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NMR Restraints Grid |
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Result table
(Save to zip file containing files for each block)
image | mrblock_id | pdb_id | cing | stage | position | program | type |
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6020 |
1ico ![]() ![]() |
cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H SER 1 1H SER 1 25.963 9.295 -19.053 2 2H SER 1 2H SER 1 25.037 8.715 -17.814 3 3H SER 1 3H SER 1 26.656 8.387 -17.859 4 HA SER 1 HA SER 1 25.416 11.063 -17.493 5 1HB SER 1 2HB SER 1 26.910 9.243 -15.512 6 2HB SER 1 1HB SER 1 26.431 10.916 -15.176 7 HG SER 1 HG SER 1 24.695 8.796 -15.922 8 H LYS 2 H LYS 2 26.762 12.669 -17.987 9 HA LYS 2 HA LYS 2 29.777 12.346 -17.980 10 1HB LYS 2 2HB LYS 2 30.168 13.392 -20.097 11 2HB LYS 2 1HB LYS 2 29.363 11.844 -20.229 12 1HG LYS 2 2HG LYS 2 27.196 13.019 -20.812 13 2HG LYS 2 1HG LYS 2 28.013 14.578 -20.678 14 1HD LYS 2 2HD LYS 2 29.587 13.914 -22.562 15 2HD LYS 2 1HD LYS 2 28.769 12.355 -22.695 16 1HE LYS 2 2HE LYS 2 26.612 13.534 -23.318 17 2HE LYS 2 1HE LYS 2 27.433 15.101 -23.184 18 1HZ LYS 2 1HZ LYS 2 27.415 14.301 -25.467 19 2HZ LYS 2 2HZ LYS 2 28.976 14.373 -24.931 20 3HZ LYS 2 3HZ LYS 2 28.212 12.913 -25.055 21 H TYR 3 H TYR 3 30.784 14.064 -17.127 22 HA TYR 3 HA TYR 3 29.124 16.350 -16.064 23 1HB TYR 3 2HB TYR 3 30.806 16.913 -14.638 24 2HB TYR 3 1HB TYR 3 30.600 15.216 -14.482 25 HD1 TYR 3 HD1 TYR 3 32.499 13.856 -16.258 26 HD2 TYR 3 HD2 TYR 3 33.073 17.630 -14.281 27 HE1 TYR 3 HE1 TYR 3 34.921 13.625 -16.450 28 HE2 TYR 3 HE2 TYR 3 35.469 17.302 -14.403 29 HH TYR 3 HH TYR 3 36.891 14.472 -15.979 30 H GLU 4 H GLU 4 29.148 18.253 -17.003 31 HA GLU 4 HA GLU 4 31.556 19.174 -18.741 32 1HB GLU 4 2HB GLU 4 30.041 19.066 -20.375 33 2HB GLU 4 1HB GLU 4 28.628 19.281 -19.393 34 1HG GLU 4 1HG GLU 4 29.150 21.776 -19.239 35 2HG GLU 4 2HG GLU 4 30.494 21.525 -20.345 36 H TYR 5 H TYR 5 32.745 20.077 -17.215 37 HA TYR 5 HA TYR 5 31.468 21.989 -15.217 38 1HB TYR 5 2HB TYR 5 32.642 21.352 -13.434 39 2HB TYR 5 1HB TYR 5 32.471 19.794 -14.180 40 HD1 TYR 5 HD1 TYR 5 34.913 19.736 -16.075 41 HD2 TYR 5 HD2 TYR 5 34.481 20.907 -11.966 42 HE1 TYR 5 HE1 TYR 5 37.334 19.515 -15.707 43 HE2 TYR 5 HE2 TYR 5 36.866 20.727 -11.668 44 HH TYR 5 HH TYR 5 38.996 19.678 -14.302 45 H THR 6 H THR 6 31.940 23.807 -15.600 46 HA THR 6 HA THR 6 34.086 24.477 -17.642 47 HB THR 6 HB THR 6 31.717 26.301 -16.835 48 HG1 THR 6 HG1 THR 6 30.928 24.242 -17.377 49 1HG2 THR 6 1HG2 THR 6 33.487 27.199 -18.447 50 2HG2 THR 6 2HG2 THR 6 33.115 25.829 -19.524 51 3HG2 THR 6 3HG2 THR 6 31.845 27.031 -19.189 52 H ILE 7 H ILE 7 35.673 25.852 -17.184 53 HA ILE 7 HA ILE 7 35.865 27.126 -14.405 54 HB ILE 7 HB ILE 7 38.081 25.421 -15.705 55 1HG1 ILE 7 2HG1 ILE 7 37.698 23.920 -13.410 56 2HG1 ILE 7 1HG1 ILE 7 36.119 24.673 -13.445 57 1HG2 ILE 7 1HG2 ILE 7 39.315 25.685 -13.544 58 2HG2 ILE 7 2HG2 ILE 7 38.961 27.256 -14.295 59 3HG2 ILE 7 3HG2 ILE 7 37.983 26.704 -12.907 60 1HD1 ILE 7 1HD1 ILE 7 37.311 22.591 -15.277 61 2HD1 ILE 7 2HD1 ILE 7 35.766 22.662 -14.389 62 3HD1 ILE 7 3HD1 ILE 7 35.951 23.597 -15.867 63 HA DPR 8 HA PRO 8 38.139 30.341 -16.635 64 1HB DPR 8 2HB PRO 8 37.589 31.612 -14.807 65 2HB DPR 8 1HB PRO 8 36.779 32.628 -16.018 66 1HG DPR 8 2HG PRO 8 35.411 31.667 -13.832 67 2HG DPR 8 1HG PRO 8 34.616 31.748 -15.430 68 1HD DPR 8 2HD PRO 8 35.576 29.296 -13.981 69 2HD DPR 8 1HD PRO 8 34.366 29.421 -15.278 70 H SER 9 H SER 9 38.109 29.836 -18.776 71 HA SER 9 HA SER 9 35.783 30.700 -20.554 72 1HB SER 9 2HB SER 9 37.634 32.389 -20.759 73 2HB SER 9 1HB SER 9 38.772 31.091 -21.172 74 HG SER 9 HG SER 9 37.402 30.584 -22.936 75 H TYR 10 H TYR 10 37.345 28.093 -19.321 76 HA TYR 10 HA TYR 10 37.534 26.568 -21.964 77 1HB TYR 10 2HB TYR 10 39.539 27.002 -20.115 78 2HB TYR 10 1HB TYR 10 38.823 25.647 -19.317 79 HD1 TYR 10 HD1 TYR 10 40.729 26.801 -22.263 80 HD2 TYR 10 HD2 TYR 10 38.835 23.365 -20.501 81 HE1 TYR 10 HE1 TYR 10 41.980 25.321 -23.750 82 HE2 TYR 10 HE2 TYR 10 40.119 21.914 -21.996 83 HH TYR 10 HH TYR 10 41.602 21.797 -23.618 84 H THR 11 H THR 11 36.028 24.992 -22.297 85 HA THR 11 HA THR 11 34.235 24.092 -20.035 86 HB THR 11 HB THR 11 33.960 23.483 -23.031 87 HG1 THR 11 HG1 THR 11 34.059 25.722 -22.678 88 1HG2 THR 11 1HG2 THR 11 31.515 23.300 -22.586 89 2HG2 THR 11 2HG2 THR 11 31.748 23.785 -20.883 90 3HG2 THR 11 3HG2 THR 11 32.378 22.225 -21.455 91 H PHE 12 H PHE 12 34.787 22.351 -19.104 92 HA PHE 12 HA PHE 12 36.687 20.263 -20.421 93 1HB PHE 12 1HB PHE 12 36.241 20.835 -17.470 94 2HB PHE 12 2HB PHE 12 37.117 19.451 -18.060 95 HD1 PHE 12 HD1 PHE 12 37.208 23.182 -17.709 96 HD2 PHE 12 HD2 PHE 12 39.472 19.718 -18.912 97 HE1 PHE 12 HE1 PHE 12 39.273 24.424 -17.477 98 HE2 PHE 12 HE2 PHE 12 41.514 21.022 -18.711 99 HZ PHE 12 HZ PHE 12 41.429 23.373 -17.960 100 H ARG 13 H ARG 13 35.422 18.692 -21.241 101 HA ARG 13 HA ARG 13 32.855 17.827 -19.810 102 1HB ARG 13 1HB ARG 13 33.042 17.633 -22.818 103 2HB ARG 13 2HB ARG 13 31.641 17.578 -21.723 104 1HG ARG 13 2HG ARG 13 31.741 20.051 -21.474 105 2HG ARG 13 1HG ARG 13 33.172 20.101 -22.496 106 1HD ARG 13 1HD ARG 13 31.772 19.050 -24.413 107 2HD ARG 13 2HD ARG 13 30.349 19.196 -23.373 108 HE ARG 13 HE ARG 13 31.467 21.817 -23.440 109 1HH1 ARG 13 1HH1 ARG 13 30.257 19.627 -26.032 110 2HH1 ARG 13 2HH1 ARG 13 29.850 21.098 -27.051 111 1HH2 ARG 13 2HH2 ARG 13 30.953 23.346 -24.702 112 2HH2 ARG 13 1HH2 ARG 13 30.214 23.035 -26.353 113 H GLY 14 H GLY 14 32.983 15.773 -19.142 114 1HA GLY 14 2HA GLY 14 34.012 13.554 -20.866 115 2HA GLY 14 1HA GLY 14 35.086 13.889 -19.512 116 HA PRO 15 HA PRO 15 31.565 11.040 -17.959 117 1HB PRO 15 2HB PRO 15 32.745 8.679 -17.373 118 2HB PRO 15 1HB PRO 15 32.444 9.204 -19.044 119 1HG PRO 15 1HG PRO 15 35.024 9.389 -17.448 120 2HG PRO 15 2HG PRO 15 34.800 8.708 -19.096 121 1HD PRO 15 1HD PRO 15 35.646 11.360 -18.606 122 2HD PRO 15 2HD PRO 15 34.714 10.912 -20.060 123 H GLY 16 H GLY 16 31.034 10.124 -15.850 124 1HA GLY 16 2HA GLY 16 31.126 9.906 -13.465 125 2HA GLY 16 1HA GLY 16 32.713 10.668 -13.447 126 H CYS 17 H CYS 17 29.565 11.156 -12.670 127 HA CYS 17 HA CYS 17 29.681 14.201 -12.784 128 1HB CYS 17 2HB CYS 17 27.291 12.364 -12.155 129 2HB CYS 17 1HB CYS 17 27.247 14.132 -12.233 130 HA PRO 18 HA PRO 18 30.440 14.249 -8.187 131 1HB PRO 18 2HB PRO 18 32.703 15.755 -8.061 132 2HB PRO 18 1HB PRO 18 32.743 14.032 -8.495 133 1HG PRO 18 2HG PRO 18 32.929 16.436 -10.370 134 2HG PRO 18 1HG PRO 18 33.942 14.961 -10.370 135 1HD PRO 18 2HD PRO 18 31.622 15.325 -12.001 136 2HD PRO 18 1HD PRO 18 32.264 13.732 -11.522 137 H THR 19 H THR 19 30.637 16.344 -6.823 138 HA THR 19 HA THR 19 29.060 18.646 -8.082 139 HB THR 19 HB THR 19 27.703 17.829 -6.393 140 HG1 THR 19 HG1 THR 19 27.903 20.006 -6.834 141 1HG2 THR 19 1HG2 THR 19 29.813 18.510 -4.254 142 2HG2 THR 19 2HG2 THR 19 29.230 16.861 -4.636 143 3HG2 THR 19 3HG2 THR 19 28.103 18.072 -3.948 144 H VAL 20 H VAL 20 29.655 20.734 -7.409 145 HA VAL 20 HA VAL 20 32.718 21.093 -7.334 146 HB VAL 20 HB VAL 20 32.530 22.871 -9.093 147 1HG1 VAL 20 1HG1 VAL 20 33.389 20.679 -9.702 148 2HG1 VAL 20 2HG1 VAL 20 32.498 21.367 -11.081 149 3HG1 VAL 20 3HG1 VAL 20 31.749 20.101 -10.062 150 1HG2 VAL 20 1HG2 VAL 20 29.702 21.916 -9.787 151 2HG2 VAL 20 2HG2 VAL 20 30.680 23.115 -10.676 152 3HG2 VAL 20 3HG2 VAL 20 30.110 23.475 -9.030 153 H LYS 21 H LYS 21 33.541 23.309 -7.064 154 HA LYS 21 HA LYS 21 32.425 24.463 -4.548 155 1HB LYS 21 1HB LYS 21 34.536 25.689 -4.455 156 2HB LYS 21 2HB LYS 21 34.739 23.944 -4.550 157 1HG LYS 21 2HG LYS 21 36.565 24.976 -5.559 158 2HG LYS 21 1HG LYS 21 35.685 24.120 -6.816 159 1HD LYS 21 1HD LYS 21 34.786 26.146 -7.766 160 2HD LYS 21 2HD LYS 21 35.333 27.145 -6.418 161 1HE LYS 21 1HE LYS 21 37.775 26.611 -7.074 162 2HE LYS 21 2HE LYS 21 37.155 25.739 -8.486 163 1HZ LYS 21 1HZ LYS 21 36.670 28.624 -7.888 164 2HZ LYS 21 2HZ LYS 21 37.721 28.037 -9.020 165 3HZ LYS 21 3HZ LYS 21 36.094 27.823 -9.214 166 HA PRO 22 HA PRO 22 30.493 28.125 -6.386 167 1HB PRO 22 1HB PRO 22 32.051 30.053 -4.581 168 2HB PRO 22 2HB PRO 22 30.305 29.947 -4.899 169 1HG PRO 22 1HG PRO 22 31.306 28.912 -2.607 170 2HG PRO 22 2HG PRO 22 30.092 27.968 -3.516 171 1HD PRO 22 1HD PRO 22 33.150 27.622 -3.583 172 2HD PRO 22 2HD PRO 22 31.895 26.366 -3.366 173 H DAL 23 H ALA 23 30.879 29.058 -8.314 174 HA DAL 23 HA ALA 23 33.751 29.691 -9.182 175 1HB DAL 23 1HB ALA 23 32.924 31.551 -10.600 176 2HB DAL 23 2HB ALA 23 32.596 31.860 -8.876 177 3HB DAL 23 3HB ALA 23 31.275 31.336 -9.956 178 H VAL 24 H VAL 24 33.330 27.292 -9.450 179 HA VAL 24 HA VAL 24 32.773 26.639 -12.299 180 HB VAL 24 HB VAL 24 33.495 24.752 -10.003 181 1HG1 VAL 24 1HG2 VAL 24 33.931 24.240 -13.052 182 2HG1 VAL 24 2HG2 VAL 24 34.296 23.092 -11.736 183 3HG1 VAL 24 3HG2 VAL 24 32.624 23.544 -12.075 184 1HG2 VAL 24 1HG1 VAL 24 35.354 26.310 -10.135 185 2HG2 VAL 24 2HG1 VAL 24 35.571 26.042 -11.863 186 3HG2 VAL 24 3HG1 VAL 24 35.929 24.732 -10.688 187 H THR 25 H THR 25 30.855 25.495 -13.024 188 HA THR 25 HA THR 25 28.826 24.558 -11.044 189 HB THR 25 HB THR 25 27.103 25.539 -12.512 190 HG1 THR 25 HG1 THR 25 27.634 27.400 -13.694 191 1HG2 THR 25 1HG2 THR 25 27.432 26.616 -10.284 192 2HG2 THR 25 2HG2 THR 25 28.656 27.708 -10.984 193 3HG2 THR 25 3HG2 THR 25 26.954 27.826 -11.504 194 H ILE 26 H ILE 26 29.124 22.592 -11.647 195 HA ILE 26 HA ILE 26 29.590 21.473 -14.187 196 HB ILE 26 HB ILE 26 30.041 20.732 -11.720 197 1HG1 ILE 26 2HG1 ILE 26 29.254 18.196 -13.299 198 2HG1 ILE 26 1HG1 ILE 26 30.386 19.267 -14.027 199 1HG2 ILE 26 1HG2 ILE 26 27.675 20.546 -10.816 200 2HG2 ILE 26 2HG2 ILE 26 28.612 19.036 -10.590 201 3HG2 ILE 26 3HG2 ILE 26 27.395 19.131 -11.881 202 1HD1 ILE 26 1HD1 ILE 26 30.801 18.203 -11.183 203 2HD1 ILE 26 2HD1 ILE 26 31.929 19.170 -12.132 204 3HD1 ILE 26 3HD1 ILE 26 31.547 17.495 -12.653 205 H ARG 27 H ARG 27 28.268 19.735 -15.245 206 HA ARG 27 HA ARG 27 25.319 19.956 -15.156 207 1HB ARG 27 2HB ARG 27 25.745 21.603 -16.816 208 2HB ARG 27 1HB ARG 27 26.759 20.437 -17.777 209 1HG ARG 27 1HG ARG 27 24.873 19.140 -18.257 210 2HG ARG 27 2HG ARG 27 23.795 20.160 -17.273 211 1HD ARG 27 2HD ARG 27 25.295 21.201 -19.786 212 2HD ARG 27 1HD ARG 27 23.717 20.426 -19.875 213 HE ARG 27 HE ARG 27 23.250 22.463 -17.996 214 1HH1 ARG 27 1HH1 ARG 27 24.541 22.613 -21.356 215 2HH1 ARG 27 2HH1 ARG 27 23.865 24.311 -21.514 216 1HH2 ARG 27 1HH2 ARG 27 22.561 24.362 -18.338 217 2HH2 ARG 27 2HH2 ARG 27 22.833 25.219 -19.938 218 H CYS 28 H CYS 28 24.976 18.176 -15.110 219 HA CYS 28 HA CYS 28 26.627 15.745 -16.084 220 1HB CYS 28 1HB CYS 28 26.099 15.623 -13.624 221 2HB CYS 28 2HB CYS 28 24.366 15.497 -14.014 222 H GLU 29 H GLU 29 25.896 15.129 -17.993 223 HA GLU 29 HA GLU 29 23.254 16.069 -19.091 224 1HB GLU 29 2HB GLU 29 25.631 14.689 -20.448 225 2HB GLU 29 1HB GLU 29 24.165 15.055 -21.323 226 1HG GLU 29 1HG GLU 29 25.859 17.241 -19.989 227 2HG GLU 29 2HG GLU 29 26.110 16.670 -21.636 Start of MODEL 2 1 1H SER 1 1H SER 1 25.129 10.094 -19.184 2 2H SER 1 2H SER 1 24.308 9.457 -17.900 3 3H SER 1 3H SER 1 25.866 8.996 -18.195 4 HA SER 1 HA SER 1 24.961 11.709 -17.388 5 1HB SER 1 1HB SER 1 26.490 9.548 -15.824 6 2HB SER 1 2HB SER 1 26.230 11.207 -15.257 7 HG SER 1 HG SER 1 24.207 9.349 -15.981 8 H LYS 2 H LYS 2 26.391 13.240 -17.898 9 HA LYS 2 HA LYS 2 29.364 12.711 -18.180 10 1HB LYS 2 1HB LYS 2 27.767 14.048 -20.439 11 2HB LYS 2 2HB LYS 2 29.521 14.129 -20.290 12 1HG LYS 2 1HG LYS 2 29.721 11.651 -20.542 13 2HG LYS 2 2HG LYS 2 27.970 11.510 -20.686 14 1HD LYS 2 1HD LYS 2 28.006 12.910 -22.769 15 2HD LYS 2 2HD LYS 2 29.749 13.104 -22.654 16 1HE LYS 2 2HE LYS 2 28.391 10.331 -22.960 17 2HE LYS 2 1HE LYS 2 28.814 11.363 -24.316 18 1HZ LYS 2 1HZ LYS 2 30.553 9.762 -23.890 19 2HZ LYS 2 2HZ LYS 2 30.785 10.317 -22.352 20 3HZ LYS 2 3HZ LYS 2 31.144 11.284 -23.642 21 H TYR 3 H TYR 3 30.432 14.355 -17.314 22 HA TYR 3 HA TYR 3 28.918 16.687 -16.119 23 1HB TYR 3 2HB TYR 3 30.634 17.081 -14.681 24 2HB TYR 3 1HB TYR 3 30.362 15.386 -14.626 25 HD1 TYR 3 HD1 TYR 3 32.176 14.090 -16.570 26 HD2 TYR 3 HD2 TYR 3 32.934 17.663 -14.302 27 HE1 TYR 3 HE1 TYR 3 34.577 13.782 -16.833 28 HE2 TYR 3 HE2 TYR 3 35.312 17.274 -14.526 29 HH TYR 3 HH TYR 3 36.906 16.023 -15.375 30 H GLU 4 H GLU 4 28.942 18.550 -17.124 31 HA GLU 4 HA GLU 4 31.395 19.457 -18.809 32 1HB GLU 4 1HB GLU 4 29.855 19.455 -20.426 33 2HB GLU 4 2HB GLU 4 28.464 19.712 -19.420 34 1HG GLU 4 1HG GLU 4 29.105 22.168 -19.202 35 2HG GLU 4 2HG GLU 4 30.435 21.886 -20.318 36 H TYR 5 H TYR 5 32.631 20.228 -17.242 37 HA TYR 5 HA TYR 5 31.455 22.129 -15.170 38 1HB TYR 5 1HB TYR 5 32.610 21.372 -13.424 39 2HB TYR 5 2HB TYR 5 32.395 19.848 -14.232 40 HD1 TYR 5 HD1 TYR 5 34.447 20.827 -11.993 41 HD2 TYR 5 HD2 TYR 5 34.802 19.769 -16.138 42 HE1 TYR 5 HE1 TYR 5 36.832 20.566 -11.726 43 HE2 TYR 5 HE2 TYR 5 37.219 19.474 -15.810 44 HH TYR 5 HH TYR 5 38.902 19.540 -14.417 45 H THR 6 H THR 6 32.002 23.948 -15.508 46 HA THR 6 HA THR 6 34.151 24.583 -17.558 47 HB THR 6 HB THR 6 31.855 26.468 -16.681 48 HG1 THR 6 HG1 THR 6 30.990 24.454 -17.274 49 1HG2 THR 6 1HG2 THR 6 33.641 27.350 -18.282 50 2HG2 THR 6 2HG2 THR 6 33.216 26.022 -19.394 51 3HG2 THR 6 3HG2 THR 6 31.989 27.257 -19.017 52 H ILE 7 H ILE 7 35.785 25.898 -17.081 53 HA ILE 7 HA ILE 7 36.049 27.085 -14.271 54 HB ILE 7 HB ILE 7 38.194 25.338 -15.632 55 1HG1 ILE 7 2HG1 ILE 7 37.768 23.785 -13.378 56 2HG1 ILE 7 1HG1 ILE 7 36.212 24.584 -13.395 57 1HG2 ILE 7 1HG2 ILE 7 39.145 27.096 -14.177 58 2HG2 ILE 7 2HG2 ILE 7 38.155 26.537 -12.798 59 3HG2 ILE 7 3HG2 ILE 7 39.448 25.491 -13.475 60 1HD1 ILE 7 1HD1 ILE 7 35.967 23.598 -15.810 61 2HD1 ILE 7 2HD1 ILE 7 37.345 22.560 -15.324 62 3HD1 ILE 7 3HD1 ILE 7 35.838 22.589 -14.372 63 HA DPR 8 HA PRO 8 38.425 30.267 -16.440 64 1HB DPR 8 2HB PRO 8 37.942 31.511 -14.575 65 2HB DPR 8 1HB PRO 8 37.160 32.588 -15.751 66 1HG DPR 8 1HG PRO 8 35.776 31.624 -13.577 67 2HG DPR 8 2HG PRO 8 34.970 31.777 -15.164 68 1HD DPR 8 1HD PRO 8 35.847 29.252 -13.788 69 2HD DPR 8 2HD PRO 8 34.632 29.458 -15.070 70 H SER 9 H SER 9 38.347 29.802 -18.591 71 HA SER 9 HA SER 9 36.043 30.802 -20.323 72 1HB SER 9 1HB SER 9 37.955 32.423 -20.509 73 2HB SER 9 2HB SER 9 39.039 31.094 -20.966 74 HG SER 9 HG SER 9 37.632 30.682 -22.726 75 H TYR 10 H TYR 10 37.545 28.111 -19.177 76 HA TYR 10 HA TYR 10 37.654 26.653 -21.861 77 1HB TYR 10 1HB TYR 10 39.678 26.953 -20.007 78 2HB TYR 10 2HB TYR 10 38.912 25.603 -19.247 79 HD1 TYR 10 HD1 TYR 10 40.864 26.768 -22.154 80 HD2 TYR 10 HD2 TYR 10 38.822 23.360 -20.506 81 HE1 TYR 10 HE1 TYR 10 42.052 25.285 -23.690 82 HE2 TYR 10 HE2 TYR 10 40.045 21.905 -22.047 83 HH TYR 10 HH TYR 10 42.378 23.218 -24.374 84 H THR 11 H THR 11 36.080 25.155 -22.234 85 HA THR 11 HA THR 11 34.258 24.264 -19.992 86 HB THR 11 HB THR 11 33.944 23.764 -23.004 87 HG1 THR 11 HG1 THR 11 34.149 25.984 -22.583 88 1HG2 THR 11 1HG2 THR 11 31.755 24.104 -20.837 89 2HG2 THR 11 2HG2 THR 11 31.494 23.683 -22.553 90 3HG2 THR 11 3HG2 THR 11 32.310 22.534 -21.459 91 H PHE 12 H PHE 12 34.725 22.464 -19.121 92 HA PHE 12 HA PHE 12 36.519 20.335 -20.520 93 1HB PHE 12 2HB PHE 12 36.121 20.827 -17.549 94 2HB PHE 12 1HB PHE 12 36.936 19.431 -18.194 95 HD1 PHE 12 HD1 PHE 12 39.302 19.632 -19.032 96 HD2 PHE 12 HD2 PHE 12 37.174 23.143 -17.720 97 HE1 PHE 12 HE1 PHE 12 41.393 20.848 -18.788 98 HE2 PHE 12 HE2 PHE 12 39.286 24.296 -17.449 99 HZ PHE 12 HZ PHE 12 41.399 23.176 -17.962 100 H ARG 13 H ARG 13 35.175 18.855 -21.378 101 HA ARG 13 HA ARG 13 32.577 18.071 -19.955 102 1HB ARG 13 2HB ARG 13 32.739 17.960 -22.970 103 2HB ARG 13 1HB ARG 13 31.343 17.942 -21.868 104 1HG ARG 13 2HG ARG 13 31.567 20.397 -21.546 105 2HG ARG 13 1HG ARG 13 32.996 20.407 -22.574 106 1HD ARG 13 1HD ARG 13 31.536 19.486 -24.514 107 2HD ARG 13 2HD ARG 13 30.127 19.674 -23.462 108 HE ARG 13 HE ARG 13 31.379 22.235 -23.459 109 1HH1 ARG 13 2HH2 ARG 13 30.042 20.188 -26.106 110 2HH1 ARG 13 1HH2 ARG 13 29.707 21.707 -27.078 111 1HH2 ARG 13 1HH1 ARG 13 30.939 23.825 -24.672 112 2HH2 ARG 13 2HH1 ARG 13 30.176 23.601 -26.326 113 H GLY 14 H GLY 14 32.560 15.977 -19.386 114 1HA GLY 14 2HA GLY 14 33.392 13.779 -21.202 115 2HA GLY 14 1HA GLY 14 34.572 13.993 -19.915 116 HA PRO 15 HA PRO 15 31.047 11.285 -18.165 117 1HB PRO 15 1HB PRO 15 32.192 8.901 -17.633 118 2HB PRO 15 2HB PRO 15 31.843 9.436 -19.292 119 1HG PRO 15 2HG PRO 15 34.482 9.551 -17.793 120 2HG PRO 15 1HG PRO 15 34.180 8.880 -19.433 121 1HD PRO 15 2HD PRO 15 35.107 11.515 -18.955 122 2HD PRO 15 1HD PRO 15 34.134 11.089 -20.389 123 H GLY 16 H GLY 16 30.585 10.408 -16.032 124 1HA GLY 16 2HA GLY 16 30.782 10.155 -13.664 125 2HA GLY 16 1HA GLY 16 32.411 10.819 -13.723 126 H CYS 17 H CYS 17 29.346 11.476 -12.758 127 