281 785 HE21 GLN 111 1HE2 GLN 111 -7.448 -24.016 -2.053 786 HE22 GLN 111 2HE2 GLN 111 -8.693 -24.930 -1.280 787 H ARG 112 H ARG 112 -4.635 -21.733 -1.105 788 HA ARG 112 HA ARG 112 -1.991 -20.749 -1.041 789 HB2 ARG 112 1HB ARG 112 -1.751 -22.458 0.726 790 HB3 ARG 112 2HB ARG 112 -2.280 -23.691 -0.410 791 HG2 ARG 112 1HG ARG 112 0.041 -23.882 -0.377 792 HG3 ARG 112 2HG ARG 112 -0.300 -22.969 -1.848 793 HD2 ARG 112 1HD ARG 112 1.509 -21.865 -0.814 794 HD3 ARG 112 2HD ARG 112 0.088 -20.877 -0.477 795 HE ARG 112 HE ARG 112 0.210 -22.433 1.701 796 HH11 ARG 112 1HH1 ARG 112 2.634 -20.561 0.047 797 HH12 ARG 112 2HH1 ARG 112 3.555 -20.245 1.480 798 HH21 ARG 112 1HH2 ARG 112 1.413 -22.025 3.595 799 HH22 ARG 112 2HH2 ARG 112 2.860 -21.079 3.498 800 H LEU 113 H LEU 113 -1.497 -20.512 -3.112 801 HA LEU 113 HA LEU 113 -2.984 -21.582 -5.219 802 HB2 LEU 113 1HB LEU 113 -0.299 -20.271 -5.048 803 HB3 LEU 113 2HB LEU 113 -0.887 -20.909 -6.582 804 HG LEU 113 HG LEU 113 -2.456 -18.905 -4.982 805 HD11 LEU 113 1HD1 LEU 113 -0.727 -18.115 -7.284 806 HD12 LEU 113 2HD1 LEU 113 -0.043 -18.209 -5.661 807 HD13 LEU 113 3HD1 LEU 113 -1.395 -17.125 -5.986 808 HD21 LEU 113 3HD2 LEU 113 -3.541 -18.472 -7.089 809 HD22 LEU 113 1HD2 LEU 113 -3.602 -20.202 -6.752 810 HD23 LEU 113 2HD2 LEU 113 -2.443 -19.573 -7.923 811 H VAL 114 H VAL 114 -2.582 -23.214 -6.714 812 HA VAL 114 HA VAL 114 -1.227 -25.515 -5.671 813 HB VAL 114 HB VAL 114 -2.469 -25.118 -8.397 814 HG11 VAL 114 1HG1 VAL 114 -2.536 -27.807 -7.431 815 HG12 VAL 114 2HG1 VAL 114 -1.780 -27.170 -8.893 816 HG13 VAL 114 3HG1 VAL 114 -0.878 -27.209 -7.377 817 HG21 VAL 114 3HG2 VAL 114 -4.251 -26.632 -7.151 818 HG22 VAL 114 1HG2 VAL 114 -3.601 -25.803 -5.737 819 HG23 VAL 114 2HG2 VAL 114 -4.303 -24.871 -7.059 820 H SER 115 H SER 115 0.677 -26.412 -6.292 821 HA SER 115 HA SER 115 2.766 -24.898 -7.199 822 HB2 SER 115 1HB SER 115 4.014 -26.901 -7.426 823 HB3 SER 115 2HB SER 115 2.819 -27.244 -6.175 824 HG SER 115 HG SER 115 1.722 -28.513 -7.544 825 HA PRO 116 HA PRO 116 2.342 -24.319 -11.530 826 HB2 PRO 116 1HB PRO 116 4.945 -24.277 -12.298 827 HB3 PRO 116 2HB PRO 116 4.187 -22.956 -11.401 828 HG2 PRO 116 1HG PRO 116 5.921 -25.180 -10.395 829 HG3 PRO 116 2HG PRO 116 5.951 -23.458 -9.971 830 HD2 PRO 116 1HD PRO 116 4.783 -25.326 -8.396 831 HD3 PRO 116 2HD PRO 116 4.183 -23.659 -8.506 832 H GLY 117 H GLY 117 3.572 -27.178 -10.216 833 HA2 GLY 117 1HA GLY 117 4.219 -28.461 -12.729 834 HA3 GLY 117 2HA GLY 117 4.201 -29.217 -11.143 835 H SER 118 H SER 118 3.211 -30.893 -12.701 836 HA SER 118 HA SER 118 0.358 -30.867 -12.232 837 HB2 SER 118 1HB SER 118 0.635 -29.719 -14.442 838 HB3 SER 118 2HB SER 118 1.379 -31.193 -15.063 839 HG SER 118 HG SER 118 -1.274 -30.832 -14.137 840 H ALA 119 H ALA 119 -0.646 -32.966 -12.786 841 HA ALA 119 HA ALA 119 1.310 -35.167 -12.833 842 HB1 ALA 119 3HB ALA 119 0.075 -36.370 -11.164 843 HB2 ALA 119 1HB ALA 119 0.453 -34.765 -10.536 844 HB3 ALA 119 2HB ALA 119 -1.172 -35.123 -11.123 845 H ASN 120 H ASN 120 0.984 -36.413 -14.545 846 HA ASN 120 HA ASN 120 -1.627 -37.385 -15.225 847 HB2 ASN 120 1HB ASN 120 -1.771 -36.487 -17.460 848 HB3 ASN 120 2HB ASN 120 -1.594 -35.146 -16.332 849 HD21 ASN 120 1HD2 ASN 120 0.246 -33.912 -16.367 850 HD22 ASN 120 2HD2 ASN 120 1.435 -34.030 -17.615 851 H GLU 121 H GLU 121 -1.399 -39.413 -15.899 852 HA GLU 121 HA GLU 121 1.201 -40.219 -17.026 853 HB2 GLU 121 1HB GLU 121 0.753 -41.243 -14.852 854 HB3 GLU 121 2HB GLU 121 -0.784 -41.859 -15.443 855 HG2 GLU 121 1HG GLU 121 0.786 -43.646 -15.449 856 HG3 GLU 121 2HG GLU 121 0.460 -43.197 -17.122 857 H THR 122 H THR 122 1.164 -40.722 -19.104 858 HA THR 122 HA THR 122 -1.247 -41.984 -20.220 859 HB THR 122 HB THR 122 -0.928 -40.705 -22.316 860 HG1 THR 122 1HG THR 122 0.980 -39.263 -20.761 861 HG21 THR 122 3HG2 THR 122 -1.972 -39.761 -19.853 862 HG22 THR 122 1HG2 THR 122 -2.472 -39.330 -21.488 863 HG23 THR 122 2HG2 THR 122 -1.217 -38.395 -20.674 864 H SER 123 H SER 123 -0.789 -43.873 -21.122 865 HA SER 123 HA SER 123 1.832 -44.857 -21.411 866 HB2 SER 123 1HB SER 123 -0.885 -45.812 -22.211 867 HB3 SER 123 2HB SER 123 0.527 -46.616 -22.898 868 HG SER 123 HG SER 123 0.668 -47.640 -21.082 869 H SER 124 H SER 124 3.093 -45.257 -23.226 870 HA SER 124 HA SER 124 2.232 -44.362 -25.835 871 HB2 SER 124 1HB SER 124 4.233 -42.835 -24.199 872 HB3 SER 124 2HB SER 124 4.378 -42.875 -25.956 873 HG SER 124 HG SER 124 3.049 -41.138 -24.871 874 H ILE 125 H ILE 125 4.156 -44.546 -27.421 875 HA ILE 125 HA ILE 125 5.338 -46.219 -28.502 876 HB ILE 125 HB ILE 125 7.610 -46.439 -27.583 877 HG12 ILE 125 1HG1 ILE 125 6.802 -44.664 -25.300 878 HG13 ILE 125 2HG1 ILE 125 6.661 -46.412 -25.155 879 HG21 ILE 125 1HG2 ILE 125 6.239 -43.911 -28.083 880 HG22 ILE 125 2HG2 ILE 125 7.740 -43.734 -27.176 881 HG23 ILE 125 3HG2 ILE 125 7.749 -44.534 -28.747 882 HD11 ILE 125 3HD1 ILE 125 9.004 -46.697 -25.460 883 HD12 ILE 125 1HD1 ILE 125 9.211 -44.996 -25.878 884 HD13 ILE 125 2HD1 ILE 125 8.762 -45.452 -24.235 Start of MODEL 18 1 H1 GLY 1 H GLY 1 -25.674 24.526 -35.974 2 HA2 GLY 1 1HA GLY 1 -24.354 23.066 -33.911 3 HA3 GLY 1 2HA GLY 1 -24.268 22.210 -35.443 4 H SER 2 H SER 2 -22.677 24.327 -33.493 5 HA SER 2 HA SER 2 -20.772 24.976 -35.544 6 HB2 SER 2 1HB SER 2 -22.513 26.767 -35.800 7 HB3 SER 2 2HB SER 2 -22.157 27.276 -34.149 8 HG SER 2 HG SER 2 -20.534 27.417 -36.445 9 H SER 3 H SER 3 -18.910 26.234 -34.625 10 HA SER 3 HA SER 3 -18.642 25.891 -31.722 11 HB2 SER 3 1HB SER 3 -16.995 24.631 -33.864 12 HB3 SER 3 2HB SER 3 -16.163 25.195 -32.415 13 HG SER 3 HG SER 3 -18.376 23.417 -32.472 14 H GLY 4 H GLY 4 -18.024 27.735 -30.824 15 HA2 GLY 4 1HA GLY 4 -16.014 29.390 -32.145 16 HA3 GLY 4 2HA GLY 4 -17.579 30.135 -31.855 17 H SER 5 H SER 5 -15.684 27.906 -29.839 18 HA SER 5 HA SER 5 -16.251 29.198 -27.434 19 HB2 SER 5 1HB SER 5 -14.336 27.907 -26.511 20 HB3 SER 5 2HB SER 5 -15.419 26.912 -27.485 21 HG SER 5 HG SER 5 -13.040 26.744 -27.851 22 H SER 6 H SER 6 -14.666 30.265 -25.979 23 HA SER 6 HA SER 6 -13.230 32.334 -27.469 24 HB2 SER 6 1HB SER 6 -14.958 32.836 -25.625 25 HB3 SER 6 2HB SER 6 -13.705 32.327 -24.493 26 HG SER 6 HG SER 6 -13.102 34.228 -26.471 27 H GLY 7 H GLY 7 -12.733 30.103 -24.743 28 HA2 GLY 7 1HA GLY 7 -10.426 28.959 -25.146 29 HA3 GLY 7 2HA GLY 7 -9.844 30.600 -24.906 30 H PHE 8 H PHE 8 -11.433 27.867 -23.382 31 HA PHE 8 HA PHE 8 -11.629 29.013 -20.794 32 HB2 PHE 8 1HB PHE 8 -11.495 26.089 -21.563 33 HB3 PHE 8 2HB PHE 8 -12.068 26.733 -20.027 34 HD1 PHE 8 2HD PHE 8 -14.123 28.217 -20.046 35 HD2 PHE 8 1HD PHE 8 -12.944 25.832 -23.369 36 HE1 PHE 8 2HE PHE 8 -16.403 28.368 -20.959 37 HE2 PHE 8 1HE PHE 8 -15.222 25.981 -24.288 38 HZ PHE 8 HZ PHE 8 -16.955 27.249 -23.082 39 H LYS 9 H LYS 9 -9.762 29.854 -20.009 40 HA LYS 9 HA LYS 9 -7.220 28.623 -20.260 41 HB2 LYS 9 1HB LYS 9 -8.334 30.913 -18.703 42 HB3 LYS 9 2HB LYS 9 -6.765 30.269 -18.235 43 HG2 LYS 9 1HG LYS 9 -6.096 30.562 -20.672 44 HG3 LYS 9 2HG LYS 9 -7.562 31.531 -20.837 45 HD2 LYS 9 1HD LYS 9 -5.659 32.132 -18.617 46 HD3 LYS 9 2HD LYS 9 -5.269 32.663 -20.254 47 HE2 LYS 9 1HE LYS 9 -7.926 33.242 -18.976 48 HE3 LYS 9 2HE LYS 9 -6.532 34.298 -18.753 49 HZ1 LYS 9 3HZ LYS 9 -6.986 33.639 -21.502 50 HZ2 LYS 9 1HZ LYS 9 -6.793 35.154 -20.774 51 HZ3 LYS 9 2HZ LYS 9 -8.315 34.419 -20.805 52 H VAL 10 H VAL 10 -6.487 26.894 -19.232 53 HA VAL 10 HA VAL 10 -7.411 26.378 -16.486 54 HB VAL 10 HB VAL 10 -7.094 24.306 -18.662 55 HG11 VAL 10 1HG1 VAL 10 -7.174 24.113 -15.726 56 HG12 VAL 10 2HG1 VAL 10 -8.228 22.994 -16.593 57 HG13 VAL 10 3HG1 VAL 10 -6.494 23.008 -16.920 58 HG21 VAL 10 3HG2 VAL 10 -9.323 25.877 -17.799 59 HG22 VAL 10 1HG2 VAL 10 -9.246 24.662 -19.075 60 HG23 VAL 10 2HG2 VAL 10 -9.621 24.180 -17.421 61 H ARG 11 H ARG 11 -5.768 26.270 -15.115 62 HA ARG 11 HA ARG 11 -3.108 25.560 -16.159 63 HB2 ARG 11 1HB ARG 11 -3.656 27.890 -15.066 64 HB3 ARG 11 2HB ARG 11 -3.487 26.995 -13.562 65 HG2 ARG 11 1HG ARG 11 -1.236 26.570 -13.918 66 HG3 ARG 11 2HG ARG 11 -1.355 26.866 -15.654 67 HD2 ARG 11 1HD ARG 11 -1.904 29.063 -13.697 68 HD3 ARG 11 2HD ARG 11 -0.245 28.646 -14.127 69 HE ARG 11 HE ARG 11 -1.972 29.086 -16.388 70 HH11 ARG 11 1HH1 ARG 11 0.166 30.560 -14.070 71 HH12 ARG 11 2HH1 ARG 11 0.525 31.925 -15.074 72 HH21 ARG 11 1HH2 ARG 11 -1.508 30.879 -17.719 73 HH22 ARG 11 2HH2 ARG 11 -0.428 32.106 -17.149 74 H VAL 12 H VAL 12 -2.684 23.494 -15.724 75 HA VAL 12 HA VAL 12 -3.665 22.294 -13.246 76 HB VAL 12 HB VAL 12 -4.101 20.893 -15.084 77 HG11 VAL 12 1HG1 VAL 12 -2.901 21.636 -16.888 78 HG12 VAL 12 2HG1 VAL 12 -1.385 21.712 -15.989 79 HG13 VAL 12 3HG1 VAL 12 -2.023 20.154 -16.514 80 HG21 VAL 12 3HG2 VAL 12 -1.559 19.902 -13.795 81 HG22 VAL 12 1HG2 VAL 12 -3.197 19.688 -13.175 82 HG23 VAL 12 2HG2 VAL 12 -2.714 18.906 -14.680 83 H GLY 13 H GLY 13 -2.354 22.859 -11.587 84 HA2 GLY 13 1HA GLY 13 -0.505 22.712 -10.222 85 HA3 GLY 13 2HA GLY 13 0.226 21.658 -11.423 86 H GLU 14 H GLU 14 0.790 24.366 -9.801 87 HA GLU 14 HA GLU 14 1.867 25.911 -12.036 88 HB2 GLU 14 1HB GLU 14 1.343 26.499 -9.144 89 HB3 GLU 14 2HB GLU 14 2.474 27.495 -10.049 90 HG2 GLU 14 1HG GLU 14 0.613 27.820 -11.738 91 HG3 GLU 14 2HG GLU 14 -0.461 27.111 -10.533 92 HA PRO 15 HA PRO 15 6.045 24.704 -11.461 93 HB2 PRO 15 1HB PRO 15 7.371 27.028 -11.920 94 HB3 PRO 15 2HB PRO 15 6.580 26.105 -13.203 95 HG2 PRO 15 1HG PRO 15 5.604 28.522 -11.730 96 HG3 PRO 15 2HG PRO 15 5.514 28.156 -13.463 97 HD2 PRO 15 1HD PRO 15 3.409 27.825 -11.793 98 HD3 PRO 15 2HD PRO 15 3.679 26.785 -13.206 99 H GLY 16 H GLY 16 7.244 24.310 -9.708 100 HA2 GLY 16 1HA GLY 16 8.399 26.117 -7.989 101 HA3 GLY 16 2HA GLY 16 6.827 25.774 -7.284 102 H GLN 17 H GLN 17 9.293 25.193 -6.041 103 HA GLN 17 HA GLN 17 9.656 22.314 -6.321 104 HB2 GLN 17 1HB GLN 17 11.505 22.632 -4.699 105 HB3 GLN 17 2HB GLN 17 11.673 23.630 -6.136 106 HG2 GLN 17 1HG GLN 17 10.371 24.755 -3.701 107 HG3 GLN 17 2HG GLN 17 12.128 24.630 -3.782 108 HE21 GLN 17 1HE2 GLN 17 10.130 26.911 -3.832 109 HE22 GLN 17 2HE2 GLN 17 10.626 27.870 -5.180 110 H ALA 18 H ALA 18 7.498 24.179 -4.792 111 HA ALA 18 HA ALA 18 7.510 22.829 -2.219 112 HB1 ALA 18 3HB ALA 18 5.609 24.872 -3.361 113 HB2 ALA 18 1HB ALA 18 5.574 24.252 -1.710 114 HB3 ALA 18 2HB ALA 18 6.958 25.191 -2.271 115 H GLY 19 H GLY 19 6.236 21.161 -1.648 116 HA2 GLY 19 1HA GLY 19 4.068 20.379 -3.487 117 HA3 GLY 19 2HA GLY 19 5.256 19.195 -2.961 118 H ASN 20 H ASN 20 2.457 18.977 -2.565 119 HA ASN 20 HA ASN 20 2.381 19.007 0.375 120 HB2 ASN 20 1HB ASN 20 0.962 20.826 -0.405 121 HB3 ASN 20 2HB ASN 20 0.112 19.731 -1.491 122 HD21 ASN 20 1HD2 ASN 20 -1.515 21.008 0.025 123 HD22 ASN 20 2HD2 ASN 20 -2.078 20.078 1.368 124 HA PRO 21 HA PRO 21 1.676 14.680 -0.577 125 HB2 PRO 21 1HB PRO 21 1.881 13.837 1.996 126 HB3 PRO 21 2HB PRO 21 3.287 14.210 0.992 127 HG2 PRO 21 1HG PRO 21 1.943 15.895 3.069 128 HG3 PRO 21 2HG PRO 21 3.674 15.645 2.781 129 HD2 PRO 21 1HD PRO 21 2.359 17.852 1.927 130 HD3 PRO 21 2HD PRO 21 3.731 17.155 1.041 131 H ALA 22 H ALA 22 -0.005 16.660 1.786 132 HA ALA 22 HA ALA 22 -2.039 14.913 2.543 133 HB1 ALA 22 3HB ALA 22 -3.121 16.746 3.443 134 HB2 ALA 22 1HB ALA 22 -1.445 17.293 3.389 135 HB3 ALA 22 2HB ALA 22 -2.588 17.826 2.155 136 H LEU 23 H LEU 23 -1.655 16.843 -0.356 137 HA LEU 23 HA LEU 23 -4.343 16.404 -1.281 138 HB2 LEU 23 1HB LEU 23 -1.891 17.442 -2.694 139 HB3 LEU 23 2HB LEU 23 -3.512 17.411 -3.386 140 HG LEU 23 HG LEU 23 -2.789 18.954 -0.900 141 HD11 LEU 23 1HD1 LEU 23 -3.168 20.143 -3.627 142 HD12 LEU 23 2HD1 LEU 23 -1.580 19.640 -3.048 143 HD13 LEU 23 3HD1 LEU 23 -2.482 20.882 -2.179 144 HD21 LEU 23 3HD2 LEU 23 -4.892 20.181 -1.552 145 HD22 LEU 23 1HD2 LEU 23 -5.118 18.527 -0.982 146 HD23 LEU 23 2HD2 LEU 23 -5.195 18.883 -2.708 147 H VAL 24 H VAL 24 -1.375 14.691 -1.401 148 HA VAL 24 HA VAL 24 -1.718 13.233 -3.785 149 HB VAL 24 HB VAL 24 -0.291 12.388 -1.259 150 HG11 VAL 24 1HG1 VAL 24 -0.943 10.779 -3.342 151 HG12 VAL 24 2HG1 VAL 24 0.626 11.394 -3.866 152 HG13 VAL 24 3HG1 VAL 24 0.476 10.560 -2.319 153 HG21 VAL 24 3HG2 VAL 24 1.703 13.279 -2.245 154 HG22 VAL 24 1HG2 VAL 24 0.851 13.660 -3.741 155 HG23 VAL 24 2HG2 VAL 24 0.473 14.542 -2.261 156 H SER 25 H SER 25 -2.832 11.424 -4.280 157 HA SER 25 HA SER 25 -4.248 10.022 -2.120 158 HB2 SER 25 1HB SER 25 -5.462 10.953 -4.732 159 HB3 SER 25 2HB SER 25 -6.256 9.872 -3.588 160 HG SER 25 HG SER 25 -5.264 12.314 -2.651 161 H ALA 26 H ALA 26 -4.991 7.861 -2.728 162 HA ALA 26 HA ALA 26 -3.507 6.693 -4.981 163 HB1 ALA 26 3HB ALA 26 -3.246 6.065 -2.120 164 HB2 ALA 26 1HB ALA 26 -3.393 4.671 -3.191 165 HB3 ALA 26 2HB ALA 26 -2.100 5.845 -3.443 166 H TYR 27 H TYR 27 -4.645 5.294 -6.187 167 HA TYR 27 HA TYR 27 -7.019 4.009 -5.083 168 HB2 TYR 27 1HB TYR 27 -8.454 4.746 -6.905 169 HB3 TYR 27 2HB TYR 27 -7.814 6.143 -6.045 170 HD1 TYR 27 1HD TYR 27 -5.776 7.323 -7.066 171 HD2 TYR 27 2HD TYR 27 -8.196 4.565 -9.220 172 HE1 TYR 27 1HE TYR 27 -4.933 8.247 -9.184 173 HE2 TYR 27 2HE TYR 27 -7.359 5.480 -11.344 174 HH TYR 27 HH TYR 27 -5.400 8.359 -11.459 175 H GLY 28 H GLY 28 -7.865 2.300 -6.481 176 HA2 GLY 28 1HA GLY 28 -6.921 1.375 -8.852 177 HA3 GLY 28 2HA GLY 28 -5.702 0.838 -7.706 178 H THR 29 H THR 29 -6.437 -1.291 -8.569 179 HA THR 29 HA THR 29 -8.935 -2.209 -7.325 180 HB THR 29 HB THR 29 -7.289 -3.793 -9.288 181 HG1 THR 29 1HG THR 29 -7.830 -2.306 -10.698 182 HG21 THR 29 3HG2 THR 29 -8.851 -5.298 -8.709 183 HG22 THR 29 1HG2 THR 29 -9.949 -4.331 -9.693 184 HG23 THR 29 2HG2 THR 29 -9.874 -4.079 -7.949 185 H GLY 30 H GLY 30 -5.564 -2.299 -6.958 186 HA2 GLY 30 1HA GLY 30 -5.372 -4.883 -5.718 187 HA3 GLY 30 2HA GLY 30 -4.135 -3.634 -5.725 188 H LEU 31 H LEU 31 -6.075 -1.655 -4.623 189 HA LEU 31 HA LEU 31 -5.536 -2.165 -1.858 190 HB2 LEU 31 1HB LEU 31 -7.178 0.002 -3.161 191 HB3 LEU 31 2HB LEU 31 -6.677 -0.025 -1.471 192 HG LEU 31 HG LEU 31 -4.775 0.104 -3.809 193 HD11 LEU 31 1HD1 LEU 31 -4.618 2.411 -3.529 194 HD12 LEU 31 2HD1 LEU 31 -5.434 2.374 -1.967 195 HD13 LEU 31 3HD1 LEU 31 -6.351 2.096 -3.447 196 HD21 LEU 31 3HD2 LEU 31 -4.449 -0.357 -0.983 197 HD22 LEU 31 1HD2 LEU 31 -3.622 1.120 -1.480 198 HD23 LEU 31 2HD2 LEU 31 -3.250 -0.409 -2.277 199 H GLU 32 H GLU 32 -8.213 -2.674 -3.982 200 HA GLU 32 HA GLU 32 -10.354 -2.681 -2.203 201 HB2 GLU 32 1HB GLU 32 -9.931 -4.496 -4.585 202 HB3 GLU 32 2HB GLU 32 -11.470 -4.174 -3.799 203 HG2 GLU 32 1HG GLU 32 -11.053 -1.724 -4.368 204 HG3 GLU 32 2HG GLU 32 -9.788 -2.318 -5.443 205 H GLY 33 H GLY 33 -7.989 -5.202 -2.932 206 HA2 GLY 33 1HA GLY 33 -8.145 -6.404 -0.411 207 HA3 GLY 33 2HA GLY 33 -9.222 -7.285 -1.484 208 H GLY 34 H GLY 34 -7.604 -9.002 -0.793 209 HA2 GLY 34 1HA GLY 34 -5.191 -8.897 -2.485 210 HA3 GLY 34 2HA GLY 34 -5.375 -9.902 -1.055 211 H THR 35 H THR 35 -5.693 -9.727 -4.433 212 HA THR 35 HA THR 35 -7.323 -12.152 -4.577 213 HB THR 35 HB THR 35 -6.850 -11.646 -7.156 214 HG1 THR 35 1HG THR 35 -6.157 -9.673 -7.515 215 HG21 THR 35 3HG2 THR 35 -9.023 -11.612 -5.743 216 HG22 THR 35 1HG2 THR 35 -8.988 -10.733 -7.270 217 HG23 THR 35 2HG2 THR 35 -8.805 -9.862 -5.747 218 H THR 36 H THR 36 -6.161 -13.946 -4.231 219 HA THR 36 HA THR 36 -3.402 -14.183 -4.960 220 HB THR 36 HB THR 36 -5.106 -16.561 -4.310 221 HG1 THR 36 1HG THR 36 -4.568 -14.359 -2.672 222 HG21 THR 36 3HG2 THR 36 -3.157 -17.530 -3.660 223 HG22 THR 36 1HG2 THR 36 -2.489 -16.023 -3.034 224 HG23 THR 36 2HG2 THR 36 -2.471 -16.343 -4.769 225 H GLY 37 H GLY 37 -2.763 -14.422 -7.000 226 HA2 GLY 37 1HA GLY 37 -2.587 -16.076 -8.810 227 HA3 GLY 37 2HA GLY 37 -4.337 -16.225 -8.734 228 H ILE 38 H ILE 38 -4.372 -13.181 -8.327 229 HA ILE 38 HA ILE 38 -4.186 -12.534 -11.192 230 HB ILE 38 HB ILE 38 -5.804 -11.080 -9.100 231 HG12 ILE 38 1HG1 ILE 38 -6.853 -13.003 -11.177 232 HG13 ILE 38 2HG1 ILE 38 -6.487 -13.493 -9.526 233 HG21 ILE 38 1HG2 ILE 38 -6.980 -10.196 -11.123 234 HG22 ILE 38 2HG2 ILE 38 -5.307 -9.667 -10.954 235 HG23 ILE 38 3HG2 ILE 38 -5.718 -10.937 -12.106 236 HD11 ILE 38 3HD1 ILE 38 -8.909 -12.758 -10.282 237 HD12 ILE 38 1HD1 ILE 38 -8.289 -12.423 -8.665 238 HD13 ILE 38 2HD1 ILE 38 -8.270 -11.160 -9.897 239 H GLN 39 H GLN 39 -3.646 -10.263 -11.714 240 HA GLN 39 HA GLN 39 -1.627 -9.217 -9.840 241 HB2 GLN 39 1HB GLN 39 -0.457 -9.921 -11.755 242 HB3 GLN 39 2HB GLN 39 -1.696 -9.312 -12.844 243 HG2 GLN 39 1HG GLN 39 -1.074 -7.026 -12.303 244 HG3 GLN 39 2HG GLN 39 0.142 -7.615 -11.171 245 HE21 GLN 39 1HE2 GLN 39 -0.827 -7.852 -14.567 246 HE22 GLN 39 2HE2 GLN 39 0.778 -7.941 -15.200 247 H SER 40 H SER 40 -2.526 -7.563 -8.780 248 HA SER 40 HA SER 40 -4.344 -5.753 -10.170 249 HB2 SER 40 1HB SER 40 -4.643 -4.764 -7.867 250 HB3 SER 40 2HB SER 40 -5.113 -6.457 -8.009 251 HG SER 40 HG SER 40 -3.877 -6.329 -6.198 252 H GLU 41 H GLU 41 -4.087 -3.399 -9.845 253 HA GLU 41 HA GLU 41 -1.365 -2.482 -9.368 254 HB2 GLU 41 1HB GLU 41 -1.451 -1.150 -11.528 255 HB3 GLU 41 2HB GLU 41 -1.185 -2.880 -11.692 256 HG2 GLU 41 1HG GLU 41 -3.672 -3.090 -12.088 257 HG3 GLU 41 2HG GLU 41 -3.699 -1.333 -12.231 258 H PHE 42 H PHE 42 -1.343 -0.581 -8.345 259 HA PHE 42 HA PHE 42 -3.783 1.068 -8.427 260 HB2 PHE 42 1HB PHE 42 -3.641 1.504 -6.112 261 HB3 PHE 42 2HB PHE 42 -3.357 -0.227 -6.260 262 HD1 PHE 42 1HD PHE 42 -1.771 3.033 -5.642 263 HD2 PHE 42 2HD PHE 42 -1.271 -1.194 -5.654 264 HE1 PHE 42 1HE PHE 42 0.348 3.283 -4.417 265 HE2 PHE 42 2HE PHE 42 0.848 -0.951 -4.428 266 HZ PHE 42 HZ PHE 42 1.660 1.290 -3.808 267 H PHE 43 H PHE 43 -3.449 3.031 -9.212 268 HA PHE 43 HA PHE 43 -0.731 4.040 -9.455 269 HB2 PHE 43 1HB PHE 43 -3.277 5.300 -10.483 270 HB3 PHE 43 2HB PHE 43 -1.629 5.654 -10.992 271 HD1 PHE 43 2HD PHE 43 -4.304 3.116 -11.069 272 HD2 PHE 43 1HD PHE 43 -0.553 4.362 -12.649 273 HE1 PHE 43 2HE PHE 43 -4.501 1.433 -12.853 274 HE2 PHE 43 1HE PHE 43 -0.744 2.682 -14.436 275 HZ PHE 43 HZ PHE 43 -2.719 1.214 -14.540 276 H ILE 44 H ILE 44 -0.013 5.992 -8.618 277 HA ILE 44 HA ILE 44 -1.526 6.944 -6.298 278 HB ILE 44 HB ILE 44 1.294 7.731 -6.987 279 HG12 ILE 44 1HG1 ILE 44 0.564 5.424 -5.188 280 HG13 ILE 44 2HG1 ILE 44 0.926 5.197 -6.896 281 HG21 ILE 44 1HG2 ILE 44 -0.420 7.794 -4.532 282 HG22 ILE 44 2HG2 ILE 44 1.339 7.825 -4.413 283 HG23 ILE 44 3HG2 ILE 44 0.492 9.101 -5.287 284 HD11 ILE 44 3HD1 ILE 44 3.082 6.600 -6.179 285 HD12 ILE 44 1HD1 ILE 44 2.717 5.819 -4.641 286 HD13 ILE 44 2HD1 ILE 44 2.995 4.842 -6.082 287 H ASN 45 H ASN 45 -2.879 8.556 -6.774 288 HA ASN 45 HA ASN 45 -2.684 10.303 -8.943 289 HB2 ASN 45 1HB ASN 45 -4.665 9.783 -7.296 290 HB3 ASN 45 2HB ASN 45 -4.032 11.170 -6.412 291 HD21 ASN 45 1HD2 ASN 45 -5.172 12.904 -6.841 292 HD22 ASN 45 2HD2 ASN 45 -5.784 13.368 -8.389 293 H THR 46 H THR 46 -0.632 11.195 -9.095 294 HA THR 46 HA THR 46 -0.053 13.296 -7.116 295 HB THR 46 HB THR 46 2.436 12.795 -7.852 296 HG1 THR 46 1HG THR 46 2.771 10.812 -8.598 297 HG21 THR 46 3HG2 THR 46 1.082 12.473 -5.575 298 HG22 THR 46 1HG2 THR 46 2.744 11.916 -5.770 299 HG23 THR 46 2HG2 THR 46 1.407 10.777 -5.934 300 H THR 47 H THR 47 -1.484 13.991 -9.249 301 HA THR 47 HA THR 47 0.440 15.140 -11.162 302 HB THR 47 HB THR 47 -1.513 15.433 -12.684 303 HG1 THR 47 1HG THR 47 -2.839 13.872 -10.698 304 HG21 THR 47 3HG2 THR 47 -0.906 13.487 -13.585 305 HG22 THR 47 1HG2 THR 47 -1.759 12.592 -12.329 306 HG23 THR 47 2HG2 THR 47 -0.086 13.088 -12.077 307 H ARG 48 H ARG 48 -1.444 15.899 -8.530 308 HA ARG 48 HA ARG 48 -1.446 18.744 -9.275 309 HB2 ARG 48 1HB ARG 48 -3.559 18.834 -7.742 310 HB3 ARG 48 2HB ARG 48 -3.718 18.342 -9.423 311 HG2 ARG 48 1HG ARG 48 -4.941 16.701 -8.454 312 HG3 ARG 48 2HG ARG 48 -3.350 15.941 -8.364 313 HD2 ARG 48 1HD ARG 48 -4.301 15.674 -6.226 314 HD3 ARG 48 2HD ARG 48 -3.137 16.989 -6.066 315 HE ARG 48 HE ARG 48 -4.872 18.449 -5.668 316 HH11 ARG 48 1HH1 ARG 48 -6.123 15.392 -6.767 317 HH12 ARG 48 2HH1 ARG 48 -7.768 15.779 -6.382 318 HH21 ARG 48 1HH2 ARG 48 -7.034 18.970 -5.157 319 HH22 ARG 48 2HH2 ARG 48 -8.285 17.815 -5.467 320 H ALA 49 H ALA 49 -0.265 16.445 -7.267 321 HA ALA 49 HA ALA 49 -0.295 18.041 -4.830 322 HB1 ALA 49 3HB ALA 49 -0.505 15.888 -4.149 323 HB2 ALA 49 1HB ALA 49 0.402 15.248 -5.520 324 HB3 ALA 49 2HB ALA 49 1.256 15.979 -4.160 325 H GLY 50 H GLY 50 2.023 16.829 -7.225 326 HA2 GLY 50 1HA GLY 50 3.743 18.611 -7.773 327 HA3 GLY 50 2HA GLY 50 4.056 18.614 -6.043 328 HA PRO 51 HA PRO 51 6.635 15.386 -8.422 329 HB2 PRO 51 1HB PRO 51 9.004 16.713 -8.467 330 HB3 PRO 51 2HB PRO 51 7.810 16.833 -9.766 331 HG2 PRO 51 1HG PRO 51 8.339 18.716 -7.500 332 HG3 PRO 51 2HG PRO 51 8.029 19.079 -9.208 333 HD2 PRO 51 1HD PRO 51 6.118 19.295 -7.302 334 HD3 PRO 51 2HD PRO 51 5.749 18.833 -8.976 335 H GLY 52 H GLY 52 8.941 14.638 -7.601 336 HA2 GLY 52 1HA GLY 52 10.337 14.851 -5.491 337 HA3 GLY 52 2HA GLY 52 8.802 14.685 -4.652 338 H THR 53 H THR 53 10.980 12.979 -4.223 339 HA THR 53 HA THR 53 10.565 10.544 -5.715 340 HB THR 53 HB THR 53 12.129 10.708 -3.154 341 HG1 THR 53 1HG THR 53 13.841 11.572 -4.273 342 HG21 THR 53 3HG2 THR 53 12.118 8.517 -3.918 343 HG22 THR 53 1HG2 THR 53 13.597 9.152 -4.638 344 HG23 THR 53 2HG2 THR 53 12.136 9.001 -5.614 345 H LEU 54 H LEU 54 9.842 8.555 -4.829 346 HA LEU 54 HA LEU 54 8.245 8.789 -2.370 347 HB2 LEU 54 1HB LEU 54 6.427 7.621 -3.335 348 HB3 LEU 54 2HB LEU 54 6.851 8.926 -4.441 349 HG LEU 54 HG LEU 54 6.328 7.007 -5.748 350 HD11 LEU 54 1HD1 LEU 54 8.206 6.892 -7.095 351 HD12 LEU 54 2HD1 LEU 54 9.318 6.957 -5.728 352 HD13 LEU 54 3HD1 LEU 54 8.448 8.408 -6.226 353 HD21 LEU 54 3HD2 LEU 54 6.865 4.871 -5.262 354 HD22 LEU 54 1HD2 LEU 54 7.064 5.515 -3.631 355 HD23 LEU 54 2HD2 LEU 54 8.472 5.295 -4.671 356 H SER 55 H SER 55 7.748 6.704 -1.356 357 HA SER 55 HA SER 55 9.512 4.500 -2.110 358 HB2 SER 55 1HB SER 55 10.889 5.652 -0.530 359 HB3 SER 55 2HB SER 55 9.535 5.883 0.576 360 HG SER 55 HG SER 55 10.852 3.463 -0.082 361 H VAL 56 H VAL 56 8.478 2.620 -2.002 362 HA VAL 56 HA VAL 56 6.147 2.396 -0.211 363 HB VAL 56 HB VAL 56 5.035 0.986 -1.875 364 HG11 VAL 56 1HG1 VAL 56 4.368 2.718 -3.390 365 HG12 VAL 56 2HG1 VAL 56 4.679 3.453 -1.816 366 HG13 VAL 56 3HG1 VAL 56 5.866 3.605 -3.113 367 HG21 VAL 56 3HG2 VAL 56 5.895 0.756 -4.128 368 HG22 VAL 56 1HG2 VAL 56 7.313 1.720 -3.711 369 HG23 VAL 56 2HG2 VAL 56 7.075 0.136 -2.972 370 H THR 57 H THR 57 5.843 0.451 0.828 371 HA THR 57 HA THR 57 7.727 -1.724 0.301 372 HB THR 57 HB THR 57 7.331 -0.556 3.063 373 HG1 THR 57 1HG THR 57 9.636 -0.555 1.382 374 HG21 THR 57 3HG2 THR 57 8.323 -3.108 2.109 375 HG22 THR 57 1HG2 THR 57 7.958 -2.587 3.753 376 HG23 THR 57 2HG2 THR 57 9.538 -2.243 3.049 377 H ILE 58 H ILE 58 6.654 -3.577 0.196 378 HA ILE 58 HA ILE 58 4.025 -3.760 1.494 379 HB ILE 58 HB ILE 58 5.217 -5.334 -0.787 380 HG12 ILE 58 1HG1 ILE 58 2.928 -3.371 -0.574 381 HG13 ILE 58 2HG1 ILE 58 4.423 -3.172 -1.482 382 HG21 ILE 58 1HG2 ILE 58 2.519 -5.977 -0.576 383 HG22 ILE 58 2HG2 ILE 58 3.891 -7.018 -0.198 384 HG23 ILE 58 3HG2 ILE 58 3.134 -6.062 1.075 385 HD11 ILE 58 3HD1 ILE 58 3.136 -3.790 -3.208 386 HD12 ILE 58 1HD1 ILE 58 3.468 -5.418 -2.616 387 HD13 ILE 58 2HD1 ILE 58 1.962 -4.610 -2.179 388 H GLU 59 H GLU 59 3.592 -5.258 3.018 389 HA GLU 59 HA GLU 59 5.692 -7.229 3.636 390 HB2 GLU 59 1HB GLU 59 4.299 -5.289 5.415 391 HB3 GLU 59 2HB GLU 59 4.664 -6.880 6.068 392 HG2 GLU 59 1HG GLU 59 6.823 -5.366 4.695 393 HG3 GLU 59 2HG GLU 59 6.344 -4.888 6.323 394 H GLY 60 H GLY 60 5.030 -9.263 4.258 395 HA2 GLY 60 1HA GLY 60 2.401 -9.962 4.995 396 HA3 GLY 60 2HA GLY 60 2.591 -10.211 3.266 397 HA PRO 61 HA PRO 61 4.107 -13.928 5.752 398 HB2 PRO 61 1HB PRO 61 2.235 -15.690 4.879 399 HB3 PRO 61 2HB PRO 61 2.016 -14.692 6.321 400 HG2 PRO 61 1HG PRO 61 0.964 -14.273 3.550 401 HG3 PRO 61 2HG PRO 61 0.137 -14.064 5.104 402 HD2 PRO 61 1HD PRO 61 1.143 -11.980 3.698 403 HD3 PRO 61 2HD PRO 61 1.082 -11.994 5.472 404 H SER 62 H SER 62 3.078 -13.335 2.466 405 HA SER 62 HA SER 62 5.019 -15.344 1.525 406 HB2 SER 62 1HB SER 62 2.471 -15.570 0.968 407 HB3 SER 62 2HB SER 62 2.805 -14.306 -0.216 408 HG SER 62 HG SER 62 3.751 -16.943 -0.102 409 H LYS 63 H LYS 63 6.771 -13.922 1.534 410 HA LYS 63 HA LYS 63 7.087 -11.385 0.767 411 HB2 LYS 63 1HB LYS 63 9.291 -12.058 -0.280 412 HB3 LYS 63 2HB LYS 63 9.023 -12.622 1.364 413 HG2 LYS 63 1HG LYS 63 8.266 -14.413 -0.883 414 HG3 LYS 63 2HG LYS 63 9.977 -14.212 -0.498 415 HD2 LYS 63 1HD LYS 63 9.083 -14.630 1.965 416 HD3 LYS 63 2HD LYS 63 7.799 -15.467 1.089 417 HE2 LYS 63 1HE LYS 63 10.686 -15.999 0.483 418 HE3 LYS 63 2HE LYS 63 9.881 -16.803 1.829 419 HZ1 LYS 63 3HZ LYS 63 9.430 -17.103 -1.052 420 HZ2 LYS 63 1HZ LYS 63 8.120 -17.331 -0.006 421 HZ3 LYS 63 2HZ LYS 63 9.506 -18.285 0.155 422 H VAL 64 H VAL 64 5.639 -10.597 -0.729 423 HA VAL 64 HA VAL 64 5.448 -11.765 -3.366 424 HB VAL 64 HB VAL 64 4.031 -9.643 -3.779 425 HG11 VAL 64 1HG1 VAL 64 2.092 -10.666 -2.723 426 HG12 VAL 64 2HG1 VAL 64 3.120 -11.899 -3.456 427 HG13 VAL 64 3HG1 VAL 64 3.146 -11.652 -1.710 428 HG21 VAL 64 3HG2 VAL 64 3.370 -8.336 -1.994 429 HG22 VAL 64 1HG2 VAL 64 3.806 -9.560 -0.802 430 HG23 VAL 64 2HG2 VAL 64 5.066 -8.629 -1.612 431 H LYS 65 H LYS 65 5.729 -10.412 -5.320 432 HA LYS 65 HA LYS 65 8.183 -8.818 -5.083 433 HB2 LYS 65 1HB LYS 65 6.942 -10.275 -7.417 434 HB3 LYS 65 2HB LYS 65 8.319 -9.193 -7.582 435 HG2 LYS 65 1HG LYS 65 8.352 -11.540 -5.713 436 HG3 LYS 65 2HG LYS 65 8.804 -11.679 -7.414 437 HD2 LYS 65 1HD LYS 65 10.055 -9.612 -5.634 438 HD3 LYS 65 2HD LYS 65 10.665 -11.268 -5.682 439 HE2 LYS 65 1HE LYS 65 10.629 -10.857 -8.278 440 HE3 LYS 65 2HE LYS 65 10.694 -9.163 -7.794 441 HZ1 LYS 65 3HZ LYS 65 12.723 -11.235 -7.570 442 HZ2 LYS 65 1HZ LYS 65 12.617 -10.154 -6.272 443 HZ3 LYS 65 2HZ LYS 65 12.896 -9.573 -7.836 444 H MET 66 H MET 66 8.279 -6.726 -5.718 445 HA MET 66 HA MET 66 5.778 -5.526 -6.711 446 HB2 MET 66 1HB MET 66 7.958 -4.229 -5.065 447 HB3 MET 66 2HB MET 66 6.481 -3.448 -5.614 448 HG2 MET 66 1HG MET 66 5.139 -4.754 -4.190 449 HG3 MET 66 2HG MET 66 6.453 -5.880 -3.859 450 HE1 MET 66 3HE MET 66 5.993 -1.616 -2.276 451 HE2 MET 66 1HE MET 66 7.072 -1.790 -3.660 452 HE3 MET 66 2HE MET 66 5.382 -2.276 -3.794 453 H ASP 67 H ASP 67 5.820 -4.331 -8.533 454 HA ASP 67 HA ASP 67 8.420 -4.052 -9.883 455 HB2 ASP 67 1HB ASP 67 5.713 -3.915 -11.207 456 HB3 ASP 67 2HB ASP 67 7.282 -4.163 -11.968 457 H CYS 68 H CYS 68 8.824 -2.126 -11.116 458 HA CYS 68 HA CYS 68 7.256 0.205 -10.236 459 HB2 CYS 68 1HB CYS 68 10.262 -0.055 -10.399 460 HB3 CYS 68 2HB CYS 68 9.426 1.482 -10.213 461 HG CYS 68 HG CYS 68 10.109 1.152 -7.684 462 H GLN 69 H GLN 69 6.136 0.422 -12.147 463 HA GLN 69 HA GLN 69 7.730 0.827 -14.585 464 HB2 GLN 69 1HB GLN 69 4.806 0.156 -14.230 465 HB3 GLN 69 2HB GLN 69 5.552 0.517 -15.781 466 HG2 GLN 69 1HG GLN 69 6.655 -1.657 -14.059 467 HG3 GLN 69 2HG GLN 69 5.225 -1.943 -15.050 468 HE21 GLN 69 1HE2 GLN 69 5.422 -2.082 -17.248 469 HE22 GLN 69 2HE2 GLN 69 6.945 -2.141 -18.061 470 H GLU 70 H GLU 70 8.011 2.836 -15.269 471 HA GLU 70 HA GLU 70 6.800 5.061 -14.006 472 HB2 GLU 70 1HB GLU 70 8.589 4.693 -16.377 473 HB3 GLU 70 2HB GLU 70 7.829 6.256 -16.108 474 HG2 GLU 70 1HG GLU 70 9.789 6.571 -15.003 475 HG3 GLU 70 2HG GLU 70 8.795 5.949 -13.688 476 H THR 71 H THR 71 4.967 6.110 -14.429 477 HA THR 71 HA THR 71 3.614 5.586 -16.995 478 HB THR 71 HB THR 71 1.445 5.778 -15.792 479 HG1 THR 71 1HG THR 71 1.403 5.888 -13.601 480 HG21 THR 71 3HG2 THR 71 3.089 3.591 -16.023 481 HG22 THR 71 1HG2 THR 71 1.395 3.548 -15.537 482 HG23 THR 71 2HG2 THR 71 2.664 3.572 -14.312 483 HA PRO 72 HA PRO 72 3.325 9.938 -17.525 484 HB2 PRO 72 1HB PRO 72 1.022 10.121 -18.951 485 HB3 PRO 72 2HB PRO 72 2.529 9.499 -19.635 486 HG2 PRO 72 1HG PRO 72 0.168 7.995 -18.574 487 HG3 PRO 72 2HG PRO 72 1.125 7.689 -20.036 488 HD2 PRO 72 1HD PRO 72 1.475 6.287 -17.745 489 HD3 PRO 72 2HD PRO 72 2.808 6.635 -18.865 490 H GLU 73 H GLU 73 1.276 8.241 -15.525 491 HA GLU 73 HA GLU 73 -0.300 10.617 -14.813 492 HB2 GLU 73 1HB GLU 73 -1.414 8.365 -15.334 493 HB3 GLU 73 2HB GLU 73 -0.772 7.826 -13.789 494 HG2 GLU 73 1HG GLU 73 -2.920 8.493 -13.265 495 HG3 GLU 73 2HG GLU 73 -1.946 9.892 -12.815 496 H GLY 74 H GLY 74 1.883 8.171 -13.518 497 HA2 GLY 74 1HA GLY 74 3.097 9.812 -11.649 498 HA3 GLY 74 2HA GLY 74 1.751 9.050 -10.815 499 H TYR 75 H TYR 75 2.094 7.126 -9.912 500 HA TYR 75 HA TYR 75 4.314 5.479 -10.914 501 HB2 TYR 75 1HB TYR 75 3.730 6.107 -8.013 502 HB3 TYR 75 2HB TYR 75 4.910 4.925 -8.570 503 HD1 TYR 75 1HD TYR 75 6.277 6.266 -10.739 504 HD2 TYR 75 2HD TYR 75 4.890 7.860 -7.046 505 HE1 TYR 75 1HE TYR 75 7.988 8.029 -10.865 506 HE2 TYR 75 2HE TYR 75 6.596 9.628 -7.162 507 HH TYR 75 HH TYR 75 8.467 10.194 -10.001 508 H LYS 76 H LYS 76 3.655 3.506 -11.410 509 HA LYS 76 HA LYS 76 1.196 2.482 -10.159 510 HB2 LYS 76 1HB LYS 76 0.931 2.663 -12.528 511 HB3 LYS 76 2HB LYS 76 2.482 1.889 -12.824 512 HG2 LYS 76 1HG LYS 76 1.435 -0.144 -11.626 513 HG3 LYS 76 2HG LYS 76 -0.100 0.664 -11.950 514 HD2 LYS 76 1HD LYS 76 0.813 0.838 -14.381 515 HD3 LYS 76 2HD LYS 76 1.898 -0.459 -13.874 516 HE2 LYS 76 1HE LYS 76 -0.050 -1.802 -13.210 517 HE3 LYS 76 2HE LYS 76 -1.117 -0.511 -13.757 518 HZ1 LYS 76 3HZ LYS 76 -0.244 -2.589 -15.268 519 HZ2 LYS 76 1HZ LYS 76 0.772 -1.327 -15.755 520 HZ3 LYS 76 2HZ LYS 76 -0.907 -1.152 -15.865 521 H VAL 77 H VAL 77 1.352 0.827 -8.802 522 HA VAL 77 HA VAL 77 3.815 -0.792 -8.847 523 HB VAL 77 HB VAL 77 2.013 -0.115 -6.520 524 HG11 VAL 77 1HG1 VAL 77 4.317 -2.036 -6.735 525 HG12 VAL 77 2HG1 VAL 77 3.768 -1.370 -5.196 526 HG13 VAL 77 3HG1 VAL 77 2.677 -2.356 -6.172 527 HG21 VAL 77 3HG2 VAL 77 4.626 0.867 -7.496 528 HG22 VAL 77 1HG2 VAL 77 3.357 1.707 -6.605 529 HG23 VAL 77 2HG2 VAL 77 4.468 0.633 -5.755 530 H MET 78 H MET 78 3.672 -2.980 -8.913 531 HA MET 78 HA MET 78 0.968 -4.152 -8.919 532 HB2 MET 78 1HB MET 78 3.305 -4.836 -10.709 533 HB3 MET 78 2HB MET 78 1.819 -5.772 -10.619 534 HG2 MET 78 1HG MET 78 0.554 -4.096 -11.613 535 HG3 MET 78 2HG MET 78 1.758 -2.855 -11.272 536 HE1 MET 78 3HE MET 78 3.181 -2.009 -12.535 537 HE2 MET 78 1HE MET 78 4.454 -3.070 -13.139 538 HE3 MET 78 2HE MET 78 3.365 -2.269 -14.271 539 H TYR 79 H TYR 79 0.698 -6.117 -7.919 540 HA TYR 79 HA TYR 79 2.981 -7.585 -6.914 541 HB2 TYR 79 1HB TYR 79 2.461 -7.398 -4.590 542 HB3 TYR 79 2HB TYR 79 2.546 -5.760 -5.229 543 HD1 TYR 79 1HD TYR 79 0.343 -8.350 -3.872 544 HD2 TYR 79 2HD TYR 79 0.546 -4.391 -5.417 545 HE1 TYR 79 1HE TYR 79 -1.908 -7.897 -2.990 546 HE2 TYR 79 2HE TYR 79 -1.704 -3.927 -4.538 547 HH TYR 79 HH TYR 79 -3.257 -4.709 -2.946 548 H THR 80 H THR 80 2.531 -9.654 -7.206 549 HA THR 80 HA THR 80 -0.287 -10.506 -7.182 550 HB THR 80 HB THR 80 2.105 -11.664 -8.613 551 HG1 THR 80 1HG THR 80 0.539 -11.309 -10.407 552 HG21 THR 80 3HG2 THR 80 0.875 -13.548 -7.803 553 HG22 THR 80 1HG2 THR 80 0.466 -13.343 -9.506 554 HG23 THR 80 2HG2 THR 80 -0.662 -12.812 -8.258 555 HA PRO 81 HA PRO 81 1.092 -12.509 -3.371 556 HB2 PRO 81 1HB PRO 81 -1.421 -13.026 -2.483 557 HB3 PRO 81 2HB PRO 81 -0.645 -11.448 -2.305 558 HG2 PRO 81 1HG PRO 81 -2.631 -12.362 -4.349 559 HG3 PRO 81 2HG PRO 81 -2.564 -10.828 -3.462 560 HD2 PRO 81 1HD PRO 81 -1.693 -11.075 -6.015 561 HD3 PRO 81 2HD PRO 81 -0.956 -9.947 -4.859 562 H MET 82 H MET 82 1.615 -14.594 -3.166 563 HA MET 82 HA MET 82 0.372 -16.542 -4.941 564 HB2 MET 82 1HB MET 82 2.887 -16.305 -4.648 565 HB3 MET 82 2HB MET 82 2.675 -17.012 -3.051 566 HG2 MET 82 1HG MET 82 1.680 -19.008 -4.105 567 HG3 MET 82 2HG MET 82 2.007 -18.301 -5.686 568 HE1 MET 82 3HE MET 82 3.253 -19.874 -6.728 569 HE2 MET 82 1HE MET 82 4.548 -18.691 -6.913 570 HE3 MET 82 2HE MET 82 4.923 -20.337 -6.402 571 H ALA 83 H ALA 83 0.663 -15.798 -1.532 572 HA ALA 83 HA ALA 83 -1.270 -17.945 -0.963 573 HB1 ALA 83 3HB ALA 83 1.152 -18.346 -0.178 574 HB2 ALA 83 1HB ALA 83 0.793 -17.130 1.049 575 HB3 ALA 83 2HB ALA 83 -0.162 -18.612 0.968 576 HA PRO 84 HA PRO 84 -3.737 -14.778 0.839 577 HB2 PRO 84 1HB PRO 84 -5.242 -16.291 2.517 578 HB3 PRO 84 2HB PRO 84 -5.467 -16.288 0.764 579 HG2 PRO 84 1HG PRO 84 -4.001 -18.252 2.483 580 HG3 PRO 84 2HG PRO 84 -5.096 -18.556 1.122 581 HD2 PRO 84 1HD PRO 84 -2.402 -18.653 0.872 582 HD3 PRO 84 2HD PRO 84 -3.465 -18.130 -0.450 583 H GLY 85 H GLY 85 -4.501 -14.040 3.079 584 HA2 GLY 85 1HA GLY 85 -3.786 -14.491 5.526 585 HA3 GLY 85 2HA GLY 85 -2.183 -14.171 4.883 586 H ASN 86 H ASN 86 -1.614 -12.276 5.763 587 HA ASN 86 HA ASN 86 -3.424 -9.994 5.328 588 HB2 ASN 86 1HB ASN 86 -2.252 -9.074 7.474 589 HB3 ASN 86 2HB ASN 86 -3.579 -10.221 7.636 590 HD21 ASN 86 1HD2 ASN 86 -3.228 -12.124 8.611 591 HD22 ASN 86 2HD2 ASN 86 -1.695 -12.653 9.208 592 H TYR 87 H TYR 87 -2.556 -8.333 4.264 593 HA TYR 87 HA TYR 87 0.380 -8.223 4.024 594 HB2 TYR 87 1HB TYR 87 -1.762 -7.751 1.963 595 HB3 TYR 87 2HB TYR 87 -0.142 -7.091 1.770 596 HD1 TYR 87 1HD TYR 87 -1.654 -10.379 2.736 597 HD2 TYR 87 2HD TYR 87 1.245 -8.313 0.404 598 HE1 TYR 87 1HE TYR 87 -0.902 -12.519 1.785 599 HE2 TYR 87 2HE TYR 87 2.004 -10.447 -0.554 600 HH TYR 87 HH TYR 87 0.422 -13.508 0.295 601 H LEU 88 H LEU 88 1.298 -6.098 3.700 602 HA LEU 88 HA LEU 88 -0.410 -3.861 4.517 603 HB2 LEU 88 1HB LEU 88 0.988 -5.007 6.410 604 HB3 LEU 88 2HB LEU 88 2.323 -4.110 5.690 605 HG LEU 88 HG LEU 88 0.899 -2.027 6.023 606 HD11 LEU 88 1HD1 LEU 88 -1.097 -3.744 6.587 607 HD12 LEU 88 2HD1 LEU 88 -1.043 -2.078 7.161 608 HD13 LEU 88 3HD1 LEU 88 -0.517 -3.391 8.215 609 HD21 LEU 88 3HD2 LEU 88 1.345 -2.222 8.631 610 HD22 LEU 88 1HD2 LEU 88 2.659 -2.056 7.466 611 HD23 LEU 88 2HD2 LEU 88 2.249 -3.645 8.112 612 H ILE 89 H ILE 89 -0.136 -2.164 3.233 613 HA ILE 89 HA ILE 89 2.344 -1.996 1.652 614 HB ILE 89 HB ILE 89 -0.313 -0.751 0.952 615 HG12 ILE 89 1HG1 ILE 89 0.893 -3.261 -0.224 616 HG13 ILE 89 2HG1 ILE 89 -0.351 -3.273 1.022 617 HG21 ILE 89 1HG2 ILE 89 0.658 -0.422 -1.233 618 HG22 ILE 89 2HG2 ILE 89 1.705 0.298 -0.011 619 HG23 ILE 89 3HG2 ILE 89 2.134 -1.251 -0.737 620 HD11 ILE 89 3HD1 ILE 89 -1.854 -3.241 -0.597 621 HD12 ILE 89 1HD1 ILE 89 -1.332 -1.600 -0.978 622 HD13 ILE 89 2HD1 ILE 89 -0.611 -2.973 -1.819 623 H SER 90 H SER 90 3.650 -0.334 2.021 624 HA SER 90 HA SER 90 2.624 1.928 3.591 625 HB2 SER 90 1HB SER 90 5.453 0.928 3.196 626 HB3 SER 90 2HB SER 90 5.022 2.367 4.120 627 HG SER 90 HG SER 90 3.818 -0.102 4.721 628 H VAL 91 H VAL 91 3.176 4.068 3.017 629 HA VAL 91 HA VAL 91 4.352 4.495 0.376 630 HB VAL 91 HB VAL 91 1.637 5.573 1.150 631 HG11 VAL 91 1HG1 VAL 91 3.606 6.381 -0.868 632 HG12 VAL 91 2HG1 VAL 91 1.971 6.143 -1.489 633 HG13 VAL 91 3HG1 VAL 91 2.258 7.280 -0.171 634 HG21 VAL 91 3HG2 VAL 91 1.020 3.537 0.393 635 HG22 VAL 91 1HG2 VAL 91 1.266 4.283 -1.187 636 HG23 VAL 91 2HG2 VAL 91 2.533 3.283 -0.477 637 H LYS 92 H LYS 92 5.559 6.301 0.261 638 HA LYS 92 HA LYS 92 5.204 8.389 2.284 639 HB2 LYS 92 1HB LYS 92 7.796 6.957 1.687 640 HB3 LYS 92 2HB LYS 92 7.703 8.475 2.571 641 HG2 LYS 92 1HG LYS 92 6.474 7.448 4.343 642 HG3 LYS 92 2HG LYS 92 6.309 5.949 3.426 643 HD2 LYS 92 1HD LYS 92 9.021 7.044 4.069 644 HD3 LYS 92 2HD LYS 92 8.124 6.116 5.273 645 HE2 LYS 92 1HE LYS 92 7.891 4.298 3.570 646 HE3 LYS 92 2HE LYS 92 8.977 5.213 2.526 647 HZ1 LYS 92 3HZ LYS 92 9.999 4.827 5.185 648 HZ2 LYS 92 1HZ LYS 92 10.747 4.565 3.690 649 HZ3 LYS 92 2HZ LYS 92 9.745 3.375 4.355 650 H TYR 93 H TYR 93 5.193 10.339 1.386 651 HA TYR 93 HA TYR 93 6.622 10.727 -1.159 652 HB2 TYR 93 1HB TYR 93 3.979 10.577 -1.147 653 HB3 TYR 93 2HB TYR 93 4.111 12.251 -0.620 654 HD1 TYR 93 1HD TYR 93 5.643 10.039 -3.224 655 HD2 TYR 93 2HD TYR 93 3.982 13.840 -2.277 656 HE1 TYR 93 1HE TYR 93 5.940 10.745 -5.561 657 HE2 TYR 93 2HE TYR 93 4.273 14.556 -4.612 658 HH TYR 93 HH TYR 93 4.481 13.504 -6.848 659 H GLY 94 H GLY 94 7.657 12.676 -1.449 660 HA2 GLY 94 1HA GLY 94 8.903 14.466 -0.699 661 HA3 GLY 94 2HA GLY 94 7.336 15.063 -0.175 662 H GLY 95 H GLY 95 10.057 13.021 0.837 663 HA2 GLY 95 1HA GLY 95 11.156 13.100 2.895 664 HA3 GLY 95 2HA GLY 95 9.901 14.171 3.498 665 HA PRO 96 HA PRO 96 9.392 9.855 5.267 666 HB2 PRO 96 1HB PRO 96 9.589 10.588 7.874 667 HB3 PRO 96 2HB PRO 96 10.990 10.144 6.892 668 HG2 PRO 96 1HG PRO 96 9.961 12.864 7.605 669 HG3 PRO 96 2HG PRO 96 11.632 12.272 7.578 670 HD2 PRO 96 1HD PRO 96 10.583 13.764 5.577 671 HD3 PRO 96 2HD PRO 96 11.816 12.519 5.294 672 H ASN 97 H ASN 97 7.791 12.740 5.085 673 HA ASN 97 HA ASN 97 5.689 12.256 6.978 674 HB2 ASN 97 1HB ASN 97 5.724 14.154 4.621 675 HB3 ASN 97 2HB ASN 97 4.610 14.200 5.985 676 HD21 ASN 97 1HD2 ASN 97 7.167 15.696 4.734 677 HD22 ASN 97 2HD2 ASN 97 7.931 16.282 6.169 678 H HIS 98 H HIS 98 4.594 10.394 6.629 679 HA HIS 98 HA HIS 98 3.973 9.268 4.145 680 HB2 HIS 98 1HB HIS 98 2.471 7.816 5.333 681 HB3 HIS 98 2HB HIS 98 3.877 8.093 6.357 682 HD2 HIS 98 2HD HIS 98 3.129 10.612 8.074 683 HE1 HIS 98 1HE HIS 98 -0.656 8.808 8.722 684 HE2 HIS 98 2HE HIS 98 0.939 10.616 9.451 685 H ILE 99 H ILE 99 1.588 8.848 3.497 686 HA ILE 99 HA ILE 99 0.219 11.456 3.416 687 HB ILE 99 HB ILE 99 -0.772 10.731 1.282 688 HG12 ILE 99 1HG1 ILE 99 1.189 8.476 1.134 689 HG13 ILE 99 2HG1 ILE 99 -0.339 8.222 1.971 690 HG21 ILE 99 1HG2 ILE 99 2.021 10.319 0.601 691 HG22 ILE 99 2HG2 ILE 99 0.943 11.653 0.195 692 HG23 ILE 99 3HG2 ILE 99 1.790 11.644 1.742 693 HD11 ILE 99 3HD1 ILE 99 0.109 7.896 -0.712 694 HD12 ILE 99 1HD1 ILE 99 -1.467 8.061 0.063 695 HD13 ILE 99 2HD1 ILE 99 -0.671 9.475 -0.629 696 H VAL 100 H VAL 100 -2.173 11.296 3.060 697 HA VAL 100 HA VAL 100 -3.392 9.890 5.147 698 HB VAL 100 HB VAL 100 -4.235 11.944 3.783 699 HG11 VAL 100 1HG1 VAL 100 -4.301 10.561 1.656 700 HG12 VAL 100 2HG1 VAL 100 -5.743 9.792 2.322 701 HG13 VAL 100 3HG1 VAL 100 -5.733 11.528 2.011 702 HG21 VAL 100 3HG2 VAL 100 -6.155 9.809 4.712 703 HG22 VAL 100 1HG2 VAL 100 -5.348 10.988 5.747 704 HG23 VAL 100 2HG2 VAL 100 -6.513 11.527 4.538 705 H GLY 101 H GLY 101 -4.695 8.060 5.214 706 HA2 GLY 101 1HA GLY 101 -5.801 6.189 4.257 707 HA3 GLY 101 2HA GLY 101 -4.857 6.416 2.791 708 H SER 102 H SER 102 -2.298 6.593 3.964 709 HA SER 102 HA SER 102 -1.849 3.774 4.492 710 HB2 SER 102 1HB SER 102 -0.206 4.428 3.039 711 HB3 SER 102 2HB SER 102 -0.177 6.083 3.649 712 HG SER 102 HG SER 102 1.370 5.543 4.958 713 HA PRO 103 HA PRO 103 0.135 2.706 5.233 714 HB2 PRO 103 1HB PRO 103 -0.051 0.649 6.995 715 HB3 PRO 103 2HB PRO 103 1.296 1.795 6.994 716 HG2 PRO 103 1HG PRO 103 -1.137 1.733 8.736 717 HG3 PRO 103 2HG PRO 103 0.550 2.048 9.181 718 HD2 PRO 103 1HD PRO 103 -1.264 4.031 8.850 719 HD3 PRO 103 2HD PRO 103 0.459 4.240 8.475 720 H PHE 104 H PHE 104 -0.905 1.238 3.956 721 HA PHE 104 HA PHE 104 -3.787 1.033 4.291 722 HB2 PHE 104 1HB PHE 104 -1.960 0.190 2.033 723 HB3 PHE 104 2HB PHE 104 -3.712 0.009 2.014 724 HD1 PHE 104 2HD PHE 104 -5.007 2.270 2.603 725 HD2 PHE 104 1HD PHE 104 -1.079 2.020 0.982 726 HE1 PHE 104 2HE PHE 104 -5.233 4.552 1.712 727 HE2 PHE 104 1HE PHE 104 -1.298 4.303 0.090 728 HZ PHE 104 HZ PHE 104 -3.377 5.572 0.454 729 H LYS 105 H LYS 105 -4.742 -0.661 5.186 730 HA LYS 105 HA LYS 105 -3.207 -3.150 5.485 731 HB2 LYS 105 1HB LYS 105 -4.686 -3.675 7.346 732 HB3 LYS 105 2HB LYS 105 -3.961 -2.088 7.575 733 HG2 LYS 105 1HG LYS 105 -6.113 -1.163 6.546 734 HG3 LYS 105 2HG LYS 105 -6.782 -2.771 6.833 735 HD2 LYS 105 1HD LYS 105 -7.363 -1.485 8.726 736 HD3 LYS 105 2HD LYS 105 -6.018 -2.507 9.236 737 HE2 LYS 105 1HE LYS 105 -4.511 -0.732 9.236 738 HE3 LYS 105 2HE LYS 105 -5.531 0.258 8.192 739 HZ1 LYS 105 3HZ LYS 105 -7.143 0.330 10.088 740 HZ2 LYS 105 1HZ LYS 105 -5.686 1.148 10.358 741 HZ3 LYS 105 2HZ LYS 105 -5.947 -0.369 11.059 742 H ALA 106 H ALA 106 -3.651 -4.524 3.882 743 HA ALA 106 HA ALA 106 -6.462 -4.843 3.057 744 HB1 ALA 106 3HB ALA 106 -4.636 -4.071 1.379 745 HB2 ALA 106 1HB ALA 106 -4.172 -5.772 1.376 746 HB3 ALA 106 2HB ALA 106 -5.801 -5.302 0.890 747 H LYS 107 H LYS 107 -7.201 -6.986 2.575 748 HA LYS 107 HA LYS 107 -5.655 -9.101 3.926 749 HB2 LYS 107 1HB LYS 107 -7.558 -8.473 5.307 750 HB3 LYS 107 2HB LYS 107 -8.649 -8.678 3.943 751 HG2 LYS 107 1HG LYS 107 -8.988 -10.655 5.012 752 HG3 LYS 107 2HG LYS 107 -7.654 -11.119 3.954 753 HD2 LYS 107 1HD LYS 107 -6.982 -11.945 6.015 754 HD3 LYS 107 2HD LYS 107 -6.151 -10.390 5.934 755 HE2 LYS 107 1HE LYS 107 -7.040 -10.337 8.061 756 HE3 LYS 107 2HE LYS 107 -8.281 -9.497 7.133 757 HZ1 LYS 107 3HZ LYS 107 -8.368 -12.121 8.403 758 HZ2 LYS 107 1HZ LYS 107 -9.183 -11.961 6.929 759 HZ3 LYS 107 2HZ LYS 107 -9.588 -10.960 8.231 760 H VAL 108 H VAL 108 -5.378 -10.967 2.843 761 HA VAL 108 HA VAL 108 -6.443 -11.114 0.128 762 HB VAL 108 HB VAL 108 -4.430 -12.960 1.412 763 HG11 VAL 108 1HG1 VAL 108 -3.876 -13.621 -0.799 764 HG12 VAL 108 2HG1 VAL 108 -5.636 -13.682 -0.680 765 HG13 VAL 108 3HG1 VAL 108 -4.852 -12.332 -1.502 766 HG21 VAL 108 3HG2 VAL 108 -3.942 -10.363 1.230 767 HG22 VAL 108 1HG2 VAL 108 -2.704 -11.567 0.871 768 HG23 VAL 108 2HG2 VAL 108 -3.591 -10.794 -0.443 769 H THR 109 H THR 109 -7.603 -12.863 -0.666 770 HA THR 109 HA THR 109 -8.430 -14.950 1.203 771 HB THR 109 HB THR 109 -10.811 -14.659 0.663 772 HG1 THR 109 1HG THR 109 -11.413 -13.285 -0.832 773 HG21 THR 109 3HG2 THR 109 -9.898 -13.610 2.688 774 HG22 THR 109 1HG2 THR 109 -11.222 -12.664 2.010 775 HG23 THR 109 2HG2 THR 109 -9.553 -12.145 1.769 776 H GLY 110 H GLY 110 -8.566 -16.887 0.245 777 HA2 GLY 110 1HA GLY 110 -9.631 -17.705 -2.071 778 HA3 GLY 110 2HA GLY 110 -8.100 -17.039 -2.619 779 H GLN 111 H GLN 111 -8.352 -19.550 -3.235 780 HA GLN 111 HA GLN 111 -7.405 -21.287 -1.119 781 HB2 GLN 111 1HB GLN 111 -7.899 -21.809 -4.055 782 HB3 GLN 111 2HB GLN 111 -7.445 -23.037 -2.880 783 HG2 GLN 111 1HG GLN 111 -9.493 -22.894 -1.765 784 HG3 GLN 111 2HG GLN 111 -9.895 -21.352 -2.519 785 HE21 GLN 111 1HE2 GLN 111 -9.114 -24.689 -3.441 786 HE22 GLN 111 2HE2 GLN 111 -10.302 -24.803 -4.689 787 H ARG 112 H ARG 112 -5.361 -21.975 -0.812 788 HA ARG 112 HA ARG 112 -3.175 -20.551 -1.658 789 HB2 ARG 112 1HB ARG 112 -3.447 -23.388 -0.697 790 HB3 ARG 112 2HB ARG 112 -1.876 -22.719 -1.119 791 HG2 ARG 112 1HG ARG 112 -2.135 -20.985 0.556 792 HG3 ARG 112 2HG ARG 112 -3.747 -21.586 0.950 793 HD2 ARG 112 1HD ARG 112 -1.375 -23.403 1.106 794 HD3 ARG 112 2HD ARG 112 -1.719 -22.279 2.420 795 HE ARG 112 HE ARG 112 -3.206 -24.653 1.724 796 HH11 ARG 112 1HH1 ARG 112 -3.232 -21.606 3.408 797 HH12 ARG 112 2HH1 ARG 112 -4.504 -22.067 4.490 798 HH21 ARG 112 1HH2 ARG 112 -4.881 -25.272 3.143 799 HH22 ARG 112 2HH2 ARG 112 -5.440 -24.152 4.340 800 H LEU 113 H LEU 113 -1.849 -20.532 -3.387 801 HA LEU 113 HA LEU 113 -2.578 -22.259 -5.641 802 HB2 LEU 113 1HB LEU 113 -1.044 -19.673 -5.497 803 HB3 LEU 113 2HB LEU 113 -1.221 -20.622 -6.971 804 HG LEU 113 HG LEU 113 -3.401 -19.216 -5.435 805 HD11 LEU 113 1HD1 LEU 113 -2.853 -18.779 -8.315 806 HD12 LEU 113 2HD1 LEU 113 -1.716 -18.095 -7.154 807 HD13 LEU 113 3HD1 LEU 113 -3.422 -17.653 -7.082 808 HD21 LEU 113 3HD2 LEU 113 -3.510 -21.466 -7.290 809 HD22 LEU 113 1HD2 LEU 113 -4.500 -20.094 -7.788 810 HD23 LEU 113 2HD2 LEU 113 -4.745 -20.828 -6.203 811 H VAL 114 H VAL 114 -1.316 -23.853 -4.101 812 HA VAL 114 HA VAL 114 1.438 -23.825 -3.851 813 HB VAL 114 HB VAL 114 -0.301 -25.537 -2.964 814 HG11 VAL 114 1HG1 VAL 114 -0.419 -27.617 -4.220 815 HG12 VAL 114 2HG1 VAL 114 -1.068 -26.281 -5.173 816 HG13 VAL 114 3HG1 VAL 114 0.545 -26.907 -5.515 817 HG21 VAL 114 3HG2 VAL 114 1.542 -27.305 -2.872 818 HG22 VAL 114 1HG2 VAL 114 2.508 -26.170 -3.816 819 HG23 VAL 114 2HG2 VAL 114 1.917 -25.710 -2.219 820 H SER 115 H SER 115 -0.532 -24.963 -6.565 821 HA SER 115 HA SER 115 1.675 -25.909 -8.097 822 HB2 SER 115 1HB SER 115 -1.223 -25.382 -8.655 823 HB3 SER 115 2HB SER 115 -0.120 -25.678 -9.999 824 HG SER 115 HG SER 115 0.252 -27.695 -9.271 825 HA PRO 116 HA PRO 116 3.207 -22.113 -9.723 826 HB2 PRO 116 1HB PRO 116 4.456 -23.081 -11.929 827 HB3 PRO 116 2HB PRO 116 5.091 -23.297 -10.294 828 HG2 PRO 116 1HG PRO 116 3.533 -25.211 -11.989 829 HG3 PRO 116 2HG PRO 116 4.952 -25.518 -10.971 830 HD2 PRO 116 1HD PRO 116 2.433 -26.112 -10.176 831 HD3 PRO 116 2HD PRO 116 3.701 -25.614 -9.038 832 H GLY 117 H GLY 117 1.357 -24.302 -11.782 833 HA2 GLY 117 1HA GLY 117 -0.582 -22.831 -12.749 834 HA3 GLY 117 2HA GLY 117 0.755 -22.109 -13.631 835 H SER 118 H SER 118 -0.188 -22.751 -15.610 836 HA SER 118 HA SER 118 0.624 -25.378 -16.453 837 HB2 SER 118 1HB SER 118 -1.562 -25.933 -15.525 838 HB3 SER 118 2HB SER 118 -2.316 -24.650 -16.473 839 HG SER 118 HG SER 118 -2.385 -26.899 -17.325 840 H ALA 119 H ALA 119 1.140 -25.399 -18.572 841 HA ALA 119 HA ALA 119 0.057 -23.343 -20.343 842 HB1 ALA 119 3HB ALA 119 2.905 -23.603 -20.772 843 HB2 ALA 119 1HB ALA 119 1.924 -22.153 -20.557 844 HB3 ALA 119 2HB ALA 119 2.542 -23.018 -19.149 845 H ASN 120 H ASN 120 0.683 -23.733 -22.637 846 HA ASN 120 HA ASN 120 0.596 -26.600 -23.174 847 HB2 ASN 120 1HB ASN 120 -0.153 -26.004 -25.391 848 HB3 ASN 120 2HB ASN 120 -1.071 -25.062 -24.220 849 HD21 ASN 120 1HD2 ASN 120 -0.395 -22.850 -23.854 850 HD22 ASN 120 2HD2 ASN 120 0.319 -21.961 -25.152 851 H GLU 121 H GLU 121 2.490 -27.586 -23.414 852 HA GLU 121 HA GLU 121 4.950 -26.411 -23.877 853 HB2 GLU 121 1HB GLU 121 5.730 -28.667 -24.527 854 HB3 GLU 121 2HB GLU 121 4.762 -28.682 -23.059 855 HG2 GLU 121 1HG GLU 121 2.840 -29.475 -24.301 856 HG3 GLU 121 2HG GLU 121 3.758 -29.398 -25.804 857 H THR 122 H THR 122 6.226 -26.054 -25.672 858 HA THR 122 HA THR 122 4.762 -25.787 -28.188 859 HB THR 122 HB THR 122 7.473 -24.705 -27.394 860 HG1 THR 122 1HG THR 122 4.872 -23.561 -27.513 861 HG21 THR 122 3HG2 THR 122 7.802 -24.260 -29.551 862 HG22 THR 122 1HG2 THR 122 6.325 -23.299 -29.570 863 HG23 THR 122 2HG2 THR 122 6.264 -25.018 -29.959 864 H SER 123 H SER 123 5.374 -26.755 -30.085 865 HA SER 123 HA SER 123 6.973 -29.145 -29.830 866 HB2 SER 123 1HB SER 123 4.940 -29.290 -31.131 867 HB3 SER 123 2HB SER 123 5.460 -27.963 -32.170 868 HG SER 123 HG SER 123 7.160 -29.296 -32.899 869 H SER 124 H SER 124 7.091 -26.206 -31.835 870 HA SER 124 HA SER 124 8.820 -25.119 -32.839 871 HB2 SER 124 1HB SER 124 9.800 -25.465 -30.478 872 HB3 SER 124 2HB SER 124 10.747 -26.762 -31.207 873 HG SER 124 HG SER 124 10.714 -24.217 -32.396 874 H ILE 125 H ILE 125 7.770 -27.224 -34.223 875 HA ILE 125 HA ILE 125 9.309 -29.292 -35.089 876 HB ILE 125 HB ILE 125 7.653 -27.496 -36.865 877 HG12 ILE 125 1HG1 ILE 125 6.754 -30.123 -35.733 878 HG13 ILE 125 2HG1 ILE 125 6.640 -28.666 -34.753 879 HG21 ILE 125 1HG2 ILE 125 7.696 -29.123 -38.503 880 HG22 ILE 125 2HG2 ILE 125 9.343 -29.187 -37.880 881 HG23 ILE 125 3HG2 ILE 125 8.162 -30.395 -37.375 882 HD11 ILE 125 3HD1 ILE 125 5.141 -29.437 -37.194 883 HD12 ILE 125 1HD1 ILE 125 4.572 -28.692 -35.700 884 HD13 ILE 125 2HD1 ILE 125 5.441 -27.725 -36.893 Start of MODEL 19 1 H1 GLY 1 H GLY 1 2.384 63.107 -0.318 2 HA2 GLY 1 1HA GLY 1 2.190 60.665 1.007 3 HA3 GLY 1 2HA GLY 1 0.983 61.726 1.719 4 H SER 2 H SER 2 -0.117 59.645 0.666 5 HA SER 2 HA SER 2 -1.669 60.648 -1.500 6 HB2 SER 2 1HB SER 2 0.094 59.999 -2.944 7 HB3 SER 2 2HB SER 2 0.368 58.496 -2.063 8 HG SER 2 HG SER 2 -0.913 58.522 -4.164 9 H SER 3 H SER 3 -3.546 59.447 -1.853 10 HA SER 3 HA SER 3 -3.974 56.851 -0.792 11 HB2 SER 3 1HB SER 3 -5.285 57.284 1.122 12 HB3 SER 3 2HB SER 3 -3.896 58.357 1.293 13 HG SER 3 HG SER 3 -6.053 59.301 1.652 14 H GLY 4 H GLY 4 -6.507 56.481 -0.624 15 HA2 GLY 4 1HA GLY 4 -8.385 57.982 -1.931 16 HA3 GLY 4 2HA GLY 4 -7.528 57.151 -3.221 17 H SER 5 H SER 5 -9.741 56.276 -3.575 18 HA SER 5 HA SER 5 -11.003 54.555 -1.760 19 HB2 SER 5 1HB SER 5 -12.323 53.792 -3.617 20 HB3 SER 5 2HB SER 5 -12.014 55.511 -3.861 21 HG SER 5 HG SER 5 -11.576 54.542 -5.784 22 H SER 6 H SER 6 -10.968 52.337 -1.482 23 HA SER 6 HA SER 6 -8.440 51.071 -2.040 24 HB2 SER 6 1HB SER 6 -9.388 49.177 -0.733 25 HB3 SER 6 2HB SER 6 -9.476 50.712 0.130 26 HG SER 6 HG SER 6 -11.449 49.081 -0.354 27 H GLY 7 H GLY 7 -11.844 50.262 -2.755 28 HA2 GLY 7 1HA GLY 7 -12.288 49.721 -5.151 29 HA3 GLY 7 2HA GLY 7 -10.858 48.703 -5.065 30 H PHE 8 H PHE 8 -12.708 47.260 -5.946 31 HA PHE 8 HA PHE 8 -13.801 45.786 -3.649 32 HB2 PHE 8 1HB PHE 8 -15.751 45.221 -5.259 33 HB3 PHE 8 2HB PHE 8 -15.745 46.793 -4.466 34 HD1 PHE 8 2HD PHE 8 -15.077 48.811 -5.740 35 HD2 PHE 8 1HD PHE 8 -15.596 45.022 -7.610 36 HE1 PHE 8 2HE PHE 8 -15.221 49.917 -7.933 37 HE2 PHE 8 1HE PHE 8 -15.740 46.122 -9.806 38 HZ PHE 8 HZ PHE 8 -15.554 48.573 -9.969 39 H LYS 9 H LYS 9 -11.862 44.496 -3.948 40 HA LYS 9 HA LYS 9 -12.364 42.176 -5.510 41 HB2 LYS 9 1HB LYS 9 -10.507 42.282 -7.047 42 HB3 LYS 9 2HB LYS 9 -11.519 43.701 -7.282 43 HG2 LYS 9 1HG LYS 9 -9.482 44.697 -7.297 44 HG3 LYS 9 2HG LYS 9 -9.806 44.756 -5.563 45 HD2 LYS 9 1HD LYS 9 -8.475 42.774 -5.204 46 HD3 LYS 9 2HD LYS 9 -8.245 