HA CYS 17 HA CYS 17 29.671 14.513 -12.768 128 1HB CYS 17 2HB CYS 17 27.164 12.895 -12.016 129 2HB CYS 17 1HB CYS 17 27.289 14.654 -12.152 130 HA PRO 18 HA PRO 18 30.781 14.153 -8.249 131 1HB PRO 18 2HB PRO 18 33.129 15.523 -8.184 132 2HB PRO 18 1HB PRO 18 33.030 13.852 -8.778 133 1HG PRO 18 2HG PRO 18 33.177 16.425 -10.428 134 2HG PRO 18 1HG PRO 18 34.118 14.920 -10.659 135 1HD PRO 18 2HD PRO 18 31.704 15.507 -12.049 136 2HD PRO 18 1HD PRO 18 32.288 13.853 -11.727 137 H THR 19 H THR 19 31.213 16.032 -6.664 138 HA THR 19 HA THR 19 29.388 18.372 -7.160 139 HB THR 19 HB THR 19 30.358 18.967 -4.754 140 HG1 THR 19 HG1 THR 19 30.896 17.147 -3.565 141 1HG2 THR 19 1HG2 THR 19 28.068 18.489 -5.068 142 2HG2 THR 19 2HG2 THR 19 28.683 17.701 -3.582 143 3HG2 THR 19 3HG2 THR 19 28.384 16.722 -5.077 144 H VAL 20 H VAL 20 30.036 20.548 -6.804 145 HA VAL 20 HA VAL 20 32.928 21.122 -7.238 146 HB VAL 20 HB VAL 20 32.510 22.856 -9.024 147 1HG1 VAL 20 1HG1 VAL 20 32.532 21.363 -10.982 148 2HG1 VAL 20 2HG1 VAL 20 33.497 20.700 -9.645 149 3HG1 VAL 20 3HG1 VAL 20 31.882 20.035 -9.979 150 1HG2 VAL 20 1HG2 VAL 20 29.735 21.660 -9.550 151 2HG2 VAL 20 2HG2 VAL 20 30.049 23.255 -8.823 152 3HG2 VAL 20 3HG2 VAL 20 30.553 22.933 -10.499 153 H LYS 21 H LYS 21 33.640 23.354 -6.978 154 HA LYS 21 HA LYS 21 32.527 24.420 -4.423 155 1HB LYS 21 1HB LYS 21 34.645 25.651 -4.327 156 2HB LYS 21 2HB LYS 21 34.871 23.931 -4.528 157 1HG LYS 21 1HG LYS 21 36.633 25.081 -5.529 158 2HG LYS 21 2HG LYS 21 35.746 24.252 -6.799 159 1HD LYS 21 2HD LYS 21 34.742 26.279 -7.623 160 2HD LYS 21 1HD LYS 21 35.299 27.241 -6.254 161 1HE LYS 21 2HE LYS 21 37.718 26.886 -6.994 162 2HE LYS 21 1HE LYS 21 37.137 25.965 -8.394 163 1HZ LYS 21 1HZ LYS 21 35.907 27.951 -9.112 164 2HZ LYS 21 2HZ LYS 21 36.448 28.808 -7.807 165 3HZ LYS 21 3HZ LYS 21 37.516 28.292 -8.956 166 HA PRO 22 HA PRO 22 30.522 28.041 -6.326 167 1HB PRO 22 1HB PRO 22 31.122 30.331 -4.845 168 2HB PRO 22 2HB PRO 22 30.038 29.022 -4.344 169 1HG PRO 22 1HG PRO 22 32.953 29.409 -3.560 170 2HG PRO 22 2HG PRO 22 31.569 29.025 -2.497 171 1HD PRO 22 2HD PRO 22 33.295 27.094 -3.430 172 2HD PRO 22 1HD PRO 22 31.566 26.725 -3.205 173 H DAL 23 H ALA 23 30.966 28.961 -8.221 174 HA DAL 23 HA ALA 23 33.863 29.601 -8.989 175 1HB DAL 23 1HB ALA 23 33.111 31.471 -10.438 176 2HB DAL 23 2HB ALA 23 31.433 31.268 -9.866 177 3HB DAL 23 3HB ALA 23 32.708 31.783 -8.729 178 H VAL 24 H VAL 24 33.452 27.204 -9.289 179 HA VAL 24 HA VAL 24 32.921 26.560 -12.157 180 HB VAL 24 HB VAL 24 33.667 24.680 -9.869 181 1HG1 VAL 24 1HG1 VAL 24 34.401 22.993 -11.607 182 2HG1 VAL 24 2HG1 VAL 24 33.990 24.120 -12.928 183 3HG1 VAL 24 3HG1 VAL 24 32.718 23.444 -11.893 184 1HG2 VAL 24 1HG2 VAL 24 36.078 24.658 -10.662 185 2HG2 VAL 24 2HG2 VAL 24 35.656 25.951 -11.837 186 3HG2 VAL 24 3HG2 VAL 24 35.522 26.247 -10.110 187 H THR 25 H THR 25 31.009 25.634 -12.838 188 HA THR 25 HA THR 25 29.020 24.501 -10.924 189 HB THR 25 HB THR 25 28.267 26.518 -10.739 190 HG1 THR 25 HG1 THR 25 26.831 24.835 -11.000 191 1HG2 THR 25 1HG2 THR 25 27.123 28.018 -12.436 192 2HG2 THR 25 2HG2 THR 25 27.696 26.958 -13.753 193 3HG2 THR 25 3HG2 THR 25 28.869 27.890 -12.783 194 H ILE 26 H ILE 26 29.090 22.834 -11.633 195 HA ILE 26 HA ILE 26 29.495 21.740 -14.203 196 HB ILE 26 HB ILE 26 29.870 20.915 -11.750 197 1HG1 ILE 26 1HG1 ILE 26 29.114 18.434 -13.416 198 2HG1 ILE 26 2HG1 ILE 26 30.273 19.522 -14.076 199 1HG2 ILE 26 1HG2 ILE 26 28.344 19.202 -10.731 200 2HG2 ILE 26 2HG2 ILE 26 27.194 19.373 -12.077 201 3HG2 ILE 26 3HG2 ILE 26 27.447 20.740 -10.951 202 1HD1 ILE 26 1HD1 ILE 26 31.751 19.372 -12.142 203 2HD1 ILE 26 2HD1 ILE 26 30.587 18.388 -11.238 204 3HD1 ILE 26 3HD1 ILE 26 31.380 17.711 -12.699 205 H ARG 27 H ARG 27 28.147 20.026 -15.284 206 HA ARG 27 HA ARG 27 25.200 20.344 -15.251 207 1HB ARG 27 1HB ARG 27 25.694 21.968 -16.900 208 2HB ARG 27 2HB ARG 27 26.634 20.746 -17.877 209 1HG ARG 27 1HG ARG 27 24.651 19.531 -18.313 210 2HG ARG 27 2HG ARG 27 23.670 20.633 -17.302 211 1HD ARG 27 1HD ARG 27 24.161 22.519 -18.932 212 2HD ARG 27 2HD ARG 27 25.103 21.399 -19.935 213 HE ARG 27 HE ARG 27 22.330 20.433 -19.407 214 1HH1 ARG 27 2HH1 ARG 27 24.228 22.430 -21.729 215 2HH1 ARG 27 1HH1 ARG 27 22.914 22.176 -22.984 216 1HH2 ARG 27 2HH2 ARG 27 20.961 20.249 -20.920 217 2HH2 ARG 27 1HH2 ARG 27 21.212 21.038 -22.557 218 H CYS 28 H CYS 28 24.857 18.581 -15.093 219 HA CYS 28 HA CYS 28 26.450 16.089 -16.000 220 1HB CYS 28 1HB CYS 28 25.951 16.079 -13.533 221 2HB CYS 28 2HB CYS 28 24.211 15.963 -13.889 222 H GLU 29 H GLU 29 25.691 15.349 -17.852 223 HA GLU 29 HA GLU 29 23.156 16.360 -19.061 224 1HB GLU 29 2HB GLU 29 25.400 14.570 -20.203 225 2HB GLU 29 1HB GLU 29 23.977 14.982 -21.144 226 1HG GLU 29 1HG GLU 29 24.510 17.412 -21.043 227 2HG GLU 29 2HG GLU 29 25.949 17.070 -20.072 Start of MODEL 3 1 1H SER 1 1H SER 1 25.747 9.606 -19.019 2 2H SER 1 2H SER 1 26.473 8.702 -17.842 3 3H SER 1 3H SER 1 24.868 9.077 -17.724 4 HA SER 1 HA SER 1 25.326 11.418 -17.471 5 1HB SER 1 2HB SER 1 26.869 9.597 -15.529 6 2HB SER 1 1HB SER 1 26.451 11.288 -15.204 7 HG SER 1 HG SER 1 24.626 9.201 -15.819 8 H LYS 2 H LYS 2 26.694 12.985 -18.031 9 HA LYS 2 HA LYS 2 29.696 12.574 -18.168 10 1HB LYS 2 2HB LYS 2 30.001 13.643 -20.305 11 2HB LYS 2 1HB LYS 2 29.191 12.098 -20.406 12 1HG LYS 2 2HG LYS 2 26.997 13.301 -20.901 13 2HG LYS 2 1HG LYS 2 27.850 14.827 -20.783 14 1HD LYS 2 1HD LYS 2 27.754 14.553 -23.079 15 2HD LYS 2 2HD LYS 2 29.378 14.028 -22.737 16 1HE LYS 2 2HE LYS 2 28.614 12.469 -24.333 17 2HE LYS 2 1HE LYS 2 28.469 11.568 -22.824 18 1HZ LYS 2 1HZ LYS 2 26.071 12.112 -22.826 19 2HZ LYS 2 2HZ LYS 2 26.230 12.954 -24.239 20 3HZ LYS 2 3HZ LYS 2 26.498 11.324 -24.214 21 H TYR 3 H TYR 3 30.741 14.228 -17.302 22 HA TYR 3 HA TYR 3 29.181 16.577 -16.210 23 1HB TYR 3 1HB TYR 3 30.874 17.050 -14.766 24 2HB TYR 3 2HB TYR 3 30.631 15.349 -14.662 25 HD1 TYR 3 HD1 TYR 3 33.168 17.618 -14.228 26 HD2 TYR 3 HD2 TYR 3 32.512 14.107 -16.613 27 HE1 TYR 3 HE1 TYR 3 35.541 17.233 -14.358 28 HE2 TYR 3 HE2 TYR 3 34.916 13.816 -16.805 29 HH TYR 3 HH TYR 3 37.177 16.015 -15.181 30 H GLU 4 H GLU 4 29.201 18.441 -17.235 31 HA GLU 4 HA GLU 4 31.656 19.317 -18.909 32 1HB GLU 4 1HB GLU 4 30.171 19.283 -20.563 33 2HB GLU 4 2HB GLU 4 28.756 19.561 -19.610 34 1HG GLU 4 1HG GLU 4 29.405 22.027 -19.402 35 2HG GLU 4 2HG GLU 4 30.765 21.726 -20.475 36 H TYR 5 H TYR 5 32.865 20.218 -17.347 37 HA TYR 5 HA TYR 5 31.549 22.029 -15.266 38 1HB TYR 5 1HB TYR 5 32.635 21.209 -13.504 39 2HB TYR 5 2HB TYR 5 32.525 19.727 -14.383 40 HD1 TYR 5 HD1 TYR 5 34.500 20.888 -12.065 41 HD2 TYR 5 HD2 TYR 5 34.948 19.631 -16.143 42 HE1 TYR 5 HE1 TYR 5 36.870 20.543 -11.707 43 HE2 TYR 5 HE2 TYR 5 37.338 19.298 -15.748 44 HH TYR 5 HH TYR 5 38.791 19.899 -12.575 45 H THR 6 H THR 6 31.932 23.850 -15.792 46 HA THR 6 HA THR 6 34.089 24.474 -17.820 47 HB THR 6 HB THR 6 31.730 26.345 -17.089 48 HG1 THR 6 HG1 THR 6 30.580 25.297 -18.711 49 1HG2 THR 6 1HG2 THR 6 33.506 27.138 -18.747 50 2HG2 THR 6 2HG2 THR 6 31.859 26.951 -19.474 51 3HG2 THR 6 3HG2 THR 6 33.113 25.712 -19.750 52 H ILE 7 H ILE 7 35.752 25.682 -17.280 53 HA ILE 7 HA ILE 7 35.903 26.778 -14.452 54 HB ILE 7 HB ILE 7 38.379 25.906 -15.905 55 1HG1 ILE 7 2HG1 ILE 7 37.185 23.996 -16.105 56 2HG1 ILE 7 1HG1 ILE 7 38.449 23.676 -14.915 57 1HG2 ILE 7 1HG2 ILE 7 37.819 26.015 -12.896 58 2HG2 ILE 7 2HG2 ILE 7 39.394 25.666 -13.666 59 3HG2 ILE 7 3HG2 ILE 7 38.663 27.282 -13.831 60 1HD1 ILE 7 1HD1 ILE 7 36.407 22.339 -14.604 61 2HD1 ILE 7 2HD1 ILE 7 36.572 23.425 -13.196 62 3HD1 ILE 7 3HD1 ILE 7 35.394 23.788 -14.508 63 HA DPR 8 HA PRO 8 37.484 30.629 -16.321 64 1HB DPR 8 1HB PRO 8 36.619 31.627 -14.437 65 2HB DPR 8 2HB PRO 8 35.624 32.514 -15.613 66 1HG DPR 8 2HG PRO 8 34.458 31.119 -13.548 67 2HG DPR 8 1HG PRO 8 33.709 31.124 -15.169 68 1HD DPR 8 2HD PRO 8 35.195 28.853 -13.843 69 2HD DPR 8 1HD PRO 8 33.995 28.791 -15.152 70 H SER 9 H SER 9 37.523 29.912 -18.420 71 HA SER 9 HA SER 9 35.222 30.545 -20.308 72 1HB SER 9 1HB SER 9 36.792 31.364 -21.994 73 2HB SER 9 2HB SER 9 36.904 32.370 -20.543 74 HG SER 9 HG SER 9 38.619 30.210 -21.246 75 H TYR 10 H TYR 10 37.350 28.255 -19.064 76 HA TYR 10 HA TYR 10 37.827 26.758 -21.640 77 1HB TYR 10 2HB TYR 10 39.452 27.197 -19.412 78 2HB TYR 10 1HB TYR 10 38.745 25.714 -18.884 79 HD1 TYR 10 HD1 TYR 10 39.111 23.586 -20.315 80 HD2 TYR 10 HD2 TYR 10 41.061 27.302 -21.229 81 HE1 TYR 10 HE1 TYR 10 40.773 22.398 -21.669 82 HE2 TYR 10 HE2 TYR 10 42.690 26.089 -22.594 83 HH TYR 10 HH TYR 10 43.369 24.136 -23.349 84 H THR 11 H THR 11 36.506 25.047 -22.261 85 HA THR 11 HA THR 11 34.402 24.071 -20.333 86 HB THR 11 HB THR 11 34.591 23.487 -23.334 87 HG1 THR 11 HG1 THR 11 34.744 25.724 -23.013 88 1HG2 THR 11 1HG2 THR 11 32.052 24.022 -21.659 89 2HG2 THR 11 2HG2 THR 11 32.688 22.389 -21.919 90 3HG2 THR 11 3HG2 THR 11 32.135 23.359 -23.313 91 H PHE 12 H PHE 12 34.953 22.364 -19.298 92 HA PHE 12 HA PHE 12 36.830 20.177 -20.479 93 1HB PHE 12 1HB PHE 12 36.165 20.791 -17.570 94 2HB PHE 12 2HB PHE 12 36.926 19.304 -18.053 95 HD1 PHE 12 HD1 PHE 12 37.409 23.074 -18.143 96 HD2 PHE 12 HD2 PHE 12 39.354 19.231 -18.070 97 HE1 PHE 12 HE1 PHE 12 39.495 24.113 -17.481 98 HE2 PHE 12 HE2 PHE 12 41.417 20.320 -17.402 99 HZ PHE 12 HZ PHE 12 41.466 22.761 -17.020 100 H ARG 13 H ARG 13 35.568 18.590 -21.323 101 HA ARG 13 HA ARG 13 32.896 17.865 -20.021 102 1HB ARG 13 2HB ARG 13 33.185 17.796 -23.042 103 2HB ARG 13 1HB ARG 13 31.739 17.721 -22.011 104 1HG ARG 13 2HG ARG 13 31.934 20.160 -21.569 105 2HG ARG 13 1HG ARG 13 33.381 20.207 -22.534 106 1HD ARG 13 1HD ARG 13 31.664 21.058 -23.944 107 2HD ARG 13 2HD ARG 13 32.071 19.470 -24.584 108 HE ARG 13 HE ARG 13 29.718 19.404 -22.748 109 1HH1 ARG 13 1HH1 ARG 13 30.586 19.933 -26.204 110 2HH1 ARG 13 2HH1 ARG 13 28.860 19.527 -26.675 111 1HH2 ARG 13 2HH2 ARG 13 27.838 18.979 -23.443 112 2HH2 ARG 13 1HH2 ARG 13 27.430 19.030 -25.231 113 H GLY 14 H GLY 14 32.899 15.791 -19.426 114 1HA GLY 14 2HA GLY 14 33.732 13.566 -21.192 115 2HA GLY 14 1HA GLY 14 34.927 13.803 -19.921 116 HA PRO 15 HA PRO 15 31.409 11.151 -18.074 117 1HB PRO 15 1HB PRO 15 32.577 8.797 -17.437 118 2HB PRO 15 2HB PRO 15 32.215 9.253 -19.117 119 1HG PRO 15 2HG PRO 15 34.863 9.457 -17.639 120 2HG PRO 15 1HG PRO 15 34.558 8.713 -19.247 121 1HD PRO 15 1HD PRO 15 35.466 11.369 -18.896 122 2HD PRO 15 2HD PRO 15 34.479 10.876 -20.298 123 H GLY 16 H GLY 16 30.970 10.336 -15.911 124 1HA GLY 16 1HA GLY 16 31.184 10.175 -13.532 125 2HA GLY 16 2HA GLY 16 32.789 10.888 -13.621 126 H CYS 17 H CYS 17 29.665 11.486 -12.725 127 HA CYS 17 HA CYS 17 29.946 14.529 -12.767 128 1HB CYS 17 2HB CYS 17 27.443 12.865 -12.106 129 2HB CYS 17 1HB CYS 17 27.536 14.627 -12.235 130 HA PRO 18 HA PRO 18 30.893 14.157 -8.210 131 1HB PRO 18 1HB PRO 18 33.206 15.581 -8.046 132 2HB PRO 18 2HB PRO 18 33.162 13.910 -8.646 133 1HG PRO 18 2HG PRO 18 33.331 16.486 -10.286 134 2HG PRO 18 1HG PRO 18 34.300 14.994 -10.485 135 1HD PRO 18 2HD PRO 18 31.931 15.560 -11.961 136 2HD PRO 18 1HD PRO 18 32.526 13.912 -11.635 137 H THR 19 H THR 19 31.182 15.987 -6.581 138 HA THR 19 HA THR 19 29.373 18.328 -7.137 139 HB THR 19 HB THR 19 30.193 18.865 -4.649 140 HG1 THR 19 HG1 THR 19 30.591 16.076 -4.777 141 1HG2 THR 19 1HG2 THR 19 28.400 17.626 -3.644 142 2HG2 THR 19 2HG2 THR 19 27.924 18.470 -5.148 143 3HG2 THR 19 3HG2 THR 19 28.184 16.694 -5.184 144 H VAL 20 H VAL 20 29.967 20.491 -6.778 145 HA VAL 20 HA VAL 20 32.874 21.086 -7.097 146 HB VAL 20 HB VAL 20 32.535 22.656 -9.024 147 1HG1 VAL 20 1HG1 VAL 20 31.823 19.790 -9.810 148 2HG1 VAL 20 2HG1 VAL 20 32.586 21.010 -10.861 149 3HG1 VAL 20 3HG1 VAL 20 33.457 20.393 -9.443 150 1HG2 VAL 20 1HG2 VAL 20 30.084 23.127 -8.906 151 2HG2 VAL 20 2HG2 VAL 20 30.601 22.673 -10.545 152 3HG2 VAL 20 3HG2 VAL 20 29.740 21.492 -9.520 153 H LYS 21 H LYS 21 33.539 23.361 -7.007 154 HA LYS 21 HA LYS 21 32.394 24.583 -4.542 155 1HB LYS 21 2HB LYS 21 34.472 25.914 -4.580 156 2HB LYS 21 1HB LYS 21 34.754 24.193 -4.621 157 1HG LYS 21 2HG LYS 21 36.471 25.298 -5.779 158 2HG LYS 21 1HG LYS 21 35.578 24.324 -6.939 159 1HD LYS 21 1HD LYS 21 34.443 26.267 -7.861 160 2HD LYS 21 2HD LYS 21 35.121 27.344 -6.638 161 1HE LYS 21 2HE LYS 21 37.476 26.846 -7.568 162 2HE LYS 21 1HE LYS 21 36.723 25.860 -8.836 163 1HZ LYS 21 1HZ LYS 21 37.122 28.136 -9.580 164 2HZ LYS 21 2HZ LYS 21 35.495 27.853 -9.553 165 3HZ LYS 21 3HZ LYS 21 36.195 28.761 -8.364 166 HA PRO 22 HA PRO 22 30.305 28.010 -6.738 167 1HB PRO 22 2HB PRO 22 30.774 30.397 -5.379 168 2HB PRO 22 1HB PRO 22 29.738 29.073 -4.819 169 1HG PRO 22 1HG PRO 22 32.614 29.640 -4.003 170 2HG PRO 22 2HG PRO 22 31.226 29.255 -2.946 171 1HD PRO 22 1HD PRO 22 33.068 27.359 -3.749 172 2HD PRO 22 2HD PRO 22 31.358 26.920 -3.495 173 H DAL 23 H ALA 23 30.724 28.960 -8.639 174 HA DAL 23 HA ALA 23 33.623 29.656 -9.392 175 1HB DAL 23 1HB ALA 23 32.353 31.778 -9.256 176 2HB DAL 23 2HB ALA 23 31.120 31.141 -10.378 177 3HB DAL 23 3HB ALA 23 32.791 31.405 -10.943 178 H VAL 24 H VAL 24 33.394 27.298 -9.584 179 HA VAL 24 HA VAL 24 32.803 26.351 -12.375 180 HB VAL 24 HB VAL 24 33.925 24.918 -9.903 181 1HG1 VAL 24 1HG1 VAL 24 33.735 23.491 -12.640 182 2HG1 VAL 24 2HG1 VAL 24 32.673 23.216 -11.248 183 3HG1 VAL 24 3HG1 VAL 24 34.396 22.858 -11.091 184 1HG2 VAL 24 1HG2 VAL 24 36.118 24.805 -11.048 185 2HG2 VAL 24 2HG2 VAL 24 35.540 26.477 -11.072 186 3HG2 VAL 24 3HG2 VAL 24 35.429 25.505 -12.548 187 H THR 25 H THR 25 30.736 25.599 -12.928 188 HA THR 25 HA THR 25 28.875 24.494 -10.856 189 HB THR 25 HB THR 25 27.061 25.630 -12.111 190 HG1 THR 25 HG1 THR 25 28.294 26.333 -13.850 191 1HG2 THR 25 1HG2 THR 25 27.579 26.501 -9.831 192 2HG2 THR 25 2HG2 THR 25 28.776 27.628 -10.525 193 3HG2 THR 25 3HG2 THR 25 27.044 27.820 -10.908 194 H ILE 26 H ILE 26 29.064 22.619 -11.629 195 HA ILE 26 HA ILE 26 29.587 21.665 -14.207 196 HB ILE 26 HB ILE 26 29.851 20.753 -11.756 197 1HG1 ILE 26 2HG1 ILE 26 29.269 18.305 -13.515 198 2HG1 ILE 26 1HG1 ILE 26 30.390 19.457 -14.129 199 1HG2 ILE 26 1HG2 ILE 26 28.341 18.985 -10.870 200 2HG2 ILE 26 2HG2 ILE 26 27.249 19.167 -12.263 201 3HG2 ILE 26 3HG2 ILE 26 27.415 20.504 -11.088 202 1HD1 ILE 26 1HD1 ILE 26 31.860 19.320 -12.205 203 2HD1 ILE 26 2HD1 ILE 26 31.520 17.645 -12.747 204 3HD1 ILE 26 3HD1 ILE 26 30.714 18.312 -11.298 205 H ARG 27 H ARG 27 28.330 19.999 -15.455 206 HA ARG 27 HA ARG 27 25.358 20.256 -15.481 207 1HB ARG 27 2HB ARG 27 25.908 21.889 -17.097 208 2HB ARG 27 1HB ARG 27 26.918 20.686 -18.026 209 1HG ARG 27 1HG ARG 27 25.003 19.457 -18.574 210 2HG ARG 27 2HG ARG 27 23.928 20.510 -17.622 211 1HD ARG 27 2HD ARG 27 25.535 21.507 -20.085 212 2HD ARG 27 1HD ARG 27 23.936 20.786 -20.220 213 HE ARG 27 HE ARG 27 23.456 22.822 -18.363 214 1HH1 ARG 27 1HH1 ARG 27 24.958 22.977 -21.633 215 2HH1 ARG 27 2HH1 ARG 27 24.362 24.704 -21.799 216 1HH2 ARG 27 2HH2 ARG 27 22.866 24.753 -18.709 217 2HH2 ARG 27 1HH2 ARG 27 23.271 25.626 -20.271 218 H CYS 28 H CYS 28 25.058 18.496 -15.295 219 HA CYS 28 HA CYS 28 26.657 16.009 -16.218 220 1HB CYS 28 2HB CYS 28 26.250 16.033 -13.724 221 2HB CYS 28 1HB CYS 28 24.504 15.858 -14.031 222 H GLU 29 H GLU 29 25.841 15.438 -18.091 223 HA GLU 29 HA GLU 29 23.169 16.382 -19.077 224 1HB GLU 29 1HB GLU 29 25.444 14.926 -20.524 225 2HB GLU 29 2HB GLU 29 23.950 15.322 -21.336 226 1HG GLU 29 2HG GLU 29 25.763 17.474 -20.110 227 2HG GLU 29 1HG GLU 29 25.916 16.880 -21.761 Start of MODEL 4 1 1H SER 1 1H SER 1 26.496 8.457 -17.775 2 2H SER 1 2H SER 1 24.886 8.827 -17.780 3 3H SER 1 3H SER 1 25.859 9.353 -19.008 4 HA SER 1 HA SER 1 25.313 11.164 -17.507 5 1HB SER 1 1HB SER 1 26.137 11.087 -15.168 6 2HB SER 1 2HB SER 1 24.960 9.806 -15.497 7 HG SER 1 HG SER 1 26.786 9.064 -14.373 8 H LYS 2 H LYS 2 26.693 12.731 -18.033 9 HA LYS 2 HA LYS 2 29.703 12.359 -17.921 10 1HB LYS 2 2HB LYS 2 30.163 13.327 -20.075 11 2HB LYS 2 1HB LYS 2 29.318 11.803 -20.186 12 1HG LYS 2 2HG LYS 2 27.183 13.068 -20.826 13 2HG LYS 2 1HG LYS 2 28.098 14.554 -20.732 14 1HD LYS 2 2HD LYS 2 28.102 14.199 -23.000 15 2HD LYS 2 1HD LYS 2 29.697 13.618 -22.573 16 1HE LYS 2 1HE LYS 2 28.794 11.217 -22.689 17 2HE LYS 2 2HE LYS 2 27.208 11.863 -23.145 18 1HZ LYS 2 1HZ LYS 2 28.511 11.252 -25.096 19 2HZ LYS 2 2HZ LYS 2 29.734 12.281 -24.678 20 3HZ LYS 2 3HZ LYS 2 28.256 12.884 -25.105 21 H TYR 3 H TYR 3 30.746 14.110 -17.144 22 HA TYR 3 HA TYR 3 29.082 16.408 -16.121 23 1HB TYR 3 2HB TYR 3 30.757 17.006 -14.712 24 2HB TYR 3 1HB TYR 3 30.555 15.310 -14.519 25 HD1 TYR 3 HD1 TYR 3 33.023 17.746 -14.376 26 HD2 TYR 3 HD2 TYR 3 32.461 13.912 -16.239 27 HE1 TYR 3 HE1 TYR 3 35.420 17.414 -14.474 28 HE2 TYR 3 HE2 TYR 3 34.884 13.671 -16.402 29 HH TYR 3 HH TYR 3 37.080 16.137 -15.129 30 H GLU 4 H GLU 4 29.125 18.317 -17.045 31 