42.573 -6.942 47 HE2 LYS 9 1HE LYS 9 -7.233 44.961 -6.820 48 HE3 LYS 9 2HE LYS 9 -7.077 44.620 -5.097 49 HZ1 LYS 9 3HZ LYS 9 -5.975 42.447 -5.975 50 HZ2 LYS 9 1HZ LYS 9 -5.079 43.880 -5.887 51 HZ3 LYS 9 2HZ LYS 9 -5.709 43.365 -7.370 52 H VAL 10 H VAL 10 -10.996 40.450 -4.973 53 HA VAL 10 HA VAL 10 -8.898 40.990 -2.994 54 HB VAL 10 HB VAL 10 -11.122 38.977 -2.639 55 HG11 VAL 10 1HG1 VAL 10 -8.434 39.195 -1.441 56 HG12 VAL 10 2HG1 VAL 10 -9.764 38.889 -0.321 57 HG13 VAL 10 3HG1 VAL 10 -9.469 37.784 -1.664 58 HG21 VAL 10 3HG2 VAL 10 -10.471 40.974 -0.562 59 HG22 VAL 10 1HG2 VAL 10 -11.224 41.590 -2.033 60 HG23 VAL 10 2HG2 VAL 10 -12.034 40.345 -1.082 61 H ARG 11 H ARG 11 -7.243 39.461 -2.907 62 HA ARG 11 HA ARG 11 -6.648 38.138 -5.321 63 HB2 ARG 11 1HB ARG 11 -5.431 38.093 -2.575 64 HB3 ARG 11 2HB ARG 11 -4.834 37.027 -3.840 65 HG2 ARG 11 1HG ARG 11 -3.422 38.802 -4.084 66 HG3 ARG 11 2HG ARG 11 -4.698 39.253 -5.218 67 HD2 ARG 11 1HD ARG 11 -5.680 40.740 -3.615 68 HD3 ARG 11 2HD ARG 11 -4.586 40.177 -2.352 69 HE ARG 11 HE ARG 11 -4.034 42.137 -4.365 70 HH11 ARG 11 1HH1 ARG 11 -2.615 39.721 -2.299 71 HH12 ARG 11 2HH1 ARG 11 -1.050 40.465 -2.285 72 HH21 ARG 11 1HH2 ARG 11 -1.979 43.126 -4.355 73 HH22 ARG 11 2HH2 ARG 11 -0.690 42.402 -3.454 74 H VAL 12 H VAL 12 -7.237 36.212 -6.064 75 HA VAL 12 HA VAL 12 -8.947 34.503 -4.546 76 HB VAL 12 HB VAL 12 -7.609 33.950 -7.198 77 HG11 VAL 12 1HG1 VAL 12 -8.961 32.121 -7.448 78 HG12 VAL 12 2HG1 VAL 12 -8.720 32.084 -5.700 79 HG13 VAL 12 3HG1 VAL 12 -10.206 32.756 -6.373 80 HG21 VAL 12 3HG2 VAL 12 -10.365 34.552 -7.471 81 HG22 VAL 12 1HG2 VAL 12 -9.627 35.832 -6.510 82 HG23 VAL 12 2HG2 VAL 12 -8.981 35.443 -8.104 83 H GLY 13 H GLY 13 -8.043 33.470 -2.849 84 HA2 GLY 13 1HA GLY 13 -6.825 31.858 -1.751 85 HA3 GLY 13 2HA GLY 13 -6.312 31.271 -3.326 86 H GLU 14 H GLU 14 -5.270 32.609 -0.481 87 HA GLU 14 HA GLU 14 -3.300 34.428 -1.163 88 HB2 GLU 14 1HB GLU 14 -2.498 34.174 0.975 89 HB3 GLU 14 2HB GLU 14 -4.105 33.486 1.161 90 HG2 GLU 14 1HG GLU 14 -3.089 31.233 0.772 91 HG3 GLU 14 2HG GLU 14 -1.508 32.008 0.845 92 HA PRO 15 HA PRO 15 -0.161 32.251 -3.322 93 HB2 PRO 15 1HB PRO 15 2.071 33.514 -2.430 94 HB3 PRO 15 2HB PRO 15 0.921 34.266 -3.541 95 HG2 PRO 15 1HG PRO 15 1.185 34.597 -0.578 96 HG3 PRO 15 2HG PRO 15 0.905 35.830 -1.821 97 HD2 PRO 15 1HD PRO 15 -1.088 34.836 -0.279 98 HD3 PRO 15 2HD PRO 15 -1.349 35.364 -1.954 99 H GLY 16 H GLY 16 -0.459 30.197 -2.272 100 HA2 GLY 16 1HA GLY 16 1.834 29.495 -0.597 101 HA3 GLY 16 2HA GLY 16 0.235 29.159 0.049 102 H GLN 17 H GLN 17 2.411 28.467 -2.650 103 HA GLN 17 HA GLN 17 1.007 25.900 -3.003 104 HB2 GLN 17 1HB GLN 17 2.141 27.816 -4.993 105 HB3 GLN 17 2HB GLN 17 2.171 26.098 -5.367 106 HG2 GLN 17 1HG GLN 17 -0.208 25.953 -5.206 107 HG3 GLN 17 2HG GLN 17 -0.316 27.606 -4.602 108 HE21 GLN 17 1HE2 GLN 17 -1.865 27.120 -6.646 109 HE22 GLN 17 2HE2 GLN 17 -1.239 27.771 -8.118 110 H ALA 18 H ALA 18 2.208 24.439 -1.951 111 HA ALA 18 HA ALA 18 4.976 24.084 -2.797 112 HB1 ALA 18 3HB ALA 18 5.263 25.441 -0.845 113 HB2 ALA 18 1HB ALA 18 4.164 24.422 0.085 114 HB3 ALA 18 2HB ALA 18 5.723 23.787 -0.441 115 H GLY 19 H GLY 19 5.787 21.965 -2.456 116 HA2 GLY 19 1HA GLY 19 4.251 19.847 -3.047 117 HA3 GLY 19 2HA GLY 19 5.659 19.689 -2.007 118 H ASN 20 H ASN 20 2.520 18.898 -2.224 119 HA ASN 20 HA ASN 20 2.184 18.892 0.703 120 HB2 ASN 20 1HB ASN 20 0.571 20.440 -0.132 121 HB3 ASN 20 2HB ASN 20 0.111 19.356 -1.442 122 HD21 ASN 20 1HD2 ASN 20 -2.017 19.986 -0.409 123 HD22 ASN 20 2HD2 ASN 20 -2.613 18.931 0.822 124 HA PRO 21 HA PRO 21 2.149 14.492 0.021 125 HB2 PRO 21 1HB PRO 21 1.732 13.810 2.616 126 HB3 PRO 21 2HB PRO 21 3.304 14.335 2.001 127 HG2 PRO 21 1HG PRO 21 1.231 15.903 3.487 128 HG3 PRO 21 2HG PRO 21 2.992 15.893 3.699 129 HD2 PRO 21 1HD PRO 21 1.700 17.844 2.337 130 HD3 PRO 21 2HD PRO 21 3.341 17.313 1.917 131 H ALA 22 H ALA 22 -0.338 16.231 1.832 132 HA ALA 22 HA ALA 22 -2.266 14.288 2.121 133 HB1 ALA 22 3HB ALA 22 -3.721 15.973 2.613 134 HB2 ALA 22 1HB ALA 22 -2.201 16.858 2.742 135 HB3 ALA 22 2HB ALA 22 -3.175 16.986 1.277 136 H LEU 23 H LEU 23 -1.786 16.430 -0.682 137 HA LEU 23 HA LEU 23 -3.882 15.579 -2.263 138 HB2 LEU 23 1HB LEU 23 -1.145 16.607 -2.894 139 HB3 LEU 23 2HB LEU 23 -2.221 16.094 -4.192 140 HG LEU 23 HG LEU 23 -2.968 18.199 -2.171 141 HD11 LEU 23 1HD1 LEU 23 -2.146 18.887 -4.945 142 HD12 LEU 23 2HD1 LEU 23 -0.894 18.605 -3.737 143 HD13 LEU 23 3HD1 LEU 23 -2.103 19.862 -3.476 144 HD21 LEU 23 3HD2 LEU 23 -4.085 17.418 -4.862 145 HD22 LEU 23 1HD2 LEU 23 -4.607 18.812 -3.914 146 HD23 LEU 23 2HD2 LEU 23 -4.850 17.180 -3.290 147 H VAL 24 H VAL 24 -0.633 14.184 -1.982 148 HA VAL 24 HA VAL 24 -0.830 12.230 -3.953 149 HB VAL 24 HB VAL 24 0.662 12.116 -1.329 150 HG11 VAL 24 1HG1 VAL 24 0.924 10.391 -3.789 151 HG12 VAL 24 2HG1 VAL 24 2.048 10.393 -2.428 152 HG13 VAL 24 3HG1 VAL 24 0.377 9.876 -2.194 153 HG21 VAL 24 3HG2 VAL 24 2.295 13.323 -2.283 154 HG22 VAL 24 1HG2 VAL 24 2.134 12.493 -3.831 155 HG23 VAL 24 2HG2 VAL 24 1.047 13.821 -3.425 156 H SER 25 H SER 25 -2.132 10.545 -4.171 157 HA SER 25 HA SER 25 -3.014 9.082 -1.795 158 HB2 SER 25 1HB SER 25 -5.334 9.044 -2.535 159 HB3 SER 25 2HB SER 25 -4.802 10.715 -2.353 160 HG SER 25 HG SER 25 -5.899 9.688 -4.455 161 H ALA 26 H ALA 26 -3.803 6.935 -2.261 162 HA ALA 26 HA ALA 26 -3.029 5.915 -4.910 163 HB1 ALA 26 3HB ALA 26 -1.953 5.166 -2.279 164 HB2 ALA 26 1HB ALA 26 -2.387 3.816 -3.328 165 HB3 ALA 26 2HB ALA 26 -1.234 5.030 -3.884 166 H TYR 27 H TYR 27 -4.328 4.355 -5.762 167 HA TYR 27 HA TYR 27 -6.256 2.947 -4.144 168 HB2 TYR 27 1HB TYR 27 -8.224 3.777 -5.387 169 HB3 TYR 27 2HB TYR 27 -7.440 5.051 -4.460 170 HD1 TYR 27 2HD TYR 27 -7.336 3.569 -7.893 171 HD2 TYR 27 1HD TYR 27 -7.110 7.082 -5.503 172 HE1 TYR 27 2HE TYR 27 -7.168 4.938 -9.930 173 HE2 TYR 27 1HE TYR 27 -6.943 8.460 -7.533 174 HH TYR 27 HH TYR 27 -6.347 8.278 -9.838 175 H GLY 28 H GLY 28 -7.540 1.402 -5.441 176 HA2 GLY 28 1HA GLY 28 -7.329 0.824 -8.095 177 HA3 GLY 28 2HA GLY 28 -5.854 0.156 -7.413 178 H THR 29 H THR 29 -6.800 -1.867 -8.268 179 HA THR 29 HA THR 29 -9.046 -2.945 -6.765 180 HB THR 29 HB THR 29 -7.388 -4.317 -8.888 181 HG1 THR 29 1HG THR 29 -9.421 -3.743 -10.126 182 HG21 THR 29 3HG2 THR 29 -9.694 -5.535 -9.096 183 HG22 THR 29 1HG2 THR 29 -9.920 -4.975 -7.440 184 HG23 THR 29 2HG2 THR 29 -8.554 -6.016 -7.840 185 H GLY 30 H GLY 30 -5.594 -3.064 -6.778 186 HA2 GLY 30 1HA GLY 30 -5.417 -5.532 -5.282 187 HA3 GLY 30 2HA GLY 30 -4.087 -4.456 -5.685 188 H LEU 31 H LEU 31 -5.619 -2.138 -4.564 189 HA LEU 31 HA LEU 31 -4.680 -2.441 -1.848 190 HB2 LEU 31 1HB LEU 31 -5.861 -0.152 -3.396 191 HB3 LEU 31 2HB LEU 31 -5.510 -0.042 -1.673 192 HG LEU 31 HG LEU 31 -3.416 -0.700 -3.735 193 HD11 LEU 31 1HD1 LEU 31 -4.588 1.894 -2.946 194 HD12 LEU 31 2HD1 LEU 31 -3.806 1.408 -4.450 195 HD13 LEU 31 3HD1 LEU 31 -2.828 1.816 -3.040 196 HD21 LEU 31 3HD2 LEU 31 -2.996 0.528 -1.037 197 HD22 LEU 31 1HD2 LEU 31 -1.862 -0.373 -2.044 198 HD23 LEU 31 2HD2 LEU 31 -3.169 -1.218 -1.215 199 H GLU 32 H GLU 32 -7.732 -2.332 -3.544 200 HA GLU 32 HA GLU 32 -9.367 -1.938 -1.245 201 HB2 GLU 32 1HB GLU 32 -11.223 -2.398 -2.677 202 HB3 GLU 32 2HB GLU 32 -10.060 -1.468 -3.611 203 HG2 GLU 32 1HG GLU 32 -9.363 -3.380 -4.818 204 HG3 GLU 32 2HG GLU 32 -10.226 -4.464 -3.729 205 H GLY 33 H GLY 33 -8.157 -4.765 -2.965 206 HA2 GLY 33 1HA GLY 33 -8.714 -6.411 -0.643 207 HA3 GLY 33 2HA GLY 33 -9.623 -6.840 -2.085 208 H GLY 34 H GLY 34 -7.896 -8.637 -0.887 209 HA2 GLY 34 1HA GLY 34 -5.526 -8.627 -2.637 210 HA3 GLY 34 2HA GLY 34 -5.676 -9.537 -1.141 211 H THR 35 H THR 35 -6.038 -9.594 -4.518 212 HA THR 35 HA THR 35 -7.644 -12.037 -4.482 213 HB THR 35 HB THR 35 -6.594 -10.871 -7.022 214 HG1 THR 35 1HG THR 35 -8.456 -9.430 -6.971 215 HG21 THR 35 3HG2 THR 35 -9.418 -11.579 -6.778 216 HG22 THR 35 1HG2 THR 35 -8.328 -12.912 -6.399 217 HG23 THR 35 2HG2 THR 35 -8.220 -12.100 -7.962 218 H THR 36 H THR 36 -6.433 -13.768 -3.971 219 HA THR 36 HA THR 36 -3.689 -14.041 -4.718 220 HB THR 36 HB THR 36 -5.523 -16.243 -3.761 221 HG1 THR 36 1HG THR 36 -5.188 -14.109 -2.461 222 HG21 THR 36 3HG2 THR 36 -2.802 -16.193 -4.516 223 HG22 THR 36 1HG2 THR 36 -3.694 -17.514 -3.763 224 HG23 THR 36 2HG2 THR 36 -2.844 -16.339 -2.759 225 H GLY 37 H GLY 37 -2.941 -14.621 -6.643 226 HA2 GLY 37 1HA GLY 37 -2.811 -16.352 -8.344 227 HA3 GLY 37 2HA GLY 37 -4.562 -16.471 -8.274 228 H ILE 38 H ILE 38 -4.661 -13.441 -8.137 229 HA ILE 38 HA ILE 38 -4.319 -13.000 -11.028 230 HB ILE 38 HB ILE 38 -6.143 -11.456 -9.188 231 HG12 ILE 38 1HG1 ILE 38 -6.624 -13.948 -10.801 232 HG13 ILE 38 2HG1 ILE 38 -7.054 -13.622 -9.126 233 HG21 ILE 38 1HG2 ILE 38 -6.681 -10.213 -10.963 234 HG22 ILE 38 2HG2 ILE 38 -5.231 -10.875 -11.717 235 HG23 ILE 38 3HG2 ILE 38 -6.801 -11.621 -12.018 236 HD11 ILE 38 3HD1 ILE 38 -8.443 -12.862 -11.629 237 HD12 ILE 38 1HD1 ILE 38 -9.096 -13.441 -10.096 238 HD13 ILE 38 2HD1 ILE 38 -8.557 -11.769 -10.250 239 H GLN 39 H GLN 39 -3.317 -11.162 -11.776 240 HA GLN 39 HA GLN 39 -1.517 -9.873 -9.921 241 HB2 GLN 39 1HB GLN 39 -0.509 -10.406 -11.974 242 HB3 GLN 39 2HB GLN 39 -1.872 -9.797 -12.904 243 HG2 GLN 39 1HG GLN 39 -1.288 -7.536 -12.413 244 HG3 GLN 39 2HG GLN 39 -0.050 -8.052 -11.270 245 HE21 GLN 39 1HE2 GLN 39 -0.972 -8.160 -14.671 246 HE22 GLN 39 2HE2 GLN 39 0.638 -8.233 -15.293 247 H SER 40 H SER 40 -2.306 -8.289 -8.693 248 HA SER 40 HA SER 40 -4.421 -6.559 -9.657 249 HB2 SER 40 1HB SER 40 -4.352 -5.591 -7.387 250 HB3 SER 40 2HB SER 40 -4.487 -7.348 -7.338 251 HG SER 40 HG SER 40 -2.268 -5.718 -6.752 252 H GLU 41 H GLU 41 -4.254 -4.209 -9.524 253 HA GLU 41 HA GLU 41 -1.575 -3.082 -9.627 254 HB2 GLU 41 1HB GLU 41 -1.866 -2.061 -11.802 255 HB3 GLU 41 2HB GLU 41 -2.042 -3.804 -11.946 256 HG2 GLU 41 1HG GLU 41 -3.771 -3.046 -13.247 257 HG3 GLU 41 2HG GLU 41 -4.575 -3.312 -11.702 258 H PHE 42 H PHE 42 -1.503 -1.043 -8.868 259 HA PHE 42 HA PHE 42 -3.995 0.491 -8.692 260 HB2 PHE 42 1HB PHE 42 -3.858 0.859 -6.401 261 HB3 PHE 42 2HB PHE 42 -3.358 -0.824 -6.529 262 HD1 PHE 42 1HD PHE 42 -2.092 2.634 -6.183 263 HD2 PHE 42 2HD PHE 42 -1.247 -1.519 -5.788 264 HE1 PHE 42 1HE PHE 42 0.009 3.176 -5.022 265 HE2 PHE 42 2HE PHE 42 0.854 -0.984 -4.625 266 HZ PHE 42 HZ PHE 42 1.484 1.365 -4.240 267 H PHE 43 H PHE 43 -3.763 2.635 -9.033 268 HA PHE 43 HA PHE 43 -1.081 3.578 -9.706 269 HB2 PHE 43 1HB PHE 43 -3.825 4.712 -10.269 270 HB3 PHE 43 2HB PHE 43 -2.326 5.526 -10.704 271 HD1 PHE 43 1HD PHE 43 -0.683 4.193 -12.189 272 HD2 PHE 43 2HD PHE 43 -4.807 3.235 -11.749 273 HE1 PHE 43 1HE PHE 43 -0.614 2.938 -14.305 274 HE2 PHE 43 2HE PHE 43 -4.744 1.978 -13.863 275 HZ PHE 43 HZ PHE 43 -2.646 1.828 -15.143 276 H ILE 44 H ILE 44 -0.716 5.991 -9.216 277 HA ILE 44 HA ILE 44 -1.691 6.636 -6.516 278 HB ILE 44 HB ILE 44 1.157 6.995 -7.456 279 HG12 ILE 44 1HG1 ILE 44 0.262 5.165 -5.245 280 HG13 ILE 44 2HG1 ILE 44 0.271 4.613 -6.916 281 HG21 ILE 44 1HG2 ILE 44 0.788 7.179 -4.626 282 HG22 ILE 44 2HG2 ILE 44 1.431 8.380 -5.745 283 HG23 ILE 44 3HG2 ILE 44 -0.304 8.301 -5.437 284 HD11 ILE 44 3HD1 ILE 44 2.754 5.656 -6.714 285 HD12 ILE 44 1HD1 ILE 44 2.494 5.080 -5.068 286 HD13 ILE 44 2HD1 ILE 44 2.353 3.963 -6.426 287 H ASN 45 H ASN 45 -2.870 8.421 -6.737 288 HA ASN 45 HA ASN 45 -2.645 10.264 -8.849 289 HB2 ASN 45 1HB ASN 45 -4.656 9.859 -7.336 290 HB3 ASN 45 2HB ASN 45 -3.845 10.876 -6.149 291 HD21 ASN 45 1HD2 ASN 45 -5.512 12.389 -6.238 292 HD22 ASN 45 2HD2 ASN 45 -5.692 13.468 -7.575 293 H THR 46 H THR 46 -0.562 11.034 -9.060 294 HA THR 46 HA THR 46 0.309 12.887 -6.943 295 HB THR 46 HB THR 46 2.192 11.248 -8.647 296 HG1 THR 46 1HG THR 46 1.384 10.872 -5.936 297 HG21 THR 46 3HG2 THR 46 2.620 13.585 -7.227 298 HG22 THR 46 1HG2 THR 46 3.857 12.442 -7.747 299 HG23 THR 46 2HG2 THR 46 3.170 12.322 -6.127 300 H THR 47 H THR 47 -1.259 13.699 -9.067 301 HA THR 47 HA THR 47 0.591 14.945 -10.972 302 HB THR 47 HB THR 47 -1.392 15.508 -12.298 303 HG1 THR 47 1HG THR 47 -2.704 14.497 -10.022 304 HG21 THR 47 3HG2 THR 47 -0.407 13.406 -12.824 305 HG22 THR 47 1HG2 THR 47 -2.152 13.152 -12.787 306 HG23 THR 47 2HG2 THR 47 -1.156 12.632 -11.428 307 H ARG 48 H ARG 48 -1.906 15.708 -8.597 308 HA ARG 48 HA ARG 48 -1.814 18.529 -9.039 309 HB2 ARG 48 1HB ARG 48 -2.990 16.789 -6.885 310 HB3 ARG 48 2HB ARG 48 -3.007 18.542 -6.754 311 HG2 ARG 48 1HG ARG 48 -5.069 18.100 -7.675 312 HG3 ARG 48 2HG ARG 48 -4.097 18.457 -9.104 313 HD2 ARG 48 1HD ARG 48 -4.052 16.264 -9.789 314 HD3 ARG 48 2HD ARG 48 -4.282 15.639 -8.156 315 HE ARG 48 HE ARG 48 -6.526 15.642 -8.544 316 HH11 ARG 48 1HH1 ARG 48 -5.022 17.876 -10.750 317 HH12 ARG 48 2HH1 ARG 48 -6.490 18.225 -11.602 318 HH21 ARG 48 1HH2 ARG 48 -8.464 16.093 -9.658 319 HH22 ARG 48 2HH2 ARG 48 -8.448 17.210 -10.979 320 H ALA 49 H ALA 49 -0.165 16.285 -6.915 321 HA ALA 49 HA ALA 49 1.043 18.374 -5.327 322 HB1 ALA 49 3HB ALA 49 2.213 15.685 -5.192 323 HB2 ALA 49 1HB ALA 49 1.634 16.741 -3.903 324 HB3 ALA 49 2HB ALA 49 0.489 15.768 -4.827 325 H GLY 50 H GLY 50 2.347 15.833 -7.478 326 HA2 GLY 50 1HA GLY 50 3.842 16.678 -9.293 327 HA3 GLY 50 2HA GLY 50 4.606 17.653 -8.047 328 HA PRO 51 HA PRO 51 6.529 13.305 -8.523 329 HB2 PRO 51 1HB PRO 51 8.697 13.957 -10.021 330 HB3 PRO 51 2HB PRO 51 7.162 13.439 -10.728 331 HG2 PRO 51 1HG PRO 51 8.251 16.206 -10.383 332 HG3 PRO 51 2HG PRO 51 7.418 15.497 -11.779 333 HD2 PRO 51 1HD PRO 51 6.166 17.110 -10.001 334 HD3 PRO 51 2HD PRO 51 5.332 15.787 -10.842 335 H GLY 52 H GLY 52 8.913 12.799 -7.954 336 HA2 GLY 52 1HA GLY 52 10.848 14.261 -6.929 337 HA3 GLY 52 2HA GLY 52 9.617 14.532 -5.705 338 H THR 53 H THR 53 9.752 13.256 -3.997 339 HA THR 53 HA THR 53 11.444 10.926 -4.034 340 HB THR 53 HB THR 53 10.712 10.714 -1.618 341 HG1 THR 53 1HG THR 53 8.736 12.099 -2.196 342 HG21 THR 53 3HG2 THR 53 12.003 12.672 -0.879 343 HG22 THR 53 1HG2 THR 53 11.892 13.351 -2.502 344 HG23 THR 53 2HG2 THR 53 12.781 11.852 -2.232 345 H LEU 54 H LEU 54 10.847 8.869 -4.283 346 HA LEU 54 HA LEU 54 7.992 8.196 -4.026 347 HB2 LEU 54 1HB LEU 54 9.005 8.370 -6.406 348 HB3 LEU 54 2HB LEU 54 9.775 6.836 -6.008 349 HG LEU 54 HG LEU 54 7.685 6.614 -7.334 350 HD11 LEU 54 1HD1 LEU 54 6.750 5.253 -5.010 351 HD12 LEU 54 2HD1 LEU 54 8.512 5.178 -5.051 352 HD13 LEU 54 3HD1 LEU 54 7.573 4.598 -6.426 353 HD21 LEU 54 3HD2 LEU 54 6.672 8.563 -5.790 354 HD22 LEU 54 1HD2 LEU 54 6.026 7.152 -4.953 355 HD23 LEU 54 2HD2 LEU 54 5.675 7.398 -6.663 356 H SER 55 H SER 55 7.770 6.876 -2.352 357 HA SER 55 HA SER 55 9.676 4.658 -2.053 358 HB2 SER 55 1HB SER 55 8.851 6.677 -0.009 359 HB3 SER 55 2HB SER 55 9.149 5.020 0.516 360 HG SER 55 HG SER 55 11.125 5.826 0.616 361 H VAL 56 H VAL 56 8.685 2.759 -2.057 362 HA VAL 56 HA VAL 56 6.013 2.514 -0.887 363 HB VAL 56 HB VAL 56 6.674 1.418 -3.623 364 HG11 VAL 56 1HG1 VAL 56 5.087 -0.026 -2.802 365 HG12 VAL 56 2HG1 VAL 56 4.327 1.208 -1.796 366 HG13 VAL 56 3HG1 VAL 56 4.064 1.205 -3.540 367 HG21 VAL 56 3HG2 VAL 56 5.445 3.131 -4.605 368 HG22 VAL 56 1HG2 VAL 56 4.673 3.581 -3.085 369 HG23 VAL 56 2HG2 VAL 56 6.371 3.969 -3.361 370 H THR 57 H THR 57 6.366 1.083 0.685 371 HA THR 57 HA THR 57 7.928 -1.335 0.043 372 HB THR 57 HB THR 57 7.590 0.019 2.727 373 HG1 THR 57 1HG THR 57 9.159 0.794 0.992 374 HG21 THR 57 3HG2 THR 57 8.996 -1.688 3.647 375 HG22 THR 57 1HG2 THR 57 9.252 -2.410 2.058 376 HG23 THR 57 2HG2 THR 57 7.661 -2.485 2.816 377 H ILE 58 H ILE 58 6.803 -3.158 -0.013 378 HA ILE 58 HA ILE 58 4.210 -3.255 1.377 379 HB ILE 58 HB ILE 58 5.103 -5.050 -0.876 380 HG12 ILE 58 1HG1 ILE 58 3.291 -2.639 -1.081 381 HG13 ILE 58 2HG1 ILE 58 4.996 -2.615 -1.518 382 HG21 ILE 58 1HG2 ILE 58 2.746 -4.873 0.829 383 HG22 ILE 58 2HG2 ILE 58 2.363 -4.894 -0.891 384 HG23 ILE 58 3HG2 ILE 58 3.315 -6.199 -0.184 385 HD11 ILE 58 3HD1 ILE 58 2.690 -3.769 -2.933 386 HD12 ILE 58 1HD1 ILE 58 4.168 -3.041 -3.562 387 HD13 ILE 58 2HD1 ILE 58 4.182 -4.707 -2.981 388 H GLU 59 H GLU 59 3.710 -4.938 2.728 389 HA GLU 59 HA GLU 59 5.799 -6.956 3.192 390 HB2 GLU 59 1HB GLU 59 5.550 -4.946 4.900 391 HB3 GLU 59 2HB GLU 59 4.223 -5.926 5.507 392 HG2 GLU 59 1HG GLU 59 5.943 -7.835 5.572 393 HG3 GLU 59 2HG GLU 59 7.146 -6.554 5.439 