HA GLU 4 HA GLU 4 31.526 19.220 -18.798 32 1HB GLU 4 1HB GLU 4 30.025 19.079 -20.446 33 2HB GLU 4 2HB GLU 4 28.602 19.295 -19.479 34 1HG GLU 4 2HG GLU 4 29.103 21.799 -19.355 35 2HG GLU 4 1HG GLU 4 30.455 21.543 -20.449 36 H TYR 5 H TYR 5 32.688 20.154 -17.273 37 HA TYR 5 HA TYR 5 31.375 22.075 -15.308 38 1HB TYR 5 2HB TYR 5 32.539 21.469 -13.506 39 2HB TYR 5 1HB TYR 5 32.383 19.902 -14.232 40 HD1 TYR 5 HD1 TYR 5 34.845 19.849 -16.112 41 HD2 TYR 5 HD2 TYR 5 34.361 21.028 -12.011 42 HE1 TYR 5 HE1 TYR 5 37.264 19.649 -15.719 43 HE2 TYR 5 HE2 TYR 5 36.745 20.872 -11.689 44 HH TYR 5 HH TYR 5 38.694 20.347 -12.570 45 H THR 6 H THR 6 31.850 23.896 -15.695 46 HA THR 6 HA THR 6 33.995 24.549 -17.746 47 HB THR 6 HB THR 6 31.609 26.367 -16.979 48 HG1 THR 6 HG1 THR 6 30.495 25.348 -18.649 49 1HG2 THR 6 1HG2 THR 6 33.382 27.256 -18.593 50 2HG2 THR 6 2HG2 THR 6 31.746 27.065 -19.343 51 3HG2 THR 6 3HG2 THR 6 33.027 25.867 -19.653 52 H ILE 7 H ILE 7 35.572 25.942 -17.302 53 HA ILE 7 HA ILE 7 35.741 27.258 -14.541 54 HB ILE 7 HB ILE 7 37.970 25.540 -15.797 55 1HG1 ILE 7 1HG1 ILE 7 37.559 24.085 -13.464 56 2HG1 ILE 7 2HG1 ILE 7 35.973 24.821 -13.554 57 1HG2 ILE 7 1HG2 ILE 7 38.841 27.396 -14.416 58 2HG2 ILE 7 2HG2 ILE 7 39.192 25.837 -13.638 59 3HG2 ILE 7 3HG2 ILE 7 37.858 26.866 -13.022 60 1HD1 ILE 7 1HD1 ILE 7 35.716 22.754 -14.447 61 2HD1 ILE 7 2HD1 ILE 7 37.240 22.751 -15.368 62 3HD1 ILE 7 3HD1 ILE 7 35.829 23.702 -15.928 63 HA DPR 8 HA PRO 8 38.021 30.446 -16.801 64 1HB DPR 8 1HB PRO 8 37.452 31.744 -14.999 65 2HB DPR 8 2HB PRO 8 36.648 32.738 -16.232 66 1HG DPR 8 1HG PRO 8 35.265 31.806 -14.043 67 2HG DPR 8 2HG PRO 8 34.483 31.858 -15.648 68 1HD DPR 8 2HD PRO 8 35.444 29.433 -14.152 69 2HD DPR 8 1HD PRO 8 34.242 29.532 -15.459 70 H SER 9 H SER 9 38.017 29.920 -18.936 71 HA SER 9 HA SER 9 35.701 30.743 -20.746 72 1HB SER 9 1HB SER 9 37.542 32.440 -20.957 73 2HB SER 9 2HB SER 9 38.694 31.145 -21.341 74 HG SER 9 HG SER 9 37.345 30.604 -23.111 75 H TYR 10 H TYR 10 37.252 28.159 -19.460 76 HA TYR 10 HA TYR 10 37.479 26.598 -22.079 77 1HB TYR 10 2HB TYR 10 39.463 27.069 -20.215 78 2HB TYR 10 1HB TYR 10 38.747 25.721 -19.408 79 HD1 TYR 10 HD1 TYR 10 40.674 26.848 -22.353 80 HD2 TYR 10 HD2 TYR 10 38.785 23.423 -20.561 81 HE1 TYR 10 HE1 TYR 10 41.947 25.355 -23.807 82 HE2 TYR 10 HE2 TYR 10 40.092 21.961 -22.023 83 HH TYR 10 HH TYR 10 41.592 21.831 -23.629 84 H THR 11 H THR 11 35.982 25.013 -22.402 85 HA THR 11 HA THR 11 34.171 24.138 -20.145 86 HB THR 11 HB THR 11 33.928 23.488 -23.134 87 HG1 THR 11 HG1 THR 11 32.543 25.277 -23.241 88 1HG2 THR 11 1HG2 THR 11 31.479 23.297 -22.711 89 2HG2 THR 11 2HG2 THR 11 31.693 23.806 -21.011 90 3HG2 THR 11 3HG2 THR 11 32.337 22.242 -21.557 91 H PHE 12 H PHE 12 34.727 22.413 -19.181 92 HA PHE 12 HA PHE 12 36.651 20.320 -20.451 93 1HB PHE 12 1HB PHE 12 36.174 20.931 -17.513 94 2HB PHE 12 2HB PHE 12 37.060 19.541 -18.075 95 HD1 PHE 12 HD1 PHE 12 39.420 19.803 -18.915 96 HD2 PHE 12 HD2 PHE 12 37.137 23.276 -17.776 97 HE1 PHE 12 HE1 PHE 12 41.456 21.116 -18.719 98 HE2 PHE 12 HE2 PHE 12 39.198 24.528 -17.548 99 HZ PHE 12 HZ PHE 12 41.359 23.476 -18.002 100 H ARG 13 H ARG 13 35.405 18.734 -21.266 101 HA ARG 13 HA ARG 13 32.829 17.865 -19.851 102 1HB ARG 13 2HB ARG 13 33.049 17.637 -22.855 103 2HB ARG 13 1HB ARG 13 31.637 17.587 -21.773 104 1HG ARG 13 1HG ARG 13 31.718 20.063 -21.555 105 2HG ARG 13 2HG ARG 13 33.159 20.110 -22.563 106 1HD ARG 13 2HD ARG 13 31.786 19.026 -24.481 107 2HD ARG 13 1HD ARG 13 30.351 19.175 -23.457 108 HE ARG 13 HE ARG 13 31.452 21.802 -23.546 109 1HH1 ARG 13 1HH1 ARG 13 30.280 19.571 -26.121 110 2HH1 ARG 13 2HH1 ARG 13 29.873 21.026 -27.162 111 1HH2 ARG 13 2HH2 ARG 13 30.940 23.312 -24.833 112 2HH2 ARG 13 1HH2 ARG 13 30.219 22.974 -26.486 113 H GLY 14 H GLY 14 32.976 15.828 -19.153 114 1HA GLY 14 2HA GLY 14 34.058 13.595 -20.836 115 2HA GLY 14 1HA GLY 14 35.089 13.955 -19.456 116 HA PRO 15 HA PRO 15 31.528 11.100 -17.994 117 1HB PRO 15 1HB PRO 15 32.687 8.733 -17.377 118 2HB PRO 15 2HB PRO 15 32.409 9.253 -19.054 119 1HG PRO 15 2HG PRO 15 34.970 9.435 -17.426 120 2HG PRO 15 1HG PRO 15 34.764 8.747 -19.074 121 1HD PRO 15 2HD PRO 15 35.618 11.394 -18.594 122 2HD PRO 15 1HD PRO 15 34.687 10.948 -20.050 123 H GLY 16 H GLY 16 30.956 10.186 -15.895 124 1HA GLY 16 2HA GLY 16 30.997 9.979 -13.507 125 2HA GLY 16 1HA GLY 16 32.586 10.734 -13.460 126 H CYS 17 H CYS 17 29.415 11.241 -12.762 127 HA CYS 17 HA CYS 17 29.565 14.286 -12.856 128 1HB CYS 17 1HB CYS 17 27.145 12.462 -12.292 129 2HB CYS 17 2HB CYS 17 27.115 14.230 -12.359 130 HA PRO 18 HA PRO 18 30.202 14.279 -8.240 131 1HB PRO 18 1HB PRO 18 32.468 15.774 -8.039 132 2HB PRO 18 2HB PRO 18 32.508 14.052 -8.475 133 1HG PRO 18 1HG PRO 18 32.780 16.458 -10.336 134 2HG PRO 18 2HG PRO 18 33.769 14.967 -10.314 135 1HD PRO 18 1HD PRO 18 31.499 15.380 -12.007 136 2HD PRO 18 2HD PRO 18 32.109 13.775 -11.529 137 H THR 19 H THR 19 30.328 16.313 -6.834 138 HA THR 19 HA THR 19 28.822 18.663 -8.089 139 HB THR 19 HB THR 19 27.427 17.855 -6.433 140 HG1 THR 19 HG1 THR 19 28.745 20.210 -5.646 141 1HG2 THR 19 1HG2 THR 19 27.797 18.038 -3.978 142 2HG2 THR 19 2HG2 THR 19 28.906 16.816 -4.676 143 3HG2 THR 19 3HG2 THR 19 29.522 18.444 -4.253 144 H VAL 20 H VAL 20 29.450 20.738 -7.383 145 HA VAL 20 HA VAL 20 32.515 21.014 -7.228 146 HB VAL 20 HB VAL 20 32.447 22.784 -8.995 147 1HG1 VAL 20 1HG2 VAL 20 31.600 20.042 -9.998 148 2HG1 VAL 20 2HG2 VAL 20 33.246 20.563 -9.579 149 3HG1 VAL 20 3HG2 VAL 20 32.425 21.282 -10.985 150 1HG2 VAL 20 1HG1 VAL 20 30.651 23.109 -10.635 151 2HG2 VAL 20 2HG1 VAL 20 29.613 21.923 -9.796 152 3HG2 VAL 20 3HG1 VAL 20 30.035 23.458 -9.003 153 H LYS 21 H LYS 21 33.515 23.058 -6.715 154 HA LYS 21 HA LYS 21 32.485 24.314 -4.381 155 1HB LYS 21 1HB LYS 21 34.600 25.224 -4.368 156 2HB LYS 21 2HB LYS 21 34.755 23.607 -4.961 157 1HG LYS 21 1HG LYS 21 34.991 24.728 -7.371 158 2HG LYS 21 2HG LYS 21 35.059 26.283 -6.531 159 1HD LYS 21 2HD LYS 21 36.956 25.381 -5.132 160 2HD LYS 21 1HD LYS 21 36.846 23.874 -6.081 161 1HE LYS 21 2HE LYS 21 38.713 24.999 -7.052 162 2HE LYS 21 1HE LYS 21 37.426 25.297 -8.212 163 1HZ LYS 21 1HZ LYS 21 38.693 27.305 -7.731 164 2HZ LYS 21 2HZ LYS 21 38.365 27.212 -6.114 165 3HZ LYS 21 3HZ LYS 21 37.148 27.524 -7.187 166 HA PRO 22 HA PRO 22 30.621 28.249 -5.908 167 1HB PRO 22 1HB PRO 22 32.375 30.160 -4.359 168 2HB PRO 22 2HB PRO 22 30.651 29.797 -4.177 169 1HG PRO 22 2HG PRO 22 32.511 28.967 -2.330 170 2HG PRO 22 1HG PRO 22 31.086 27.966 -2.732 171 1HD PRO 22 1HD PRO 22 33.929 27.658 -3.941 172 2HD PRO 22 2HD PRO 22 32.922 26.396 -3.213 173 H DAL 23 H ALA 23 30.947 29.020 -7.959 174 HA DAL 23 HA ALA 23 33.768 29.618 -8.974 175 1HB DAL 23 1HB ALA 23 32.720 31.818 -8.576 176 2HB DAL 23 2HB ALA 23 31.319 31.363 -9.583 177 3HB DAL 23 3HB ALA 23 32.934 31.523 -10.321 178 H VAL 24 H VAL 24 33.333 27.255 -9.319 179 HA VAL 24 HA VAL 24 32.642 26.772 -12.159 180 HB VAL 24 HB VAL 24 33.483 24.749 -10.033 181 1HG1 VAL 24 1HG1 VAL 24 34.226 23.219 -11.921 182 2HG1 VAL 24 2HG1 VAL 24 33.772 24.447 -13.129 183 3HG1 VAL 24 3HG1 VAL 24 32.530 23.660 -12.138 184 1HG2 VAL 24 1HG2 VAL 24 35.882 24.805 -10.838 185 2HG2 VAL 24 2HG2 VAL 24 35.456 26.175 -11.912 186 3HG2 VAL 24 3HG2 VAL 24 35.337 26.342 -10.155 187 H THR 25 H THR 25 30.773 25.577 -12.908 188 HA THR 25 HA THR 25 28.758 24.561 -10.950 189 HB THR 25 HB THR 25 27.025 25.581 -12.384 190 HG1 THR 25 HG1 THR 25 28.368 26.225 -14.065 191 1HG2 THR 25 1HG2 THR 25 26.872 27.835 -11.306 192 2HG2 THR 25 2HG2 THR 25 28.576 27.706 -10.793 193 3HG2 THR 25 3HG2 THR 25 27.356 26.588 -10.125 194 H ILE 26 H ILE 26 29.061 22.625 -11.617 195 HA ILE 26 HA ILE 26 29.543 21.574 -14.183 196 HB ILE 26 HB ILE 26 29.993 20.778 -11.744 197 1HG1 ILE 26 2HG1 ILE 26 29.192 18.264 -13.349 198 2HG1 ILE 26 1HG1 ILE 26 30.313 19.344 -14.077 199 1HG2 ILE 26 1HG2 ILE 26 28.555 19.074 -10.632 200 2HG2 ILE 26 2HG2 ILE 26 27.619 20.586 -10.840 201 3HG2 ILE 26 3HG2 ILE 26 27.337 19.186 -11.922 202 1HD1 ILE 26 1HD1 ILE 26 31.506 17.570 -12.735 203 2HD1 ILE 26 2HD1 ILE 26 30.751 18.236 -11.251 204 3HD1 ILE 26 3HD1 ILE 26 31.868 19.237 -12.179 205 H ARG 27 H ARG 27 28.219 19.818 -15.257 206 HA ARG 27 HA ARG 27 25.276 20.063 -15.204 207 1HB ARG 27 1HB ARG 27 25.735 21.712 -16.862 208 2HB ARG 27 2HB ARG 27 26.756 20.542 -17.808 209 1HG ARG 27 2HG ARG 27 24.874 19.256 -18.319 210 2HG ARG 27 1HG ARG 27 23.784 20.275 -17.347 211 1HD ARG 27 2HD ARG 27 25.322 21.319 -19.837 212 2HD ARG 27 1HD ARG 27 23.743 20.550 -19.949 213 HE ARG 27 HE ARG 27 23.250 22.580 -18.074 214 1HH1 ARG 27 2HH2 ARG 27 24.620 22.748 -21.402 215 2HH1 ARG 27 1HH2 ARG 27 23.958 24.452 -21.562 216 1HH2 ARG 27 1HH1 ARG 27 22.580 24.486 -18.417 217 2HH2 ARG 27 2HH1 ARG 27 22.895 25.353 -20.003 218 H CYS 28 H CYS 28 24.896 18.280 -15.218 219 HA CYS 28 HA CYS 28 26.569 15.849 -16.160 220 1HB CYS 28 2HB CYS 28 25.939 15.704 -13.723 221 2HB CYS 28 1HB CYS 28 24.226 15.576 -14.189 222 H GLU 29 H GLU 29 25.919 15.278 -18.107 223 HA GLU 29 HA GLU 29 23.301 16.205 -19.282 224 1HB GLU 29 2HB GLU 29 25.759 14.887 -20.588 225 2HB GLU 29 1HB GLU 29 24.302 15.267 -21.494 226 1HG GLU 29 1HG GLU 29 24.558 17.703 -21.025 227 2HG GLU 29 2HG GLU 29 26.025 17.380 -20.089 Start of MODEL 5 1 1H SER 1 1H SER 1 24.811 8.846 -17.937 2 2H SER 1 2H SER 1 26.421 8.481 -18.011 3 3H SER 1 3H SER 1 25.734 9.430 -19.176 4 HA SER 1 HA SER 1 25.248 11.176 -17.573 5 1HB SER 1 2HB SER 1 26.720 9.279 -15.649 6 2HB SER 1 1HB SER 1 26.290 10.957 -15.273 7 HG SER 1 HG SER 1 24.111 10.414 -15.703 8 H LYS 2 H LYS 2 26.621 12.755 -18.078 9 HA LYS 2 HA LYS 2 29.626 12.392 -18.063 10 1HB LYS 2 2HB LYS 2 30.054 13.419 -20.189 11 2HB LYS 2 1HB LYS 2 29.271 11.858 -20.305 12 1HG LYS 2 1HG LYS 2 27.094 13.000 -20.958 13 2HG LYS 2 2HG LYS 2 27.895 14.566 -20.858 14 1HD LYS 2 2HD LYS 2 29.515 13.831 -22.696 15 2HD LYS 2 1HD LYS 2 28.672 12.291 -22.777 16 1HE LYS 2 1HE LYS 2 27.795 13.463 -24.591 17 2HE LYS 2 2HE LYS 2 26.503 13.607 -23.410 18 1HZ LYS 2 1HZ LYS 2 28.547 15.703 -24.033 19 2HZ LYS 2 2HZ LYS 2 27.348 15.874 -22.909 20 3HZ LYS 2 3HZ LYS 2 26.964 15.715 -24.508 21 H TYR 3 H TYR 3 30.586 14.085 -17.165 22 HA TYR 3 HA TYR 3 28.920 16.379 -16.154 23 1HB TYR 3 1HB TYR 3 30.568 16.896 -14.674 24 2HB TYR 3 2HB TYR 3 30.293 15.211 -14.555 25 HD1 TYR 3 HD1 TYR 3 32.835 17.577 -14.287 26 HD2 TYR 3 HD2 TYR 3 32.213 13.810 -16.264 27 HE1 TYR 3 HE1 TYR 3 35.228 17.177 -14.337 28 HE2 TYR 3 HE2 TYR 3 34.641 13.540 -16.431 29 HH TYR 3 HH TYR 3 36.613 14.324 -15.901 30 H GLU 4 H GLU 4 28.987 18.356 -17.092 31 HA GLU 4 HA GLU 4 31.461 19.187 -18.782 32 1HB GLU 4 1HB GLU 4 29.969 19.120 -20.430 33 2HB GLU 4 2HB GLU 4 28.549 19.341 -19.463 34 1HG GLU 4 1HG GLU 4 29.091 21.830 -19.295 35 2HG GLU 4 2HG GLU 4 30.430 21.571 -20.404 36 H TYR 5 H TYR 5 32.671 20.011 -17.200 37 HA TYR 5 HA TYR 5 31.443 22.032 -15.275 38 1HB TYR 5 1HB TYR 5 32.528 21.343 -13.462 39 2HB TYR 5 2HB TYR 5 32.319 19.791 -14.206 40 HD1 TYR 5 HD1 TYR 5 34.795 19.606 -16.035 41 HD2 TYR 5 HD2 TYR 5 34.327 20.903 -11.966 42 HE1 TYR 5 HE1 TYR 5 37.180 19.249 -15.605 43 HE2 TYR 5 HE2 TYR 5 36.694 20.581 -11.601 44 HH TYR 5 HH TYR 5 38.818 19.342 -14.157 45 H THR 6 H THR 6 32.000 23.816 -15.619 46 HA THR 6 HA THR 6 34.223 24.419 -17.595 47 HB THR 6 HB THR 6 31.947 26.363 -16.804 48 HG1 THR 6 HG1 THR 6 30.786 25.461 -18.508 49 1HG2 THR 6 1HG2 THR 6 33.799 27.166 -18.380 50 2HG2 THR 6 2HG2 THR 6 33.355 25.835 -19.478 51 3HG2 THR 6 3HG2 THR 6 32.160 27.111 -19.146 52 H ILE 7 H ILE 7 35.873 25.676 -17.082 53 HA ILE 7 HA ILE 7 36.095 26.894 -14.281 54 HB ILE 7 HB ILE 7 38.259 25.162 -15.648 55 1HG1 ILE 7 1HG1 ILE 7 37.940 23.556 -13.508 56 2HG1 ILE 7 2HG1 ILE 7 36.422 24.391 -13.306 57 1HG2 ILE 7 1HG2 ILE 7 39.508 25.352 -13.463 58 2HG2 ILE 7 2HG2 ILE 7 39.178 26.949 -14.166 59 3HG2 ILE 7 3HG2 ILE 7 38.182 26.368 -12.805 60 1HD1 ILE 7 1HD1 ILE 7 36.067 23.429 -15.863 61 2HD1 ILE 7 2HD1 ILE 7 35.722 22.554 -14.381 62 3HD1 ILE 7 3HD1 ILE 7 37.260 22.258 -15.235 63 HA DPR 8 HA PRO 8 38.443 30.102 -16.446 64 1HB DPR 8 1HB PRO 8 37.930 31.345 -14.588 65 2HB DPR 8 2HB PRO 8 37.143 32.409 -15.775 66 1HG DPR 8 2HG PRO 8 35.753 31.435 -13.609 67 2HG DPR 8 1HG PRO 8 34.960 31.569 -15.204 68 1HD DPR 8 2HD PRO 8 35.863 29.063 -13.809 69 2HD DPR 8 1HD PRO 8 34.652 29.247 -15.099 70 H SER 9 H SER 9 38.380 29.609 -18.595 71 HA SER 9 HA SER 9 36.082 30.579 -20.349 72 1HB SER 9 2HB SER 9 37.976 32.222 -20.531 73 2HB SER 9 1HB SER 9 39.079 30.903 -20.972 74 HG SER 9 HG SER 9 37.691 30.465 -22.740 75 H TYR 10 H TYR 10 37.597 27.918 -19.174 76 HA TYR 10 HA TYR 10 37.721 26.429 -21.841 77 1HB TYR 10 1HB TYR 10 39.765 26.792 -20.033 78 2HB TYR 10 2HB TYR 10 39.030 25.453 -19.222 79 HD1 TYR 10 HD1 TYR 10 38.943 23.176 -20.421 80 HD2 TYR 10 HD2 TYR 10 40.918 26.561 -22.193 81 HE1 TYR 10 HE1 TYR 10 40.159 21.694 -21.942 82 HE2 TYR 10 HE2 TYR 10 42.099 25.051 -23.707 83 HH TYR 10 HH TYR 10 42.439 22.970 -24.341 84 H THR 11 H THR 11 36.176 24.898 -22.172 85 HA THR 11 HA THR 11 34.376 24.024 -19.904 86 HB THR 11 HB THR 11 34.064 23.471 -22.908 87 HG1 THR 11 HG1 THR 11 33.072 25.668 -21.412 88 1HG2 THR 11 1HG2 THR 11 31.874 23.797 -20.739 89 2HG2 THR 11 2HG2 THR 11 32.452 22.231 -21.348 90 3HG2 THR 11 3HG2 THR 11 31.615 23.356 -22.450 91 H PHE 12 H PHE 12 34.838 22.250 -19.006 92 HA PHE 12 HA PHE 12 36.683 20.115 -20.328 93 1HB PHE 12 2HB PHE 12 36.229 20.687 -17.374 94 2HB PHE 12 1HB PHE 12 37.031 19.256 -17.956 95 HD1 PHE 12 HD1 PHE 12 37.322 22.995 -17.681 96 HD2 PHE 12 HD2 PHE 12 39.411 19.374 -18.724 97 HE1 PHE 12 HE1 PHE 12 39.448 24.127 -17.440 98 HE2 PHE 12 HE2 PHE 12 41.519 20.565 -18.509 99 HZ PHE 12 HZ PHE 12 41.550 22.940 -17.830 100 H ARG 13 H ARG 13 35.373 18.614 -21.208 101 HA ARG 13 HA ARG 13 32.767 17.791 -19.822 102 1HB ARG 13 1HB ARG 13 32.980 17.667 -22.837 103 2HB ARG 13 2HB ARG 13 31.568 17.616 -21.758 104 1HG ARG 13 1HG ARG 13 31.737 20.082 -21.435 105 2HG ARG 13 2HG ARG 13 33.174 20.118 -22.450 106 1HD ARG 13 1HD ARG 13 31.754 19.161 -24.401 107 2HD ARG 13 2HD ARG 13 30.330 19.321 -23.364 108 HE ARG 13 HE ARG 13 31.583 21.905 -23.381 109 1HH1 ARG 13 2HH2 ARG 13 30.101 19.837 -25.932 110 2HH1 ARG 13 1HH2 ARG 13 29.709 21.349 -26.895 111 1HH2 ARG 13 1HH1 ARG 13 31.073 23.485 -24.579 112 2HH2 ARG 13 2HH1 ARG 13 30.217 23.249 -26.185 113 H GLY 14 H GLY 14 32.784 15.699 -19.249 114 1HA GLY 14 1HA GLY 14 33.665 13.509 -21.037 115 2HA GLY 14 2HA GLY 14 34.857 13.762 -19.768 116 HA PRO 15 HA PRO 15 31.381 11.028 -17.947 117 1HB PRO 15 2HB PRO 15 32.462 8.573 -17.642 118 2HB PRO 15 1HB PRO 15 32.023 9.222 -19.238 119 1HG PRO 15 2HG PRO 15 34.763 9.141 -17.929 120 2HG PRO 15 1HG PRO 15 34.319 8.590 -19.582 121 1HD PRO 15 1HD PRO 15 35.385 11.153 -18.997 122 2HD PRO 15 2HD PRO 15 34.317 10.852 -20.394 123 H GLY 16 H GLY 16 31.040 10.049 -15.868 124 1HA GLY 16 2HA GLY 16 31.332 9.677 -13.505 125 2HA GLY 16 1HA GLY 16 33.010 10.187 -13.653 126 H CYS 17 H CYS 17 29.970 11.132 -12.611 127 HA CYS 17 HA CYS 17 30.470 14.098 -12.695 128 1HB CYS 17 2HB CYS 17 27.965 12.552 -11.829 129 2HB CYS 17 1HB CYS 17 28.094 14.306 -12.022 130 HA PRO 18 HA PRO 18 31.519 14.101 -8.127 131 1HB PRO 18 1HB PRO 18 33.670 15.767 -8.110 132 2HB PRO 18 2HB PRO 18 33.794 14.075 -8.637 133 1HG PRO 18 1HG PRO 18 33.606 16.578 -10.389 134 2HG PRO 18 2HG PRO 18 34.746 15.208 -10.557 135 1HD PRO 18 1HD PRO 18 32.300 15.396 -11.985 136 2HD PRO 18 2HD PRO 18 33.089 13.853 -11.569 137 H THR 19 H THR 19 31.698 16.087 -6.615 138 HA THR 19 HA THR 19 29.607 18.167 -7.243 139 HB THR 19 HB THR 19 30.451 18.942 -4.822 140 HG1 THR 19 HG1 THR 19 32.135 17.430 -4.712 141 1HG2 THR 19 1HG2 THR 19 28.646 16.561 -5.163 142 2HG2 THR 19 2HG2 THR 19 28.814 17.595 -3.685 143 3HG2 THR 19 3HG2 THR 19 28.215 18.301 -5.215 144 H VAL 20 H VAL 20 29.984 20.422 -6.874 145 HA VAL 20 HA VAL 20 32.773 21.309 -7.450 146 HB VAL 20 HB VAL 20 32.070 22.917 -9.260 147 1HG1 VAL 20 1HG1 VAL 20 32.138 21.343 -11.172 148 2HG1 VAL 20 2HG1 VAL 20 31.703 20.007 -10.068 149 3HG1 VAL 20 3HG1 VAL 20 33.247 20.863 -9.873 150 1HG2 VAL 20 1HG2 VAL 20 30.037 22.760 -10.603 151 2HG2 VAL 20 2HG2 VAL 20 29.590 23.048 -8.907 152 3HG2 VAL 20 3HG2 VAL 20 29.414 21.417 -9.600 153 H LYS 21 H LYS 21 33.270 23.590 -7.253 154 HA LYS 21 HA LYS 21 32.037 24.725 -4.771 155 1HB LYS 21 2HB LYS 21 34.026 26.152 -4.730 156 2HB LYS 21 1HB LYS 21 34.417 24.451 -4.788 157 1HG LYS 21 1HG LYS 21 36.098 25.668 -5.871 158 2HG LYS 21 2HG LYS 21 35.297 24.677 -7.080 159 1HD LYS 21 1HD LYS 21 34.159 26.540 -8.049 160 2HD LYS 21 2HD LYS 21 34.571 27.652 -6.757 161 1HE LYS 21 1HE LYS 21 36.702 26.426 -8.647 162 2HE LYS 21 2HE LYS 21 35.853 27.934 -8.976 163 1HZ LYS 21 1HZ LYS 21 36.754 28.874 -6.928 164 2HZ LYS 21 2HZ LYS 21 37.970 28.362 -7.921 165 3HZ LYS 21 3HZ LYS 21 37.563 27.475 -6.588 166 HA PRO 22 HA PRO 22 29.773 27.969 -7.027 167 1HB PRO 22 1HB PRO 22 30.041 30.391 -5.671 168 2HB PRO 22 2HB PRO 22 29.089 28.998 -5.128 169 1HG PRO 22 2HG PRO 22 31.900 29.768 -4.253 170 2HG PRO 22 1HG PRO 22 30.519 29.291 -3.225 171 1HD PRO 22 2HD PRO 22 32.502 27.522 -3.971 172 2HD PRO 22 1HD PRO 22 30.819 26.969 -3.767 173 H DAL 23 H ALA 23 30.192 28.873 -8.945 174 HA DAL 23 HA ALA 23 33.039 29.788 -9.624 175 1HB DAL 23 1HB ALA 23 31.638 31.832 -9.523 176 2HB DAL 23 2HB ALA 23 30.477 31.120 -10.677 177 3HB DAL 23 3HB ALA 23 32.143 31.488 -11.199 178 H VAL 24 H VAL 24 32.881 27.360 -9.796 179 HA VAL 24 HA VAL 24 32.587 26.491 -12.651 180 HB VAL 24 HB VAL 24 33.440 24.899 -10.184 181 1HG1 VAL 24 1HG1 VAL 24 32.645 23.352 -12.034 182 2HG1 VAL 24 2HG1 VAL 24 34.355 23.097 -11.657 183 3HG1 VAL 24 3HG1 VAL 24 33.880 23.990 -13.132 184 1HG2 VAL 24 1HG2 VAL 24 35.345 26.054 -12.323 185 2HG2 VAL 24 2HG2 VAL 24 35.834 25.070 -10.905 186 3HG2 VAL 24 3HG2 VAL 24 35.110 26.675 -10.690 187 H THR 25 H THR 25 30.592 25.633 -13.368 188 HA THR 25 HA THR 25 28.593 24.556 -11.391 189 HB THR 25 HB THR 25 26.877 25.536 -12.840 190 HG1 THR 25 HG1 THR 25 27.400 27.390 -14.038 191 1HG2 THR 25 1HG2 THR 25 28.440 27.714 -11.338 192 2HG2 THR 25 2HG2 THR 25 27.220 26.625 -10.625 193 3HG2 THR 25 3HG2 THR 25 26.734 27.827 -11.850 194 H ILE 26 H ILE 26 28.988 22.642 -11.977 195 HA ILE 26 HA ILE 26 29.542 21.442 -14.428 196 HB ILE 26 HB ILE 26 29.899 20.795 -11.957 197 1HG1 ILE 26 1HG1 ILE 26 29.057 18.199 -13.391 198 2HG1 ILE 26 2HG1 ILE 26 30.251 19.183 -14.138 199 1HG2 ILE 26 1HG2 ILE 26 27.187 19.276 -12.080 200 2HG2 ILE 26 2HG2 ILE 26 28.363 19.215 -10.746 201 3HG2 ILE 26 3HG2 ILE 26 27.489 20.740 -11.097 202 1HD1 ILE 26 1HD1 ILE 26 31.307 17.462 -12.653 203 2HD1 ILE 26 2HD1 ILE 26 31.723 19.143 -12.177 204 3HD1 ILE 26 3HD1 ILE 26 30.522 18.247 -11.239 205 H ARG 27 H ARG 27 28.366 19.656 -15.560 206 HA ARG 27 HA ARG 27 25.372 19.718 -15.497 207 1HB ARG 27 1HB ARG 27 26.839 20.161 -18.120 208 2HB ARG 27 2HB ARG 27 25.153 19.542 -17.986 209 1HG ARG 27 1HG ARG 27 24.370 21.455 -16.977 210 2HG ARG 27 2HG ARG 27 26.017 22.204 -16.951 211 1HD ARG 27 1HD ARG 27 26.011 22.259 -19.476 212 2HD ARG 27 2HD ARG 27 24.393 21.540 -19.504 213 HE ARG 27 HE ARG 27 25.081 24.343 -18.507 214 1HH1 ARG 27 1HH1 ARG 27 22.419 22.094 -19.413 215 2HH1 ARG 27 2HH1 ARG 27 21.245 23.503 -19.367 216 1HH2 ARG 27 1HH2 ARG 27 23.645 25.802 -18.500 217 2HH2 ARG 27 2HH2 ARG 27 21.889 25.436 -18.890 218 H CYS 28 H CYS 28 25.290 17.965 -14.983 219 HA CYS 28 HA CYS 28 26.807 15.520 -16.075 220 1HB CYS 28 2HB CYS 28 26.696 15.617 -13.569 221 2HB CYS 28 1HB CYS 28 24.929 15.374 -13.661 222 H GLU 29 H GLU 29 25.843 15.454 -17.943 223 HA GLU 29 HA GLU 29 23.091 16.271 -18.556 224 1HB GLU 29 1HB GLU 29 25.250 15.013 -20.370 225 2HB GLU 29 2HB GLU 29 23.673 15.454 -21.001 226 1HG GLU 29 1HG GLU 29 24.011 17.847 -20.428 227 2HG GLU 29 2HG GLU 29 25.600 17.477 -19.747 Start of MODEL 6 1 1H SER 1 1H SER 1 24.910 8.891 -18.100 2 2H SER 1 2H SER 1 26.526 8.572 -18.220 3 3H SER 1 3H SER 1 25.781 9.504 -19.362 4 HA SER 1 HA SER 1 25.292 11.231 -17.739 5 1HB SER 1 1HB SER 1 26.876 9.375 -15.866 6 2HB SER 1 2HB SER 1 26.402 11.036 -15.470 7 HG SER 1 HG SER 1 24.231 10.425 -15.840 8 H LYS 2 H LYS 2 26.613 12.865 -18.221 9 HA LYS 2 HA LYS 2 29.624 12.587 -18.289 10 1HB LYS 2 2HB LYS 2 29.952 13.732 -20.411 11 2HB LYS 2 1HB LYS 2 29.305 12.117 -20.559 12 1HG LYS 2 2HG LYS 2 27.085 12.953 -21.230 13 2HG LYS 2 1HG LYS 2 27.551 14.604 -20.866 14 1HD LYS 2 1HD LYS 2 27.627 14.594 -23.178 15 2HD LYS 2 2HD LYS 2 29.306 14.459 -22.739 16 1HE LYS 2 1HE LYS 2 29.079 12.974 -24.567 17 2HE LYS 2 2HE LYS 2 29.089 11.881 -23.183 18 1HZ LYS 2 1HZ LYS 2 27.337 11.322 -24.762 19 2HZ LYS 2 2HZ LYS 2 26.637 11.791 -23.341 20 3HZ LYS 2 3HZ LYS 2 26.650 12.819 -24.635 21 H TYR 3 H TYR 3 30.549 14.306 -17.382 22 HA TYR 3 HA TYR 3 28.829 16.631 -16.488 23 1HB TYR 3 1HB TYR 3 30.366 17.188 -14.921 24 2HB TYR 3 2HB TYR 3 30.097 15.498 -14.753 25 HD1 TYR 3 HD1 TYR 3 32.069 13.964 -16.088 26 HD2 TYR 3 HD2 TYR 3 32.640 17.954 -14.588 27 HE1 TYR 3 HE1 TYR 3 34.490 13.636 -16.028 28 HE2 TYR 3 HE2 TYR 3 35.021 17.514 -14.415 29 HH TYR 3 HH TYR 3 36.670 16.125 -14.797 30 H GLU 4 H GLU 4 29.048 18.587 -17.299 31 HA GLU 4 HA GLU 4 31.538 19.377 -18.977 32 1HB GLU 4 1HB GLU 4 30.077 19.365 -20.674 33 2HB GLU 4 2HB GLU 4 28.644 19.570 -19.735 34 1HG GLU 4 2HG GLU 4 29.463 22.105 -19.470 35 2HG GLU 4 1HG GLU 4 30.505 21.751 -20.832 36 H TYR 5 H TYR 5 32.701 20.294 -17.392 37 HA TYR 5 HA TYR 5 31.359 22.276 -15.508 38 1HB TYR 5 2HB TYR 5 32.484 21.726 -13.667 39 2HB TYR 5 1HB TYR 5 32.230 20.146 -14.323 40 HD1 TYR 5 HD1 TYR 5 34.773 19.930 -16.172 41 HD2 TYR 5 HD2 TYR 5 34.209 21.193 -12.107 42 HE1 TYR 5 HE1 TYR 5 37.148 19.545 -15.669 43 HE2 TYR 5 HE2 TYR 5 36.559 20.870 -11.683 44 HH TYR 5 HH TYR 5 38.499 20.186 -12.476 45 H THR 6 H THR 6 31.916 24.091 -15.831 46 HA THR 6 HA THR 6 34.158 24.695 -17.790 47 HB THR 6 HB THR 6 31.838 26.619 -17.084 48 HG1 THR 6 HG1 THR 6 31.813 24.517 -18.981 49 1HG2 THR 6 1HG2 THR 6 33.296 26.039 -19.720 50 2HG2 THR 6 2HG2 THR 6 32.083 27.312 -19.441 51 3HG2 THR 6 3HG2 THR 6 33.708 27.405 -18.650 52 H ILE 7 H ILE 7 35.795 25.956 -17.237 53 HA ILE 7 HA ILE 7 35.906 27.229 -14.453 54 HB ILE 7 HB ILE 7 38.102 25.447 -15.691 55 1HG1 ILE 7 2HG1 ILE 7 37.661 23.931 -13.483 56 2HG1 ILE 7 1HG1 ILE 7 36.143 24.795 -13.412 57 1HG2 ILE 7 1HG2 ILE 7 37.953 26.748 -12.894 58 2HG2 ILE 7 2HG2 ILE 7 39.000 27.268 -14.241 59 3HG2 ILE 7 3HG2 ILE 7 39.280 25.690 -13.475 60 1HD1 ILE 7 1HD1 ILE 7 37.052 22.550 -15.174 61 2HD1 ILE 7 2HD1 ILE 7 35.463 22.944 -14.456 62 3HD1 ILE 7 3HD1 ILE 7 35.942 23.720 -15.948 63 HA DPR 8 HA PRO 8 38.336 30.398 -16.578 64 1HB DPR 8 2HB PRO 8 37.733 31.676 -14.771 65 2HB DPR 8 1HB PRO 8 37.000 32.713 -16.013 66 1HG DPR 8 2HG PRO 8 35.514 31.777 -13.895 67 2HG DPR 8 1HG PRO 8 34.794 31.877 -15.527 68 1HD DPR 8 2HD PRO 8 35.641 29.402 -14.043 69 2HD DPR 8 1HD PRO 8 34.490 29.553 -15.391 70 H SER 9 H SER 9 38.393 29.905 -18.722 71 HA SER 9 HA SER 9 36.165 30.821 -20.595 72 1HB SER 9 2HB SER 9 38.048 32.480 -20.708 73 2HB SER 9 1HB SER 9 39.185 31.167 -21.077 74 HG SER 9 HG SER 9 36.865 31.868 -22.562 75 H TYR 10 H TYR 10 37.583 28.179 -19.304 76 HA TYR 10 HA TYR 10 37.871 26.652 -21.939 77 1HB TYR 10 2HB TYR 10 39.806 27.047 -20.019 78 2HB TYR 10 1HB TYR 10 39.025 25.720 -19.233 79 HD1 TYR 10 HD1 TYR 10 39.027 23.423 -20.389 80 HD2 TYR 10 HD2 TYR 10 41.074 26.789 -22.117 81 HE1 TYR 10 HE1 TYR 10 40.330 21.923 -21.816 82 HE2 TYR 10 HE2 TYR 10 42.343 25.259 -23.536 83 HH TYR 10 HH TYR 10 41.872 21.748 -23.377 84 H THR 11 H THR 11 36.355 25.110 -22.336 85 HA THR 11 HA THR 11 34.412 24.279 -20.173 86 HB THR 11 HB THR 11 34.301 23.660 -23.175 87 HG1 THR 11 HG1 THR 11 33.216 25.894 -21.810 88 1HG2 THR 11 1HG2 THR 11 31.848 23.497 -22.907 89 2HG2 THR 11 2HG2 THR 11 32.567 22.491 -21.620 90 3HG2 THR 11 3HG2 THR 11 31.935 24.098 -21.228 91 H PHE 12 H PHE 12 34.907 22.542 -19.170 92 HA PHE 12 HA PHE 12 36.843 20.412 -20.356 93 1HB PHE 12 1HB PHE 12 36.251 21.051 -17.440 94 2HB PHE 12 2HB PHE 12 37.112 19.626 -17.946 95 HD1 PHE 12 HD1 PHE 12 37.333 23.348 -17.645 96 HD2 PHE 12 HD2 PHE 12 39.495 19.790 -18.756 97 HE1 PHE 12 HE1 PHE 12 39.437 24.514 -17.369 98 HE2 PHE 12 HE2 PHE 12 41.578 21.018 -18.514 99 HZ PHE 12 HZ PHE 12 41.563 23.376 -17.792 100 H ARG 13 H ARG 13 35.659 18.747 -21.138 101 HA ARG 13 HA ARG 13 32.995 17.980 -19.838 102 1HB ARG 13 2HB ARG 13 33.305 17.882 -22.856 103 2HB ARG 13 1HB ARG 13 31.848 17.821 -21.844 104 1HG ARG 13 2HG ARG 13 31.996 20.237 -21.415 105 2HG ARG 13 1HG ARG 13 33.490 20.318 -22.305 106 1HD ARG 13 1HD ARG 13 31.845 21.162 -23.794 107 2HD ARG 13 2HD ARG 13 32.306 19.585 -24.426 108 HE ARG 13 HE ARG 13 29.843 19.526 -22.719 109 1HH1 ARG 13 2HH1 ARG 13 30.942 19.904 -26.128 110 2HH1 ARG 13 1HH1 ARG 13 29.260 19.441 -26.697 111 1HH2 ARG 13 1HH2 ARG 13 28.023 19.028 -23.521 112 2HH2 ARG 13 2HH2 ARG 13 27.742 18.985 -25.334 113 H GLY 14 H GLY 14 32.970 15.911 -19.249 114 1HA GLY 14 2HA GLY 14 33.909 13.674 -20.952 115 2HA GLY 14 1HA GLY 14 35.043 13.955 -19.637 116 HA PRO 15 HA PRO 15 31.397 11.312 -17.980 117 1HB PRO 15 1HB PRO 15 32.295 8.770 -17.775 118 2HB PRO 15 2HB PRO 15 31.872 9.512 -19.334 119 1HG PRO 15 1HG PRO 15 34.624 9.188 -18.088 120 2HG PRO 15 2HG PRO 15 34.108 8.730 -19.749 121 1HD PRO 15 1HD PRO 15 35.373 11.182 -19.125 122 2HD PRO 15 2HD PRO 15 34.224 11.020 -20.480 123 H GLY 16 H GLY 16 30.973 10.331 -15.965 124 1HA GLY 16 2HA GLY 16 31.188 9.903 -13.584 125 2HA GLY 16 1HA GLY 16 32.907 10.262 -13.700 126 H CYS 17 H CYS 17 29.903 11.499 -12.769 127 HA CYS 17 HA CYS 17 30.630 14.404 -12.885 128 1HB CYS 17 2HB CYS 17 28.038 13.043 -11.976 129 2HB CYS 17 1HB CYS 17 28.279 14.783 -12.183 130 HA PRO 18 HA PRO 18 31.674 14.384 -8.297 131 1HB PRO 18 2HB PRO 18 33.822 16.068 -8.282 132 2HB PRO 18 1HB PRO 18 33.951 14.376 -8.804 133 1HG PRO 18 2HG PRO 18 33.726 16.874 -10.567 134 2HG PRO 18 1HG PRO 18 34.888 15.523 -10.734 135 1HD PRO 18 2HD PRO 18 32.453 15.636 -12.176 136 2HD PRO 18 1HD PRO 18 33.238 14.113 -11.687 137 H THR 19 H THR 19 31.828 16.312 -6.753 138 HA THR 19 HA THR 19 29.769 18.429 -7.357 139 HB THR 19 HB THR 19 30.616 19.127 -4.893 140 HG1 THR 19 HG1 THR 19 32.196 17.504 -4.788 141 1HG2 THR 19 1HG2 THR 19 28.669 16.883 -5.367 142 2HG2 THR 19 2HG2 THR 19 28.861 17.856 -3.850 143 3HG2 THR 19 3HG2 THR 19 28.358 18.648 -5.370 144 H VAL 20 H VAL 20 30.146 20.664 -6.927 145 HA VAL 20 HA VAL 20 32.902 21.521 -7.715 146 HB VAL 20 HB VAL 20 32.010 23.101 -9.473 147 1HG1 VAL 20 1HG2 VAL 20 33.122 21.009 -10.134 148 2HG1 VAL 20 2HG2 VAL 20 31.542 20.199 -10.240 149 3HG1 VAL 20 3HG2 VAL 20 31.942 21.550 -11.341 150 1HG2 VAL 20 1HG1 VAL 20 29.870 22.947 -10.584 151 2HG2 VAL 20 2HG1 VAL 20 29.341 21.591 -9.543 152 3HG2 VAL 20 3HG1 VAL 20 29.576 23.218 -8.857 153 H LYS 21 H LYS 21 33.498 23.631 -7.620 154 HA LYS 21 HA LYS 21 32.873 24.911 -5.079 155 1HB LYS 21 1HB LYS 21 34.949 25.167 -7.308 156 2HB LYS 21 2HB LYS 21 34.529 26.704 -6.679 157 1HG LYS 21 1HG LYS 21 36.483 25.988 -5.648 158 2HG LYS 21 2HG LYS 21 35.238 26.121 -4.412 159 1HD LYS 21 2HD LYS 21 34.966 23.714 -4.333 160 2HD LYS 21 1HD LYS 21 36.118 23.449 -5.639 161 1HE LYS 21 2HE LYS 21 36.914 24.748 -2.928 162 2HE LYS 21 1HE LYS 21 36.926 23.011 -3.202 163 1HZ LYS 21 1HZ LYS 21 38.548 24.954 -4.764 164 2HZ LYS 21 2HZ LYS 21 38.539 23.318 -4.993 165 3HZ LYS 21 3HZ LYS 21 39.108 23.951 -3.577 166 HA PRO 22 HA PRO 22 30.021 28.296 -6.325 167 1HB PRO 22 1HB PRO 22 30.700 30.452 -4.743 168 2HB PRO 22 2HB PRO 22 29.884 28.986 -4.163 169 1HG PRO 22 1HG PRO 22 32.816 29.718 -3.877 170 2HG PRO 22 2HG PRO 22 31.737 28.976 -2.664 171 1HD PRO 22 2HD PRO 22 33.547 27.545 -4.326 172 2HD PRO 22 1HD PRO 22 32.129 26.786 -3.591 173 H DAL 23 H ALA 23 30.366 28.857 -8.387 174 HA DAL 23 HA ALA 23 33.017 29.996 -9.350 175 1HB DAL 23 1HB ALA 23 30.333 31.277 -10.144 176 2HB DAL 23 2HB ALA 23 31.567 32.005 -9.081 177 3HB DAL 23 3HB ALA 23 31.937 31.700 -10.800 178 H VAL 24 H VAL 24 32.880 27.526 -9.568 179 HA VAL 24 HA VAL 24 32.482 26.811 -12.434 180 HB VAL 24 HB VAL 24 33.349 25.048 -10.097 181 1HG1 VAL 24 1HG1 VAL 24 34.251 23.364 -11.751 182 2HG1 VAL 24 2HG1 VAL 24 33.727 24.379 -13.122 183 3HG1 VAL 24 3HG1 VAL 24 32.531 23.633 -12.046 184 1HG2 VAL 24 1HG2 VAL 24 35.747 25.222 -10.870 185 2HG2 VAL 24 2HG2 VAL 24 35.064 26.796 -10.434 186 3HG2 VAL 24 3HG2 VAL 24 35.237 26.372 -12.146 187 H THR 25 H THR 25 30.503 25.953 -13.191 188 HA THR 25 HA THR 25 28.510 24.775 -11.269 189 HB THR 25 HB THR 25 26.789 25.846 -12.648 190 HG1 THR 25 HG1 THR 25 27.311 27.768 -13.733 191 1HG2 THR 25 1HG2 THR 25 28.366 27.924 -11.024 192 2HG2 THR 25 2HG2 THR 25 26.658 28.073 -11.519 193 3HG2 THR 25 3HG2 THR 25 27.146 26.796 -10.372 194 H ILE 26 H ILE 26 28.889 22.896 -11.973 195 HA ILE 26 HA ILE 26 29.427 21.847 -14.496 196 HB ILE 26 HB ILE 26 29.795 21.058 -12.051 197 1HG1 ILE 26 2HG1 ILE 26 28.934 18.566 -13.667 198 2HG1 ILE 26 1HG1 ILE 26 30.157 19.580 -14.323 199 1HG2 ILE 26 1HG2 ILE 26 27.384 20.957 -11.204 200 2HG2 ILE 26 2HG2 ILE 26 28.249 19.405 -10.947 201 3HG2 ILE 26 3HG2 ILE 26 27.077 19.562 -12.279 202 1HD1 ILE 26 1HD1 ILE 26 30.368 18.450 -11.486 203 2HD1 ILE 26 2HD1 ILE 26 31.145 17.723 -12.932 204 3HD1 ILE 26 3HD1 ILE 26 31.607 19.357 -12.366 205 H ARG 27 H ARG 27 28.257 20.203 -15.730 206 HA ARG 27 HA ARG 27 25.241 20.198 -15.640 207 1HB ARG 27 1HB ARG 27 25.617 21.855 -17.240 208 2HB ARG 27 2HB ARG 27 26.679 20.723 -18.212 209 1HG ARG 27 2HG ARG 27 24.804 19.379 -18.702 210 2HG ARG 27 1HG ARG 27 23.714 20.396 -17.727 211 1HD ARG 27 2HD ARG 27 25.214 21.437 -20.243 212 2HD ARG 27 1HD ARG 27 23.649 20.640 -20.334 213 HE ARG 27 HE ARG 27 23.417 22.824 -18.418 214 1HH1 ARG 27 1HH2 ARG 27 23.661 22.428 -21.990 215 2HH1 ARG 27 2HH2 ARG 27 22.790 24.029 -22.202 216 1HH2 ARG 27 2HH1 ARG 27 22.458 24.586 -18.831 217 2HH2 ARG 27 1HH1 ARG 27 22.164 25.150 -20.552 218 H CYS 28 H CYS 28 25.227 18.472 -15.193 219 HA CYS 28 HA CYS 28 26.702 15.991 -16.330 220 1HB CYS 28 1HB CYS 28 26.903 16.153 -13.832 221 2HB CYS 28 2HB CYS 28 25.142 15.934 -13.692 222 H GLU 29 H GLU 29 25.504 15.227 -17.923 223 HA GLU 29 HA GLU 29 22.878 16.219 -18.536 224 1HB GLU 29 2HB GLU 29 22.822 15.215 -20.596 225 2HB GLU 29 1HB GLU 29 24.408 15.898 -20.299 226 1HG GLU 29 1HG GLU 29 25.383 13.704 -19.949 227 2HG GLU 29 2HG GLU 29 23.784 12.932 -20.076 Start of MODEL 7 1 1H SER 1 1H SER 1 26.585 8.600 -17.977 2 2H SER 1 2H SER 1 25.878 9.494 -19.173 3 3H SER 1 3H SER 1 24.965 8.921 -17.921 4 HA SER 1 HA SER 1 25.336 11.273 -17.625 5 1HB SER 1 2HB SER 1 26.855 9.479 -15.640 6 2HB SER 1 1HB SER 1 26.370 11.153 -15.315 7 HG SER 1 HG SER 1 24.640 9.016 -16.027 8 H LYS 2 H LYS 2 26.673 12.888 -18.114 9 HA LYS 2 HA LYS 2 29.689 12.575 -18.133 10 1HB LYS 2 1HB LYS 2 30.059 13.646 -20.250 11 2HB LYS 2 2HB LYS 2 29.268 12.096 -20.396 12 1HG LYS 2 1HG LYS 2 27.072 13.291 -20.943 13 2HG LYS 2 2HG LYS 2 27.921 14.812 -20.806 14 1HD LYS 2 2HD LYS 2 27.887 14.550 -23.087 15 2HD LYS 2 1HD LYS 2 29.516 14.027 -22.720 16 1HE LYS 2 2HE LYS 2 28.719 11.594 -22.916 17 2HE LYS 2 1HE LYS 2 27.095 12.184 -23.311 18 1HZ LYS 2 1HZ LYS 2 28.379 11.713 -25.313 19 2HZ LYS 2 2HZ LYS 2 28.050 13.331 -25.248 20 3HZ LYS 2 3HZ LYS 2 29.563 12.781 -24.879 21 H TYR 3 H TYR 3 30.679 14.270 -17.262 22 HA TYR 3 HA TYR 3 29.039 16.592 -16.232 23 1HB TYR 3 1HB TYR 3 30.680 17.097 -14.745 24 2HB TYR 3 2HB TYR 3 30.473 15.395 -14.631 25 HD1 TYR 3 HD1 TYR 3 32.945 17.805 -14.322 26 HD2 TYR 3 HD2 TYR 3 32.412 14.079 -16.398 27 HE1 TYR 3 HE1 TYR 3 35.340 17.486 -14.409 28 HE2 TYR 3 HE2 TYR 3 34.833 13.847 -16.540 29 HH TYR 3 HH TYR 3 36.796 14.689 -16.018 30 H GLU 4 H GLU 4 29.097 18.474 -17.224 31 HA GLU 4 HA GLU 4 31.573 19.351 -18.885 32 1HB GLU 4 1HB GLU 4 30.088 19.288 -20.558 33 2HB GLU 4 2HB GLU 4 28.663 19.558 -19.616 34 1HG GLU 4 1HG GLU 4 29.281 22.033 -19.425 35 2HG GLU 4 2HG GLU 4 30.645 21.742 -20.494 36 H TYR 5 H TYR 5 32.732 20.240 -17.306 37 HA TYR 5 HA TYR 5 31.401 22.159 -15.347 38 1HB TYR 5 2HB TYR 5 32.532 21.533 -13.535 39 2HB TYR 5 1HB TYR 5 32.390 19.971 -14.272 40 HD1 TYR 5 HD1 TYR 5 34.868 19.900 -16.107 41 HD2 TYR 5 HD2 TYR 5 34.344 21.127 -12.025 42 HE1 TYR 5 HE1 TYR 5 37.283 19.717 -15.694 43 HE2 TYR 5 HE2 TYR 5 36.726 20.973 -11.678 44 HH TYR 5 HH TYR 5 38.917 19.915 -14.257 45 H THR 6 H THR 6 31.875 23.990 -15.758 46 HA THR 6 HA THR 6 34.059 24.620 -17.770 47 HB THR 6 HB THR 6 31.661 26.446 -17.055 48 HG1 THR 6 HG1 THR 6 30.894 24.371 -17.564 49 1HG2 THR 6 1HG2 THR 6 33.456 27.317 -18.653 50 2HG2 THR 6 2HG2 THR 6 31.831 27.119 -19.424 51 3HG2 THR 6 3HG2 THR 6 33.115 25.916 -19.703 52 H ILE 7 H ILE 7 35.635 26.008 -17.296 53 HA ILE 7 HA ILE 7 35.741 27.341 -14.541 54 HB ILE 7 HB ILE 7 38.002 25.613 -15.726 55 1HG1 ILE 7 1HG1 ILE 7 37.532 24.166 -13.406 56 2HG1 ILE 7 2HG1 ILE 7 35.952 24.906 -13.534 57 1HG2 ILE 7 1HG2 ILE 7 37.805 26.954 -12.963 58 2HG2 ILE 7 2HG2 ILE 7 38.830 27.478 -14.329 59 3HG2 ILE 7 3HG2 ILE 7 39.160 25.924 -13.533 60 1HD1 ILE 7 1HD1 ILE 7 35.889 23.776 -15.926 61 2HD1 ILE 7 2HD1 ILE 7 35.668 22.862 -14.440 62 3HD1 ILE 7 3HD1 ILE 7 37.241 22.799 -15.274 63 HA DPR 8 HA PRO 8 38.079 30.508 -16.770 64 1HB DPR 8 1HB PRO 8 37.469 31.817 -14.988 65 2HB DPR 8 2HB PRO 8 36.697 32.806 -16.246 66 1HG DPR 8 1HG PRO 8 35.260 31.890 -14.086 67 2HG DPR 8 2HG PRO 8 34.517 31.935 -15.710 68 1HD DPR 8 1HD PRO 8 35.431 29.516 -14.177 