394 H GLY 60 H GLY 60 5.091 -8.993 3.832 395 HA2 GLY 60 1HA GLY 60 2.397 -9.581 4.514 396 HA3 GLY 60 2HA GLY 60 2.680 -9.908 2.810 397 HA PRO 61 HA PRO 61 3.981 -13.527 5.571 398 HB2 PRO 61 1HB PRO 61 2.049 -15.268 4.792 399 HB3 PRO 61 2HB PRO 61 1.857 -14.172 6.165 400 HG2 PRO 61 1HG PRO 61 0.846 -13.891 3.361 401 HG3 PRO 61 2HG PRO 61 0.014 -13.551 4.890 402 HD2 PRO 61 1HD PRO 61 1.113 -11.602 3.364 403 HD3 PRO 61 2HD PRO 61 1.036 -11.500 5.135 404 H SER 62 H SER 62 2.865 -13.241 2.245 405 HA SER 62 HA SER 62 4.794 -15.323 1.456 406 HB2 SER 62 1HB SER 62 2.197 -15.439 0.920 407 HB3 SER 62 2HB SER 62 2.664 -14.391 -0.420 408 HG SER 62 HG SER 62 3.061 -17.056 -0.091 409 H LYS 63 H LYS 63 6.610 -14.535 0.647 410 HA LYS 63 HA LYS 63 7.130 -11.905 -0.019 411 HB2 LYS 63 1HB LYS 63 9.125 -12.771 -1.212 412 HB3 LYS 63 2HB LYS 63 8.921 -13.478 0.386 413 HG2 LYS 63 1HG LYS 63 7.786 -14.913 -1.958 414 HG3 LYS 63 2HG LYS 63 9.531 -14.955 -1.696 415 HD2 LYS 63 1HD LYS 63 8.747 -15.528 0.781 416 HD3 LYS 63 2HD LYS 63 7.331 -16.130 -0.085 417 HE2 LYS 63 1HE LYS 63 8.612 -17.677 -1.311 418 HE3 LYS 63 2HE LYS 63 10.129 -16.891 -0.875 419 HZ1 LYS 63 3HZ LYS 63 9.733 -17.579 1.436 420 HZ2 LYS 63 1HZ LYS 63 9.864 -18.900 0.387 421 HZ3 LYS 63 2HZ LYS 63 8.344 -18.412 0.947 422 H VAL 64 H VAL 64 6.811 -10.646 -1.755 423 HA VAL 64 HA VAL 64 6.026 -11.893 -4.293 424 HB VAL 64 HB VAL 64 4.270 -10.177 -4.614 425 HG11 VAL 64 1HG1 VAL 64 4.058 -12.101 -2.320 426 HG12 VAL 64 2HG1 VAL 64 2.678 -11.144 -2.859 427 HG13 VAL 64 3HG1 VAL 64 3.455 -12.276 -3.967 428 HG21 VAL 64 3HG2 VAL 64 3.707 -8.601 -3.066 429 HG22 VAL 64 1HG2 VAL 64 4.229 -9.592 -1.704 430 HG23 VAL 64 2HG2 VAL 64 5.424 -8.753 -2.694 431 H LYS 65 H LYS 65 6.692 -10.828 -6.114 432 HA LYS 65 HA LYS 65 8.681 -8.747 -5.711 433 HB2 LYS 65 1HB LYS 65 9.152 -10.689 -7.181 434 HB3 LYS 65 2HB LYS 65 7.857 -10.168 -8.250 435 HG2 LYS 65 1HG LYS 65 9.757 -9.361 -9.290 436 HG3 LYS 65 2HG LYS 65 9.165 -7.955 -8.401 437 HD2 LYS 65 1HD LYS 65 10.862 -8.058 -6.845 438 HD3 LYS 65 2HD LYS 65 11.129 -9.785 -7.095 439 HE2 LYS 65 1HE LYS 65 11.816 -7.621 -9.080 440 HE3 LYS 65 2HE LYS 65 12.963 -8.378 -7.977 441 HZ1 LYS 65 3HZ LYS 65 11.744 -9.435 -10.401 442 HZ2 LYS 65 1HZ LYS 65 11.953 -10.530 -9.128 443 HZ3 LYS 65 2HZ LYS 65 13.286 -9.702 -9.758 444 H MET 66 H MET 66 8.354 -6.650 -6.073 445 HA MET 66 HA MET 66 5.797 -5.824 -7.232 446 HB2 MET 66 1HB MET 66 7.864 -4.295 -5.645 447 HB3 MET 66 2HB MET 66 6.398 -3.581 -6.303 448 HG2 MET 66 1HG MET 66 5.042 -4.620 -4.789 449 HG3 MET 66 2HG MET 66 6.145 -5.976 -4.566 450 HE1 MET 66 3HE MET 66 8.876 -4.880 -2.494 451 HE2 MET 66 1HE MET 66 7.586 -5.812 -1.732 452 HE3 MET 66 2HE MET 66 8.016 -6.114 -3.416 453 H ASP 67 H ASP 67 5.635 -4.834 -9.150 454 HA ASP 67 HA ASP 67 8.125 -4.287 -10.609 455 HB2 ASP 67 1HB ASP 67 5.322 -4.905 -11.538 456 HB3 ASP 67 2HB ASP 67 6.564 -4.293 -12.628 457 H CYS 68 H CYS 68 8.199 -2.407 -12.015 458 HA CYS 68 HA CYS 68 6.468 -0.206 -11.107 459 HB2 CYS 68 1HB CYS 68 8.810 -0.170 -10.122 460 HB3 CYS 68 2HB CYS 68 9.398 0.114 -11.756 461 HG CYS 68 HG CYS 68 9.254 2.658 -11.526 462 H GLN 69 H GLN 69 6.324 1.600 -12.624 463 HA GLN 69 HA GLN 69 7.223 1.249 -15.325 464 HB2 GLN 69 1HB GLN 69 5.123 -0.251 -14.966 465 HB3 GLN 69 2HB GLN 69 4.240 1.269 -15.012 466 HG2 GLN 69 1HG GLN 69 5.975 0.114 -17.180 467 HG3 GLN 69 2HG GLN 69 4.219 0.277 -17.190 468 HE21 GLN 69 1HE2 GLN 69 3.305 2.346 -17.406 469 HE22 GLN 69 2HE2 GLN 69 4.205 3.662 -18.071 470 H GLU 70 H GLU 70 7.847 3.256 -15.758 471 HA GLU 70 HA GLU 70 6.881 5.561 -14.476 472 HB2 GLU 70 1HB GLU 70 9.101 5.367 -15.584 473 HB3 GLU 70 2HB GLU 70 8.291 5.396 -17.145 474 HG2 GLU 70 1HG GLU 70 8.920 7.582 -16.933 475 HG3 GLU 70 2HG GLU 70 7.289 7.635 -16.267 476 H THR 71 H THR 71 4.921 6.401 -14.664 477 HA THR 71 HA THR 71 3.584 6.298 -17.289 478 HB THR 71 HB THR 71 1.450 6.603 -15.969 479 HG1 THR 71 1HG THR 71 1.515 6.489 -13.812 480 HG21 THR 71 3HG2 THR 71 2.629 4.069 -14.996 481 HG22 THR 71 1HG2 THR 71 2.693 4.351 -16.735 482 HG23 THR 71 2HG2 THR 71 1.141 4.353 -15.897 483 HA PRO 72 HA PRO 72 3.523 10.685 -17.482 484 HB2 PRO 72 1HB PRO 72 1.179 11.116 -18.782 485 HB3 PRO 72 2HB PRO 72 2.613 10.458 -19.580 486 HG2 PRO 72 1HG PRO 72 0.206 9.024 -18.524 487 HG3 PRO 72 2HG PRO 72 1.080 8.773 -20.046 488 HD2 PRO 72 1HD PRO 72 1.433 7.182 -17.885 489 HD3 PRO 72 2HD PRO 72 2.738 7.532 -19.036 490 H GLU 73 H GLU 73 1.442 8.966 -15.528 491 HA GLU 73 HA GLU 73 0.047 11.369 -14.574 492 HB2 GLU 73 1HB GLU 73 -0.539 8.441 -14.421 493 HB3 GLU 73 2HB GLU 73 -1.189 9.506 -13.183 494 HG2 GLU 73 1HG GLU 73 -1.583 10.120 -16.082 495 HG3 GLU 73 2HG GLU 73 -2.621 8.961 -15.252 496 H GLY 74 H GLY 74 1.839 8.540 -13.362 497 HA2 GLY 74 1HA GLY 74 3.289 10.082 -11.468 498 HA3 GLY 74 2HA GLY 74 1.969 9.232 -10.680 499 H TYR 75 H TYR 75 2.076 7.025 -10.401 500 HA TYR 75 HA TYR 75 4.240 5.508 -11.577 501 HB2 TYR 75 1HB TYR 75 4.101 5.895 -8.580 502 HB3 TYR 75 2HB TYR 75 5.195 4.806 -9.425 503 HD1 TYR 75 1HD TYR 75 6.950 5.784 -10.944 504 HD2 TYR 75 2HD TYR 75 4.628 8.181 -8.304 505 HE1 TYR 75 1HE TYR 75 8.604 7.593 -11.141 506 HE2 TYR 75 2HE TYR 75 6.276 9.997 -8.496 507 HH TYR 75 HH TYR 75 9.104 9.697 -10.619 508 H LYS 76 H LYS 76 3.572 3.501 -11.963 509 HA LYS 76 HA LYS 76 1.119 2.577 -10.644 510 HB2 LYS 76 1HB LYS 76 1.159 2.695 -13.130 511 HB3 LYS 76 2HB LYS 76 2.457 1.509 -13.137 512 HG2 LYS 76 1HG LYS 76 0.930 -0.085 -11.998 513 HG3 LYS 76 2HG LYS 76 -0.367 1.099 -12.179 514 HD2 LYS 76 1HD LYS 76 -0.100 1.026 -14.607 515 HD3 LYS 76 2HD LYS 76 1.213 -0.141 -14.433 516 HE2 LYS 76 1HE LYS 76 -0.223 -1.830 -13.719 517 HE3 LYS 76 2HE LYS 76 -1.495 -0.693 -13.275 518 HZ1 LYS 76 3HZ LYS 76 -2.392 -1.006 -15.258 519 HZ2 LYS 76 1HZ LYS 76 -1.137 -2.049 -15.707 520 HZ3 LYS 76 2HZ LYS 76 -1.003 -0.389 -16.002 521 H VAL 77 H VAL 77 1.116 0.882 -9.301 522 HA VAL 77 HA VAL 77 3.547 -0.782 -9.163 523 HB VAL 77 HB VAL 77 1.822 0.104 -6.845 524 HG11 VAL 77 1HG1 VAL 77 2.658 -2.158 -6.530 525 HG12 VAL 77 2HG1 VAL 77 4.298 -1.618 -6.896 526 HG13 VAL 77 3HG1 VAL 77 3.480 -1.037 -5.445 527 HG21 VAL 77 3HG2 VAL 77 4.538 0.942 -7.812 528 HG22 VAL 77 1HG2 VAL 77 3.143 1.949 -7.423 529 HG23 VAL 77 2HG2 VAL 77 4.045 1.154 -6.132 530 H MET 78 H MET 78 3.211 -2.878 -9.482 531 HA MET 78 HA MET 78 0.518 -3.961 -8.977 532 HB2 MET 78 1HB MET 78 2.406 -4.824 -11.173 533 HB3 MET 78 2HB MET 78 0.781 -5.434 -10.890 534 HG2 MET 78 1HG MET 78 0.349 -3.965 -12.562 535 HG3 MET 78 2HG MET 78 0.144 -2.898 -11.175 536 HE1 MET 78 3HE MET 78 2.596 -4.475 -13.449 537 HE2 MET 78 1HE MET 78 3.442 -3.140 -14.231 538 HE3 MET 78 2HE MET 78 4.036 -3.784 -12.701 539 H TYR 79 H TYR 79 0.385 -6.070 -8.171 540 HA TYR 79 HA TYR 79 2.764 -7.605 -7.650 541 HB2 TYR 79 1HB TYR 79 2.746 -7.517 -5.274 542 HB3 TYR 79 2HB TYR 79 2.697 -5.845 -5.825 543 HD1 TYR 79 1HD TYR 79 0.461 -8.611 -4.704 544 HD2 TYR 79 2HD TYR 79 1.066 -4.409 -4.997 545 HE1 TYR 79 1HE TYR 79 -1.557 -8.232 -3.350 546 HE2 TYR 79 2HE TYR 79 -0.950 -4.019 -3.644 547 HH TYR 79 HH TYR 79 -2.577 -6.571 -1.989 548 H THR 80 H THR 80 2.327 -9.736 -7.219 549 HA THR 80 HA THR 80 -0.523 -10.479 -7.068 550 HB THR 80 HB THR 80 1.566 -12.192 -8.400 551 HG1 THR 80 1HG THR 80 0.925 -11.264 -10.361 552 HG21 THR 80 3HG2 THR 80 -0.125 -13.594 -8.819 553 HG22 THR 80 1HG2 THR 80 -1.166 -12.288 -9.383 554 HG23 THR 80 2HG2 THR 80 -1.066 -12.655 -7.661 555 HA PRO 81 HA PRO 81 1.046 -12.323 -3.277 556 HB2 PRO 81 1HB PRO 81 -1.409 -12.915 -2.281 557 HB3 PRO 81 2HB PRO 81 -0.704 -11.297 -2.199 558 HG2 PRO 81 1HG PRO 81 -2.709 -12.394 -4.132 559 HG3 PRO 81 2HG PRO 81 -2.687 -10.819 -3.316 560 HD2 PRO 81 1HD PRO 81 -1.888 -11.142 -5.883 561 HD3 PRO 81 2HD PRO 81 -1.169 -9.929 -4.804 562 H MET 82 H MET 82 1.726 -14.359 -3.081 563 HA MET 82 HA MET 82 0.668 -16.429 -4.773 564 HB2 MET 82 1HB MET 82 3.132 -15.998 -3.906 565 HB3 MET 82 2HB MET 82 2.600 -17.014 -2.573 566 HG2 MET 82 1HG MET 82 2.063 -18.804 -4.107 567 HG3 MET 82 2HG MET 82 2.492 -17.784 -5.479 568 HE1 MET 82 3HE MET 82 4.333 -19.774 -6.366 569 HE2 MET 82 1HE MET 82 4.445 -18.035 -6.641 570 HE3 MET 82 2HE MET 82 5.877 -18.946 -6.162 571 H ALA 83 H ALA 83 0.595 -15.641 -1.340 572 HA ALA 83 HA ALA 83 -1.513 -17.661 -0.996 573 HB1 ALA 83 3HB ALA 83 0.762 -17.160 0.918 574 HB2 ALA 83 1HB ALA 83 -0.622 -18.209 1.229 575 HB3 ALA 83 2HB ALA 83 0.514 -18.605 -0.062 576 HA PRO 84 HA PRO 84 -3.830 -14.423 0.864 577 HB2 PRO 84 1HB PRO 84 -5.432 -15.861 2.517 578 HB3 PRO 84 2HB PRO 84 -5.636 -15.839 0.762 579 HG2 PRO 84 1HG PRO 84 -4.294 -17.885 2.487 580 HG3 PRO 84 2HG PRO 84 -5.389 -18.125 1.113 581 HD2 PRO 84 1HD PRO 84 -2.700 -18.363 0.893 582 HD3 PRO 84 2HD PRO 84 -3.719 -17.779 -0.439 583 H GLY 85 H GLY 85 -4.213 -13.307 2.858 584 HA2 GLY 85 1HA GLY 85 -3.629 -13.955 5.412 585 HA3 GLY 85 2HA GLY 85 -2.037 -13.637 4.737 586 H ASN 86 H ASN 86 -1.552 -11.799 5.851 587 HA ASN 86 HA ASN 86 -3.312 -9.485 5.362 588 HB2 ASN 86 1HB ASN 86 -2.256 -8.583 7.530 589 HB3 ASN 86 2HB ASN 86 -3.474 -9.847 7.679 590 HD21 ASN 86 1HD2 ASN 86 -2.309 -9.920 9.820 591 HD22 ASN 86 2HD2 ASN 86 -0.980 -11.017 9.941 592 H TYR 87 H TYR 87 -2.417 -8.053 4.048 593 HA TYR 87 HA TYR 87 0.520 -7.853 3.966 594 HB2 TYR 87 1HB TYR 87 -1.568 -7.348 1.849 595 HB3 TYR 87 2HB TYR 87 0.099 -6.809 1.682 596 HD1 TYR 87 1HD TYR 87 -1.495 -9.982 2.867 597 HD2 TYR 87 2HD TYR 87 1.255 -8.135 0.197 598 HE1 TYR 87 1HE TYR 87 -0.876 -12.193 1.985 599 HE2 TYR 87 2HE TYR 87 1.881 -10.341 -0.693 600 HH TYR 87 HH TYR 87 0.512 -13.322 0.654 601 H LEU 88 H LEU 88 1.508 -5.874 4.116 602 HA LEU 88 HA LEU 88 -0.239 -3.619 4.853 603 HB2 LEU 88 1HB LEU 88 1.270 -4.624 6.626 604 HB3 LEU 88 2HB LEU 88 2.624 -3.984 5.697 605 HG LEU 88 HG LEU 88 1.630 -1.699 5.998 606 HD11 LEU 88 1HD1 LEU 88 -0.080 -1.322 7.582 607 HD12 LEU 88 2HD1 LEU 88 -0.050 -2.999 8.126 608 HD13 LEU 88 3HD1 LEU 88 -0.668 -2.603 6.522 609 HD21 LEU 88 3HD2 LEU 88 3.491 -2.568 7.369 610 HD22 LEU 88 1HD2 LEU 88 2.318 -3.166 8.541 611 HD23 LEU 88 2HD2 LEU 88 2.465 -1.433 8.248 612 H ILE 89 H ILE 89 -0.197 -1.902 3.568 613 HA ILE 89 HA ILE 89 2.173 -1.471 1.871 614 HB ILE 89 HB ILE 89 -0.705 -1.006 1.078 615 HG12 ILE 89 1HG1 ILE 89 1.184 -2.896 -0.284 616 HG13 ILE 89 2HG1 ILE 89 0.327 -3.411 1.164 617 HG21 ILE 89 1HG2 ILE 89 0.006 -0.021 -0.857 618 HG22 ILE 89 2HG2 ILE 89 1.280 0.514 0.238 619 HG23 ILE 89 3HG2 ILE 89 1.561 -0.853 -0.841 620 HD11 ILE 89 3HD1 ILE 89 -0.653 -3.872 -1.206 621 HD12 ILE 89 1HD1 ILE 89 -1.710 -3.399 0.123 622 HD13 ILE 89 2HD1 ILE 89 -1.214 -2.205 -1.077 623 H SER 90 H SER 90 3.152 0.343 2.446 624 HA SER 90 HA SER 90 1.504 2.598 3.388 625 HB2 SER 90 1HB SER 90 4.153 1.547 4.279 626 HB3 SER 90 2HB SER 90 3.870 3.285 4.379 627 HG SER 90 HG SER 90 2.610 1.188 5.743 628 H VAL 91 H VAL 91 2.536 4.766 3.003 629 HA VAL 91 HA VAL 91 4.275 4.910 0.675 630 HB VAL 91 HB VAL 91 1.561 6.235 0.654 631 HG11 VAL 91 1HG1 VAL 91 3.853 7.061 -0.580 632 HG12 VAL 91 2HG1 VAL 91 3.100 6.064 -1.826 633 HG13 VAL 91 3HG1 VAL 91 2.217 7.422 -1.129 634 HG21 VAL 91 3HG2 VAL 91 1.194 4.698 -1.326 635 HG22 VAL 91 1HG2 VAL 91 2.603 3.798 -0.767 636 HG23 VAL 91 2HG2 VAL 91 1.178 3.935 0.264 637 H LYS 92 H LYS 92 5.765 6.381 1.118 638 HA LYS 92 HA LYS 92 5.060 8.615 2.903 639 HB2 LYS 92 1HB LYS 92 7.623 7.106 2.471 640 HB3 LYS 92 2HB LYS 92 7.639 8.725 3.156 641 HG2 LYS 92 1HG LYS 92 5.932 7.788 4.844 642 HG3 LYS 92 2HG LYS 92 6.498 6.207 4.298 643 HD2 LYS 92 1HD LYS 92 8.456 8.311 5.140 644 HD3 LYS 92 2HD LYS 92 7.629 7.326 6.349 645 HE2 LYS 92 1HE LYS 92 9.239 6.242 4.039 646 HE3 LYS 92 2HE LYS 92 9.834 6.415 5.690 647 HZ1 LYS 92 3HZ LYS 92 7.989 4.932 6.389 648 HZ2 LYS 92 1HZ LYS 92 9.125 4.181 5.385 649 HZ3 LYS 92 2HZ LYS 92 7.629 4.662 4.759 650 H TYR 93 H TYR 93 4.788 10.480 1.887 651 HA TYR 93 HA TYR 93 6.322 10.987 -0.574 652 HB2 TYR 93 1HB TYR 93 3.969 11.015 -1.029 653 HB3 TYR 93 2HB TYR 93 3.654 12.057 0.354 654 HD1 TYR 93 2HD TYR 93 4.431 14.440 0.291 655 HD2 TYR 93 1HD TYR 93 4.562 11.922 -3.136 656 HE1 TYR 93 2HE TYR 93 4.629 16.423 -1.150 657 HE2 TYR 93 1HE TYR 93 4.762 13.898 -4.587 658 HH TYR 93 HH TYR 93 4.002 16.511 -4.253 659 H GLY 94 H GLY 94 7.877 12.462 -0.483 660 HA2 GLY 94 1HA GLY 94 8.701 14.640 -0.013 661 HA3 GLY 94 2HA GLY 94 7.590 14.738 1.345 662 H GLY 95 H GLY 95 8.165 12.368 2.666 663 HA2 GLY 95 1HA GLY 95 10.782 11.648 3.074 664 HA3 GLY 95 2HA GLY 95 10.575 13.114 4.022 665 HA PRO 96 HA PRO 96 9.360 10.300 7.229 666 HB2 PRO 96 1HB PRO 96 8.786 12.195 9.086 667 HB3 PRO 96 2HB PRO 96 10.439 11.726 8.671 668 HG2 PRO 96 1HG PRO 96 8.848 14.084 7.738 669 HG3 PRO 96 2HG PRO 96 10.545 14.009 8.244 670 HD2 PRO 96 1HD PRO 96 9.802 14.052 5.641 671 HD3 PRO 96 2HD PRO 96 11.248 13.191 6.207 672 H ASN 97 H ASN 97 7.414 13.215 6.583 673 HA ASN 97 HA ASN 97 5.032 12.210 7.731 674 HB2 ASN 97 1HB ASN 97 5.076 14.257 5.527 675 HB3 ASN 97 2HB ASN 97 3.982 14.142 6.902 676 HD21 ASN 97 1HD2 ASN 97 7.228 14.965 5.891 677 HD22 ASN 97 2HD2 ASN 97 7.608 15.954 7.256 678 H HIS 98 H HIS 98 3.689 10.710 6.999 679 HA HIS 98 HA HIS 98 4.003 9.664 4.317 680 HB2 HIS 98 1HB HIS 98 1.999 8.788 6.399 681 HB3 HIS 98 2HB HIS 98 2.585 7.869 5.015 682 HD2 HIS 98 2HD HIS 98 4.291 9.360 8.275 683 HE1 HIS 98 1HE HIS 98 6.034 5.614 7.313 684 HE2 HIS 98 2HE HIS 98 5.948 7.502 8.977 685 H ILE 99 H ILE 99 1.617 8.885 3.468 686 HA ILE 99 HA ILE 99 0.242 11.419 2.946 687 HB ILE 99 HB ILE 99 -0.767 10.312 1.027 688 HG12 ILE 99 1HG1 ILE 99 0.903 7.875 1.604 689 HG13 ILE 99 2HG1 ILE 99 -0.736 8.024 2.226 690 HG21 ILE 99 1HG2 ILE 99 1.700 11.222 1.129 691 HG22 ILE 99 2HG2 ILE 99 2.096 9.534 0.810 692 HG23 ILE 99 3HG2 ILE 99 1.080 10.429 -0.320 693 HD11 ILE 99 3HD1 ILE 99 -0.772 6.756 0.198 694 HD12 ILE 99 1HD1 ILE 99 -1.537 8.318 -0.094 695 HD13 ILE 99 2HD1 ILE 99 0.107 8.022 -0.659 696 H VAL 100 H VAL 100 -2.161 11.279 2.642 697 HA VAL 100 HA VAL 100 -3.367 10.306 5.019 698 HB VAL 100 HB VAL 100 -4.544 11.467 2.498 699 HG11 VAL 100 1HG1 VAL 100 -6.136 9.896 3.545 700 HG12 VAL 100 2HG1 VAL 100 -6.007 10.805 5.052 701 HG13 VAL 100 3HG1 VAL 100 -6.684 11.570 3.614 702 HG21 VAL 100 3HG2 VAL 100 -5.014 13.387 3.991 703 HG22 VAL 100 1HG2 VAL 100 -4.154 12.552 5.285 704 HG23 VAL 100 2HG2 VAL 100 -3.292 13.045 3.828 705 H GLY 101 H GLY 101 -4.798 8.620 5.350 706 HA2 GLY 101 1HA GLY 101 -6.145 6.791 4.661 707 HA3 GLY 101 2HA GLY 101 -5.316 6.799 3.112 708 H SER 102 H SER 102 -2.662 6.796 4.009 709 HA SER 102 HA SER 102 -2.358 4.011 4.608 710 HB2 SER 102 1HB SER 102 0.154 4.809 4.727 711 HB3 SER 102 2HB SER 102 -0.685 4.727 3.179 712 HG SER 102 HG SER 102 0.528 6.769 3.950 713 HA PRO 103 HA PRO 103 -0.263 2.964 5.337 714 HB2 PRO 103 1HB PRO 103 -0.404 0.815 6.991 715 HB3 PRO 103 2HB PRO 103 0.891 2.014 7.082 716 HG2 PRO 103 1HG PRO 103 -1.580 1.765 8.753 717 HG3 PRO 103 2HG PRO 103 0.080 2.126 9.259 718 HD2 PRO 103 1HD PRO 103 -1.807 4.047 8.976 719 HD3 PRO 103 2HD PRO 103 -0.086 4.346 8.659 720 H PHE 104 H PHE 104 -1.092 1.155 4.194 721 HA PHE 104 HA PHE 104 -4.012 0.966 4.311 722 HB2 PHE 104 1HB PHE 104 -2.042 0.172 2.159 723 HB3 PHE 104 2HB PHE 104 -3.780 -0.089 2.054 724 HD1 PHE 104 2HD PHE 104 -5.184 2.141 2.598 725 HD2 PHE 104 1HD PHE 104 -1.210 2.005 1.079 726 HE1 PHE 104 2HE PHE 104 -5.466 4.401 1.667 727 HE2 PHE 104 1HE PHE 104 -1.485 4.266 0.147 728 HZ PHE 104 HZ PHE 104 -3.615 5.466 0.439 729 H LYS 105 H LYS 105 -5.065 -0.871 4.808 730 HA LYS 105 HA LYS 105 -3.446 -3.293 5.255 731 HB2 LYS 105 1HB LYS 105 -5.582 -2.034 6.937 732 HB3 LYS 105 2HB LYS 105 -5.338 -3.775 7.000 733 HG2 LYS 105 1HG LYS 105 -2.841 -3.116 7.395 734 HG3 LYS 105 2HG LYS 105 -3.542 -1.575 7.896 735 HD2 LYS 105 1HD LYS 105 -3.396 -2.812 9.877 736 HD3 LYS 105 2HD LYS 105 -5.084 -2.978 9.387 737 HE2 LYS 105 1HE LYS 105 -4.239 -5.122 8.179 738 HE3 LYS 105 2HE LYS 105 -2.868 -4.985 9.279 739 HZ1 LYS 105 3HZ LYS 105 -4.097 -5.951 10.827 740 HZ2 LYS 105 1HZ LYS 105 -5.439 -6.000 9.798 741 HZ3 LYS 105 2HZ LYS 105 -5.182 -4.654 10.788 742 H ALA 106 H ALA 106 -3.916 -4.421 3.430 743 HA ALA 106 HA ALA 106 -6.733 -4.760 2.683 744 HB1 ALA 106 3HB ALA 106 -5.972 -5.499 0.548 745 HB2 ALA 106 1HB ALA 106 -5.073 -4.038 0.958 746 HB3 ALA 106 2HB ALA 106 -4.307 -5.619 1.119 747 H LYS 107 H LYS 107 -7.522 -6.893 2.151 748 HA LYS 107 HA LYS 107 -6.196 -9.000 3.728 749 HB2 LYS 107 1HB LYS 107 -8.407 -8.225 4.596 750 HB3 LYS 107 2HB LYS 107 -9.142 -8.763 3.091 751 HG2 LYS 107 1HG LYS 107 -8.572 -11.043 3.558 752 HG3 LYS 107 2HG LYS 107 -7.641 -10.564 4.979 753 HD2 LYS 107 1HD LYS 107 -9.773 -9.612 5.919 754 HD3 LYS 107 2HD LYS 107 -10.623 -10.385 4.579 755 HE2 LYS 107 1HE LYS 107 -10.818 -11.969 6.247 756 HE3 LYS 107 2HE LYS 107 -9.388 -12.527 5.381 757 HZ1 LYS 107 3HZ LYS 107 -9.225 -10.781 7.767 758 HZ2 LYS 107 1HZ LYS 107 -7.982 -11.668 7.040 759 HZ3 LYS 107 2HZ LYS 107 -9.217 -12.469 7.872 760 H VAL 108 H VAL 108 -5.450 -10.686 2.632 761 HA VAL 108 HA VAL 108 -6.400 -11.105 -0.119 762 HB VAL 108 HB VAL 108 -3.914 -12.319 1.063 763 HG11 VAL 108 1HG1 VAL 108 -3.452 -11.852 -1.576 764 HG12 VAL 108 2HG1 VAL 108 -4.059 -13.372 -0.916 765 HG13 VAL 108 3HG1 VAL 108 -5.184 -12.185 -1.578 766 HG21 VAL 108 3HG2 VAL 108 -4.379 -9.558 0.675 767 HG22 VAL 108 1HG2 VAL 108 -2.861 -10.364 1.072 768 HG23 VAL 108 2HG2 VAL 108 -3.302 -10.093 -0.614 769 H THR 109 H THR 109 -7.710 -12.758 -0.483 770 HA THR 109 HA THR 109 -7.622 -15.059 1.359 771 HB THR 109 HB THR 109 -10.011 -15.452 0.730 772 HG1 THR 109 1HG THR 109 -10.997 -13.371 -0.114 773 HG21 THR 109 3HG2 THR 109 -9.552 -12.722 1.930 774 HG22 THR 109 1HG2 THR 109 -9.309 -14.234 2.804 775 HG23 THR 109 2HG2 THR 109 -10.916 -13.803 2.217 776 H GLY 110 H GLY 110 -8.147 -17.150 0.435 777 HA2 GLY 110 1HA GLY 110 -8.666 -18.055 -1.977 778 HA3 GLY 110 2HA GLY 110 -7.069 -17.384 -2.277 779 H GLN 111 H GLN 111 -6.312 -19.477 -2.827 780 HA GLN 111 HA GLN 111 -5.796 -21.165 -0.471 781 HB2 GLN 111 1HB GLN 111 -6.004 -23.156 -1.838 782 HB3 GLN 111 2HB GLN 111 -7.484 -22.212 -1.942 783 HG2 GLN 111 1HG GLN 111 -6.362 -21.216 -4.074 784 HG3 GLN 111 2HG GLN 111 -5.389 -22.684 -4.006 785 HE21 GLN 111 1HE2 GLN 111 -8.360 -21.313 -4.887 786 HE22 GLN 111 2HE2 GLN 111 -9.160 -22.764 -5.376 787 H ARG 112 H ARG 112 -3.784 -22.184 -0.377 788 HA ARG 112 HA ARG 112 -1.572 -20.810 -1.190 789 HB2 ARG 112 1HB ARG 112 -1.775 -23.801 -0.793 790 HB3 ARG 112 2HB ARG 112 -0.280 -22.876 -0.796 791 HG2 ARG 112 1HG ARG 112 -0.738 -21.881 1.243 792 HG3 ARG 112 2HG ARG 112 -2.470 -22.196 1.120 793 HD2 ARG 112 1HD ARG 112 -0.503 -24.449 1.289 794 HD3 ARG 112 2HD ARG 112 -1.050 -23.618 2.744 795 HE ARG 112 HE ARG 112 -2.540 -25.479 1.155 796 HH11 ARG 112 1HH1 ARG 112 -2.782 -22.759 3.314 797 HH12 ARG 112 2HH1 ARG 112 -4.386 -23.150 3.838 798 HH21 ARG 112 1HH2 ARG 112 -4.652 -26.005 1.836 799 HH22 ARG 112 2HH2 ARG 112 -5.449 -24.997 2.997 800 H LEU 113 H LEU 113 -1.055 -20.210 -3.189 801 HA LEU 113 HA LEU 113 -1.582 -21.994 -5.436 802 HB2 LEU 113 1HB LEU 113 -0.579 -19.152 -5.376 803 HB3 LEU 113 2HB LEU 113 -0.980 -20.065 -6.829 804 HG LEU 113 HG LEU 113 -2.879 -19.102 -4.695 805 HD11 LEU 113 1HD1 LEU 113 -3.714 -17.629 -6.290 806 HD12 LEU 113 2HD1 LEU 113 -2.965 -18.499 -7.628 807 HD13 LEU 113 3HD1 LEU 113 -1.968 -17.548 -6.528 808 HD21 LEU 113 3HD2 LEU 113 -3.285 -20.999 -6.988 809 HD22 LEU 113 1HD2 LEU 113 -4.610 -20.059 -6.301 810 HD23 LEU 113 2HD2 LEU 113 -3.728 -21.206 -5.293 811 H VAL 114 H VAL 114 0.418 -22.887 -3.705 812 HA VAL 114 HA VAL 114 3.031 -22.187 -4.311 813 HB VAL 114 HB VAL 114 2.000 -24.957 -3.682 814 HG11 VAL 114 1HG1 VAL 114 4.314 -24.834 -4.621 815 HG12 VAL 114 2HG1 VAL 114 4.760 -23.832 -3.238 816 HG13 VAL 114 3HG1 VAL 114 4.221 -25.494 -2.988 817 HG21 VAL 114 3HG2 VAL 114 1.715 -22.757 -2.122 818 HG22 VAL 114 1HG2 VAL 114 1.871 -24.401 -1.505 819 HG23 VAL 114 2HG2 VAL 114 3.285 -23.350 -1.583 820 H SER 115 H SER 115 3.555 -21.841 -6.414 821 HA SER 115 HA SER 115 2.740 -23.474 -8.573 822 HB2 SER 115 1HB SER 115 4.195 -22.159 -9.925 823 HB3 SER 115 2HB SER 115 3.569 -21.069 -8.688 824 HG SER 115 HG SER 115 5.986 -21.208 -9.195 825 HA PRO 116 HA PRO 116 5.492 -26.895 -8.204 826 HB2 PRO 116 1HB PRO 116 5.376 -27.784 -10.766 827 HB3 PRO 116 2HB PRO 116 4.054 -28.001 -9.613 828 HG2 PRO 116 1HG PRO 116 4.372 -25.945 -11.765 829 HG3 PRO 116 2HG PRO 116 2.932 -26.873 -11.309 830 HD2 PRO 116 1HD PRO 116 3.321 -24.310 -10.528 831 HD3 PRO 116 2HD PRO 116 2.451 -25.491 -9.528 832 H GLY 117 H GLY 117 5.918 -24.994 -11.202 833 HA2 GLY 117 1HA GLY 117 8.167 -23.774 -11.170 834 HA3 GLY 117 2HA GLY 117 8.828 -25.384 -10.925 835 H SER 118 H SER 118 9.935 -25.716 -12.771 836 HA SER 118 HA SER 118 8.424 -25.507 -15.293 837 HB2 SER 118 1HB SER 118 10.296 -23.866 -15.103 838 HB3 SER 118 2HB SER 118 11.419 -25.219 -14.956 839 HG SER 118 HG SER 118 9.659 -25.172 -17.130 840 H ALA 119 H ALA 119 7.854 -27.480 -15.919 841 HA ALA 119 HA ALA 119 9.889 -29.605 -15.848 842 HB1 ALA 119 3HB ALA 119 7.780 -29.622 -14.161 843 HB2 ALA 119 1HB ALA 119 7.100 -30.489 -15.538 844 HB3 ALA 119 2HB ALA 119 8.573 -31.077 -14.766 845 H ASN 120 H ASN 120 10.089 -30.776 -17.677 846 HA ASN 120 HA ASN 120 7.969 -30.782 -19.665 847 HB2 ASN 120 1HB ASN 120 10.629 -29.443 -20.060 848 HB3 ASN 120 2HB ASN 120 9.780 -30.158 -21.429 849 HD21 ASN 120 1HD2 ASN 120 8.575 -28.799 -22.516 850 HD22 ASN 120 2HD2 ASN 120 7.792 -27.394 -21.886 851 H GLU 121 H GLU 121 8.293 -32.359 -21.343 852 HA GLU 121 HA GLU 121 10.480 -34.254 -20.924 853 HB2 GLU 121 1HB GLU 121 8.354 -34.902 -19.615 854 HB3 GLU 121 2HB GLU 121 7.658 -35.260 -21.189 855 HG2 GLU 121 1HG GLU 121 8.470 -37.297 -20.320 856 HG3 GLU 121 2HG GLU 121 9.592 -36.803 -21.588 857 H THR 122 H THR 122 10.765 -35.750 -22.703 858 HA THR 122 HA THR 122 9.558 -34.793 -25.217 859 HB THR 122 HB THR 122 11.669 -35.247 -26.370 860 HG1 THR 122 1HG THR 122 12.387 -36.187 -23.829 861 HG21 THR 122 3HG2 THR 122 11.913 -33.418 -23.981 862 HG22 THR 122 1HG2 THR 122 11.347 -32.991 -25.595 863 HG23 THR 122 2HG2 THR 122 13.036 -33.432 -25.341 864 H SER 123 H SER 123 9.904 -36.449 -27.028 865 HA SER 123 HA SER 123 10.048 -39.210 -26.206 866 HB2 SER 123 1HB SER 123 7.807 -39.839 -26.866 867 HB3 SER 123 2HB SER 123 7.695 -38.561 -25.656 868 HG SER 123 HG SER 123 6.356 -38.382 -27.648 869 H SER 124 H SER 124 11.428 -39.886 -27.715 870 HA SER 124 HA SER 124 11.486 -38.812 -30.366 871 HB2 SER 124 1HB SER 124 13.442 -39.801 -28.974 872 HB3 SER 124 2HB SER 124 12.861 -41.361 -29.555 873 HG SER 124 HG SER 124 13.906 -39.195 -31.027 874 H ILE 125 H ILE 125 11.492 -40.328 -32.291 875 HA ILE 125 HA ILE 125 8.949 -41.476 -32.588 876 HB ILE 125 HB ILE 125 11.411 -41.939 -34.275 877 HG12 ILE 125 1HG1 ILE 125 9.136 -40.018 -34.775 878 HG13 ILE 125 2HG1 ILE 125 10.624 -39.544 -33.962 879 HG21 ILE 125 1HG2 ILE 125 8.607 -42.822 -34.503 880 HG22 ILE 125 2HG2 ILE 125 9.346 -42.194 -35.975 881 HG23 ILE 125 3HG2 ILE 125 10.084 -43.554 -35.129 882 HD11 ILE 125 3HD1 ILE 125 11.890 -39.763 -35.877 883 HD12 ILE 125 1HD1 ILE 125 10.726 -40.839 -36.649 884 HD13 ILE 125 2HD1 ILE 125 10.367 -39.119 -36.491 Start of MODEL 20 1 H1 GLY 1 H GLY 1 -19.699 17.798 35.905 2 HA2 GLY 1 1HA GLY 1 -22.156 16.934 34.534 3 HA3 GLY 1 2HA GLY 1 -21.811 18.650 34.691 4 H SER 2 H SER 2 -21.754 18.904 32.434 5 HA SER 2 HA SER 2 -19.175 18.523 31.278 6 HB2 SER 2 1HB SER 2 -20.139 16.255 30.948 7 HB3 SER 2 2HB SER 2 -21.458 16.977 30.026 8 HG SER 2 HG SER 2 -18.730 16.768 29.366 9 H SER 3 H SER 3 -19.097 19.368 29.015 10 HA SER 3 HA SER 3 -21.260 20.823 27.917 11 HB2 SER 3 1HB SER 3 -20.597 22.192 30.005 12 HB3 SER 3 2HB SER 3 -19.156 22.632 29.089 13 HG SER 3 HG SER 3 -20.416 24.128 28.311 14 H GLY 4 H GLY 4 -20.341 22.512 26.253 15 HA2 GLY 4 1HA GLY 4 -17.883 22.639 25.189 16 HA3 GLY 4 2HA GLY 4 -18.400 21.041 24.673 17 H SER 5 H SER 5 -17.754 22.981 22.829 18 HA SER 5 HA SER 5 -20.341 23.353 21.517 19 HB2 SER 5 1HB SER 5 -19.636 25.490 22.717 20 HB3 SER 5 2HB SER 5 -18.303 25.581 21.566 21 HG SER 5 HG SER 5 -19.743 26.592 20.402 22 H SER 6 H SER 6 -20.118 22.156 19.746 23 HA SER 6 HA SER 6 -17.535 22.046 18.381 24 HB2 SER 6 1HB SER 6 -19.967 20.325 18.435 25 HB3 SER 6 2HB SER 6 -18.999 20.325 16.961 26 HG SER 6 HG SER 6 -18.532 18.925 19.076 27 H GLY 7 H GLY 7 -17.132 23.219 16.628 28 HA2 GLY 7 1HA GLY 7 -18.097 23.685 14.327 29 HA3 GLY 7 2HA GLY 7 -19.425 24.422 15.212 30 H PHE 8 H PHE 8 -16.047 24.705 14.335 31 HA PHE 8 HA PHE 8 -16.186 27.565 15.021 32 HB2 PHE 8 1HB PHE 8 -13.643 27.339 15.392 33 HB3 PHE 8 2HB PHE 8 -14.716 26.736 16.651 34 HD1 PHE 8 2HD PHE 8 -15.111 24.293 16.861 35 HD2 PHE 8 1HD PHE 8 -12.178 25.900 14.229 36 HE1 PHE 8 2HE PHE 8 -14.025 22.089 16.731 37 HE2 PHE 8 1HE PHE 8 -11.087 23.699 14.094 38 HZ PHE 8 HZ PHE 8 -12.010 21.790 15.347 39 H LYS 9 H LYS 9 -15.896 28.853 13.334 40 HA LYS 9 HA LYS 9 -15.186 27.806 10.770 41 HB2 LYS 9 1HB LYS 9 -15.855 30.537 11.823 42 HB3 LYS 9 2HB LYS 9 -15.227 30.343 10.192 43 HG2 LYS 9 1HG LYS 9 -17.087 28.889 9.624 44 HG3 LYS 9 2HG LYS 9 -17.705 29.016 11.272 45 HD2 LYS 9 1HD LYS 9 -18.972 30.543 9.994 46 HD3 LYS 9 2HD LYS 9 -17.808 31.522 10.890 47 HE2 LYS 9 1HE LYS 9 -17.890 32.325 8.636 48 HE3 LYS 9 2HE LYS 9 -16.346 31.509 8.875 49 HZ1 LYS 9 3HZ LYS 9 -18.333 30.963 6.967 50 HZ2 LYS 9 1HZ LYS 9 -18.174 29.610 7.970 51 HZ3 LYS 9 2HZ LYS 9 -16.824 30.224 7.156 52 H VAL 10 H VAL 10 -13.106 27.108 10.652 53 HA VAL 10 HA VAL 10 -11.033 29.172 10.867 54 HB VAL 10 HB VAL 10 -10.775 26.387 12.010 55 HG11 VAL 10 1HG1 VAL 10 -8.718 28.541 12.276 56 HG12 VAL 10 2HG1 VAL 10 -8.536 26.792 12.430 57 HG13 VAL 10 3HG1 VAL 10 -8.754 27.521 10.838 58 HG21 VAL 10 3HG2 VAL 10 -12.085 27.914 13.416 59 HG22 VAL 10 1HG2 VAL 10 -10.540 27.503 14.159 60 HG23 VAL 10 2HG2 VAL 10 -10.756 29.073 13.386 61 H ARG 11 H ARG 11 -9.739 29.230 9.144 62 HA ARG 11 HA ARG 11 -10.053 27.197 7.093 63 HB2 ARG 11 1HB ARG 11 -8.624 29.856 7.137 64 HB3 ARG 11 2HB ARG 11 -8.598 28.769 5.755 65 HG2 ARG 11 1HG ARG 11 -11.188 28.892 5.950 66 HG3 ARG 11 2HG ARG 11 -10.859 30.364 6.865 67 HD2 ARG 11 1HD ARG 11 -9.707 31.341 5.018 68 HD3 ARG 11 2HD ARG 11 -9.736 29.822 4.124 69 HE ARG 11 HE ARG 11 -11.881 30.289 3.462 70 HH11 ARG 11 1HH1 ARG 11 -10.992 32.413 6.073 71 HH12 ARG 11 2HH1 ARG 11 -12.403 33.406 5.919 72 HH21 ARG 11 1HH2 ARG 11 -13.743 31.589 3.249 73 HH22 ARG 11 2HH2 ARG 11 -13.967 32.936 4.312 74 H VAL 12 H VAL 12 -8.792 25.466 7.095 75 HA VAL 12 HA VAL 12 -6.553 25.045 8.669 76 HB VAL 12 HB VAL 12 -7.164 23.740 6.013 77 HG11 VAL 12 1HG1 VAL 12 -4.835 23.439 6.889 78 HG12 VAL 12 2HG1 VAL 12 -5.537 22.652 8.304 79 HG13 VAL 12 3HG1 VAL 12 -5.754 21.946 6.702 80 HG21 VAL 12 3HG2 VAL 12 -8.973 23.668 7.774 81 HG22 VAL 12 1HG2 VAL 12 -8.393 22.103 7.206 82 HG23 VAL 12 2HG2 VAL 12 -7.855 22.731 8.764 83 H GLY 13 H GLY 13 -4.817 26.343 8.655 84 HA2 GLY 13 1HA GLY 13 -3.786 27.384 6.133 85 HA3 GLY 13 2HA GLY 13 -3.247 27.835 7.744 86 H GLU 14 H GLU 14 -2.471 26.131 4.984 87 HA GLU 14 HA GLU 14 -1.030 23.941 6.019 88 HB2 GLU 14 1HB GLU 14 -0.292 23.582 3.862 89 HB3 GLU 14 2HB GLU 14 -1.748 24.524 3.570 90 HG2 GLU 14 1HG GLU 14 1.049 25.634 3.644 91 HG3 GLU 14 2HG GLU 14 0.145 25.241 2.183 92 HA PRO 15 HA PRO 15 2.651 25.701 7.634 93 HB2 PRO 15 1HB PRO 15 4.467 23.780 7.018 94 HB3 PRO 15 2HB PRO 15 3.242 23.576 8.276 95 HG2 PRO 15 1HG PRO 15 3.241 22.582 5.452 96 HG3 PRO 15 2HG PRO 15 2.756 21.739 6.935 97 HD2 PRO 15 1HD PRO 15 0.962 22.842 5.233 98 HD3 PRO 15 2HD PRO 15 0.687 22.753 6.984 99 H GLY 16 H GLY 16 2.876 24.446 4.321 100 HA2 GLY 16 1HA GLY 16 3.648 25.638 2.457 101 HA3 GLY 16 2HA GLY 16 4.322 26.849 3.537 102 H GLN 17 H GLN 17 4.772 23.447 2.592 103 HA GLN 17 HA GLN 17 7.675 23.918 2.684 104 HB2 GLN 17 1HB GLN 17 6.184 21.473 3.646 105 HB3 GLN 17 2HB GLN 17 7.929 21.546 3.440 106 HG2 GLN 17 1HG GLN 17 6.242 23.105 5.376 107 HG3 GLN 17 2HG GLN 17 7.455 21.880 5.740 108 HE21 GLN 17 1HE2 GLN 17 7.096 24.826 6.388 109 HE22 GLN 17 2HE2 GLN 17 8.631 25.523 6.009 110 H ALA 18 H ALA 18 8.839 23.151 0.995 111 HA ALA 18 HA ALA 18 7.804 22.770 -1.480 112 HB1 ALA 18 3HB ALA 18 9.974 22.731 -1.932 113 HB2 ALA 18 1HB ALA 18 10.348 22.366 -0.248 114 HB3 ALA 18 2HB ALA 18 10.039 21.055 -1.387 115 H GLY 19 H GLY 19 6.293 21.400 -2.160 116 HA2 GLY 19 1HA GLY 19 5.325 19.382 -2.726 117 HA3 GLY 19 2HA GLY 19 6.699 18.568 -1.994 118 H ASN 20 H ASN 20 3.548 18.540 -1.847 119 HA ASN 20 HA ASN 20 3.475 18.211 1.080 120 HB2 ASN 20 1HB ASN 20 2.100 20.074 0.736 121 HB3 ASN 20 2HB ASN 20 1.457 19.440 -0.776 122 HD21 ASN 20 1HD2 ASN 20 -0.571 20.099 0.305 123 HD22 ASN 20 2HD2 ASN 20 -1.351 18.946 1.329 124 HA PRO 21 HA PRO 21 2.476 14.019 0.007 125 HB2 PRO 21 1HB PRO 21 1.990 13.167 2.539 126 HB3 PRO 21 2HB PRO 21 3.621 13.430 1.910 127 HG2 PRO 21 1HG PRO 21 1.943 15.216 3.630 128 HG3 PRO 21 2HG PRO 21 3.669 14.834 3.764 129 HD2 PRO 21 1HD PRO 21 2.767 17.134 2.656 130 HD3 PRO 21 2HD PRO 21 4.257 16.333 2.115 131 H ALA 22 H ALA 22 0.454 15.769 2.363 132 HA ALA 22 HA ALA 22 -1.809 14.302 2.444 133 HB1 ALA 22 3HB ALA 22 -1.373 16.553 3.517 134 HB2 ALA 22 1HB ALA 22 -1.936 17.274 2.009 135 HB3 ALA 22 2HB ALA 22 -3.021 16.260 2.961 136 H LEU 23 H LEU 23 -0.899 16.495 -0.190 137 HA LEU 23 HA LEU 23 -3.232 16.258 -1.715 138 HB2 LEU 23 1HB LEU 23 -0.382 16.878 -2.406 139 HB3 LEU 23 2HB LEU 23 -1.620 16.774 -3.656 140 HG LEU 23 HG LEU 23 -1.604 18.705 -1.337 141 HD11 LEU 23 1HD1 LEU 23 0.040 19.452 -2.819 142 HD12 LEU 23 2HD1 LEU 23 -1.403 20.352 -3.283 143 HD13 LEU 23 3HD1 LEU 23 -0.886 18.963 -4.238 144 HD21 LEU 23 3HD2 LEU 23 -3.777 18.947 -1.715 145 HD22 LEU 23 1HD2 LEU 23 -3.717 17.790 -3.046 146 HD23 LEU 23 2HD2 LEU 23 -3.396 19.498 -3.347 147 H VAL 24 H VAL 24 -0.294 14.294 -1.660 148 HA VAL 24 HA VAL 24 -0.911 12.654 -3.864 149 HB VAL 24 HB VAL 24 0.758 12.010 -1.428 150 HG11 VAL 24 1HG1 VAL 24 -0.104 10.076 -2.880 151 HG12 VAL 24 2HG1 VAL 24 0.993 10.698 -4.115 152 HG13 VAL 24 3HG1 VAL 24 1.628 10.162 -2.558 153 HG21 VAL 24 3HG2 VAL 24 1.408 13.248 -4.090 154 HG22 VAL 24 1HG2 VAL 24 1.715 13.890 -2.477 155 HG23 VAL 24 2HG2 VAL 24 2.637 12.507 -3.065 156 H SER 25 H SER 25 -2.143 10.875 -4.093 157 HA SER 25 HA SER 25 -3.276 9.609 -1.705 158 HB2 SER 25 1HB SER 25 -4.899 11.309 -2.587 159 HB3 SER 25 2HB SER 25 -4.959 10.395 -4.094 160 HG SER 25 HG SER 25 -6.646 9.871 -2.571 161 H ALA 26 H ALA 26 -4.351 7.517 -2.229 162 HA ALA 26 HA ALA 26 -3.159 6.241 -4.601 163 HB1 ALA 26 3HB ALA 26 -2.452 5.732 -1.950 164 HB2 ALA 26 1HB ALA 26 -3.477 4.377 -2.428 165 HB3 ALA 26 2HB ALA 26 -2.038 4.771 -3.370 166 H TYR 27 H TYR 27 -4.517 5.064 -5.809 167 HA TYR 27 HA TYR 27 -6.957 3.978 -4.659 168 HB2 TYR 27 1HB TYR 27 -8.413 5.025 -6.320 169 HB3 TYR 27 2HB TYR 27 -7.600 6.251 -5.352 170 HD1 TYR 27 1HD TYR 27 -5.425 7.255 -6.372 171 HD2 TYR 27 2HD TYR 27 -8.368 5.180 -8.637 172 HE1 TYR 27 1HE TYR 27 -4.598 8.333 -8.422 173 HE2 TYR 27 2HE TYR 27 -7.549 6.250 -10.694 174 HH TYR 27 HH TYR 27 -4.885 7.409 -11.230 175 H GLY 28 H GLY 28 -8.098 2.537 -6.169 176 HA2 GLY 28 1HA GLY 28 -7.432 1.741 -8.663 177 HA3 GLY 28 2HA GLY 28 -6.183 0.986 -7.684 178 H THR 29 H THR 29 -6.867 -1.101 -8.164 179 HA THR 29 HA THR 29 -9.452 -1.863 -6.965 180 HB THR 29 HB THR 29 -8.122 -3.485 -9.117 181 HG1 THR 29 1HG THR 29 -9.484 -2.338 -10.604 182 HG21 THR 29 3HG2 THR 29 -11.048 -3.267 -8.922 183 HG22 THR 29 1HG2 THR 29 -10.264 -3.999 -7.523 184 HG23 THR 29 2HG2 THR 29 -10.028 -4.691 -9.129 185 H GLY 30 H GLY 30 -6.070 -2.262 -6.939 186 HA2 GLY 30 1HA GLY 30 -5.918 -4.917 -5.930 187 HA3 GLY 30 2HA GLY 30 -4.659 -3.696 -5.825 188 H LEU 31 H LEU 31 -6.388 -1.791 -4.420 189 HA LEU 31 HA LEU 31 -5.818 -2.623 -1.766 190 HB2 LEU 31 1HB LEU 31 -7.557 -0.347 -2.705 191 HB3 LEU 31 2HB LEU 31 -6.887 -0.546 -1.087 192 HG LEU 31 HG LEU 31 -5.069 -0.325 -3.456 193 HD11 LEU 31 1HD1 LEU 31 -6.055 2.056 -1.912 194 HD12 LEU 31 2HD1 LEU 31 -6.765 1.558 -3.447 195 HD13 LEU 31 3HD1 LEU 31 -5.066 2.027 -3.372 196 HD21 LEU 31 3HD2 LEU 31 -4.576 0.838 -0.762 197 HD22 LEU 31 1HD2 LEU 31 -3.443 0.137 -1.917 198 HD23 LEU 31 2HD2 LEU 31 -4.482 -0.913 -0.954 199 H GLU 32 H GLU 32 -8.624 -2.811 -3.806 200 HA GLU 32 HA GLU 32 -10.696 -3.035 -2.014 201 HB2 GLU 32 1HB GLU 32 -10.219 -4.576 -4.567 202 HB3 GLU 32 2HB GLU 32 -11.741 -4.595 -3.688 203 HG2 GLU 32 1HG GLU 32 -11.689 -2.046 -3.929 204 HG3 GLU 32 2HG GLU 32 -10.449 -2.325 -5.150 205 H GLY 33 H GLY 33 -8.101 -5.264 -2.608 206 HA2 GLY 33 1HA GLY 33 -8.271 -6.664 -0.267 207 HA3 GLY 33 2HA GLY 33 -9.358 -7.520 -1.350 208 H GLY 34 H GLY 34 -7.443 -9.050 -0.493 209 HA2 GLY 34 1HA GLY 34 -5.170 -8.898 -2.336 210 HA3 GLY 34 2HA GLY 34 -5.290 -9.943 -0.928 211 H THR 35 H THR 35 -5.684 -9.697 -4.294 212 HA THR 35 HA THR 35 -7.221 -12.184 -4.457 213 HB THR 35 HB THR 35 -6.294 -10.662 -6.867 214 HG1 THR 35 1HG THR 35 -8.127 -9.324 -6.658 215 HG21 THR 35 3HG2 THR 35 -8.840 -11.420 -7.330 216 HG22 THR 35 1HG2 THR 35 -8.351 -12.668 -6.186 217 HG23 THR 35 2HG2 THR 35 -7.442 -12.437 -7.679 218 H THR 36 H THR 36 -5.932 -13.906 -4.158 219 HA THR 36 HA THR 36 -3.206 -13.994 -5.018 220 HB THR 36 HB THR 36 -4.768 -16.463 -4.345 221 HG1 THR 36 1HG THR 36 -4.173 -14.291 -2.662 222 HG21 THR 36 3HG2 THR 36 -2.750 -17.372 -3.937 223 HG22 THR 36 1HG2 THR 36 -2.157 -15.928 -3.118 224 HG23 THR 36 2HG2 THR 36 -2.128 -16.018 -4.879 225 H GLY 37 H GLY 37 -2.313 -14.925 -6.798 226 HA2 GLY 37 1HA GLY 37 -2.243 -16.276 -8.720 227 HA3 GLY 37 2HA GLY 37 -3.981 -16.505 -8.594 228 H ILE 38 H ILE 38 -4.279 -13.516 -8.249 229 HA ILE 38 HA ILE 38 -4.112 -12.869 -11.113 230 HB ILE 38 HB ILE 38 -5.845 -11.506 -9.055 231 HG12 ILE 38 1HG1 ILE 38 -6.529 -13.766 -10.948 232 HG13 ILE 38 2HG1 ILE 38 -6.499 -13.849 -9.190 233 HG21 ILE 38 1HG2 ILE 38 -7.118 -10.974 -11.246 234 HG22 ILE 38 2HG2 ILE 38 -5.660 -10.063 -10.856 235 HG23 ILE 38 3HG2 ILE 38 -5.591 -11.375 -12.032 236 HD11 ILE 38 3HD1 ILE 38 -8.690 -13.482 -9.345 237 HD12 ILE 38 1HD1 ILE 38 -8.237 -11.800 -9.619 238 HD13 ILE 38 2HD1 ILE 38 -8.568 -12.859 -10.990 239 H GLN 39 H GLN 39 -3.677 -10.619 -11.689 240 HA GLN 39 HA GLN 39 -1.792 -9.378 -9.798 241 HB2 GLN 39 1HB GLN 39 -0.583 -10.053 -11.721 242 HB3 GLN 39 2HB GLN 39 -1.833 -9.461 -12.808 243 HG2 GLN 39 1HG GLN 39 -1.301 -7.150 -12.051 244 HG3 GLN 39 2HG GLN 39 0.054 -7.817 -11.141 245 HE21 GLN 39 1HE2 GLN 39 1.266 -9.521 -12.690 246 HE22 GLN 39 2HE2 GLN 39 1.778 -8.817 -14.182 247 H SER 40 H SER 40 -2.482 -7.567 -8.895 248 HA SER 40 HA SER 40 -4.528 -5.979 -10.287 249 HB2 SER 40 1HB SER 40 -3.770 -6.033 -7.356 250 HB3 SER 40 2HB SER 40 -5.029 -5.018 -8.061 251 HG SER 40 HG SER 40 -5.880 -6.946 -7.169 252 H GLU 41 H GLU 41 -4.407 -3.616 -10.028 253 HA GLU 41 HA GLU 41 -1.733 -2.551 -9.543 254 HB2 GLU 41 1HB GLU 41 -1.891 -1.230 -11.692 255 HB3 GLU 41 2HB GLU 41 -1.589 -2.951 -11.878 256 HG2 GLU 41 1HG GLU 41 -4.299 -1.672 -12.130 257 HG3 GLU 41 2HG GLU 41 -3.230 -2.021 -13.487 258 H PHE 42 H PHE 42 -1.762 -0.592 -8.605 259 HA PHE 42 HA PHE 42 -4.324 0.863 -8.556 260 HB2 PHE 42 1HB PHE 42 -3.857 1.531 -6.261 261 HB3 PHE 42 2HB PHE 42 -3.844 -0.224 -6.389 262 HD1 PHE 42 1HD PHE 42 -1.624 2.745 -6.283 263 HD2 PHE 42 2HD PHE 42 -1.994 -1.454 -5.687 264 HE1 PHE 42 1HE PHE 42 0.619 2.694 -5.274 265 HE2 PHE 42 2HE PHE 42 0.248 -1.511 -4.676 266 HZ PHE 42 HZ PHE 42 1.558 0.564 -4.467 267 H PHE 43 H PHE 43 -4.272 3.007 -8.960 268 HA PHE 43 HA PHE 43 -1.716 4.131 -9.798 269 HB2 PHE 43 1HB PHE 43 -4.543 5.158 -10.121 270 HB3 PHE 43 2HB PHE 43 -3.107 5.951 -10.761 271 HD1 PHE 43 1HD PHE 43 -1.661 4.612 -12.398 272 HD2 PHE 43 2HD PHE 43 -5.653 3.552 -11.370 273 HE1 PHE 43 1HE PHE 43 -1.826 3.259 -14.447 274 HE2 PHE 43 2HE PHE 43 -5.824 2.196 -13.416 275 HZ PHE 43 HZ PHE 43 -3.908 2.048 -14.957 276 H ILE 44 H ILE 44 -0.843 6.023 -8.980 277 HA ILE 44 HA ILE 44 -1.906 6.842 -6.361 278 HB ILE 44 HB ILE 44 0.895 6.869 -7.463 279 HG12 ILE 44 1HG1 ILE 44 -0.273 5.696 -4.930 280 HG13 ILE 44 2HG1 ILE 44 0.041 4.789 -6.405 281 HG21 ILE 44 1HG2 ILE 44 -0.148 8.255 -5.000 282 HG22 ILE 44 2HG2 ILE 44 1.558 7.979 -5.343 283 HG23 ILE 44 3HG2 ILE 44 0.600 9.006 -6.409 284 HD11 ILE 44 3HD1 ILE 44 1.778 5.249 -4.260 285 HD12 ILE 44 1HD1 ILE 44 2.134 4.450 -5.792 286 HD13 ILE 44 2HD1 ILE 44 2.406 6.185 -5.617 287 H ASN 45 H ASN 45 -2.898 8.737 -6.313 288 HA ASN 45 HA ASN 45 -2.798 10.589 -8.468 289 HB2 ASN 45 1HB ASN 45 -4.665 10.133 -6.665 290 HB3 ASN 45 2HB ASN 45 -3.803 11.376 -5.761 291 HD21 ASN 45 1HD2 ASN 45 -6.449 11.109 -7.339 292 HD22 ASN 45 2HD2 ASN 45 -6.504 12.578 -8.246 293 H THR 46 H THR 46 -0.547 11.055 -8.639 294 HA THR 46 HA THR 46 0.347 13.066 -6.684 295 HB THR 46 HB THR 46 1.635 11.059 -6.241 296 HG1 THR 46 1HG THR 46 3.780 11.990 -7.006 297 HG21 THR 46 3HG2 THR 46 2.094 11.104 -9.208 298 HG22 THR 46 1HG2 THR 46 1.531 9.775 -8.195 299 HG23 THR 46 2HG2 THR 46 3.217 10.288 -8.121 300 H THR 47 H THR 47 -0.989 13.793 -8.949 301 HA THR 47 HA THR 47 1.094 14.638 -10.844 302 HB THR 47 HB THR 47 -0.895 15.293 -12.292 303 HG1 THR 47 1HG THR 47 -2.287 13.613 -10.456 304 HG21 THR 47 3HG2 THR 47 -1.321 12.454 -12.082 305 HG22 THR 47 1HG2 THR 47 0.392 12.830 -11.906 306 HG23 THR 47 2HG2 THR 47 -0.487 13.366 -13.338 307 H ARG 48 H ARG 48 -1.446 15.815 -8.721 308 HA ARG 48 HA ARG 48 -0.918 18.581 -9.463 309 HB2 ARG 48 1HB ARG 48 -2.827 19.158 -8.193 310 HB3 ARG 48 2HB ARG 48 -3.243 17.659 -9.013 311 HG2 ARG 48 1HG ARG 48 -3.344 16.470 -7.089 312 HG3 ARG 48 2HG ARG 48 -2.086 17.425 -6.303 313 HD2 ARG 48 1HD ARG 48 -3.882 18.173 -5.125 314 HD3 ARG 48 2HD ARG 48 -3.947 19.309 -6.472 315 HE ARG 48 HE ARG 48 -5.508 17.310 -7.345 316 HH11 ARG 48 1HH1 ARG 48 -5.414 19.047 -4.329 317 HH12 ARG 48 2HH1 ARG 48 -7.110 18.871 -4.025 318 HH21 ARG 48 1HH2 ARG 48 -7.743 17.072 -6.955 319 HH22 ARG 48 2HH2 ARG 48 -8.434 17.746 -5.519 320 H ALA 49 H ALA 49 0.478 16.374 -7.467 321 HA ALA 49 HA ALA 49 0.963 18.098 -5.196 322 HB1 ALA 49 3HB ALA 49 2.377 16.248 -4.389 323 HB2 ALA 49 1HB ALA 49 0.749 15.720 -4.815 324 HB3 ALA 49 2HB ALA 49 2.096 15.396 -5.908 325 H GLY 50 H GLY 50 2.791 16.850 -7.966 326 HA2 GLY 50 1HA GLY 50 4.305 18.746 -8.829 327 HA3 GLY 50 2HA GLY 50 5.025 18.622 -7.230 328 HA PRO 51 HA PRO 51 7.849 15.679 -8.854 329 HB2 PRO 51 1HB PRO 51 8.541 14.402 -6.561 330 HB3 PRO 51 2HB PRO 51 9.090 16.035 -6.954 331 HG2 PRO 51 1HG PRO 51 6.848 15.169 -5.169 332 HG3 PRO 51 2HG PRO 51 8.062 16.435 -4.907 333 HD2 PRO 51 1HD PRO 51 5.540 16.982 -5.728 334 HD3 PRO 51 2HD PRO 51 6.938 17.960 -6.220 335 H GLY 52 H GLY 52 8.355 13.235 -8.614 336 HA2 GLY 52 1HA GLY 52 5.895 11.684 -8.184 337 HA3 GLY 52 2HA GLY 52 6.714 11.574 -9.735 338 H THR 53 H THR 53 8.252 11.821 -6.571 339 HA THR 53 HA THR 53 9.249 9.069 -6.918 340 HB THR 53 HB THR 53 10.810 11.402 -5.791 341 HG1 THR 53 1HG THR 53 12.073 11.057 -7.730 342 HG21 THR 53 3HG2 THR 53 12.618 9.455 -6.324 343 HG22 THR 53 1HG2 THR 53 11.231 8.487 -5.824 344 HG23 THR 53 2HG2 THR 53 11.886 9.716 -4.741 345 H LEU 54 H LEU 54 8.168 7.923 -5.429 346 HA LEU 54 HA LEU 54 8.221 8.907 -2.654 347 HB2 LEU 54 1HB LEU 54 6.058 7.425 -2.505 348 HB3 LEU 54 2HB LEU 54 5.985 9.104 -3.034 349 HG LEU 54 HG LEU 54 4.573 7.543 -4.362 350 HD11 LEU 54 1HD1 LEU 54 5.985 9.695 -5.181 351 HD12 LEU 54 2HD1 LEU 54 4.833 8.823 -6.192 352 HD13 LEU 54 3HD1 LEU 54 6.557 8.477 -6.321 353 HD21 LEU 54 3HD2 LEU 54 5.370 5.714 -5.379 354 HD22 LEU 54 1HD2 LEU 54 6.727 5.869 -4.262 355 HD23 LEU 54 2HD2 LEU 54 6.849 6.526 -5.895 356 H SER 55 H SER 55 8.018 7.152 -1.031 357 HA SER 55 HA SER 55 9.512 4.788 -1.935 358 HB2 SER 55 1HB SER 55 10.557 6.240 -0.181 359 HB3 SER 55 2HB SER 55 9.217 5.832 0.890 360 HG SER 55 HG SER 55 11.438 4.469 0.498 361 H VAL 56 H VAL 56 7.998 3.313 -2.503 362 HA VAL 56 HA VAL 56 5.779 2.786 -0.661 363 HB VAL 56 HB VAL 56 5.112 3.096 -2.967 364 HG11 VAL 56 1HG1 VAL 56 6.133 0.763 -4.221 365 HG12 VAL 56 2HG1 VAL 56 6.407 2.453 -4.651 366 HG13 VAL 56 3HG1 VAL 56 7.489 1.644 -3.517 367 HG21 VAL 56 3HG2 VAL 56 3.702 1.590 -1.852 368 HG22 VAL 56 1HG2 VAL 56 4.088 0.789 -3.375 369 HG23 VAL 56 2HG2 VAL 56 4.904 0.300 -1.890 370 H THR 57 H THR 57 5.762 1.055 0.616 371 HA THR 57 HA THR 57 7.432 -1.256 -0.072 372 HB THR 57 HB THR 57 7.407 0.060 2.652 373 HG1 THR 57 1HG THR 57 9.204 0.056 0.494 374 HG21 THR 57 3HG2 THR 57 8.382 -2.573 1.666 375 HG22 THR 57 1HG2 THR 57 7.682 -2.140 3.225 376 HG23 THR 57 2HG2 THR 57 9.357 -1.721 2.863 377 H ILE 58 H ILE 58 6.598 -3.217 0.510 378 HA ILE 58 HA ILE 58 3.954 -3.168 1.811 379 HB ILE 58 HB ILE 58 5.001 -5.172 -0.192 380 HG12 ILE 58 1HG1 ILE 58 2.661 -3.362 -0.656 381 HG13 ILE 58 2HG1 ILE 58 4.289 -2.737 -0.889 382 HG21 ILE 58 1HG2 ILE 58 3.529 -6.448 0.990 383 HG22 ILE 58 2HG2 ILE 58 2.576 -5.061 1.514 384 HG23 ILE 58 3HG2 ILE 58 2.402 -5.680 -0.128 385 HD11 ILE 58 3HD1 ILE 58 3.169 -5.168 -2.261 386 HD12 ILE 58 1HD1 ILE 58 3.254 -3.553 -2.964 387 HD13 ILE 58 2HD1 ILE 58 4.737 -4.416 -2.554 388 H GLU 59 H GLU 59 3.445 -4.772 3.316 389 HA GLU 59 HA GLU 59 5.683 -6.452 4.224 390 HB2 GLU 59 1HB GLU 59 5.113 -4.281 5.601 391 HB3 GLU 59 2HB GLU 59 3.797 -5.269 6.220 392 HG2 GLU 59 1HG GLU 59 6.594 -6.309 6.253 393 HG3 GLU 59 2HG GLU 59 6.048 -5.180 7.492 394 H GLY 60 H GLY 60 5.172 -8.530 4.512 395 HA2 GLY 60 1HA GLY 60 2.605 -9.396 5.427 396 HA3 GLY 60 2HA GLY 60 2.806 -9.674 3.703 397 HA PRO 61 HA PRO 61 4.523 -13.280 6.154 398 HB2 PRO 61 1HB PRO 61 2.962 -15.175 4.995 399 HB3 PRO 61 2HB PRO 61 2.471 -14.276 6.436 400 HG2 PRO 61 1HG PRO 61 1.715 -13.828 3.574 401 HG3 PRO 61 2HG PRO 61 0.693 -13.780 5.022 402 HD2 PRO 61 1HD PRO 61 1.633 -11.539 3.827 403 HD3 PRO 61 2HD PRO 61 1.365 -11.646 5.579 404 H SER 62 H SER 62 3.417 -13.317 2.761 405 HA SER 62 HA SER 62 5.938 -14.649 2.032 406 HB2 SER 62 1HB SER 62 3.239 -14.594 0.678 407 HB3 SER 62 2HB SER 62 4.692 -15.203 -0.114 408 HG SER 62 HG SER 62 3.460 -16.191 2.240 409 H LYS 63 H LYS 63 6.865 -14.040 -0.084 410 HA LYS 63 HA LYS 63 7.176 -11.207 -0.251 411 HB2 LYS 63 1HB LYS 63 9.066 -12.643 -0.705 412 HB3 LYS 63 2HB LYS 63 8.194 -13.449 -2.003 413 HG2 LYS 63 1HG LYS 63 9.697 -11.967 -3.041 414 HG3 LYS 63 2HG LYS 63 8.106 -11.215 -3.170 415 HD2 LYS 63 1HD LYS 63 8.737 -9.975 -1.012 416 HD3 LYS 63 2HD LYS 63 10.389 -10.489 -1.360 417 HE2 LYS 63 1HE LYS 63 10.543 -9.178 -3.244 418 HE3 LYS 63 2HE LYS 63 8.800 -9.168 -3.508 419 HZ1 LYS 63 3HZ LYS 63 10.397 -7.539 -1.646 420 HZ2 LYS 63 1HZ LYS 63 8.761 -7.827 -1.327 421 HZ3 LYS 63 2HZ LYS 63 9.219 -7.045 -2.755 422 H VAL 64 H VAL 64 6.714 -9.853 -2.041 423 HA VAL 64 HA VAL 64 4.702 -10.876 -3.924 424 HB VAL 64 HB VAL 64 3.478 -8.706 -3.718 425 HG11 VAL 64 1HG1 VAL 64 3.571 -10.866 -1.753 426 HG12 VAL 64 2HG1 VAL 64 2.833 -9.382 -1.147 427 HG13 VAL 64 3HG1 VAL 64 2.194 -10.158 -2.597 428 HG21 VAL 64 3HG2 VAL 64 5.543 -8.294 -1.614 429 HG22 VAL 64 1HG2 VAL 64 4.853 -7.146 -2.761 430 HG23 VAL 64 2HG2 VAL 64 3.925 -7.645 -1.347 431 H LYS 65 H LYS 65 6.246 -10.910 -5.569 432 HA LYS 65 HA LYS 65 8.163 -9.203 -6.320 433 HB2 LYS 65 1HB LYS 65 7.880 -9.888 -8.562 434 HB3 LYS 65 2HB LYS 65 7.284 -11.227 -7.590 435 HG2 LYS 65 1HG LYS 65 5.408 -9.138 -8.620 436 HG3 LYS 65 2HG LYS 65 5.933 -10.473 -9.648 437 HD2 LYS 65 1HD LYS 65 4.914 -11.086 -6.916 438 HD3 LYS 65 2HD LYS 65 3.754 -10.655 -8.174 439 HE2 LYS 65 1HE LYS 65 3.929 -13.010 -8.224 440 HE3 LYS 65 2HE LYS 65 4.850 -12.424 -9.609 441 HZ1 LYS 65 3HZ LYS 65 6.868 -12.848 -8.521 442 HZ2 LYS 65 1HZ LYS 65 5.919 -14.216 -8.218 443 HZ3 LYS 65 2HZ LYS 65 6.128 -13.048 -7.013 444 H MET 66 H MET 66 8.398 -7.254 -7.403 445 HA MET 66 HA MET 66 5.960 -5.667 -7.819 446 HB2 MET 66 1HB MET 66 8.298 -5.039 -6.085 447 HB3 MET 66 2HB MET 66 7.570 -3.716 -6.986 448 HG2 MET 66 1HG MET 66 5.796 -5.511 -5.417 449 HG3 MET 66 2HG MET 66 6.780 -4.328 -4.559 450 HE1 MET 66 3HE MET 66 6.402 -2.267 -4.173 451 HE2 MET 66 1HE MET 66 5.299 -1.116 -4.928 452 HE3 MET 66 2HE MET 66 4.685 -2.294 -3.769 453 H ASP 67 H ASP 67 5.893 -5.085 -9.878 454 HA ASP 67 HA ASP 67 8.126 -5.208 -11.617 455 HB2 ASP 67 1HB ASP 67 5.704 -5.493 -12.274 456 HB3 ASP 67 2HB ASP 67 5.533 -3.746 -12.128 457 H CYS 68 H CYS 68 6.542 -2.582 -9.895 458 HA CYS 68 HA CYS 68 7.101 -0.404 -9.560 459 HB2 CYS 68 1HB CYS 68 9.910 -1.215 -10.311 460 HB3 CYS 68 2HB CYS 68 9.418 0.110 -9.262 461 HG CYS 68 HG CYS 68 9.252 -1.228 -7.052 462 H GLN 69 H GLN 69 5.991 -0.818 -11.994 463 HA GLN 69 HA GLN 69 7.615 0.289 -14.095 464 HB2 GLN 69 1HB GLN 69 5.830 -1.366 -14.542 465 HB3 GLN 69 2HB GLN 69 4.632 -0.191 -14.015 466 HG2 GLN 69 1HG GLN 69 4.815 -0.352 -16.460 467 HG3 GLN 69 2HG GLN 69 5.172 1.262 -15.847 468 HE21 GLN 69 1HE2 GLN 69 6.170 1.466 -17.991 469 HE22 GLN 69 2HE2 GLN 69 7.809 0.955 -18.187 470 H GLU 70 H GLU 70 7.643 2.341 -14.866 471 HA GLU 70 HA GLU 70 6.243 4.353 -13.253 472 HB2 GLU 70 1HB GLU 70 8.778 4.389 -13.556 473 HB3 GLU 70 2HB GLU 70 8.469 4.868 -15.218 474 HG2 GLU 70 1HG GLU 70 7.331 6.864 -14.469 475 HG3 GLU 70 2HG GLU 70 7.524 6.371 -12.787 476 H THR 71 H THR 71 4.841 5.797 -14.124 477 HA THR 71 HA THR 71 4.231 5.484 -16.992 478 HB THR 71 HB THR 71 1.935 6.510 -16.109 479 HG1 THR 71 1HG THR 71 2.813 6.502 -13.899 480 HG21 THR 71 3HG2 THR 71 2.734 3.605 -15.914 481 HG22 THR 71 1HG2 THR 71 2.106 4.432 -17.339 482 HG23 THR 71 2HG2 THR 71 1.072 4.193 -15.930 483 HA PRO 72 HA PRO 72 4.913 9.767 -17.667 484 HB2 PRO 72 1HB PRO 72 2.971 10.371 -19.465 485 HB3 PRO 72 2HB PRO 72 4.388 9.396 -19.873 486 HG2 PRO 72 1HG PRO 72 1.610 8.509 -19.199 487 HG3 PRO 72 2HG PRO 72 2.695 7.919 -20.472 488 HD2 PRO 72 1HD PRO 72 2.346 6.605 -18.130 489 HD3 PRO 72 2HD PRO 72 3.885 6.588 -19.014 490 H GLU 73 H GLU 73 1.959 8.673 -16.327 491 HA GLU 73 HA GLU 73 0.937 11.360 -15.857 492 HB2 GLU 73 1HB GLU 73 -0.612 9.527 -16.482 493 HB3 GLU 73 2HB GLU 73 -0.189 8.691 -14.994 494 HG2 GLU 73 1HG GLU 73 -2.277 9.802 -14.682 495 HG3 GLU 73 2HG GLU 73 -1.054 10.622 -13.714 496 H GLY 74 H GLY 74 1.844 8.517 -13.901 497 HA2 GLY 74 1HA GLY 74 2.958 10.283 -11.876 498 HA3 GLY 74 2HA GLY 74 1.571 9.330 -11.371 499 H TYR 75 H TYR 75 1.768 7.085 -11.165 500 HA TYR 75 HA TYR 75 4.131 5.663 -11.825 501 HB2 TYR 75 1HB TYR 75 5.145 6.885 -10.015 502 HB3 TYR 75 2HB TYR 75 3.795 6.521 -8.946 503 HD1 TYR 75 2HD TYR 75 6.382 4.756 -10.986 504 HD2 TYR 75 1HD TYR 75 4.029 4.784 -7.441 505 HE1 TYR 75 2HE TYR 75 7.558 2.745 -10.196 506 HE2 TYR 75 1HE TYR 75 5.199 2.773 -6.642 507 HH TYR 75 HH TYR 75 6.481 0.928 -7.494 508 H LYS 76 H LYS 76 3.209 3.807 -12.373 509 HA LYS 76 HA LYS 76 0.869 2.830 -10.957 510 HB2 LYS 76 1HB LYS 76 1.122 2.780 -13.478 511 HB3 LYS 76 2HB LYS 76 2.315 1.507 -13.253 512 HG2 LYS 76 1HG LYS 76 0.592 0.152 -12.109 513 HG3 LYS 76 2HG LYS 76 -0.591 1.411 -12.471 514 HD2 LYS 76 1HD LYS 76 0.122 1.102 -14.917 515 HD3 LYS 76 2HD LYS 76 0.871 -0.400 -14.370 516 HE2 LYS 76 1HE LYS 76 -1.191 -1.322 -13.732 517 HE3 LYS 76 2HE LYS 76 -1.999 0.245 -13.768 518 HZ1 LYS 76 3HZ LYS 76 -1.700 0.272 -16.186 519 HZ2 LYS 76 1HZ LYS 76 -2.622 -1.054 -15.680 520 HZ3 LYS 76 2HZ LYS 76 -1.004 -1.269 -16.121 521 H VAL 77 H VAL 77 0.751 0.938 -9.787 522 HA VAL 77 HA VAL 77 3.320 -0.373 -9.175 523 HB VAL 77 HB VAL 77 1.050 0.037 -7.227 524 HG11 VAL 77 1HG1 VAL 77 2.075 -1.605 -6.123 525 HG12 VAL 77 2HG1 VAL 77 3.460 -1.577 -7.217 526 HG13 VAL 77 3HG1 VAL 77 3.394 -0.468 -5.846 527 HG21 VAL 77 3HG2 VAL 77 2.976 1.511 -6.164 528 HG22 VAL 77 1HG2 VAL 77 3.447 1.675 -7.856 529 HG23 VAL 77 2HG2 VAL 77 1.838 2.177 -7.335 530 H MET 78 H MET 78 3.348 -2.576 -9.060 531 HA MET 78 HA MET 78 0.803 -4.006 -9.348 532 HB2 MET 78 1HB MET 78 3.252 -4.415 -11.072 533 HB3 MET 78 2HB MET 78 1.857 -5.486 -11.052 534 HG2 MET 78 1HG MET 78 0.449 -3.818 -11.965 535 HG3 MET 78 2HG MET 78 1.665 -2.566 -11.721 536 HE1 MET 78 3HE MET 78 4.401 -3.223 -13.974 537 HE2 MET 78 1HE MET 78 3.258 -1.958 -14.427 538 HE3 MET 78 2HE MET 78 3.610 -2.261 -12.725 539 H TYR 79 H TYR 79 0.658 -5.815 -8.151 540 HA TYR 79 HA TYR 79 2.982 -7.290 -7.315 541 HB2 TYR 79 1HB TYR 79 2.944 -6.860 -5.017 542 HB3 TYR 79 2HB TYR 79 2.728 -5.264 -5.728 543 HD1 TYR 79 1HD TYR 79 0.667 -8.143 -4.523 544 HD2 TYR 79 2HD TYR 79 1.057 -3.921 -4.874 545 HE1 TYR 79 1HE TYR 79 -1.397 -7.850 -3.219 546 HE2 TYR 79 2HE TYR 79 -1.006 -3.616 -3.569 547 HH TYR 79 HH TYR 79 -3.241 -5.718 -3.147 548 H THR 80 H THR 80 2.481 -9.371 -6.944 549 HA THR 80 HA THR 80 -0.373 -10.055 -6.649 550 HB THR 80 HB THR 80 1.757 -11.547 -8.191 551 HG1 THR 80 1HG THR 80 0.483 -11.011 -9.959 552 HG21 THR 80 3HG2 THR 80 -0.183 -13.054 -8.801 553 HG22 THR 80 1HG2 THR 80 -1.064 -12.316 -7.464 554 HG23 THR 80 2HG2 THR 80 0.423 -13.213 -7.152 555 HA PRO 81 HA PRO 81 1.150 -11.850 -2.848 556 HB2 PRO 81 1HB PRO 81 -1.283 -12.662 -1.958 557 HB3 PRO 81 2HB PRO 81 -0.734 -10.985 -1.857 558 HG2 PRO 81 1HG PRO 81 -2.541 -12.269 -3.868 559 HG3 PRO 81 2HG PRO 81 -2.700 -10.697 -3.065 560 HD2 PRO 81 1HD PRO 81 -1.761 -10.954 -5.591 561 HD3 PRO 81 2HD PRO 81 -1.205 -9.676 -4.491 562 H MET 82 H MET 82 2.284 -13.574 -3.888 563 HA MET 82 HA MET 82 1.272 -15.788 -5.140 564 HB2 MET 82 1HB MET 82 3.671 -15.341 -4.909 565 HB3 MET 82 2HB MET 82 3.583 -15.712 -3.192 566 HG2 MET 82 1HG MET 82 3.110 -18.000 -3.628 567 HG3 MET 82 2HG MET 82 2.890 -17.685 -5.348 568 HE1 MET 82 3HE MET 82 5.660 -19.970 -5.433 569 HE2 MET 82 1HE MET 82 4.062 -19.444 -5.963 570 HE3 MET 82 2HE MET 82 5.502 -18.881 -6.812 571 H ALA 83 H ALA 83 1.213 -15.029 -1.735 572 HA ALA 83 HA ALA 83 -0.431 -17.422 -1.284 573 HB1 ALA 83 3HB ALA 83 2.144 -16.862 -0.116 574 HB2 ALA 83 1HB ALA 83 0.899 -16.987 1.128 575 HB3 ALA 83 2HB ALA 83 1.151 -18.316 -0.005 576 HA PRO 84 HA PRO 84 -3.250 -14.664 0.654 577 HB2 PRO 84 1HB PRO 84 -4.471 -16.357 2.390 578 HB3 PRO 84 2HB PRO 84 -4.750 -16.405 0.645 579 HG2 PRO 84 1HG PRO 84 -2.964 -18.122 2.327 580 HG3 PRO 84 2HG PRO 84 -4.049 -18.593 1.005 581 HD2 PRO 84 1HD PRO 84 -1.377 -18.309 0.667 582 HD3 PRO 84 2HD PRO 84 -2.545 -17.957 -0.623 583 H GLY 85 H GLY 85 -3.995 -13.930 2.863 584 HA2 GLY 85 1HA GLY 85 -3.202 -14.242 5.309 585 HA3 GLY 85 2HA GLY 85 -1.646 -13.791 4.628 586 H ASN 86 H ASN 86 -1.681 -12.010 6.135 587 HA ASN 86 HA ASN 86 -3.433 -9.809 5.258 588 HB2 ASN 86 1HB ASN 86 -2.911 -8.867 7.591 589 HB3 ASN 86 2HB ASN 86 -4.017 -10.234 7.498 590 HD21 ASN 86 1HD2 ASN 86 -1.328 -9.009 9.001 591 HD22 ASN 86 2HD2 ASN 86 -0.717 -10.466 9.700 592 H TYR 87 H TYR 87 -2.347 -8.437 4.016 593 HA TYR 87 HA TYR 87 0.500 -7.965 4.569 594 HB2 TYR 87 1HB TYR 87 -1.144 -7.540 2.071 595 HB3 TYR 87 2HB TYR 87 0.518 -6.986 2.245 596 HD1 TYR 87 1HD TYR 87 -1.414 -10.142 2.825 597 HD2 TYR 87 2HD TYR 87 2.120 -8.333 1.293 598 HE1 TYR 87 1HE TYR 87 -0.609 -12.347 2.091 599 HE2 TYR 87 2HE TYR 87 2.933 -10.533 0.555 600 HH TYR 87 HH TYR 87 0.936 -13.432 0.870 601 H LEU 88 H LEU 88 1.269 -5.713 4.111 602 HA LEU 88 HA LEU 88 -0.747 -3.684 4.781 603 HB2 LEU 88 1HB LEU 88 0.689 -4.526 6.750 604 HB3 LEU 88 2HB LEU 88 1.996 -3.623 5.987 605 HG LEU 88 HG LEU 88 0.288 -1.639 6.106 606 HD11 LEU 88 1HD1 LEU 88 -0.850 -3.679 7.952 607 HD12 LEU 88 2HD1 LEU 88 -1.669 -2.515 6.911 608 HD13 LEU 88 3HD1 LEU 88 -0.914 -1.977 8.411 609 HD21 LEU 88 3HD2 LEU 88 2.220 -2.736 8.020 610 HD22 LEU 88 1HD2 LEU 88 1.083 -1.574 8.704 611 HD23 LEU 88 2HD2 LEU 88 2.092 -1.116 7.332 612 H ILE 89 H ILE 89 -0.690 -2.010 3.440 613 HA ILE 89 HA ILE 89 1.714 -1.622 1.792 614 HB ILE 89 HB ILE 89 -1.091 -0.636 1.265 615 HG12 ILE 89 1HG1 ILE 89 0.388 -2.876 -0.122 616 HG13 ILE 89 2HG1 ILE 89 -0.769 -3.140 1.178 617 HG21 ILE 89 1HG2 ILE 89 0.017 -0.463 -1.104 618 HG22 ILE 89 2HG2 ILE 89 0.225 0.825 0.082 619 HG23 ILE 89 3HG2 ILE 89 1.507 -0.360 -0.167 620 HD11 ILE 89 3HD1 ILE 89 -2.412 -3.131 -0.294 621 HD12 ILE 89 1HD1 ILE 89 -2.000 -1.480 -0.756 622 HD13 ILE 89 2HD1 ILE 89 -1.254 -2.842 -1.592 623 H SER 90 H SER 90 2.975 0.027 2.311 624 HA SER 90 HA SER 90 1.759 2.380 3.604 625 HB2 SER 90 1HB SER 90 4.606 1.404 3.919 626 HB3 SER 90 2HB SER 90 3.845 2.736 4.789 627 HG SER 90 HG SER 90 3.469 1.193 6.190 628 H VAL 91 H VAL 91 1.965 4.281 2.608 629 HA VAL 91 HA VAL 91 3.893 4.479 0.385 630 HB VAL 91 HB VAL 91 1.192 5.813 0.621 631 HG11 VAL 91 1HG1 VAL 91 3.495 6.590 -0.829 632 HG12 VAL 91 2HG1 VAL 91 2.316 5.974 -1.989 633 HG13 VAL 91 3HG1 VAL 91 1.876 7.284 -0.893 634 HG21 VAL 91 3HG2 VAL 91 2.061 3.811 -1.446 635 HG22 VAL 91 1HG2 VAL 91 1.292 3.331 0.066 636 HG23 VAL 91 2HG2 VAL 91 0.429 4.366 -1.071 637 H LYS 92 H LYS 92 5.424 5.959 0.624 638 HA LYS 92 HA LYS 92 4.936 8.200 2.477 639 HB2 LYS 92 1HB LYS 92 7.376 6.517 2.008 640 HB3 LYS 92 2HB LYS 92 7.540 8.160 2.613 641 HG2 LYS 92 1HG LYS 92 6.255 7.640 4.563 642 HG3 LYS 92 2HG LYS 92 5.854 6.043 3.928 643 HD2 LYS 92 1HD LYS 92 8.724 6.781 4.232 644 HD3 LYS 92 2HD LYS 92 7.798 6.371 5.678 645 HE2 LYS 92 1HE LYS 92 7.949 4.628 3.224 646 HE3 LYS 92 2HE LYS 92 9.009 4.450 4.622 647 HZ1 LYS 92 3HZ LYS 92 7.085 4.027 6.001 648 HZ2 LYS 92 1HZ LYS 92 7.116 2.936 4.708 649 HZ3 LYS 92 2HZ LYS 92 6.046 4.245 4.683 650 H TYR 93 H TYR 93 5.346 10.232 1.783 651 HA TYR 93 HA TYR 93 6.758 10.607 -0.755 652 HB2 TYR 93 1HB TYR 93 4.566 10.617 -1.580 653 HB3 TYR 93 2HB TYR 93 3.931 11.429 -0.154 654 HD1 TYR 93 2HD TYR 93 4.719 13.873 0.226 655 HD2 TYR 93 1HD TYR 93 5.024 11.845 -3.502 656 HE1 TYR 93 2HE TYR 93 4.875 16.037 -0.932 657 HE2 TYR 93 1HE TYR 93 5.181 14.003 -4.670 658 HH TYR 93 HH TYR 93 4.391 16.448 -4.134 659 H GLY 94 H GLY 94 8.080 12.327 -0.754 660 HA2 GLY 94 1HA GLY 94 9.132 14.251 -0.067 661 HA3 GLY 94 2HA GLY 94 7.609 14.727 0.668 662 H GLY 95 H GLY 95 9.683 11.933 1.377 663 HA2 GLY 95 1HA GLY 95 11.220 11.924 3.253 664 HA3 GLY 95 2HA GLY 95 10.170 13.088 4.048 665 HA PRO 96 HA PRO 96 9.223 8.944 5.844 666 HB2 PRO 96 1HB PRO 96 9.030 9.850 8.396 667 HB3 PRO 96 2HB PRO 96 10.565 9.381 7.657 668 HG2 PRO 96 1HG PRO 96 9.399 12.113 8.029 669 HG3 PRO 96 2HG PRO 96 11.066 11.564 8.280 670 HD2 PRO 96 1HD PRO 96 10.291 12.896 6.054 671 HD3 PRO 96 2HD PRO 96 11.573 11.667 6.034 672 H ASN 97 H ASN 97 7.716 12.052 5.838 673 HA ASN 97 HA ASN 97 5.350 11.486 7.234 674 HB2 ASN 97 1HB ASN 97 6.087 13.470 5.105 675 HB3 ASN 97 2HB ASN 97 4.415 13.329 5.638 676 HD21 ASN 97 1HD2 ASN 97 7.705 13.843 6.802 677 HD22 ASN 97 2HD2 ASN 97 7.264 14.832 8.149 678 H HIS 98 H HIS 98 3.644 10.265 6.765 679 HA HIS 98 HA HIS 98 3.511 8.985 4.148 680 HB2 HIS 98 1HB HIS 98 1.753 7.567 5.239 681 HB3 HIS 98 2HB HIS 98 3.332 7.484 6.014 682 HD2 HIS 98 2HD HIS 98 3.475 8.888 8.522 683 HE1 HIS 98 1HE HIS 98 -0.739 8.990 9.009 684 HE2 HIS 98 2HE HIS 98 1.492 9.405 10.102 685 H ILE 99 H ILE 99 1.303 8.668 3.186 686 HA ILE 99 HA ILE 99 -0.051 11.254 3.110 687 HB ILE 99 HB ILE 99 -1.098 10.497 1.071 688 HG12 ILE 99 1HG1 ILE 99 0.361 7.872 1.345 689 HG13 ILE 99 2HG1 ILE 99 -1.293 8.086 1.909 690 HG21 ILE 99 1HG2 ILE 99 0.918 10.091 -0.313 691 HG22 ILE 99 2HG2 ILE 99 1.108 11.421 0.828 692 HG23 ILE 99 3HG2 ILE 99 1.845 9.856 1.168 693 HD11 ILE 99 3HD1 ILE 99 -1.145 9.062 -0.744 694 HD12 ILE 99 1HD1 ILE 99 -0.374 7.477 -0.696 695 HD13 ILE 99 2HD1 ILE 99 -2.033 7.670 -0.127 696 H VAL 100 H VAL 100 -2.478 11.177 2.793 697 HA VAL 100 HA VAL 100 -3.686 10.050 5.073 698 HB VAL 100 HB VAL 100 -4.830 11.309 2.591 699 HG11 VAL 100 1HG1 VAL 100 -7.025 11.283 3.707 700 HG12 VAL 100 2HG1 VAL 100 -6.448 9.659 3.325 701 HG13 VAL 100 3HG1 VAL 100 -6.350 10.266 4.979 702 HG21 VAL 100 3HG2 VAL 100 -5.573 12.973 4.416 703 HG22 VAL 100 1HG2 VAL 100 -4.381 12.159 5.430 704 HG23 VAL 100 2HG2 VAL 100 -3.875 12.953 3.938 705 H GLY 101 H GLY 101 -5.052 8.307 5.348 706 HA2 GLY 101 1HA GLY 101 -6.314 6.439 4.651 707 HA3 GLY 101 2HA GLY 101 -5.585 6.569 3.058 708 H SER 102 H SER 102 -2.878 6.655 3.830 709 HA SER 102 HA SER 102 -2.436 3.846 4.274 710 HB2 SER 102 1HB SER 102 -0.091 4.345 3.852 711 HB3 SER 102 2HB SER 102 -1.090 5.163 2.650 712 HG SER 102 HG SER 102 -0.555 7.054 3.468 713 HA PRO 103 HA PRO 103 -0.489 2.670 4.848 714 HB2 PRO 103 1HB PRO 103 -0.666 0.525 6.503 715 HB3 PRO 103 2HB PRO 103 0.726 1.614 6.488 716 HG2 PRO 103 1HG PRO 103 -1.610 1.550 8.359 717 HG3 PRO 103 2HG PRO 103 0.111 1.773 8.725 718 HD2 PRO 103 1HD PRO 103 -1.632 3.841 8.605 719 HD3 PRO 103 2HD PRO 103 0.075 4.003 8.145 720 H PHE 104 H PHE 104 -1.483 0.391 4.360 721 HA PHE 104 HA PHE 104 -4.411 0.538 4.624 722 HB2 PHE 104 1HB PHE 104 -2.870 -0.206 2.128 723 HB3 PHE 104 2HB PHE 104 -4.621 -0.267 2.303 724 HD1 PHE 104 2HD PHE 104 -5.839 1.911 2.806 725 HD2 PHE 104 1HD PHE 104 -1.811 1.747 1.442 726 HE1 PHE 104 2HE PHE 104 -5.995 4.255 2.076 727 HE2 PHE 104 1HE PHE 104 -1.959 4.091 0.710 728 HZ PHE 104 HZ PHE 104 -4.054 5.348 1.026 729 H LYS 105 H LYS 105 -5.112 -1.175 5.695 730 HA LYS 105 HA LYS 105 -3.531 -3.614 5.767 731 HB2 LYS 105 1HB LYS 105 -5.923 -2.621 7.294 732 HB3 LYS 105 2HB LYS 105 -5.421 -4.304 7.388 733 HG2 LYS 105 1HG LYS 105 -3.411 -3.774 8.435 734 HG3 LYS 105 2HG LYS 105 -3.490 -2.082 7.936 735 HD2 LYS 105 1HD LYS 105 -5.221 -1.614 9.489 736 HD3 LYS 105 2HD LYS 105 -5.485 -3.328 9.816 737 HE2 LYS 105 1HE LYS 105 -3.081 -3.363 10.664 738 HE3 LYS 105 2HE LYS 105 -3.163 -1.602 10.634 739 HZ1 LYS 105 3HZ LYS 105 -5.195 -3.203 12.060 740 HZ2 LYS 105 1HZ LYS 105 -4.790 -1.574 12.274 741 HZ3 LYS 105 2HZ LYS 105 -3.733 -2.785 12.801 742 H ALA 106 H ALA 106 -3.787 -4.756 3.918 743 HA ALA 106 HA ALA 106 -6.499 -5.222 2.908 744 HB1 ALA 106 3HB ALA 106 -3.978 -6.126 1.557 745 HB2 ALA 106 1HB ALA 106 -5.560 -5.796 0.849 746 HB3 ALA 106 2HB ALA 106 -4.553 -4.465 1.421 747 H LYS 107 H LYS 107 -7.342 -7.283 2.625 748 HA LYS 107 HA LYS 107 -5.934 -9.418 4.089 749 HB2 LYS 107 1HB LYS 107 -7.903 -8.863 5.302 750 HB3 LYS 107 2HB LYS 107 -8.875 -8.804 3.838 751 HG2 LYS 107 1HG LYS 107 -8.812 -11.164 3.597 752 HG3 LYS 107 2HG LYS 107 -7.585 -11.321 4.857 753 HD2 LYS 107 1HD LYS 107 -9.194 -10.495 6.514 754 HD3 LYS 107 2HD LYS 107 -10.419 -10.357 5.251 755 HE2 LYS 107 1HE LYS 107 -10.912 -12.400 6.237 756 HE3 LYS 107 2HE LYS 107 -9.944 -12.860 4.837 757 HZ1 LYS 107 3HZ LYS 107 -8.931 -12.587 7.616 758 HZ2 LYS 107 1HZ LYS 107 -8.014 -13.048 6.271 759 HZ3 LYS 107 2HZ LYS 107 -9.259 -14.048 6.828 760 H VAL 108 H VAL 108 -5.194 -10.984 2.830 761 HA VAL 108 HA VAL 108 -6.353 -11.381 0.179 762 HB VAL 108 HB VAL 108 -3.939 -12.806 1.273 763 HG11 VAL 108 1HG1 VAL 108 -4.586 -12.008 -1.556 764 HG12 VAL 108 2HG1 VAL 108 -3.359 -13.148 -1.000 765 HG13 VAL 108 3HG1 VAL 108 -5.070 -13.552 -0.855 766 HG21 VAL 108 3HG2 VAL 108 -2.724 -10.946 1.255 767 HG22 VAL 108 1HG2 VAL 108 -3.217 -10.608 -0.404 768 HG23 VAL 108 2HG2 VAL 108 -4.190 -10.016 0.943 769 H THR 109 H THR 109 -7.586 -13.072 -0.345 770 HA THR 109 HA THR 109 -7.571 -15.449 1.373 771 HB THR 109 HB THR 109 -10.051 -15.562 1.276 772 HG1 THR 109 1HG THR 109 -9.852 -12.877 0.333 773 HG21 THR 109 3HG2 THR 109 -10.381 -13.457 2.801 774 HG22 THR 109 1HG2 THR 109 -8.628 -13.330 2.663 775 HG23 THR 109 2HG2 THR 109 -9.356 -14.788 3.337 776 H GLY 110 H GLY 110 -8.338 -17.369 0.358 777 HA2 GLY 110 1HA GLY 110 -9.491 -17.940 -1.946 778 HA3 GLY 110 2HA GLY 110 -7.963 -17.308 -2.540 779 H GLN 111 H GLN 111 -7.216 -19.203 -3.425 780 HA GLN 111 HA GLN 111 -6.750 -21.418 -1.540 781 HB2 GLN 111 1HB GLN 111 -7.070 -21.463 -4.544 782 HB3 GLN 111 2HB GLN 111 -6.582 -22.854 -3.585 783 HG2 GLN 111 1HG GLN 111 -9.189 -21.372 -3.319 784 HG3 GLN 111 2HG GLN 111 -8.956 -22.911 -4.148 785 HE21 GLN 111 1HE2 GLN 111 -10.777 -22.624 -2.103 786 HE22 GLN 111 2HE2 GLN 111 -10.246 -23.534 -0.733 787 H ARG 112 H ARG 112 -4.717 -21.693 -0.929 788 HA ARG 112 HA ARG 112 -2.552 -20.205 -1.684 789 HB2 ARG 112 1HB ARG 112 -2.463 -21.582 0.285 790 HB3 ARG 112 2HB ARG 112 -2.630 -23.048 -0.671 791 HG2 ARG 112 1HG ARG 112 -0.420 -22.274 -1.784 792 HG3 ARG 112 2HG ARG 112 -0.259 -21.266 -0.344 793 HD2 ARG 112 1HD ARG 112 0.890 -23.291 0.106 794 HD3 ARG 112 2HD ARG 112 -0.615 -23.345 1.022 795 HE ARG 112 HE ARG 112 -0.978 -24.584 -1.484 796 HH11 ARG 112 1HH1 ARG 112 0.591 -25.076 1.584 797 HH12 ARG 112 2HH1 ARG 112 0.522 -26.805 1.489 798 HH21 ARG 112 1HH2 ARG 112 -1.075 -26.858 -1.621 799 HH22 ARG 112 2HH2 ARG 112 -0.425 -27.818 -0.334 800 H LEU 113 H LEU 113 -0.873 -20.386 -3.142 801 HA LEU 113 HA LEU 113 -1.413 -22.129 -5.440 802 HB2 LEU 113 1HB LEU 113 0.397 -19.726 -5.258 803 HB3 LEU 113 2HB LEU 113 -0.011 -20.620 -6.720 804 HG LEU 113 HG LEU 113 -2.038 -19.116 -5.075 805 HD11 LEU 113 1HD1 LEU 113 -0.346 -17.567 -5.918 806 HD12 LEU 113 2HD1 LEU 113 -1.888 -17.351 -6.744 807 HD13 LEU 113 3HD1 LEU 113 -0.571 -18.205 -7.547 808 HD21 LEU 113 3HD2 LEU 113 -3.392 -20.362 -6.357 809 HD22 LEU 113 1HD2 LEU 113 -2.102 -20.786 -7.483 810 HD23 LEU 113 2HD2 LEU 113 -2.936 -19.241 -7.641 811 H VAL 114 H VAL 114 0.053 -23.591 -6.175 812 HA VAL 114 HA VAL 114 2.560 -23.852 -4.645 813 HB VAL 114 HB VAL 114 0.868 -25.635 -4.151 814 HG11 VAL 114 1HG1 VAL 114 0.280 -25.627 -6.750 815 HG12 VAL 114 2HG1 VAL 114 1.462 -26.937 -6.745 816 HG13 VAL 114 3HG1 VAL 114 0.026 -27.039 -5.726 817 HG21 VAL 114 3HG2 VAL 114 2.738 -27.445 -5.118 818 HG22 VAL 114 1HG2 VAL 114 3.642 -25.945 -4.916 819 HG23 VAL 114 2HG2 VAL 114 2.766 -26.637 -3.550 820 H SER 115 H SER 115 4.407 -24.024 -5.774 821 HA SER 115 HA SER 115 4.668 -23.246 -8.380 822 HB2 SER 115 1HB SER 115 6.399 -24.798 -6.519 823 HB3 SER 115 2HB SER 115 6.856 -24.772 -8.222 824 HG SER 115 HG SER 115 6.707 -22.661 -6.380 825 HA PRO 116 HA PRO 116 3.263 -26.553 -10.917 826 HB2 PRO 116 1HB PRO 116 4.671 -26.007 -13.173 827 HB3 PRO 116 2HB PRO 116 3.288 -25.040 -12.646 828 HG2 PRO 116 1HG PRO 116 6.213 -24.503 -12.307 829 HG3 PRO 116 2HG PRO 116 4.917 -23.385 -12.768 830 HD2 PRO 116 1HD PRO 116 5.916 -23.501 -10.254 831 HD3 PRO 116 2HD PRO 116 4.220 -23.097 -10.589 832 H GLY 117 H GLY 117 4.352 -28.130 -12.641 833 HA2 GLY 117 1HA GLY 117 6.455 -29.511 -11.151 834 HA3 GLY 117 2HA GLY 117 5.473 -30.196 -12.437 835 H SER 118 H SER 118 8.040 -30.775 -12.599 836 HA SER 118 HA SER 118 9.254 -28.831 -14.437 837 HB2 SER 118 1HB SER 118 10.632 -29.514 -12.505 838 HB3 SER 118 2HB SER 118 10.524 -31.194 -13.031 839 HG SER 118 HG SER 118 11.410 -30.191 -15.114 840 H ALA 119 H ALA 119 8.947 -29.205 -16.521 841 HA ALA 119 HA ALA 119 8.647 -31.990 -17.432 842 HB1 ALA 119 3HB ALA 119 7.429 -31.083 -19.356 843 HB2 ALA 119 1HB ALA 119 6.669 -30.633 -17.829 844 HB3 ALA 119 2HB ALA 119 7.637 -29.454 -18.714 845 H ASN 120 H ASN 120 10.758 -32.529 -17.847 846 HA ASN 120 HA ASN 120 12.808 -31.055 -18.847 847 HB2 ASN 120 1HB ASN 120 13.695 -33.157 -19.838 848 HB3 ASN 120 2HB ASN 120 13.115 -33.367 -18.188 849 HD21 ASN 120 1HD2 ASN 120 12.957 -35.610 -18.632 850 HD22 ASN 120 2HD2 ASN 120 11.611 -36.241 -19.512 851 H GLU 121 H GLU 121 13.784 -31.009 -21.033 852 HA GLU 121 HA GLU 121 11.967 -31.262 -23.276 853 HB2 GLU 121 1HB GLU 121 11.409 -29.036 -22.474 854 HB3 GLU 121 2HB GLU 121 13.109 -28.586 -22.458 855 HG2 GLU 121 1HG GLU 121 12.365 -27.619 -24.405 856 HG3 GLU 121 2HG GLU 121 13.032 -29.146 -24.981 857 H THR 122 H THR 122 13.155 -32.347 -24.690 858 HA THR 122 HA THR 122 15.996 -32.363 -24.678 859 HB THR 122 HB THR 122 15.082 -34.349 -25.478 860 HG1 THR 122 1HG THR 122 16.278 -34.467 -27.222 861 HG21 THR 122 3HG2 THR 122 13.085 -32.578 -26.677 862 HG22 THR 122 1HG2 THR 122 12.920 -34.227 -26.076 863 HG23 THR 122 2HG2 THR 122 13.537 -33.939 -27.703 864 H SER 123 H SER 123 17.443 -31.595 -26.262 865 HA SER 123 HA SER 123 16.473 -29.202 -27.660 866 HB2 SER 123 1HB SER 123 18.337 -28.957 -25.998 867 HB3 SER 123 2HB SER 123 19.336 -29.964 -27.046 868 HG SER 123 HG SER 123 18.343 -27.370 -27.488 869 H SER 124 H SER 124 17.301 -28.731 -29.793 870 HA SER 124 HA SER 124 17.793 -31.188 -31.339 871 HB2 SER 124 1HB SER 124 16.572 -30.298 -33.112 872 HB3 SER 124 2HB SER 124 15.691 -29.678 -31.717 873 HG SER 124 HG SER 124 16.323 -28.157 -33.494 874 H ILE 125 H ILE 125 19.359 -31.201 -32.962 875 HA ILE 125 HA ILE 125 21.798 -30.156 -32.519 876 HB ILE 125 HB ILE 125 22.329 -30.408 -34.894 877 HG12 ILE 125 1HG1 ILE 125 20.165 -29.395 -35.702 878 HG13 ILE 125 2HG1 ILE 125 20.664 -30.851 -36.556 879 HG21 ILE 125 1HG2 ILE 125 20.591 -32.517 -33.643 880 HG22 ILE 125 2HG2 ILE 125 21.453 -32.776 -35.159 881 HG23 ILE 125 3HG2 ILE 125 22.352 -32.427 -33.683 882 HD11 ILE 125 3HD1 ILE 125 19.115 -32.101 -34.967 883 HD12 ILE 125 1HD1 ILE 125 18.460 -30.516 -34.558 884 HD13 ILE 125 2HD1 ILE 125 18.373 -31.105 -36.219
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