69 2HD DPR 8 2HD PRO 8 34.265 29.611 -15.517 70 H SER 9 H SER 9 38.112 29.943 -18.896 71 HA SER 9 HA SER 9 35.843 30.760 -20.766 72 1HB SER 9 1HB SER 9 37.690 32.456 -20.951 73 2HB SER 9 2HB SER 9 38.849 31.156 -21.300 74 HG SER 9 HG SER 9 38.000 32.131 -23.162 75 H TYR 10 H TYR 10 37.394 28.190 -19.430 76 HA TYR 10 HA TYR 10 37.693 26.622 -22.036 77 1HB TYR 10 2HB TYR 10 39.610 27.085 -20.109 78 2HB TYR 10 1HB TYR 10 38.859 25.744 -19.319 79 HD1 TYR 10 HD1 TYR 10 38.918 23.441 -20.467 80 HD2 TYR 10 HD2 TYR 10 40.897 26.846 -22.195 81 HE1 TYR 10 HE1 TYR 10 40.265 21.964 -21.878 82 HE2 TYR 10 HE2 TYR 10 42.211 25.340 -23.600 83 HH TYR 10 HH TYR 10 42.648 23.258 -24.165 84 H THR 11 H THR 11 36.199 25.056 -22.417 85 HA THR 11 HA THR 11 34.274 24.209 -20.244 86 HB THR 11 HB THR 11 34.157 23.576 -23.243 87 HG1 THR 11 HG1 THR 11 32.823 25.397 -23.412 88 1HG2 THR 11 1HG2 THR 11 31.802 23.988 -21.277 89 2HG2 THR 11 2HG2 THR 11 31.703 23.401 -22.960 90 3HG2 THR 11 3HG2 THR 11 32.449 22.390 -21.692 91 H PHE 12 H PHE 12 34.802 22.475 -19.234 92 HA PHE 12 HA PHE 12 36.735 20.361 -20.450 93 1HB PHE 12 2HB PHE 12 36.180 20.966 -17.526 94 2HB PHE 12 1HB PHE 12 37.077 19.576 -18.068 95 HD1 PHE 12 HD1 PHE 12 39.464 19.833 -18.832 96 HD2 PHE 12 HD2 PHE 12 37.161 23.307 -17.736 97 HE1 PHE 12 HE1 PHE 12 41.499 21.135 -18.559 98 HE2 PHE 12 HE2 PHE 12 39.217 24.549 -17.435 99 HZ PHE 12 HZ PHE 12 41.388 23.491 -17.826 100 H ARG 13 H ARG 13 35.517 18.742 -21.254 101 HA ARG 13 HA ARG 13 32.882 17.944 -19.912 102 1HB ARG 13 1HB ARG 13 33.157 17.788 -22.924 103 2HB ARG 13 2HB ARG 13 31.723 17.727 -21.880 104 1HG ARG 13 1HG ARG 13 31.872 20.183 -21.524 105 2HG ARG 13 2HG ARG 13 33.316 20.228 -22.495 106 1HD ARG 13 2HD ARG 13 31.582 20.995 -23.927 107 2HD ARG 13 1HD ARG 13 32.014 19.393 -24.514 108 HE ARG 13 HE ARG 13 29.741 19.086 -22.724 109 1HH1 ARG 13 1HH2 ARG 13 30.312 20.531 -25.973 110 2HH1 ARG 13 2HH2 ARG 13 28.547 20.245 -26.384 111 1HH2 ARG 13 1HH1 ARG 13 27.803 18.838 -23.342 112 2HH2 ARG 13 2HH1 ARG 13 27.242 19.362 -25.009 113 H GLY 14 H GLY 14 32.913 15.879 -19.272 114 1HA GLY 14 2HA GLY 14 33.845 13.638 -20.982 115 2HA GLY 14 1HA GLY 14 34.982 13.923 -19.668 116 HA PRO 15 HA PRO 15 31.442 11.233 -17.917 117 1HB PRO 15 2HB PRO 15 32.596 8.878 -17.276 118 2HB PRO 15 1HB PRO 15 32.294 9.357 -18.962 119 1HG PRO 15 2HG PRO 15 34.884 9.547 -17.386 120 2HG PRO 15 1HG PRO 15 34.640 8.823 -19.014 121 1HD PRO 15 1HD PRO 15 35.524 11.483 -18.585 122 2HD PRO 15 2HD PRO 15 34.608 11.000 -20.038 123 H GLY 16 H GLY 16 30.930 10.413 -15.775 124 1HA GLY 16 1HA GLY 16 31.060 10.236 -13.393 125 2HA GLY 16 2HA GLY 16 32.678 10.924 -13.424 126 H CYS 17 H CYS 17 29.557 11.565 -12.600 127 HA CYS 17 HA CYS 17 29.841 14.603 -12.692 128 1HB CYS 17 2HB CYS 17 27.338 12.941 -12.024 129 2HB CYS 17 1HB CYS 17 27.421 14.701 -12.182 130 HA PRO 18 HA PRO 18 30.714 14.398 -8.109 131 1HB PRO 18 2HB PRO 18 33.044 15.791 -7.962 132 2HB PRO 18 1HB PRO 18 32.991 14.104 -8.517 133 1HG PRO 18 2HG PRO 18 33.197 16.634 -10.224 134 2HG PRO 18 1HG PRO 18 34.165 15.135 -10.366 135 1HD PRO 18 1HD PRO 18 31.820 15.658 -11.894 136 2HD PRO 18 2HD PRO 18 32.405 14.020 -11.500 137 H THR 19 H THR 19 31.058 16.336 -6.562 138 HA THR 19 HA THR 19 29.226 18.631 -7.204 139 HB THR 19 HB THR 19 30.123 19.339 -4.801 140 HG1 THR 19 HG1 THR 19 31.733 17.747 -4.709 141 1HG2 THR 19 1HG2 THR 19 28.449 18.089 -3.616 142 2HG2 THR 19 2HG2 THR 19 27.853 18.803 -5.146 143 3HG2 THR 19 3HG2 THR 19 28.204 17.043 -5.076 144 H VAL 20 H VAL 20 29.838 20.840 -6.923 145 HA VAL 20 HA VAL 20 32.731 21.411 -7.345 146 HB VAL 20 HB VAL 20 32.341 23.036 -9.217 147 1HG1 VAL 20 1HG2 VAL 20 32.350 21.454 -11.108 148 2HG1 VAL 20 2HG2 VAL 20 33.300 20.841 -9.735 149 3HG1 VAL 20 3HG2 VAL 20 31.678 20.181 -10.053 150 1HG2 VAL 20 1HG1 VAL 20 29.557 21.847 -9.756 151 2HG2 VAL 20 2HG1 VAL 20 30.408 23.120 -10.684 152 3HG2 VAL 20 3HG1 VAL 20 29.863 23.442 -9.026 153 H LYS 21 H LYS 21 33.556 23.557 -7.033 154 HA LYS 21 HA LYS 21 32.640 24.681 -4.620 155 1HB LYS 21 1HB LYS 21 34.668 25.465 -6.839 156 2HB LYS 21 2HB LYS 21 34.650 26.205 -5.277 157 1HG LYS 21 2HG LYS 21 35.175 24.090 -4.084 158 2HG LYS 21 1HG LYS 21 35.153 23.212 -5.629 159 1HD LYS 21 2HD LYS 21 36.931 24.616 -6.527 160 2HD LYS 21 1HD LYS 21 36.978 25.567 -5.009 161 1HE LYS 21 1HE LYS 21 37.735 23.491 -3.744 162 2HE LYS 21 2HE LYS 21 37.694 22.553 -5.251 163 1HZ LYS 21 1HZ LYS 21 39.402 24.951 -4.771 164 2HZ LYS 21 2HZ LYS 21 39.921 23.382 -4.783 165 3HZ LYS 21 3HZ LYS 21 39.363 24.079 -6.173 166 HA PRO 22 HA PRO 22 30.446 28.582 -5.953 167 1HB PRO 22 2HB PRO 22 32.192 30.496 -4.411 168 2HB PRO 22 1HB PRO 22 30.480 30.092 -4.191 169 1HG PRO 22 1HG PRO 22 32.395 29.257 -2.407 170 2HG PRO 22 2HG PRO 22 30.996 28.223 -2.812 171 1HD PRO 22 1HD PRO 22 33.821 28.052 -4.093 172 2HD PRO 22 2HD PRO 22 32.890 26.728 -3.380 173 H DAL 23 H ALA 23 30.771 29.102 -8.074 174 HA DAL 23 HA ALA 23 33.535 29.815 -9.134 175 1HB DAL 23 1HB ALA 23 32.665 31.643 -10.560 176 2HB DAL 23 2HB ALA 23 32.415 32.007 -8.831 177 3HB DAL 23 3HB ALA 23 31.043 31.469 -9.837 178 H VAL 24 H VAL 24 33.167 27.414 -9.399 179 HA VAL 24 HA VAL 24 32.510 26.842 -12.229 180 HB VAL 24 HB VAL 24 33.377 24.889 -10.052 181 1HG1 VAL 24 1HG1 VAL 24 33.665 24.505 -13.144 182 2HG1 VAL 24 2HG1 VAL 24 32.440 23.722 -12.130 183 3HG1 VAL 24 3HG1 VAL 24 34.143 23.318 -11.905 184 1HG2 VAL 24 1HG2 VAL 24 35.306 26.306 -11.982 185 2HG2 VAL 24 2HG2 VAL 24 35.200 26.512 -10.228 186 3HG2 VAL 24 3HG2 VAL 24 35.772 24.971 -10.881 187 H THR 25 H THR 25 30.609 25.757 -12.960 188 HA THR 25 HA THR 25 28.622 24.660 -11.011 189 HB THR 25 HB THR 25 26.874 25.728 -12.406 190 HG1 THR 25 HG1 THR 25 28.946 27.494 -13.139 191 1HG2 THR 25 1HG2 THR 25 26.728 27.942 -11.252 192 2HG2 THR 25 2HG2 THR 25 27.218 26.657 -10.115 193 3HG2 THR 25 3HG2 THR 25 28.434 27.797 -10.752 194 H ILE 26 H ILE 26 28.913 22.765 -11.735 195 HA ILE 26 HA ILE 26 29.478 21.767 -14.300 196 HB ILE 26 HB ILE 26 29.807 20.933 -11.850 197 1HG1 ILE 26 2HG1 ILE 26 29.133 18.442 -13.533 198 2HG1 ILE 26 1HG1 ILE 26 30.288 19.548 -14.165 199 1HG2 ILE 26 1HG2 ILE 26 27.166 19.345 -12.240 200 2HG2 ILE 26 2HG2 ILE 26 27.368 20.714 -11.108 201 3HG2 ILE 26 3HG2 ILE 26 28.286 19.191 -10.865 202 1HD1 ILE 26 1HD1 ILE 26 31.742 19.398 -12.215 203 2HD1 ILE 26 2HD1 ILE 26 30.561 18.430 -11.316 204 3HD1 ILE 26 3HD1 ILE 26 31.369 17.730 -12.752 205 H ARG 27 H ARG 27 28.211 20.004 -15.431 206 HA ARG 27 HA ARG 27 25.253 20.260 -15.491 207 1HB ARG 27 1HB ARG 27 25.772 21.869 -17.137 208 2HB ARG 27 2HB ARG 27 26.786 20.660 -18.058 209 1HG ARG 27 1HG ARG 27 24.851 19.392 -18.565 210 2HG ARG 27 2HG ARG 27 23.802 20.485 -17.616 211 1HD ARG 27 2HD ARG 27 24.328 22.359 -19.250 212 2HD ARG 27 1HD ARG 27 25.341 21.247 -20.192 213 HE ARG 27 HE ARG 27 22.791 19.950 -19.968 214 1HH1 ARG 27 1HH1 ARG 27 23.888 23.021 -21.501 215 2HH1 ARG 27 2HH1 ARG 27 22.501 22.892 -22.695 216 1HH2 ARG 27 1HH2 ARG 27 21.301 19.959 -21.374 217 2HH2 ARG 27 2HH2 ARG 27 21.155 21.293 -22.624 218 H CYS 28 H CYS 28 24.947 18.492 -15.306 219 HA CYS 28 HA CYS 28 26.590 16.016 -16.183 220 1HB CYS 28 1HB CYS 28 26.126 16.058 -13.696 221 2HB CYS 28 2HB CYS 28 24.390 15.859 -14.042 222 H GLU 29 H GLU 29 25.825 15.403 -18.061 223 HA GLU 29 HA GLU 29 23.150 16.290 -19.116 224 1HB GLU 29 1HB GLU 29 25.510 14.873 -20.502 225 2HB GLU 29 2HB GLU 29 24.007 15.223 -21.341 226 1HG GLU 29 2HG GLU 29 24.304 17.674 -21.019 227 2HG GLU 29 1HG GLU 29 25.816 17.391 -20.147 Start of MODEL 8 1 1H SER 1 1H SER 1 26.078 8.928 -18.369 2 2H SER 1 2H SER 1 25.271 10.061 -19.259 3 3H SER 1 3H SER 1 24.540 9.363 -17.952 4 HA SER 1 HA SER 1 25.215 11.596 -17.386 5 1HB SER 1 2HB SER 1 26.850 9.380 -16.021 6 2HB SER 1 1HB SER 1 26.624 11.013 -15.369 7 HG SER 1 HG SER 1 24.368 10.651 -15.453 8 H LYS 2 H LYS 2 26.585 13.154 -17.977 9 HA LYS 2 HA LYS 2 29.546 12.688 -18.367 10 1HB LYS 2 1HB LYS 2 27.917 14.007 -20.609 11 2HB LYS 2 2HB LYS 2 29.674 14.070 -20.465 12 1HG LYS 2 1HG LYS 2 29.833 11.582 -20.717 13 2HG LYS 2 2HG LYS 2 28.080 11.476 -20.865 14 1HD LYS 2 1HD LYS 2 28.147 12.877 -22.945 15 2HD LYS 2 2HD LYS 2 29.893 13.039 -22.827 16 1HE LYS 2 2HE LYS 2 28.484 10.291 -23.140 17 2HE LYS 2 1HE LYS 2 28.928 11.318 -24.494 18 1HZ LYS 2 1HZ LYS 2 31.256 11.195 -23.816 19 2HZ LYS 2 2HZ LYS 2 30.637 9.685 -24.068 20 3HZ LYS 2 3HZ LYS 2 30.877 10.232 -22.528 21 H TYR 3 H TYR 3 30.535 14.314 -17.430 22 HA TYR 3 HA TYR 3 28.978 16.643 -16.277 23 1HB TYR 3 1HB TYR 3 30.638 17.019 -14.773 24 2HB TYR 3 2HB TYR 3 30.393 15.318 -14.746 25 HD1 TYR 3 HD1 TYR 3 32.280 14.054 -16.598 26 HD2 TYR 3 HD2 TYR 3 32.923 17.683 -14.391 27 HE1 TYR 3 HE1 TYR 3 34.693 13.778 -16.791 28 HE2 TYR 3 HE2 TYR 3 35.311 17.325 -14.536 29 HH TYR 3 HH TYR 3 36.946 16.083 -15.316 30 H GLU 4 H GLU 4 29.011 18.520 -17.307 31 HA GLU 4 HA GLU 4 31.501 19.419 -18.924 32 1HB GLU 4 2HB GLU 4 29.997 19.411 -20.576 33 2HB GLU 4 1HB GLU 4 28.588 19.685 -19.610 34 1HG GLU 4 2HG GLU 4 29.253 22.140 -19.370 35 2HG GLU 4 1HG GLU 4 30.601 21.849 -20.459 36 H TYR 5 H TYR 5 32.692 20.223 -17.318 37 HA TYR 5 HA TYR 5 31.420 22.107 -15.286 38 1HB TYR 5 2HB TYR 5 32.586 21.412 -13.524 39 2HB TYR 5 1HB TYR 5 32.448 19.879 -14.323 40 HD1 TYR 5 HD1 TYR 5 34.497 21.162 -12.127 41 HD2 TYR 5 HD2 TYR 5 34.828 19.733 -16.168 42 HE1 TYR 5 HE1 TYR 5 36.880 20.920 -11.852 43 HE2 TYR 5 HE2 TYR 5 37.236 19.453 -15.822 44 HH TYR 5 HH TYR 5 38.782 20.258 -12.750 45 H THR 6 H THR 6 31.885 23.964 -15.649 46 HA THR 6 HA THR 6 34.033 24.645 -17.682 47 HB THR 6 HB THR 6 31.675 26.491 -16.890 48 HG1 THR 6 HG1 THR 6 30.849 24.437 -17.389 49 1HG2 THR 6 1HG2 THR 6 31.807 27.173 -19.260 50 2HG2 THR 6 2HG2 THR 6 33.457 27.326 -18.530 51 3HG2 THR 6 3HG2 THR 6 33.051 25.938 -19.576 52 H ILE 7 H ILE 7 35.659 25.924 -17.153 53 HA ILE 7 HA ILE 7 35.804 27.165 -14.356 54 HB ILE 7 HB ILE 7 38.050 25.520 -15.696 55 1HG1 ILE 7 1HG1 ILE 7 37.794 23.892 -13.589 56 2HG1 ILE 7 2HG1 ILE 7 36.248 24.665 -13.360 57 1HG2 ILE 7 1HG2 ILE 7 38.872 27.350 -14.204 58 2HG2 ILE 7 2HG2 ILE 7 39.263 25.768 -13.495 59 3HG2 ILE 7 3HG2 ILE 7 37.883 26.724 -12.858 60 1HD1 ILE 7 1HD1 ILE 7 36.026 23.695 -15.993 61 2HD1 ILE 7 2HD1 ILE 7 35.473 22.941 -14.523 62 3HD1 ILE 7 3HD1 ILE 7 37.075 22.493 -15.190 63 HA DPR 8 HA PRO 8 38.020 30.458 -16.531 64 1HB DPR 8 2HB PRO 8 37.419 31.687 -14.685 65 2HB DPR 8 1HB PRO 8 36.604 32.706 -15.892 66 1HG DPR 8 1HG PRO 8 35.225 31.681 -13.742 67 2HG DPR 8 2HG PRO 8 34.452 31.771 -15.350 68 1HD DPR 8 1HD PRO 8 35.443 29.316 -13.926 69 2HD DPR 8 2HD PRO 8 34.252 29.434 -15.241 70 H SER 9 H SER 9 38.000 29.927 -18.674 71 HA SER 9 HA SER 9 35.687 30.781 -20.466 72 1HB SER 9 2HB SER 9 37.504 32.513 -20.636 73 2HB SER 9 1HB SER 9 38.673 31.245 -21.055 74 HG SER 9 HG SER 9 37.328 30.731 -22.837 75 H TYR 10 H TYR 10 37.345 28.201 -19.259 76 HA TYR 10 HA TYR 10 37.619 26.741 -21.930 77 1HB TYR 10 2HB TYR 10 39.571 27.163 -20.047 78 2HB TYR 10 1HB TYR 10 38.857 25.792 -19.269 79 HD1 TYR 10 HD1 TYR 10 40.817 26.987 -22.156 80 HD2 TYR 10 HD2 TYR 10 38.898 23.521 -20.482 81 HE1 TYR 10 HE1 TYR 10 42.112 25.530 -23.630 82 HE2 TYR 10 HE2 TYR 10 40.228 22.093 -21.961 83 HH TYR 10 HH TYR 10 41.752 22.003 -23.547 84 H THR 11 H THR 11 36.144 25.165 -22.346 85 HA THR 11 HA THR 11 34.239 24.256 -20.188 86 HB THR 11 HB THR 11 34.109 23.690 -23.200 87 HG1 THR 11 HG1 THR 11 34.258 25.919 -22.820 88 1HG2 THR 11 1HG2 THR 11 32.394 22.492 -21.671 89 2HG2 THR 11 2HG2 THR 11 31.765 24.087 -21.221 90 3HG2 THR 11 3HG2 THR 11 31.656 23.537 -22.916 91 H PHE 12 H PHE 12 34.750 22.488 -19.225 92 HA PHE 12 HA PHE 12 36.654 20.380 -20.501 93 1HB PHE 12 2HB PHE 12 36.118 20.938 -17.560 94 2HB PHE 12 1HB PHE 12 36.977 19.535 -18.125 95 HD1 PHE 12 HD1 PHE 12 39.380 19.719 -18.783 96 HD2 PHE 12 HD2 PHE 12 37.153 23.284 -17.842 97 HE1 PHE 12 HE1 PHE 12 41.444 20.963 -18.470 98 HE2 PHE 12 HE2 PHE 12 39.238 24.466 -17.483 99 HZ PHE 12 HZ PHE 12 41.387 23.332 -17.786 100 H ARG 13 H ARG 13 35.403 18.794 -21.341 101 HA ARG 13 HA ARG 13 32.767 18.006 -19.996 102 1HB ARG 13 1HB ARG 13 33.015 17.909 -23.011 103 2HB ARG 13 2HB ARG 13 31.590 17.848 -21.955 104 1HG ARG 13 1HG ARG 13 31.783 20.293 -21.547 105 2HG ARG 13 2HG ARG 13 33.216 20.336 -22.535 106 1HD ARG 13 2HD ARG 13 31.479 21.160 -23.930 107 2HD ARG 13 1HD ARG 13 31.874 19.562 -24.554 108 HE ARG 13 HE ARG 13 29.551 19.543 -22.673 109 1HH1 ARG 13 1HH1 ARG 13 30.371 19.955 -26.156 110 2HH1 ARG 13 2HH1 ARG 13 28.638 19.534 -26.589 111 1HH2 ARG 13 2HH2 ARG 13 27.661 19.095 -23.327 112 2HH2 ARG 13 1HH2 ARG 13 27.229 19.087 -25.110 113 H GLY 14 H GLY 14 32.745 15.917 -19.415 114 1HA GLY 14 2HA GLY 14 33.616 13.706 -21.186 115 2HA GLY 14 1HA GLY 14 34.779 13.931 -19.884 116 HA PRO 15 HA PRO 15 31.227 11.273 -18.112 117 1HB PRO 15 1HB PRO 15 32.349 8.888 -17.549 118 2HB PRO 15 2HB PRO 15 32.040 9.414 -19.219 119 1HG PRO 15 1HG PRO 15 34.646 9.520 -17.664 120 2HG PRO 15 2HG PRO 15 34.374 8.842 -19.307 121 1HD PRO 15 1HD PRO 15 35.305 11.480 -18.807 122 2HD PRO 15 2HD PRO 15 34.388 11.044 -20.275 123 H GLY 16 H GLY 16 30.730 10.426 -15.972 124 1HA GLY 16 1HA GLY 16 30.912 10.191 -13.601 125 2HA GLY 16 2HA GLY 16 32.537 10.861 -13.648 126 H CYS 17 H CYS 17 29.480 11.509 -12.701 127 HA CYS 17 HA CYS 17 29.751 14.546 -12.750 128 1HB CYS 17 2HB CYS 17 27.591 13.607 -13.499 129 2HB CYS 17 1HB CYS 17 27.333 12.811 -11.934 130 HA PRO 18 HA PRO 18 31.008 14.361 -8.250 131 1HB PRO 18 1HB PRO 18 33.276 15.866 -8.299 132 2HB PRO 18 2HB PRO 18 33.258 14.170 -8.828 133 1HG PRO 18 2HG PRO 18 33.214 16.680 -10.577 134 2HG PRO 18 1HG PRO 18 34.233 15.222 -10.778 135 1HD PRO 18 2HD PRO 18 31.756 15.617 -12.124 136 2HD PRO 18 1HD PRO 18 32.435 14.012 -11.753 137 H THR 19 H THR 19 31.373 16.329 -6.746 138 HA THR 19 HA THR 19 29.420 18.558 -7.313 139 HB THR 19 HB THR 19 30.353 19.274 -4.926 140 HG1 THR 19 HG1 THR 19 30.957 17.520 -3.672 141 1HG2 THR 19 1HG2 THR 19 28.722 17.981 -3.720 142 2HG2 THR 19 2HG2 THR 19 28.473 16.940 -5.182 143 3HG2 THR 19 3HG2 THR 19 28.085 18.691 -5.234 144 H VAL 20 H VAL 20 29.977 20.780 -7.032 145 HA VAL 20 HA VAL 20 32.843 21.445 -7.474 146 HB VAL 20 HB VAL 20 32.407 23.054 -9.352 147 1HG1 VAL 20 1HG1 VAL 20 31.836 20.177 -10.178 148 2HG1 VAL 20 2HG1 VAL 20 32.472 21.465 -11.239 149 3HG1 VAL 20 3HG1 VAL 20 33.436 20.888 -9.861 150 1HG2 VAL 20 1HG2 VAL 20 30.452 23.036 -10.839 151 2HG2 VAL 20 2HG2 VAL 20 29.925 23.395 -9.180 152 3HG2 VAL 20 3HG2 VAL 20 29.658 21.772 -9.855 153 H LYS 21 H LYS 21 33.590 23.622 -7.160 154 HA LYS 21 HA LYS 21 32.605 24.746 -4.768 155 1HB LYS 21 2HB LYS 21 34.633 25.563 -6.975 156 2HB LYS 21 1HB LYS 21 34.568 26.333 -5.429 157 1HG LYS 21 2HG LYS 21 35.153 24.267 -4.184 158 2HG LYS 21 1HG LYS 21 35.177 23.352 -5.707 159 1HD LYS 21 1HD LYS 21 36.918 24.794 -6.621 160 2HD LYS 21 2HD LYS 21 36.916 25.783 -5.127 161 1HE LYS 21 2HE LYS 21 37.728 23.764 -3.803 162 2HE LYS 21 1HE LYS 21 37.735 22.789 -5.287 163 1HZ LYS 21 1HZ LYS 21 39.357 25.254 -4.849 164 2HZ LYS 21 2HZ LYS 21 39.363 24.347 -6.229 165 3HZ LYS 21 3HZ LYS 21 39.928 23.705 -4.816 166 HA PRO 22 HA PRO 22 30.277 28.536 -6.172 167 1HB PRO 22 2HB PRO 22 31.949 30.540 -4.655 168 2HB PRO 22 1HB PRO 22 30.249 30.084 -4.440 169 1HG PRO 22 2HG PRO 22 32.175 29.342 -2.629 170 2HG PRO 22 1HG PRO 22 30.818 28.251 -3.031 171 1HD PRO 22 1HD PRO 22 33.660 28.167 -4.285 172 2HD PRO 22 2HD PRO 22 32.772 26.821 -3.560 173 H DAL 23 H ALA 23 30.559 29.110 -8.284 174 HA DAL 23 HA ALA 23 33.300 29.910 -9.359 175 1HB DAL 23 1HB ALA 23 32.331 31.678 -10.798 176 2HB DAL 23 2HB ALA 23 30.725 31.432 -10.061 177 3HB DAL 23 3HB ALA 23 32.077 32.047 -9.072 178 H VAL 24 H VAL 24 33.019 27.497 -9.568 179 HA VAL 24 HA VAL 24 32.377 26.805 -12.381 180 HB VAL 24 HB VAL 24 33.331 24.989 -10.125 181 1HG1 VAL 24 1HG1 VAL 24 33.547 24.370 -13.180 182 2HG1 VAL 24 2HG1 VAL 24 34.084 23.307 -11.854 183 3HG1 VAL 24 3HG1 VAL 24 32.366 23.646 -12.072 184 1HG2 VAL 24 1HG2 VAL 24 35.169 26.271 -12.247 185 2HG2 VAL 24 2HG2 VAL 24 35.087 26.693 -10.527 186 3HG2 VAL 24 3HG2 VAL 24 35.689 25.098 -11.001 187 H THR 25 H THR 25 30.462 25.737 -13.061 188 HA THR 25 HA THR 25 28.533 24.602 -11.077 189 HB THR 25 HB THR 25 26.742 25.644 -12.438 190 HG1 THR 25 HG1 THR 25 28.034 26.369 -14.125 191 1HG2 THR 25 1HG2 THR 25 28.296 27.734 -10.805 192 2HG2 THR 25 2HG2 THR 25 26.578 27.851 -11.275 193 3HG2 THR 25 3HG2 THR 25 27.111 26.572 -10.151 194 H ILE 26 H ILE 26 28.839 22.715 -11.811 195 HA ILE 26 HA ILE 26 29.402 21.734 -14.381 196 HB ILE 26 HB ILE 26 29.752 20.900 -11.941 197 1HG1 ILE 26 1HG1 ILE 26 29.126 18.414 -13.641 198 2HG1 ILE 26 2HG1 ILE 26 30.288 19.546 -14.233 199 1HG2 ILE 26 1HG2 ILE 26 28.275 19.142 -10.936 200 2HG2 ILE 26 2HG2 ILE 26 27.322 20.641 -11.180 201 3HG2 ILE 26 3HG2 ILE 26 27.141 19.260 -12.303 202 1HD1 ILE 26 1HD1 ILE 26 31.359 17.721 -12.824 203 2HD1 ILE 26 2HD1 ILE 26 30.528 18.405 -11.395 204 3HD1 ILE 26 3HD1 ILE 26 31.706 19.389 -12.281 205 H ARG 27 H ARG 27 28.193 20.067 -15.626 206 HA ARG 27 HA ARG 27 25.199 20.203 -15.595 207 1HB ARG 27 1HB ARG 27 25.636 21.877 -17.153 208 2HB ARG 27 2HB ARG 27 26.685 20.745 -18.139 209 1HG ARG 27 1HG ARG 27 24.793 19.461 -18.691 210 2HG ARG 27 2HG ARG 27 23.708 20.469 -17.703 211 1HD ARG 27 2HD ARG 27 25.264 21.554 -20.165 212 2HD ARG 27 1HD ARG 27 23.686 20.790 -20.302 213 HE ARG 27 HE ARG 27 23.204 22.796 -18.383 214 1HH1 ARG 27 2HH1 ARG 27 24.504 22.983 -21.737 215 2HH1 ARG 27 1HH1 ARG 27 23.828 24.683 -21.878 216 1HH2 ARG 27 2HH2 ARG 27 22.516 24.698 -18.705 217 2HH2 ARG 27 1HH2 ARG 27 22.792 25.573 -20.294 218 H CYS 28 H CYS 28 25.036 18.425 -15.253 219 HA CYS 28 HA CYS 28 26.686 15.991 -16.153 220 1HB CYS 28 1HB CYS 28 24.666 16.258 -13.839 221 2HB CYS 28 2HB CYS 28 25.546 14.775 -14.290 222 H GLU 29 H GLU 29 25.867 15.386 -18.047 223 HA GLU 29 HA GLU 29 23.218 16.165 -19.048 224 1HB GLU 29 1HB GLU 29 25.445 14.437 -20.315 225 2HB GLU 29 2HB GLU 29 23.951 14.770 -21.171 226 1HG GLU 29 2HG GLU 29 24.381 17.221 -21.148 227 2HG GLU 29 1HG GLU 29 25.890 16.962 -20.263 Start of MODEL 9 1 1H SER 1 1H SER 1 25.957 9.026 -18.317 2 2H SER 1 2H SER 1 25.246 10.157 -19.289 3 3H SER 1 3H SER 1 24.414 9.530 -18.007 4 HA SER 1 HA SER 1 25.137 11.754 -17.474 5 1HB SER 1 1HB SER 1 26.611 9.531 -15.945 6 2HB SER 1 2HB SER 1 26.404 11.190 -15.356 7 HG SER 1 HG SER 1 24.323 9.401 -16.089 8 H LYS 2 H LYS 2 26.610 13.248 -17.970 9 HA LYS 2 HA LYS 2 29.565 12.646 -18.262 10 1HB LYS 2 2HB LYS 2 28.063 14.064 -20.538 11 2HB LYS 2 1HB LYS 2 29.816 14.006 -20.351 12 1HG LYS 2 2HG LYS 2 29.781 11.498 -20.603 13 2HG LYS 2 1HG LYS 2 28.031 11.553 -20.824 14 1HD LYS 2 2HD LYS 2 28.347 12.998 -22.905 15 2HD LYS 2 1HD LYS 2 30.086 12.910 -22.668 16 1HE LYS 2 1HE LYS 2 29.698 11.323 -24.333 17 2HE LYS 2 2HE LYS 2 29.904 10.313 -22.911 18 1HZ LYS 2 1HZ LYS 2 27.289 11.100 -24.135 19 2HZ LYS 2 2HZ LYS 2 28.009 9.617 -24.248 20 3HZ LYS 2 3HZ LYS 2 27.442 10.152 -22.791 21 H TYR 3 H TYR 3 30.624 14.268 -17.313 22 HA TYR 3 HA TYR 3 29.101 16.558 -16.088 23 1HB TYR 3 2HB TYR 3 30.809 16.934 -14.654 24 2HB TYR 3 1HB TYR 3 30.572 15.240 -14.648 25 HD1 TYR 3 HD1 TYR 3 32.412 14.026 -16.606 26 HD2 TYR 3 HD2 TYR 3 33.079 17.637 -14.365 27 HE1 TYR 3 HE1 TYR 3 34.823 13.788 -16.883 28 HE2 TYR 3 HE2 TYR 3 35.468 17.326 -14.618 29 HH TYR 3 HH TYR 3 37.092 16.115 -15.471 30 H GLU 4 H GLU 4 29.013 18.480 -17.130 31 HA GLU 4 HA GLU 4 31.443 19.426 -18.819 32 1HB GLU 4 2HB GLU 4 29.885 19.379 -20.414 33 2HB GLU 4 1HB GLU 4 28.501 19.608 -19.403 34 1HG GLU 4 2HG GLU 4 29.061 22.072 -19.184 35 2HG GLU 4 1HG GLU 4 30.414 21.834 -20.279 36 H TYR 5 H TYR 5 32.681 20.235 -17.233 37 HA TYR 5 HA TYR 5 31.452 22.189 -15.239 38 1HB TYR 5 2HB TYR 5 32.658 21.572 -13.472 39 2HB TYR 5 1HB TYR 5 32.393 20.012 -14.178 40 HD1 TYR 5 HD1 TYR 5 34.506 21.088 -12.043 41 HD2 TYR 5 HD2 TYR 5 34.785 19.798 -16.128 42 HE1 TYR 5 HE1 TYR 5 36.889 20.809 -11.795 43 HE2 TYR 5 HE2 TYR 5 37.206 19.526 -15.833 44 HH TYR 5 HH TYR 5 38.782 20.187 -12.739 45 H THR 6 H THR 6 31.912 23.981 -15.666 46 HA THR 6 HA THR 6 34.067 24.657 -17.704 47 HB THR 6 HB THR 6 31.693 26.460 -16.867 48 HG1 THR 6 HG1 THR 6 31.699 24.392 -18.804 49 1HG2 THR 6 1HG2 THR 6 31.767 27.185 -19.230 50 2HG2 THR 6 2HG2 THR 6 33.415 27.393 -18.503 51 3HG2 THR 6 3HG2 THR 6 33.061 26.023 -19.578 52 H ILE 7 H ILE 7 35.758 25.935 -17.174 53 HA ILE 7 HA ILE 7 35.860 27.342 -14.460 54 HB ILE 7 HB ILE 7 38.030 25.402 -15.478 55 1HG1 ILE 7 1HG1 ILE 7 37.401 24.076 -13.146 56 2HG1 ILE 7 2HG1 ILE 7 35.892 24.944 -13.320 57 1HG2 ILE 7 1HG2 ILE 7 37.853 26.856 -12.779 58 2HG2 ILE 7 2HG2 ILE 7 38.945 27.257 -14.138 59 3HG2 ILE 7 3HG2 ILE 7 39.144 25.714 -13.281 60 1HD1 ILE 7 1HD1 ILE 7 35.883 23.712 -15.732 61 2HD1 ILE 7 2HD1 ILE 7 36.997 22.607 -14.867 62 3HD1 ILE 7 3HD1 ILE 7 35.355 22.986 -14.241 63 HA DPR 8 HA PRO 8 38.456 30.251 -16.735 64 1HB DPR 8 2HB PRO 8 37.700 31.840 -15.272 65 2HB DPR 8 1HB PRO 8 37.029 32.620 -16.715 66 1HG DPR 8 1HG PRO 8 35.418 32.026 -14.581 67 2HG DPR 8 2HG PRO 8 34.820 31.759 -16.243 68 1HD DPR 8 2HD PRO 8 35.752 29.675 -14.254 69 2HD DPR 8 1HD PRO 8 34.569 29.516 -15.571 70 H SER 9 H SER 9 38.930 30.039 -18.782 71 HA SER 9 HA SER 9 37.086 30.784 -21.063 72 1HB SER 9 1HB SER 9 39.059 30.467 -22.488 73 2HB SER 9 2HB SER 9 39.433 31.567 -21.158 74 HG SER 9 HG SER 9 40.000 28.781 -21.256 75 H TYR 10 H TYR 10 37.872 27.840 -19.335 76 HA TYR 10 HA TYR 10 37.644 26.145 -21.866 77 1HB TYR 10 2HB TYR 10 38.920 25.738 -19.089 78 2HB TYR 10 1HB TYR 10 38.249 24.333 -19.808 79 HD1 TYR 10 HD1 TYR 10 40.972 26.827 -20.197 80 HD2 TYR 10 HD2 TYR 10 39.120 23.328 -21.905 81 HE1 TYR 10 HE1 TYR 10 42.968 26.352 -21.490 82 HE2 TYR 10 HE2 TYR 10 41.120 22.891 -23.172 83 HH TYR 10 HH TYR 10 43.965 25.032 -22.947 84 H THR 11 H THR 11 35.966 24.845 -22.258 85 HA THR 11 HA THR 11 33.921 24.200 -20.080 86 HB THR 11 HB THR 11 33.709 23.808 -23.118 87 HG1 THR 11 HG1 THR 11 32.444 25.695 -23.109 88 1HG2 THR 11 1HG2 THR 11 31.248 23.716 -22.789 89 2HG2 THR 11 2HG2 THR 11 32.005 22.548 -21.678 90 3HG2 THR 11 3HG2 THR 11 31.424 24.100 -21.052 91 H PHE 12 H PHE 12 34.727 22.526 -19.121 92 HA PHE 12 HA PHE 12 36.542 20.470 -20.567 93 1HB PHE 12 2HB PHE 12 36.047 20.827 -17.597 94 2HB PHE 12 1HB PHE 12 36.931 19.480 -18.248 95 HD1 PHE 12 HD1 PHE 12 39.266 19.816 -19.223 96 HD2 PHE 12 HD2 PHE 12 37.117 23.081 -17.423 97 HE1 PHE 12 HE1 PHE 12 41.351 20.985 -18.779 98 HE2 PHE 12 HE2 PHE 12 39.223 24.177 -16.943 99 HZ PHE 12 HZ PHE 12 41.337 23.160 -17.590 100 H ARG 13 H ARG 13 35.239 18.876 -21.428 101 HA ARG 13 HA ARG 13 32.662 18.012 -20.000 102 1HB ARG 13 1HB ARG 13 32.806 17.989 -23.024 103 2HB ARG 13 2HB ARG 13 31.417 17.901 -21.921 104 1HG ARG 13 1HG ARG 13 31.581 20.325 -21.478 105 2HG ARG 13 2HG ARG 13 33.007 20.412 -22.473 106 1HD ARG 13 2HD ARG 13 31.242 21.252 -23.828 107 2HD ARG 13 1HD ARG 13 31.668 19.685 -24.504 108 HE ARG 13 HE ARG 13 29.363 19.508 -22.627 109 1HH1 ARG 13 2HH2 ARG 13 30.118 20.232 -26.074 110 2HH1 ARG 13 1HH2 ARG 13 28.385 19.819 -26.516 111 1HH2 ARG 13 1HH1 ARG 13 27.471 19.083 -23.289 112 2HH2 ARG 13 2HH1 ARG 13 27.009 19.220 -25.059 113 H GLY 14 H GLY 14 32.692 15.916 -19.470 114 1HA GLY 14 2HA GLY 14 33.520 13.756 -21.322 115 2HA GLY 14 1HA GLY 14 34.731 13.970 -20.063 116 HA PRO 15 HA PRO 15 31.264 11.210 -18.260 117 1HB PRO 15 1HB PRO 15 32.435 8.815 -17.809 118 2HB PRO 15 2HB PRO 15 32.007 9.369 -19.444 119 1HG PRO 15 1HG PRO 15 34.717 9.471 -18.069 120 2HG PRO 15 2HG PRO 15 34.340 8.821 -19.702 121 1HD PRO 15 1HD PRO 15 35.284 11.447 -19.243 122 2HD PRO 15 2HD PRO 15 34.230 11.041 -20.625 123 H GLY 16 H GLY 16 30.919 10.232 -16.111 124 1HA GLY 16 2HA GLY 16 31.255 9.954 -13.764 125 2HA GLY 16 1HA GLY 16 32.833 10.724 -13.883 126 H CYS 17 H CYS 17 29.808 11.165 -12.745 127 HA CYS 17 HA CYS 17 29.877 14.213 -12.775 128 1HB CYS 17 2HB CYS 17 27.742 13.146 -13.396 129 2HB CYS 17 1HB CYS 17 27.635 12.312 -11.832 130 HA PRO 18 HA PRO 18 31.443 14.071 -8.371 131 1HB PRO 18 2HB PRO 18 33.582 15.745 -8.543 132 2HB PRO 18 1HB PRO 18 33.656 14.057 -9.093 133 1HG PRO 18 1HG PRO 18 33.312 16.573 -10.801 134 2HG PRO 18 2HG PRO 18 34.419 15.196 -11.090 135 1HD PRO 18 1HD PRO 18 31.836 15.418 -12.265 136 2HD PRO 18 2HD PRO 18 32.653 13.865 -11.957 137 H THR 19 H THR 19 31.735 16.002 -6.846 138 HA THR 19 HA THR 19 29.636 18.136 -7.273 139 HB THR 19 HB THR 19 30.574 18.791 -4.870 140 HG1 THR 19 HG1 THR 19 31.280 16.063 -4.987 141 1HG2 THR 19 1HG2 THR 19 29.016 17.373 -3.702 142 2HG2 THR 19 2HG2 THR 19 28.794 16.389 -5.206 143 3HG2 THR 19 3HG2 THR 19 28.328 18.121 -5.175 144 H VAL 20 H VAL 20 30.093 20.361 -6.892 145 HA VAL 20 HA VAL 20 32.919 21.192 -7.318 146 HB VAL 20 HB VAL 20 32.375 22.902 -9.091 147 1HG1 VAL 20 1HG2 VAL 20 31.981 20.040 -10.052 148 2HG1 VAL 20 2HG2 VAL 20 33.533 20.846 -9.734 149 3HG1 VAL 20 3HG2 VAL 20 32.508 21.410 -11.072 150 1HG2 VAL 20 1HG1 VAL 20 30.420 22.856 -10.571 151 2HG2 VAL 20 2HG1 VAL 20 29.884 23.096 -8.892 152 3HG2 VAL 20 3HG1 VAL 20 29.704 21.498 -9.656 153 H LYS 21 H LYS 21 33.444 23.449 -6.977 154 HA LYS 21 HA LYS 21 32.103 24.450 -4.495 155 1HB LYS 21 2HB LYS 21 34.079 25.836 -4.241 156 2HB LYS 21 1HB LYS 21 34.477 24.152 -4.440 157 1HG LYS 21 2HG LYS 21 36.180 25.521 -5.289 158 2HG LYS 21 1HG LYS 21 35.519 24.562 -6.596 159 1HD LYS 21 2HD LYS 21 34.499 26.413 -7.688 160 2HD LYS 21 1HD LYS 21 34.555 27.443 -6.273 161 1HE LYS 21 1HE LYS 21 36.176 28.378 -7.710 162 2HE LYS 21 2HE LYS 21 37.104 27.560 -6.459 163 1HZ LYS 21 1HZ LYS 21 36.602 26.504 -9.205 164 2HZ LYS 21 2HZ LYS 21 37.478 25.723 -8.043 165 3HZ LYS 21 3HZ LYS 21 38.017 27.158 -8.659 166 HA PRO 22 HA PRO 22 29.850 27.781 -6.518 167 1HB PRO 22 1HB PRO 22 30.062 30.137 -5.045 168 2HB PRO 22 2HB PRO 22 29.162 28.688 -4.562 169 1HG PRO 22 1HG PRO 22 31.953 29.507 -3.679 170 2HG PRO 22 2HG PRO 22 30.605 28.920 -2.666 171 1HD PRO 22 1HD PRO 22 32.650 27.291 -3.543 172 2HD PRO 22 2HD PRO 22 31.002 26.644 -3.326 173 H DAL 23 H ALA 23 30.172 28.840 -8.365 174 HA DAL 23 HA ALA 23 32.985 29.835 -9.083 175 1HB DAL 23 1HB ALA 23 32.000 31.587 -10.545 176 2HB DAL 23 2HB ALA 23 30.361 31.155 -9.992 177 3HB DAL 23 3HB ALA 23 31.541 31.839 -8.841 178 H VAL 24 H VAL 24 32.816 27.381 -9.336 179 HA VAL 24 HA VAL 24 32.514 26.645 -12.215 180 HB VAL 24 HB VAL 24 33.288 24.891 -9.834 181 1HG1 VAL 24 1HG1 VAL 24 34.248 23.218 -11.463 182 2HG1 VAL 24 2HG1 VAL 24 33.806 24.266 -12.846 183 3HG1 VAL 24 3HG1 VAL 24 32.550 23.525 -11.844 184 1HG2 VAL 24 1HG2 VAL 24 35.736 25.052 -10.520 185 2HG2 VAL 24 2HG2 VAL 24 35.030 26.593 -10.020 186 3HG2 VAL 24 3HG2 VAL 24 35.262 26.280 -11.741 187 H THR 25 H THR 25 30.608 25.640 -13.016 188 HA THR 25 HA THR 25 28.569 24.496 -11.132 189 HB THR 25 HB THR 25 26.869 25.503 -12.599 190 HG1 THR 25 HG1 THR 25 28.244 26.181 -14.242 191 1HG2 THR 25 1HG2 THR 25 26.650 27.744 -11.512 192 2HG2 THR 25 2HG2 THR 25 28.340 27.641 -10.952 193 3HG2 THR 25 3HG2 THR 25 27.122 26.497 -10.326 194 H ILE 26 H ILE 26 28.981 22.605 -11.787 195 HA ILE 26 HA ILE 26 29.578 21.530 -14.319 196 HB ILE 26 HB ILE 26 29.939 20.785 -11.852 197 1HG1 ILE 26 1HG1 ILE 26 29.242 18.213 -13.398 198 2HG1 ILE 26 2HG1 ILE 26 30.364 19.292 -14.126 199 1HG2 ILE 26 1HG2 ILE 26 27.303 19.161 -12.091 200 2HG2 ILE 26 2HG2 ILE 26 27.530 20.587 -11.033 201 3HG2 ILE 26 3HG2 ILE 26 28.466 19.088 -10.748 202 1HD1 ILE 26 1HD1 ILE 26 31.844 19.296 -12.162 203 2HD1 ILE 26 2HD1 ILE 26 31.567 17.615 -12.704 204 3HD1 ILE 26 3HD1 ILE 26 30.722 18.268 -11.257 205 H ARG 27 H ARG 27 28.332 19.668 -15.410 206 HA ARG 27 HA ARG 27 25.374 19.838 -15.379 207 1HB ARG 27 1HB ARG 27 26.850 20.295 -18.008 208 2HB ARG 27 2HB ARG 27 25.167 19.661 -17.892 209 1HG ARG 27 1HG ARG 27 24.359 21.549 -16.882 210 2HG ARG 27 2HG ARG 27 26.000 22.318 -16.826 211 1HD ARG 27 2HD ARG 27 26.021 22.410 -19.347 212 2HD ARG 27 1HD ARG 27 24.407 21.672 -19.401 213 HE ARG 27 HE ARG 27 24.209 24.009 -17.703 214 1HH1 ARG 27 1HH2 ARG 27 24.782 23.438 -21.214 215 2HH1 ARG 27 2HH2 ARG 27 24.070 25.090 -21.574 216 1HH2 ARG 27 2HH1 ARG 27 23.445 25.820 -18.277 217 2HH2 ARG 27 1HH1 ARG 27 23.374 26.329 -20.039 218 H CYS 28 H CYS 28 25.170 17.997 -14.978 219 HA CYS 28 HA CYS 28 26.850 15.654 -15.997 220 1HB CYS 28 1HB CYS 28 24.834 15.760 -13.657 221 2HB CYS 28 2HB CYS 28 25.757 14.325 -14.173 222 H GLU 29 H GLU 29 26.003 15.448 -17.978 223 HA GLU 29 HA GLU 29 23.439 16.362 -18.852 224 1HB GLU 29 2HB GLU 29 25.523 14.595 -20.284 225 2HB GLU 29 1HB GLU 29 24.082 15.085 -21.127 226 1HG GLU 29 1HG GLU 29 26.068 17.120 -19.977 227 2HG GLU 29 2HG GLU 29 26.168 16.441 -21.599 Start of MODEL 10 1 1H SER 1 1H SER 1 25.968 9.177 -18.699 2 2H SER 1 2H SER 1 26.568 8.382 -17.381 3 3H SER 1 3H SER 1 24.953 8.715 -17.481 4 HA SER 1 HA SER 1 25.326 11.081 -17.351 5 1HB SER 1 1HB SER 1 26.662 9.449 -15.111 6 2HB SER 1 2HB SER 1 26.176 11.147 -14.964 7 HG SER 1 HG SER 1 24.586 9.715 -14.223 8 H LYS 2 H LYS 2 26.716 12.635 -17.896 9 HA LYS 2 HA LYS 2 29.719 12.304 -17.644 10 1HB LYS 2 2HB LYS 2 30.270 13.141 -19.814 11 2HB LYS 2 1HB LYS 2 29.419 11.613 -19.876 12 1HG LYS 2 1HG LYS 2 27.335 12.801 -20.685 13 2HG LYS 2 2HG LYS 2 28.194 14.340 -20.623 14 1HD LYS 2 2HD LYS 2 29.858 13.483 -22.344 15 2HD LYS 2 1HD LYS 2 28.997 11.942 -22.406 16 1HE LYS 2 1HE LYS 2 26.924 13.129 -23.256 17 2HE LYS 2 2HE LYS 2 27.788 14.677 -23.194 18 1HZ LYS 2 1HZ LYS 2 27.883 13.697 -25.403 19 2HZ LYS 2 2HZ LYS 2 28.605 12.325 -24.834 20 3HZ LYS 2 3HZ LYS 2 29.409 13.766 -24.775 21 H TYR 3 H TYR 3 30.760 14.134 -16.993 22 HA TYR 3 HA TYR 3 29.037 16.435 -16.089 23 1HB TYR 3 2HB TYR 3 30.714 17.125 -14.696 24 2HB TYR 3 1HB TYR 3 30.519 15.436 -14.429 25 HD1 TYR 3 HD1 TYR 3 32.985 17.922 -14.501 26 HD2 TYR 3 HD2 TYR 3 32.403 13.935 -15.994 27 HE1 TYR 3 HE1 TYR 3 35.385 17.569 -14.577 28 HE2 TYR 3 HE2 TYR 3 34.831 13.678 -16.163 29 HH TYR 3 HH TYR 3 37.035 16.239 -15.128 30 H GLU 4 H GLU 4 29.102 18.364 -17.024 31 HA GLU 4 HA GLU 4 31.483 19.193 -18.833 32 1HB GLU 4 1HB GLU 4 30.004 18.982 -20.483 33 2HB GLU 4 2HB GLU 4 28.568 19.169 -19.528 34 1HG GLU 4 1HG GLU 4 28.978 21.699 -19.489 35 2HG GLU 4 2HG GLU 4 30.331 21.450 -20.585 36 H TYR 5 H TYR 5 32.639 20.238 -17.366 37 HA TYR 5 HA TYR 5 31.286 22.197 -15.470 38 1HB TYR 5 2HB TYR 5 32.427 21.663 -13.640 39 2HB TYR 5 1HB TYR 5 32.298 20.071 -14.325 40 HD1 TYR 5 HD1 TYR 5 34.831 20.031 -16.153 41 HD2 TYR 5 HD2 TYR 5 34.161 21.221 -12.083 42 HE1 TYR 5 HE1 TYR 5 37.222 19.769 -15.633 43 HE2 TYR 5 HE2 TYR 5 36.531 21.030 -11.645 44 HH TYR 5 HH TYR 5 38.509 20.457 -12.426 45 H THR 6 H THR 6 31.790 24.014 -15.837 46 HA THR 6 HA THR 6 33.964 24.646 -17.867 47 HB THR 6 HB THR 6 31.596 26.505 -17.146 48 HG1 THR 6 HG1 THR 6 31.612 24.373 -19.012 49 1HG2 THR 6 1HG2 THR 6 33.022 25.939 -19.802 50 2HG2 THR 6 2HG2 THR 6 31.771 27.172 -19.515 51 3HG2 THR 6 3HG2 THR 6 33.407 27.332 -18.759 52 H ILE 7 H ILE 7 35.536 26.028 -17.424 53 HA ILE 7 HA ILE 7 35.709 27.365 -14.673 54 HB ILE 7 HB ILE 7 37.923 25.636 -15.943 55 1HG1 ILE 7 1HG1 ILE 7 37.558 24.199 -13.607 56 2HG1 ILE 7 2HG1 ILE 7 35.981 24.956 -13.638 57 1HG2 ILE 7 1HG2 ILE 7 38.817 27.506 -14.590 58 2HG2 ILE 7 2HG2 ILE 7 37.847 26.995 -13.179 59 3HG2 ILE 7 3HG2 ILE 7 39.174 25.956 -13.797 60 1HD1 ILE 7 1HD1 ILE 7 35.751 23.807 -16.011 61 2HD1 ILE 7 2HD1 ILE 7 37.167 22.853 -15.476 62 3HD1 ILE 7 3HD1 ILE 7 35.674 22.876 -14.512 63 HA DPR 8 HA PRO 8 37.960 30.558 -16.954 64 1HB DPR 8 2HB PRO 8 37.378 31.868 -15.167 65 2HB DPR 8 1HB PRO 8 36.562 32.843 -16.409 66 1HG DPR 8 2HG PRO 8 35.190 31.918 -14.211 67 2HG DPR 8 1HG PRO 8 34.408 31.943 -15.816 68 1HD DPR 8 2HD PRO 8 35.403 29.545 -14.297 69 2HD DPR 8 1HD PRO 8 34.192 29.617 -15.597 70 H SER 9 H SER 9 37.991 30.080 -19.093 71 HA SER 9 HA SER 9 35.656 30.845 -20.909 72 1HB SER 9 1HB SER 9 37.461 32.576 -21.115 73 2HB SER 9 2HB SER 9 38.643 31.305 -21.491 74 HG SER 9 HG SER 9 36.253 31.872 -22.918 75 H TYR 10 H TYR 10 37.139 28.280 -19.599 76 HA TYR 10 HA TYR 10 37.386 26.680 -22.198 77 1HB TYR 10 2HB TYR 10 39.397 27.231 -20.376 78 2HB TYR 10 1HB TYR 10 38.719 25.888 -19.529 79 HD1 TYR 10 HD1 TYR 10 38.791 23.567 -20.628 80 HD2 TYR 10 HD2 TYR 10 40.573 26.987 -22.534 81 HE1 TYR 10 HE1 TYR 10 40.098 22.099 -22.081 82 HE2 TYR 10 HE2 TYR 10 41.850 25.488 -23.977 83 HH TYR 10 HH TYR 10 41.570 21.962 -23.713 84 H THR 11 H THR 11 35.931 25.037 -22.452 85 HA THR 11 HA THR 11 34.184 24.185 -20.137 86 HB THR 11 HB THR 11 33.916 23.416 -23.097 87 HG1 THR 11 HG1 THR 11 33.932 25.672 -22.856 88 1HG2 THR 11 1HG2 THR 11 31.480 23.167 -22.619 89 2HG2 THR 11 2HG2 THR 11 32.393 22.179 -21.449 90 3HG2 THR 11 3HG2 THR 11 31.711 23.739 -20.942 91 H PHE 12 H PHE 12 34.782 22.515 -19.136 92 HA PHE 12 HA PHE 12 36.767 20.431 -20.329 93 1HB PHE 12 1HB PHE 12 36.287 21.187 -17.416 94 2HB PHE 12 2HB PHE 12 37.179 19.771 -17.899 95 HD1 PHE 12 HD1 PHE 12 37.258 23.512 -17.808 96 HD2 PHE 12 HD2 PHE 12 39.513 19.983 -18.826 97 HE1 PHE 12 HE1 PHE 12 39.326 24.768 -17.681 98 HE2 PHE 12 HE2 PHE 12 41.553 21.300 -18.745 99 HZ PHE 12 HZ PHE 12 41.475 23.692 -18.142 100 H ARG 13 H ARG 13 35.573 18.754 -21.063 101 HA ARG 13 HA ARG 13 33.033 17.883 -19.586 102 1HB ARG 13 2HB ARG 13 33.235 17.561 -22.594 103 2HB ARG 13 1HB ARG 13 31.832 17.487 -21.504 104 1HG ARG 13 2HG ARG 13 31.840 19.979 -21.350 105 2HG ARG 13 1HG ARG 13 33.261 20.035 -22.384 106 1HD ARG 13 1HD ARG 13 31.891 18.845 -24.242 107 2HD ARG 13 2HD ARG 13 30.469 18.990 -23.200 108 HE ARG 13 HE ARG 13 31.539 21.641 -23.421 109 1HH1 ARG 13 1HH2 ARG 13 30.219 19.292 -25.814 110 2HH1 ARG 13 2HH2 ARG 13 29.727 20.698 -26.886 111 1HH2 ARG 13 2HH1 ARG 13 30.926 23.089 -24.733 112 2HH2 ARG 13 1HH1 ARG 13 30.098 22.676 -26.318 113 H GLY 14 H GLY 14 33.116 15.847 -18.894 114 1HA GLY 14 2HA GLY 14 34.246 13.597 -20.516 115 2HA GLY 14 1HA GLY 14 35.232 13.959 -19.104 116 HA PRO 15 HA PRO 15 31.608 11.152 -17.720 117 1HB PRO 15 2HB PRO 15 32.725 8.782 -17.049 118 2HB PRO 15 1HB PRO 15 32.519 9.296 -18.738 119 1HG PRO 15 1HG PRO 15 35.012 9.465 -17.010 120 2HG PRO 15 2HG PRO 15 34.866 8.770 -18.662 121 1HD PRO 15 1HD PRO 15 35.719 11.418 -18.152 122 2HD PRO 15 2HD PRO 15 34.861 10.967 -19.650 123 H GLY 16 H GLY 16 30.947 10.286 -15.637 124 1HA GLY 16 1HA GLY 16 30.886 10.109 -13.248 125 2HA GLY 16 2HA GLY 16 32.497 10.811 -13.148 126 H CYS 17 H CYS 17 29.328 11.427 -12.569 127 HA CYS 17 HA CYS 17 29.575 14.469 -12.677 128 1HB CYS 17 2HB CYS 17 27.093 12.697 -12.184 129 2HB CYS 17 1HB CYS 17 27.092 14.462 -12.293 130 HA PRO 18 HA PRO 18 29.944 14.511 -8.037 131 1HB PRO 18 2HB PRO 18 32.315 15.802 -7.710 132 2HB PRO 18 1HB PRO 18 32.232 14.078 -8.131 133 1HG PRO 18 1HG PRO 18 32.842 16.427 -9.984 134 2HG PRO 18 2HG PRO 18 33.680 14.849 -9.895 135 1HD PRO 18 1HD PRO 18 31.551 15.469 -11.723 136 2HD PRO 18 2HD PRO 18 32.012 13.820 -11.226 137 H THR 19 H THR 19 30.139 16.531 -6.651 138 HA THR 19 HA THR 19 28.992 19.012 -8.025 139 HB THR 19 HB THR 19 27.407 18.513 -6.473 140 HG1 THR 19 HG1 THR 19 28.048 20.616 -6.816 141 1HG2 THR 19 1HG2 THR 19 27.627 18.626 -3.991 142 2HG2 THR 19 2HG2 THR 19 28.553 17.231 -4.626 143 3HG2 THR 19 3HG2 THR 19 29.409 18.725 -4.138 144 H VAL 20 H VAL 20 29.931 20.951 -7.542 145 HA VAL 20 HA VAL 20 32.916 20.875 -6.808 146 HB VAL 20 HB VAL 20 33.633 21.941 -8.946 147 1HG1 VAL 20 1HG2 VAL 20 33.894 19.461 -8.627 148 2HG1 VAL 20 2HG2 VAL 20 33.759 19.905 -10.340 149 3HG1 VAL 20 3HG2 VAL 20 32.361 19.200 -9.492 150 1HG2 VAL 20 1HG1 VAL 20 31.708 23.020 -9.886 151 2HG2 VAL 20 2HG1 VAL 20 32.215 21.814 -11.090 152 3HG2 VAL 20 3HG1 VAL 20 30.825 21.495 -10.003 153 H LYS 21 H LYS 21 34.033 22.795 -6.626 154 HA LYS 21 HA LYS 21 33.781 24.825 -5.090 155 1HB LYS 21 1HB LYS 21 34.403 25.578 -8.001 156 2HB LYS 21 2HB LYS 21 34.973 26.415 -6.575 157 1HG LYS 21 1HG LYS 21 35.924 23.671 -7.538 158 2HG LYS 21 2HG LYS 21 36.712 25.214 -7.828 159 1HD LYS 21 1HD LYS 21 37.067 25.498 -5.364 160 2HD LYS 21 2HD LYS 21 36.296 23.941 -5.068 161 1HE LYS 21 1HE LYS 21 38.862 24.229 -6.790 162 2HE LYS 21 2HE LYS 21 38.898 24.057 -5.042 163 1HZ LYS 21 1HZ LYS 21 37.760 21.920 -5.240 164 2HZ LYS 21 2HZ LYS 21 39.162 21.923 -6.115 165 3HZ LYS 21 3HZ LYS 21 37.707 22.051 -6.886 166 HA PRO 22 HA PRO 22 30.266 27.734 -6.186 167 1HB PRO 22 2HB PRO 22 30.759 29.932 -4.580 168 2HB PRO 22 1HB PRO 22 30.084 28.393 -4.007 169 1HG PRO 22 1HG PRO 22 32.965 29.349 -3.788 170 2HG PRO 22 2HG PRO 22 31.961 28.578 -2.527 171 1HD PRO 22 2HD PRO 22 33.799 27.175 -4.108 172 2HD PRO 22 1HD PRO 22 32.329 26.408 -3.455 173 H DAL 23 H ALA 23 30.409 28.589 -8.180 174 HA DAL 23 HA ALA 23 33.000 29.867 -9.174 175 1HB DAL 23 1HB ALA 23 31.770 31.596 -10.465 176 2HB DAL 23 2HB ALA 23 31.460 31.769 -8.716 177 3HB DAL 23 3HB ALA 23 30.220 31.043 -9.775 178 H VAL 24 H VAL 24 32.938 27.382 -9.506 179 HA VAL 24 HA VAL 24 32.440 26.790 -12.388 180 HB VAL 24 HB VAL 24 33.442 24.923 -10.188 181 1HG1 VAL 24 1HG1 VAL 24 33.788 24.522 -13.270 182 2HG1 VAL 24 2HG1 VAL 24 32.603 23.676 -12.263 183 3HG1 VAL 24 3HG1 VAL 24 34.329 23.404 -11.992 184 1HG2 VAL 24 1HG2 VAL 24 35.120 26.704 -10.389 185 2HG2 VAL 24 2HG2 VAL 24 35.811 25.181 -10.962 186 3HG2 VAL 24 3HG2 VAL 24 35.289 26.431 -12.134 187 H THR 25 H THR 25 30.414 25.938 -13.042 188 HA THR 25 HA THR 25 28.567 24.684 -11.019 189 HB THR 25 HB THR 25 26.744 25.662 -12.333 190 HG1 THR 25 HG1 THR 25 27.965 26.367 -14.084 191 1HG2 THR 25 1HG2 THR 25 27.163 26.663 -10.089 192 2HG2 THR 25 2HG2 THR 25 28.304 27.830 -10.811 193 3HG2 THR 25 3HG2 THR 25 26.571 27.899 -11.231 194 H ILE 26 H ILE 26 28.998 22.815 -11.719 195 HA ILE 26 HA ILE 26 29.435 21.750 -14.274 196 HB ILE 26 HB ILE 26 29.952 20.993 -11.894 197 1HG1 ILE 26 2HG1 ILE 26 29.163 18.413 -13.364 198 2HG1 ILE 26 1HG1 ILE 26 30.245 19.497 -14.148 199 1HG2 ILE 26 1HG2 ILE 26 27.637 20.795 -10.871 200 2HG2 ILE 26 2HG2 ILE 26 27.336 19.341 -11.884 201 3HG2 ILE 26 3HG2 ILE 26 28.615 19.314 -10.644 202 1HD1 ILE 26 1HD1 ILE 26 30.735 18.438 -11.306 203 2HD1 ILE 26 2HD1 ILE 26 31.545 17.828 -12.786 204 3HD1 ILE 26 3HD1 ILE 26 31.814 19.507 -12.205 205 H ARG 27 H ARG 27 28.150 19.921 -15.308 206 HA ARG 27 HA ARG 27 25.201 20.115 -15.266 207 1HB ARG 27 2HB ARG 27 25.646 21.726 -16.971 208 2HB ARG 27 1HB ARG 27 26.698 20.550 -17.873 209 1HG ARG 27 2HG ARG 27 24.852 19.212 -18.368 210 2HG ARG 27 1HG ARG 27 23.728 20.232 -17.437 211 1HD ARG 27 2HD ARG 27 25.272 21.242 -19.937 212 2HD ARG 27 1HD ARG 27 23.711 20.436 -20.045 213 HE ARG 27 HE ARG 27 23.171 22.513 -18.224 214 1HH1 ARG 27 2HH1 ARG 27 24.509 22.590 -21.568 215 2HH1 ARG 27 1HH1 ARG 27 23.802 24.270 -21.786 216 1HH2 ARG 27 1HH2 ARG 27 22.451 24.387 -18.632 217 2HH2 ARG 27 2HH2 ARG 27 22.730 25.203 -20.251 218 H CYS 28 H CYS 28 24.828 18.327 -15.278 219 HA CYS 28 HA CYS 28 26.559 15.900 -16.115 220 1HB CYS 28 2HB CYS 28 25.823 15.808 -13.697 221 2HB CYS 28 1HB CYS 28 24.140 15.608 -14.243 222 H GLU 29 H GLU 29 25.993 15.248 -18.065 223 HA GLU 29 HA GLU 29 23.419 16.112 -19.376 224 1HB GLU 29 1HB GLU 29 25.943 14.777 -20.532 225 2HB GLU 29 2HB GLU 29 24.523 15.109 -21.511 226 1HG GLU 29 1HG GLU 29 24.734 17.563 -21.115 227 2HG GLU 29 2HG GLU 29 26.162 17.289 -20.109 Start of MODEL 11 1 1H SER 1 1H SER 1 25.951 8.910 -18.224 2 2H SER 1 2H SER 1 24.409 9.387 -17.875 3 3H SER 1 3H SER 1 25.202 10.037 -19.170 4 HA SER 1 HA SER 1 25.110 11.619 -17.339 5 1HB SER 1 2HB SER 1 26.647 9.405 -15.861 6 2HB SER 1 1HB SER 1 26.432 11.058 -15.257 7 HG SER 1 HG SER 1 24.173 10.740 -15.415 8 H LYS 2 H LYS 2 26.538 13.135 -17.900 9 HA LYS 2 HA LYS 2 29.499 12.590 -18.197 10 1HB LYS 2 1HB LYS 2 27.945 13.915 -20.492 11 2HB LYS 2 2HB LYS 2 29.700 13.953 -20.316 12 1HG LYS 2 2HG LYS 2 29.831 11.462 -20.532 13 2HG LYS 2 1HG LYS 2 28.079 11.375 -20.708 14 1HD LYS 2 2HD LYS 2 28.199 12.746 -22.806 15 2HD LYS 2 1HD LYS 2 29.944 12.888 -22.660 16 1HE LYS 2 1HE LYS 2 28.506 10.154 -22.959 17 2HE LYS 2 2HE LYS 2 28.986 11.156 -24.319 18 1HZ LYS 2 1HZ LYS 2 30.666 9.507 -23.841 19 2HZ LYS 2 2HZ LYS 2 30.887 10.074 -22.305 20 3HZ LYS 2 3HZ LYS 2 31.300 11.014 -23.599 21 H TYR 3 H TYR 3 30.536 14.227 -17.294 22 HA TYR 3 HA TYR 3 28.995 16.545 -16.122 23 1HB TYR 3 2HB TYR 3 30.722 16.947 -14.689 24 2HB TYR 3 1HB TYR 3 30.433 15.257 -14.617 25 HD1 TYR 3 HD1 TYR 3 32.240 13.926 -16.538 26 HD2 TYR 3 HD2 TYR 3 33.021 17.548 -14.355 27 HE1 TYR 3 HE1 TYR 3 34.644 13.611 -16.812 28 HE2 TYR 3 HE2 TYR 3 35.399 17.137 -14.568 29 HH TYR 3 HH TYR 3 36.983 15.866 -15.401 30 H GLU 4 H GLU 4 29.028 18.457 -17.065 31 HA GLU 4 HA GLU 4 31.456 19.369 -18.775 32 1HB GLU 4 2HB GLU 4 29.897 19.345 -20.372 33 2HB GLU 4 1HB GLU 4 28.516 19.594 -19.353 34 1HG GLU 4 2HG GLU 4 29.167 22.060 -19.147 35 2HG GLU 4 1HG GLU 4 30.457 21.777 -20.305 36 H TYR 5 H TYR 5 32.697 20.148 -17.218 37 HA TYR 5 HA TYR 5 31.523 22.028 -15.127 38 1HB TYR 5 1HB TYR 5 32.707 21.271 -13.406 39 2HB TYR 5 2HB TYR 5 32.517 19.753 -14.229 40 HD1 TYR 5 HD1 TYR 5 34.639 20.947 -12.055 41 HD2 TYR 5 HD2 TYR 5 34.849 19.586 -16.127 42 HE1 TYR 5 HE1 TYR 5 37.023 20.635 -11.836 43 HE2 TYR 5 HE2 TYR 5 37.251 19.225 -15.836 44 HH TYR 5 HH TYR 5 38.886 19.937 -12.786 45 H THR 6 H THR 6 32.025 23.861 -15.451 46 HA THR 6 HA THR 6 34.152 24.552 -17.500 47 HB THR 6 HB THR 6 31.877 26.447 -16.596 48 HG1 THR 6 HG1 THR 6 31.730 24.400 -18.548 49 1HG2 THR 6 1HG2 THR 6 31.983 27.203 -18.945 50 2HG2 THR 6 2HG2 THR 6 33.176 25.938 -19.329 51 3HG2 THR 6 3HG2 THR 6 33.652 27.275 -18.249 52 H ILE 7 H ILE 7 35.824 25.766 -16.984 53 HA ILE 7 HA ILE 7 36.098 26.913 -14.158 54 HB ILE 7 HB ILE 7 38.253 25.283 -15.653 55 1HG1 ILE 7 1HG1 ILE 7 38.092 23.568 -13.639 56 2HG1 ILE 7 2HG1 ILE 7 36.583 24.342 -13.245 57 1HG2 ILE 7 1HG2 ILE 7 39.571 25.433 -13.501 58 2HG2 ILE 7 2HG2 ILE 7 39.171 27.046 -14.128 59 3HG2 ILE 7 3HG2 ILE 7 38.235 26.377 -12.764 60 1HD1 ILE 7 1HD1 ILE 7 37.213 22.238 -15.203 61 2HD1 ILE 7 2HD1 ILE 7 35.658 22.731 -14.461 62 3HD1 ILE 7 3HD1 ILE 7 36.192 23.503 -15.933 63 HA DPR 8 HA PRO 8 38.289 30.243 -16.304 64 1HB DPR 8 2HB PRO 8 37.786 31.417 -14.396 65 2HB DPR 8 1HB PRO 8 36.943 32.492 -15.533 66 1HG DPR 8 1HG PRO 8 35.631 31.418 -13.365 67 2HG DPR 8 2HG PRO 8 34.797 31.576 -14.937 68 1HD DPR 8 1HD PRO 8 35.801 29.057 -13.637 69 2HD DPR 8 2HD PRO 8 34.558 29.240 -14.895 70 H SER 9 H SER 9 38.177 29.790 -18.463 71 HA SER 9 HA SER 9 35.812 30.747 -20.130 72 1HB SER 9 2HB SER 9 37.650 32.454 -20.311 73 2HB SER 9 1HB SER 9 38.780 31.183 -20.819 74 HG SER 9 HG SER 9 37.359 30.755 -22.564 75 H TYR 10 H TYR 10 37.451 28.099 -19.077 76 HA TYR 10 HA TYR 10 37.578 26.715 -21.801 77 1HB TYR 10 1HB TYR 10 39.635 27.061 -20.016 78 2HB TYR 10 2HB TYR 10 38.942 25.681 -19.232 79 HD1 TYR 10 HD1 TYR 10 40.767 26.914 -22.191 80 HD2 TYR 10 HD2 TYR 10 38.874 23.441 -20.503 81 HE1 TYR 10 HE1 TYR 10 41.956 25.473 -23.766 82 HE2 TYR 10 HE2 TYR 10 40.098 22.028 -22.084 83 HH TYR 10 HH TYR 10 41.535 21.952 -23.750 84 H THR 11 H THR 11 36.064 25.157 -22.177 85 HA THR 11 HA THR 11 34.287 24.204 -19.933 86 HB THR 11 HB THR 11 33.971 23.698 -22.945 87 HG1 THR 11 HG1 THR 11 32.989 25.883 -21.426 88 1HG2 THR 11 1HG2 THR 11 31.520 23.602 -22.476 89 2HG2 THR 11 2HG2 THR 11 31.798 23.998 -20.757 90 3HG2 THR 11 3HG2 THR 11 32.361 22.444 -21.410 91 H PHE 12 H PHE 12 34.769 22.408 -19.077 92 HA PHE 12 HA PHE 12 36.575 20.288 -20.476 93 1HB PHE 12 1HB PHE 12 36.164 20.795 -17.504 94 2HB PHE 12 2HB PHE 12 36.954 19.376 -18.128 95 HD1 PHE 12 HD1 PHE 12 37.253 23.125 -17.837 96 HD2 PHE 12 HD2 PHE 12 39.342 19.489 -18.825 97 HE1 PHE 12 HE1 PHE 12 39.383 24.243 -17.543 98 HE2 PHE 12 HE2 PHE 12 41.451 20.668 -18.570 99 HZ PHE 12 HZ PHE 12 41.486 23.040 -17.892 100 H ARG 13 H ARG 13 35.243 18.790 -21.346 101 HA ARG 13 HA ARG 13 32.654 17.980 -19.923 102 1HB ARG 13 1HB ARG 13 32.805 17.889 -22.938 103 2HB ARG 13 2HB ARG 13 31.417 17.837 -21.822 104 1HG ARG 13 2HG ARG 13 31.612 20.289 -21.477 105 2HG ARG 13 1HG ARG 13 33.011 20.342 -22.539 106 1HD ARG 13 2HD ARG 13 31.573 19.452 -24.463 107 2HD ARG 13 1HD ARG 13 30.167 19.489 -23.390 108 HE ARG 13 HE ARG 13 31.480 22.125 -23.451 109 1HH1 ARG 13 1HH2 ARG 13 29.266 20.142 -25.490 110 2HH1 ARG 13 2HH2 ARG 13 28.641 21.683 -26.266 111 1HH2 ARG 13 1HH1 ARG 13 30.674 23.742 -24.417 112 2HH2 ARG 13 2HH1 ARG 13 29.378 23.557 -25.703 113 H GLY 14 H GLY 14 32.670 15.884 -19.354 114 1HA GLY 14 2HA GLY 14 33.561 13.700 -21.175 115 2HA GLY 14 1HA GLY 14 34.705 13.932 -19.859 116 HA PRO 15 HA PRO 15 31.171 11.156 -18.226 117 1HB PRO 15 1HB PRO 15 32.314 8.762 -17.736 118 2HB PRO 15 2HB PRO 15 31.987 9.337 -19.386 119 1HG PRO 15 1HG PRO 15 34.604 9.422 -17.846 120 2HG PRO 15 2HG PRO 15 34.327 8.790 -19.506 121 1HD PRO 15 1HD PRO 15 35.241 11.415 -18.955 122 2HD PRO 15 2HD PRO 15 34.286 11.021 -20.410 123 H GLY 16 H GLY 16 30.678 10.219 -16.117 124 1HA GLY 16 1HA GLY 16 30.853 9.929 -13.747 125 2HA GLY 16 2HA GLY 16 32.461 10.642 -13.765 126 H CYS 17 H CYS 17 29.389 11.189 -12.826 127 HA CYS 17 HA CYS 17 29.549 14.234 -12.862 128 1HB CYS 17 2HB CYS 17 27.431 13.318 -13.653 129 2HB CYS 17 1HB CYS 17 27.198 12.350 -12.186 130 HA PRO 18 HA PRO 18 30.683 14.219 -8.338 131 1HB PRO 18 2HB PRO 18 32.918 15.774 -8.388 132 2HB PRO 18 1HB PRO 18 32.961 14.054 -8.832 133 1HG PRO 18 1HG PRO 18 32.936 16.469 -10.703 134 2HG PRO 18 2HG PRO 18 33.982 15.020 -10.794 135 1HD PRO 18 1HD PRO 18 31.536 15.322 -12.236 136 2HD PRO 18 2HD PRO 18 32.241 13.746 -11.803 137 H THR 19 H THR 19 30.956 16.342 -6.999 138 HA THR 19 HA THR 19 29.272 18.621 -8.165 139 HB THR 19 HB THR 19 27.957 17.740 -6.473 140 HG1 THR 19 HG1 THR 19 29.179 20.165 -5.745 141 1HG2 THR 19 1HG2 THR 19 29.530 16.795 -4.748 142 2HG2 THR 19 2HG2 THR 19 28.380 17.969 -4.034 143 3HG2 THR 19 3HG2 THR 19 30.075 18.456 -4.357 144 H VAL 20 H VAL 20 29.826 20.709 -7.452 145 HA VAL 20 HA VAL 20 32.880 21.144 -7.415 146 HB VAL 20 HB VAL 20 32.644 22.899 -9.184 147 1HG1 VAL 20 1HG2 VAL 20 31.890 20.116 -10.149 148 2HG1 VAL 20 2HG2 VAL 20 33.526 20.704 -9.786 149 3HG1 VAL 20 3HG2 VAL 20 32.634 21.390 -11.163 150 1HG2 VAL 20 1HG1 VAL 20 30.220 23.467 -9.100 151 2HG2 VAL 20 2HG1 VAL 20 29.824 21.897 -9.837 152 3HG2 VAL 20 3HG1 VAL 20 30.766 23.108 -10.754 153 H LYS 21 H LYS 21 33.638 23.389 -7.165 154 HA LYS 21 HA LYS 21 32.505 24.532 -4.651 155 1HB LYS 21 2HB LYS 21 34.579 25.826 -4.591 156 2HB LYS 21 1HB LYS 21 34.837 24.089 -4.667 157 1HG LYS 21 1HG LYS 21 36.621 25.167 -5.719 158 2HG LYS 21 2HG LYS 21 35.749 24.267 -6.951 159 1HD LYS 21 2HD LYS 21 34.756 26.261 -7.895 160 2HD LYS 21 1HD LYS 21 35.328 27.285 -6.575 161 1HE LYS 21 2HE LYS 21 37.762 26.772 -7.319 162 2HE LYS 21 1HE LYS 21 37.093 25.901 -8.710 163 1HZ LYS 21 1HZ LYS 21 35.987 27.983 -9.380 164 2HZ LYS 21 2HZ LYS 21 36.608 28.779 -8.072 165 3HZ LYS 21 3HZ LYS 21 37.618 28.208 -9.249 166 HA PRO 22 HA PRO 22 30.479 28.140 -6.538 167 1HB PRO 22 2HB PRO 22 31.991 30.114 -4.741 168 2HB PRO 22 1HB PRO 22 30.248 29.969 -5.066 169 1HG PRO 22 1HG PRO 22 31.262 28.978 -2.760 170 2HG PRO 22 2HG PRO 22 30.070 28.001 -3.663 171 1HD PRO 22 2HD PRO 22 33.134 27.715 -3.719 172 2HD PRO 22 1HD PRO 22 31.903 26.437 -3.490 173 H DAL 23 H ALA 23 30.851 29.098 -8.461 174 HA DAL 23 HA ALA 23 33.720 29.773 -9.320 175 1HB DAL 23 1HB ALA 23 31.209 31.349 -10.123 176 2HB DAL 23 2HB ALA 23 32.856 31.598 -10.759 177 3HB DAL 23 3HB ALA 23 32.510 31.914 -9.039 178 H VAL 24 H VAL 24 33.385 27.384 -9.576 179 HA VAL 24 HA VAL 24 32.777 26.636 -12.399 180 HB VAL 24 HB VAL 24 33.613 24.865 -10.051 181 1HG1 VAL 24 1HG2 VAL 24 32.633 23.508 -11.970 182 2HG1 VAL 24 2HG2 VAL 24 34.320 23.087 -11.666 183 3HG1 VAL 24 3HG2 VAL 24 33.893 24.112 -13.064 184 1HG2 VAL 24 1HG1 VAL 24 35.439 26.475 -10.466 185 2HG2 VAL 24 2HG1 VAL 24 35.565 25.987 -12.160 186 3HG2 VAL 24 3HG1 VAL 24 35.995 24.841 -10.850 187 H THR 25 H THR 25 30.823 25.541 -13.047 188 HA THR 25 HA THR 25 28.876 24.564 -11.006 189 HB THR 25 HB THR 25 27.094 25.573 -12.395 190 HG1 THR 25 HG1 THR 25 27.581 27.458 -13.553 191 1HG2 THR 25 1HG2 THR 25 27.500 26.600 -10.156 192 2HG2 THR 25 2HG2 THR 25 26.979 27.836 -11.333 193 3HG2 THR 25 3HG2 THR 25 28.699 27.710 -10.875 194 H ILE 26 H ILE 26 29.134 22.617 -11.659 195 HA ILE 26 HA ILE 26 29.564 21.541 -14.219 196 HB ILE 26 HB ILE 26 30.036 20.766 -11.779 197 1HG1 ILE 26 2HG1 ILE 26 29.218 18.264 -13.383 198 2HG1 ILE 26 1HG1 ILE 26 30.379 19.336 -14.075 199 1HG2 ILE 26 1HG2 ILE 26 27.678 20.590 -10.835 200 2HG2 ILE 26 2HG2 ILE 26 28.615 19.080 -10.629 201 3HG2 ILE 26 3HG2 ILE 26 27.378 19.178 -11.900 202 1HD1 ILE 26 1HD1 ILE 26 31.900 19.179 -12.182 203 2HD1 ILE 26 2HD1 ILE 26 31.497 17.520 -12.725 204 3HD1 ILE 26 3HD1 ILE 26 30.751 18.213 -11.251 205 H ARG 27 H ARG 27 28.237 19.875 -15.355 206 HA ARG 27 HA ARG 27 25.276 20.083 -15.194 207 1HB ARG 27 1HB ARG 27 25.639 21.796 -16.751 208 2HB ARG 27 2HB ARG 27 26.650 20.696 -17.803 209 1HG ARG 27 1HG ARG 27 24.750 19.409 -18.306 210 2HG ARG 27 2HG ARG 27 23.695 20.393 -17.261 211 1HD ARG 27 1HD ARG 27 25.167 21.532 -19.751 212 2HD ARG 27 2HD ARG 27 23.591 20.758 -19.856 213 HE ARG 27 HE ARG 27 23.532 22.915 -17.841 214 1HH1 ARG 27 1HH1 ARG 27 23.264 22.442 -21.402 215 2HH1 ARG 27 2HH1 ARG 27 22.336 24.021 -21.517 216 1HH2 ARG 27 2HH2 ARG 27 22.486 24.650 -18.145 217 2HH2 ARG 27 1HH2 ARG 27 21.933 25.169 -19.816 218 H CYS 28 H CYS 28 25.009 18.278 -15.044 219 HA CYS 28 HA CYS 28 26.649 15.888 -16.057 220 1HB CYS 28 2HB CYS 28 24.496 15.987 -13.853 221 2HB CYS 28 1HB CYS 28 25.417 14.546 -14.362 222 H GLU 29 H GLU 29 25.878 15.263 -17.970 223 HA GLU 29 HA GLU 29 23.294 16.184 -19.073 224 1HB GLU 29 1HB GLU 29 25.536 14.443 -20.295 225 2HB GLU 29 2HB GLU 29 24.086 14.838 -21.200 226 1HG GLU 29 1HG GLU 29 24.573 17.276 -21.083 227 2HG GLU 29 2HG GLU 29 26.038 16.953 -20.147 Start of MODEL 12 1 1H SER 1 1H SER 1 25.914 9.269 -19.078 2 2H SER 1 2H SER 1 25.024 8.688 -17.813 3 3H SER 1 3H SER 1 26.653 8.420 -17.869 4 HA SER 1 HA SER 1 25.316 11.055 -17.559 5 1HB SER 1 2HB SER 1 26.900 9.349 -15.548 6 2HB SER 1 1HB SER 1 26.359 11.010 -15.251 7 HG SER 1 HG SER 1 24.222 10.306 -15.654 8 H LYS 2 H LYS 2 26.597 12.706 -18.080 9 HA LYS 2 HA LYS 2 29.620 12.492 -18.104 10 1HB LYS 2 2HB LYS 2 29.952 13.534 -20.239 11 2HB LYS 2 1HB LYS 2 29.198 11.963 -20.360 12 1HG LYS 2 2HG LYS 2 26.973 13.085 -20.916 13 2HG LYS 2 1HG LYS 2 27.772 14.635 -20.795 14 1HD LYS 2 2HD LYS 2 27.741 14.352 -23.073 15 2HD LYS 2 1HD LYS 2 29.387 13.884 -22.706 16 1HE LYS 2 2HE LYS 2 28.669 11.425 -22.879 17 2HE LYS 2 1HE LYS 2 27.026 11.958 -23.273 18 1HZ LYS 2 1HZ LYS 2 27.937 13.119 -25.224 19 2HZ LYS 2 2HZ LYS 2 29.468 12.622 -24.855 20 3HZ LYS 2 3HZ LYS 2 28.319 11.513 -25.276 21 H TYR 3 H TYR 3 30.578 14.250 -17.294 22 HA TYR 3 HA TYR 3 28.870 16.550 -16.314 23 1HB TYR 3 2HB TYR 3 30.515 17.152 -14.872 24 2HB TYR 3 1HB TYR 3 30.288 15.462 -14.648 25 HD1 TYR 3 HD1 TYR 3 32.258 14.086 -16.420 26 HD2 TYR 3 HD2 TYR 3 32.760 17.818 -14.347 27 HE1 TYR 3 HE1 TYR 3 34.688 13.877 -16.561 28 HE2 TYR 3 HE2 TYR 3 35.157 17.481 -14.373 29 HH TYR 3 HH TYR 3 36.839 16.255 -15.068 30 H GLU 4 H GLU 4 28.999 18.488 -17.216 31 HA GLU 4 HA GLU 4 31.444 19.307 -18.943 32 1HB GLU 4 1HB GLU 4 29.953 19.200 -20.601 33 2HB GLU 4 2HB GLU 4 28.529 19.437 -19.644 34 1HG GLU 4 1HG GLU 4 29.075 21.940 -19.532 35 2HG GLU 4 2HG GLU 4 30.408 21.661 -20.640 36 H TYR 5 H TYR 5 32.626 20.214 -17.391 37 HA TYR 5 HA TYR 5 31.332 22.197 -15.475 38 1HB TYR 5 1HB TYR 5 32.462 21.601 -13.650 39 2HB TYR 5 2HB TYR 5 32.230 20.023 -14.332 40 HD1 TYR 5 HD1 TYR 5 34.752 19.891 -16.205 41 HD2 TYR 5 HD2 TYR 5 34.207 21.049 -12.107 42 HE1 TYR 5 HE1 TYR 5 37.152 19.590 -15.751 43 HE2 TYR 5 HE2 TYR 5 36.577 20.803 -11.727 44 HH TYR 5 HH TYR 5 38.766 19.694 -14.287 45 H THR 6 H THR 6 31.889 24.005 -15.816 46 HA THR 6 HA THR 6 34.098 24.602 -17.816 47 HB THR 6 HB THR 6 31.765 26.499 -17.076 48 HG1 THR 6 HG1 THR 6 30.650 25.543 -18.781 49 1HG2 THR 6 1HG2 THR 6 33.606 27.340 -18.641 50 2HG2 THR 6 2HG2 THR 6 31.980 27.222 -19.427 51 3HG2 THR 6 3HG2 THR 6 33.220 25.980 -19.727 52 H ILE 7 H ILE 7 35.701 25.947 -17.339 53 HA ILE 7 HA ILE 7 35.883 27.227 -14.561 54 HB ILE 7 HB ILE 7 38.066 25.452 -15.821 55 1HG1 ILE 7 2HG1 ILE 7 37.600 23.984 -13.512 56 2HG1 ILE 7 1HG1 ILE 7 36.042 24.776 -13.589 57 1HG2 ILE 7 1HG2 ILE 7 39.284 25.688 -13.652 58 2HG2 ILE 7 2HG2 ILE 7 37.980 26.752 -13.032 59 3HG2 ILE 7 3HG2 ILE 7 38.988 27.265 -14.414 60 1HD1 ILE 7 1HD1 ILE 7 37.236 22.689 -15.426 61 2HD1 ILE 7 2HD1 ILE 7 35.714 22.727 -14.502 62 3HD1 ILE 7 3HD1 ILE 7 35.855 23.688 -15.976 63 HA DPR 8 HA PRO 8 38.285 30.366 -16.764 64 1HB DPR 8 1HB PRO 8 37.739 31.665 -14.956 65 2HB DPR 8 2HB PRO 8 36.976 32.695 -16.186 66 1HG DPR 8 1HG PRO 8 35.546 31.786 -14.019 67 2HG DPR 8 2HG PRO 8 34.781 31.875 -15.630 68 1HD DPR 8 2HD PRO 8 35.657 29.409 -14.149 69 2HD DPR 8 1HD PRO 8 34.468 29.557 -15.463 70 H SER 9 H SER 9 38.292 29.874 -18.906 71 HA SER 9 HA SER 9 36.018 30.784 -20.730 72 1HB SER 9 2HB SER 9 37.912 32.425 -20.904 73 2HB SER 9 1HB SER 9 39.028 31.100 -21.290 74 HG SER 9 HG SER 9 38.189 32.133 -23.124 75 H TYR 10 H TYR 10 37.458 28.141 -19.454 76 HA TYR 10 HA TYR 10 37.652 26.589 -22.083 77 1HB TYR 10 2HB TYR 10 39.647 26.995 -20.212 78 2HB TYR 10 1HB TYR 10 38.893 25.662 -19.415 79 HD1 TYR 10 HD1 TYR 10 38.870 23.372 -20.583 80 HD2 TYR 10 HD2 TYR 10 40.855 26.755 -22.350 81 HE1 TYR 10 HE1 TYR 10 40.138 21.884 -22.054 82 HE2 TYR 10 HE2 TYR 10 42.089 25.237 -23.813 83 HH TYR 10 HH TYR 10 41.635 21.723 -23.659 84 H THR 11 H THR 11 36.116 25.043 -22.413 85 HA THR 11 HA THR 11 34.290 24.196 -20.156 86 HB THR 11 HB THR 11 34.025 23.571 -23.149 87 HG1 THR 11 HG1 THR 11 32.981 25.788 -21.720 88 1HG2 THR 11 1HG2 THR 11 31.811 23.904 -21.005 89 2HG2 THR 11 2HG2 THR 11 31.569 23.438 -22.712 90 3HG2 THR 11 3HG2 THR 11 32.416 22.339 -21.590 91 H PHE 12 H PHE 12 34.777 22.447 -19.217 92 HA PHE 12 HA PHE 12 36.670 20.321 -20.483 93 1HB PHE 12 1HB PHE 12 36.184 20.938 -17.545 94 2HB PHE 12 2HB PHE 12 37.034 19.524 -18.100 95 HD1 PHE 12 HD1 PHE 12 39.403 19.714 -18.931 96 HD2 PHE 12 HD2 PHE 12 37.220 23.255 -17.808 97 HE1 PHE 12 HE1 PHE 12 41.476 20.965 -18.728 98 HE2 PHE 12 HE2 PHE 12 39.316 24.445 -17.569 99 HZ PHE 12 HZ PHE 12 41.447 23.329 -18.015 100 H ARG 13 H ARG 13 35.398 18.763 -21.319 101 HA ARG 13 HA ARG 13 32.794 17.948 -19.928 102 1HB ARG 13 2HB ARG 13 33.033 17.751 -22.938 103 2HB ARG 13 1HB ARG 13 31.615 17.685 -21.864 104 1HG ARG 13 2HG ARG 13 31.730 20.159 -21.588 105 2HG ARG 13 1HG ARG 13 33.150 20.217 -22.620 106 1HD ARG 13 2HD ARG 13 31.785 19.220 -24.545 107 2HD ARG 13 1HD ARG 13 30.353 19.252 -23.506 108 HE ARG 13 HE ARG 13 31.303 21.925 -23.444 109 1HH1 ARG 13 1HH1 ARG 13 30.307 19.796 -26.175 110 2HH1 ARG 13 2HH1 ARG 13 29.834 21.288 -27.133 111 1HH2 ARG 13 2HH2 ARG 13 30.727 23.481 -24.646 112 2HH2 ARG 13 1HH2 ARG 13 30.055 23.207 -26.332 113 H GLY 14 H GLY 14 32.806 15.876 -19.300 114 1HA GLY 14 1HA GLY 14 33.710 13.642 -21.019 115 2HA GLY 14 2HA GLY 14 34.884 13.922 -19.738 116 HA PRO 15 HA PRO 15 31.419 11.231 -17.862 117 1HB PRO 15 2HB PRO 15 32.595 8.878 -17.284 118 2HB PRO 15 1HB PRO 15 32.256 9.376 -18.957 119 1HG PRO 15 1HG PRO 15 34.878 9.550 -17.436 120 2HG PRO 15 2HG PRO 15 34.600 8.849 -19.068 121 1HD PRO 15 2HD PRO 15 35.482 11.511 -18.603 122 2HD PRO 15 1HD PRO 15 34.565 11.039 -20.060 123 H GLY 16 H GLY 16 30.966 10.416 -15.719 124 1HA GLY 16 1HA GLY 16 31.146 10.214 -13.341 125 2HA GLY 16 2HA GLY 16 32.791 10.832 -13.418 126 H CYS 17 H CYS 17 29.708 11.596 -12.514 127 HA CYS 17 HA CYS 17 30.083 14.617 -12.611 128 1HB CYS 17 2HB CYS 17 27.565 13.013 -11.863 129 2HB CYS 17 1HB CYS 17 27.676 14.768 -12.052 130 HA PRO 18 HA PRO 18 31.026 14.426 -8.032 131 1HB PRO 18 1HB PRO 18 33.352 15.834 -7.926 132 2HB PRO 18 2HB PRO 18 33.296 14.142 -8.466 133 1HG PRO 18 2HG PRO 18 33.473 16.657 -10.198 134 2HG PRO 18 1HG PRO 18 34.439 15.157 -10.343 135 1HD PRO 18 1HD PRO 18 32.073 15.665 -11.842 136 2HD PRO 18 2HD PRO 18 32.659 14.030 -11.436 137 H THR 19 H THR 19 31.352 16.332 -6.483 138 HA THR 19 HA THR 19 29.540 18.641 -7.126 139 HB THR 19 HB THR 19 30.454 19.304 -4.679 140 HG1 THR 19 HG1 THR 19 31.890 17.553 -4.552 141 1HG2 THR 19 1HG2 THR 19 28.606 18.211 -3.604 142 2HG2 THR 19 2HG2 THR 19 28.320 17.227 -5.100 143 3HG2 THR 19 3HG2 THR 19 28.161 19.013 -5.138 144 H VAL 20 H VAL 20 30.113 20.826 -6.830 145 HA VAL 20 HA VAL 20 32.964 21.420 -7.522 146 HB VAL 20 HB VAL 20 32.300 22.909 -9.447 147 1HG1 VAL 20 1HG1 VAL 20 33.245 20.680 -9.898 148 2HG1 VAL 20 2HG1 VAL 20 31.602 20.002 -10.013 149 3HG1 VAL 20 3HG1 VAL 20 32.159 21.215 -11.197 150 1HG2 VAL 20 1HG2 VAL 20 30.202 22.830 -10.666 151 2HG2 VAL 20 2HG2 VAL 20 29.508 21.643 -9.522 152 3HG2 VAL 20 3HG2 VAL 20 29.868 23.303 -8.986 153 H LYS 21 H LYS 21 33.686 23.492 -7.601 154 HA LYS 21 HA LYS 21 33.257 24.764 -5.086 155 1HB LYS 21 1HB LYS 21 35.287 24.765 -7.293 156 2HB LYS 21 2HB LYS 21 34.913 26.406 -7.000 157 1HG LYS 21 2HG LYS 21 36.761 26.025 -5.720 158 2HG LYS 21 1HG LYS 21 35.458 26.088 -4.528 159 1HD LYS 21 1HD LYS 21 35.457 23.572 -4.436 160 2HD LYS 21 2HD LYS 21 36.749 23.537 -5.633 161 1HE LYS 21 1HE LYS 21 37.903 23.177 -3.607 162 2HE LYS 21 2HE LYS 21 38.232 24.875 -3.925 163 1HZ LYS 21 1HZ LYS 21 36.158 23.820 -2.044 164 2HZ LYS 21 2HZ LYS 21 36.438 25.424 -2.322 165 3HZ LYS 21 3HZ LYS 21 37.605 24.492 -1.616 166 HA PRO 22 HA PRO 22 30.653 28.478 -5.964 167 1HB PRO 22 2HB PRO 22 32.517 30.259 -4.362 168 2HB PRO 22 1HB PRO 22 30.776 29.963 -4.163 169 1HG PRO 22 2HG PRO 22 32.567 28.855 -2.437 170 2HG PRO 22 1HG PRO 22 31.178 27.889 -3.012 171 1HD PRO 22 1HD PRO 22 34.055 27.824 -4.141 172 2HD PRO 22 2HD PRO 22 33.038 26.454 -3.630 173 H DAL 23 H ALA 23 30.934 28.848 -8.106 174 HA DAL 23 HA ALA 23 33.555 29.809 -9.279 175 1HB DAL 23 1HB ALA 23 32.299 31.935 -8.951 176 2HB DAL 23 2HB ALA 23 30.934 31.296 -9.906 177 3HB DAL 23 3HB ALA 23 32.515 31.572 -10.684 178 H VAL 24 H VAL 24 33.240 27.348 -9.477 179 HA VAL 24 HA VAL 24 32.671 26.740 -12.318 180 HB VAL 24 HB VAL 24 33.505 24.829 -10.096 181 1HG1 VAL 24 1HG1 VAL 24 34.317 23.227 -11.903 182 2HG1 VAL 24 2HG1 VAL 24 32.605 23.590 -12.140 183 3HG1 VAL 24 3HG1 VAL 24 33.815 24.370 -13.174 184 1HG2 VAL 24 1HG2 VAL 24 35.906 24.923 -10.904 185 2HG2 VAL 24 2HG2 VAL 24 35.308 26.478 -10.305 186 3HG2 VAL 24 3HG2 VAL 24 35.434 26.216 -12.052 187 H THR 25 H THR 25 30.825 25.743 -13.059 188 HA THR 25 HA THR 25 28.829 24.528 -11.194 189 HB THR 25 HB THR 25 28.026 26.525 -11.015 190 HG1 THR 25 HG1 THR 25 26.441 25.119 -12.869 191 1HG2 THR 25 1HG2 THR 25 26.884 28.004 -12.733 192 2HG2 THR 25 2HG2 THR 25 28.639 27.919 -13.044 193 3HG2 THR 25 3HG2 THR 25 27.509 26.963 -14.040 194 H ILE 26 H ILE 26 28.983 22.872 -11.896 195 HA ILE 26 HA ILE 26 29.436 21.755 -14.432 196 HB ILE 26 HB ILE 26 29.831 20.978 -11.990 197 1HG1 ILE 26 2HG1 ILE 26 28.947 18.476 -13.574 198 2HG1 ILE 26 1HG1 ILE 26 30.155 19.488 -14.260 199 1HG2 ILE 26 1HG2 ILE 26 27.102 19.489 -12.194 200 2HG2 ILE 26 2HG2 ILE 26 27.420 20.886 -11.122 201 3HG2 ILE 26 3HG2 ILE 26 28.282 19.331 -10.870 202 1HD1 ILE 26 1HD1 ILE 26 31.642 19.290 -12.334 203 2HD1 ILE 26 2HD1 ILE 26 31.150 17.635 -12.831 204 3HD1 ILE 26 3HD1 ILE 26 30.421 18.417 -11.396 205 H ARG 27 H ARG 27 28.166 20.024 -15.533 206 HA ARG 27 HA ARG 27 25.189 20.211 -15.489 207 1HB ARG 27 1HB ARG 27 25.621 21.818 -17.144 208 2HB ARG 27 2HB ARG 27 26.626 20.625 -18.100 209 1HG ARG 27 2HG ARG 27 24.703 19.332 -18.556 210 2HG ARG 27 1HG ARG 27 23.664 20.396 -17.563 211 1HD ARG 27 1HD ARG 27 24.116 22.298 -19.203 212 2HD ARG 27 2HD ARG 27 25.097 21.196 -20.188 213 HE ARG 27 HE ARG 27 22.608 19.850 -19.929 214 1HH1 ARG 27 1HH1 ARG 27 23.455 23.086 -21.267 215 2HH1 ARG 27 2HH1 ARG 27 21.993 22.985 -22.371 216 1HH2 ARG 27 1HH2 ARG 27 21.022 19.898 -21.224 217 2HH2 ARG 27 2HH2 ARG 27 20.728 21.321 -22.345 218 H CYS 28 H CYS 28 24.977 18.448 -15.191 219 HA CYS 28 HA CYS 28 26.619 15.980 -16.101 220 1HB CYS 28 1HB CYS 28 26.332 16.094 -13.607 221 2HB CYS 28 2HB CYS 28 24.578 15.862 -13.810 222 H GLU 29 H GLU 29 25.765 15.259 -17.897 223 HA GLU 29 HA GLU 29 23.086 16.098 -18.889 224 1HB GLU 29 1HB GLU 29 25.310 14.451 -20.219 225 2HB GLU 29 2HB GLU 29 23.805 14.761 -21.045 226 1HG GLU 29 2HG GLU 29 25.635 17.035 -20.096 227 2HG GLU 29 1HG GLU 29 25.775 16.251 -21.666 Start of MODEL 13 1 1H SER 1 1H SER 1 25.792 9.815 -19.197 2 2H SER 1 2H SER 1 24.850 9.187 -17.994 3 3H SER 1 3H SER 1 26.446 8.774 -18.094 4 HA SER 1 HA SER 1 25.361 11.469 -17.491 5 1HB SER 1 1HB SER 1 26.267 11.116 -15.208 6 2HB SER 1 2HB SER 1 25.039 9.911 -15.625 7 HG SER 1 HG SER 1 26.750 8.484 -16.168 8 H LYS 2 H LYS 2 26.764 13.032 -17.961 9 HA LYS 2 HA LYS 2 29.762 12.608 -17.934 10 1HB LYS 2 1HB LYS 2 30.217 13.701 -20.035 11 2HB LYS 2 2HB LYS 2 29.419 12.157 -20.211 12 1HG LYS 2 2HG LYS 2 27.250 13.371 -20.828 13 2HG LYS 2 1HG LYS 2 28.103 14.885 -20.649 14 1HD LYS 2 2HD LYS 2 28.148 14.648 -22.930 15 2HD LYS 2 1HD LYS 2 29.760 14.107 -22.513 16 1HE LYS 2 1HE LYS 2 28.952 11.683 -22.761 17 2HE LYS 2 2HE LYS 2 27.347 12.289 -23.204 18 1HZ LYS 2 1HZ LYS 2 29.871 12.883 -24.682 19 2HZ LYS 2 2HZ LYS 2 28.694 11.829 -25.167 20 3HZ LYS 2 3HZ LYS 2 28.375 13.449 -25.096 21 H TYR 3 H TYR 3 30.745 14.256 -16.988 22 HA TYR 3 HA TYR 3 29.148 16.581 -15.944 23 1HB TYR 3 2HB TYR 3 30.793 17.032 -14.436 24 2HB TYR 3 1HB TYR 3 30.584 15.331 -14.394 25 HD1 TYR 3 HD1 TYR 3 32.475 14.004 -16.097 26 HD2 TYR 3 HD2 TYR 3 33.068 17.829 -14.231 27 HE1 TYR 3 HE1 TYR 3 34.897 13.761 -16.296 28 HE2 TYR 3 HE2 TYR 3 35.463 17.501 -14.370 29 HH TYR 3 HH TYR 3 36.870 14.622 -15.872 30 H GLU 4 H GLU 4 29.059 18.416 -17.147 31 HA GLU 4 HA GLU 4 31.570 19.305 -18.751 32 1HB GLU 4 2HB GLU 4 30.103 19.164 -20.414 33 2HB GLU 4 1HB GLU 4 28.669 19.461 -19.497 34 1HG GLU 4 1HG GLU 4 29.227 21.930 -19.398 35 2HG GLU 4 2HG GLU 4 30.660 21.623 -20.374 36 H TYR 5 H TYR 5 32.736 20.196 -17.192 37 HA TYR 5 HA TYR 5 31.447 22.175 -15.263 38 1HB TYR 5 1HB TYR 5 32.593 21.549 -13.466 39 2HB TYR 5 2HB TYR 5 32.501 19.986 -14.200 40 HD1 TYR 5 HD1 TYR 5 34.483 21.371 -12.036 41 HD2 TYR 5 HD2 TYR 5 34.908 19.843 -16.025 42 HE1 TYR 5 HE1 TYR 5 36.875 21.239 -11.733 43 HE2 TYR 5 HE2 TYR 5 37.329 19.690 -15.660 44 HH TYR 5 HH TYR 5 38.812 20.646 -12.602 45 H THR 6 H THR 6 31.853 23.994 -15.770 46 HA THR 6 HA THR 6 34.011 24.612 -17.812 47 HB THR 6 HB THR 6 31.562 26.385 -17.135 48 HG1 THR 6 HG1 THR 6 31.687 24.219 -18.957 49 1HG2 THR 6 1HG2 THR 6 31.705 26.997 -19.523 50 2HG2 THR 6 2HG2 THR 6 33.033 25.836 -19.770 51 3HG2 THR 6 3HG2 THR 6 33.322 27.275 -18.757 52 H ILE 7 H ILE 7 35.591 25.981 -17.335 53 HA ILE 7 HA ILE 7 35.647 27.392 -14.614 54 HB ILE 7 HB ILE 7 37.943 25.694 -15.780 55 1HG1 ILE 7 1HG1 ILE 7 37.576 24.263 -13.482 56 2HG1 ILE 7 2HG1 ILE 7 35.999 25.017 -13.487 57 1HG2 ILE 7 1HG2 ILE 7 39.112 26.097 -13.599 58 2HG2 ILE 7 2HG2 ILE 7 37.731 27.103 -13.049 59 3HG2 ILE 7 3HG2 ILE 7 38.735 27.621 -14.431 60 1HD1 ILE 7 1HD1 ILE 7 35.974 23.814 -15.992 61 2HD1 ILE 7 2HD1 ILE 7 37.111 22.751 -15.110 62 3HD1 ILE 7 3HD1 ILE 7 35.466 23.086 -14.492 63 HA DPR 8 HA PRO 8 37.866 30.585 -16.933 64 1HB DPR 8 1HB PRO 8 37.229 31.907 -15.167 65 2HB DPR 8 2HB PRO 8 36.418 32.847 -16.439 66 1HG DPR 8 2HG PRO 8 35.023 31.929 -14.251 67 2HG DPR 8 1HG PRO 8 34.270 31.921 -15.871 68 1HD DPR 8 2HD PRO 8 35.266 29.560 -14.300 69 2HD DPR 8 1HD PRO 8 34.092 29.593 -15.635 70 H SER 9 H SER 9 37.874 29.923 -19.039 71 HA SER 9 HA SER 9 35.579 30.657 -20.909 72 1HB SER 9 1HB SER 9 38.575 31.108 -21.466 73 2HB SER 9 2HB SER 9 37.277 31.247 -22.659 74 HG SER 9 HG SER 9 37.810 33.232 -21.719 75 H TYR 10 H TYR 10 37.272 28.168 -19.536 76 HA TYR 10 HA TYR 10 37.570 26.552 -22.109 77 1HB TYR 10 2HB TYR 10 39.484 27.088 -20.199 78 2HB TYR 10 1HB TYR 10 38.766 25.743 -19.384 79 HD1 TYR 10 HD1 TYR 10 38.876 23.426 -20.490 80 HD2 TYR 10 HD2 TYR 10 40.766 26.846 -22.285 81 HE1 TYR 10 HE1 TYR 10 40.251 21.957 -21.883 82 HE2 TYR 10 HE2 TYR 10 42.109 25.347 -23.672 83 HH TYR 10 HH TYR 10 42.592 23.267 -24.203 84 H THR 11 H THR 11 36.104 24.951 -22.456 85 HA THR 11 HA THR 11 34.195 24.118 -20.265 86 HB THR 11 HB THR 11 34.088 23.418 -23.250 87 HG1 THR 11 HG1 THR 11 32.733 25.219 -23.462 88 1HG2 THR 11 1HG2 THR 11 32.395 22.246 -21.678 89 2HG2 THR 11 2HG2 THR 11 31.729 23.844 -21.294 90 3HG2 THR 11 3HG2 THR 11 31.636 23.224 -22.965 91 H PHE 12 H PHE 12 34.744 22.412 -19.218 92 HA PHE 12 HA PHE 12 36.700 20.294 -20.396 93 1HB PHE 12 2HB PHE 12 36.157 20.960 -17.485 94 2HB PHE 12 1HB PHE 12 37.064 19.567 -17.997 95 HD1 PHE 12 HD1 PHE 12 39.457 19.821 -18.705 96 HD2 PHE 12 HD2 PHE 12 37.106 23.319 -17.814 97 HE1 PHE 12 HE1 PHE 12 41.475 21.149 -18.438 98 HE2 PHE 12 HE2 PHE 12 39.147 24.584 -17.495 99 HZ PHE 12 HZ PHE 12 41.334 23.528 -17.799 100 H ARG 13 H ARG 13 35.482 18.662 -21.162 101 HA ARG 13 HA ARG 13 32.858 17.865 -19.787 102 1HB ARG 13 2HB ARG 13 33.140 17.616 -22.794 103 2HB ARG 13 1HB ARG 13 31.703 17.589 -21.754 104 1HG ARG 13 2HG ARG 13 31.819 20.049 -21.496 105 2HG ARG 13 1HG ARG 13 33.285 20.078 -22.435 106 1HD ARG 13 2HD ARG 13 31.570 20.780 -23.926 107 2HD ARG 13 1HD ARG 13 32.043 19.170 -24.455 108 HE ARG 13 HE ARG 13 29.709 18.944 -22.696 109 1HH1 ARG 13 2HH1 ARG 13 30.420 20.040 -26.053 110 2HH1 ARG 13 1HH1 ARG 13 28.684 19.670 -26.516 111 1HH2 ARG 13 1HH2 ARG 13 27.810 18.586 -23.378 112 2HH2 ARG 13 2HH2 ARG 13 27.326 18.912 -25.117 113 H GLY 14 H GLY 14 32.936 15.819 -19.087 114 1HA GLY 14 1HA GLY 14 33.941 13.550 -20.734 115 2HA GLY 14 2HA GLY 14 35.036 13.897 -19.400 116 HA PRO 15 HA PRO 15 31.470 11.184 -17.709 117 1HB PRO 15 1HB PRO 15 32.595 8.800 -17.100 118 2HB PRO 15 2HB PRO 15 32.263 9.293 -18.775 119 1HG PRO 15 1HG PRO 15 34.893 9.432 -17.258 120 2HG PRO 15 2HG PRO 15 34.601 8.722 -18.883 121 1HD PRO 15 1HD PRO 15 35.541 11.357 -18.473 122 2HD PRO 15 2HD PRO 15 34.561 10.905 -19.894 123 H GLY 16 H GLY 16 30.985 10.325 -15.573 124 1HA GLY 16 1HA GLY 16 31.151 10.125 -13.190 125 2HA GLY 16 2HA GLY 16 32.761 10.831 -13.236 126 H CYS 17 H CYS 17 29.623 11.437 -12.402 127 HA CYS 17 HA CYS 17 29.883 14.482 -12.475 128 1HB CYS 17 2HB CYS 17 27.393 12.757 -11.896 129 2HB CYS 17 1HB CYS 17 27.434 14.517 -12.067 130 HA PRO 18 HA PRO 18 30.531 14.259 -7.861 131 1HB PRO 18 2HB PRO 18 32.907 15.547 -7.594 132 2HB PRO 18 1HB PRO 18 32.807 13.863 -8.150 133 1HG PRO 18 1HG PRO 18 33.243 16.371 -9.844 134 2HG PRO 18 2HG PRO 18 34.126 14.817 -9.936 135 1HD PRO 18 2HD PRO 18 31.878 15.491 -11.573 136 2HD PRO 18 1HD PRO 18 32.383 13.824 -11.193 137 H THR 19 H THR 19 30.829 16.152 -6.295 138 HA THR 19 HA THR 19 29.257 18.607 -7.090 139 HB THR 19 HB THR 19 29.915 19.228 -4.597 140 HG1 THR 19 HG1 THR 19 30.214 16.424 -4.518 141 1HG2 THR 19 1HG2 THR 19 27.866 17.090 -5.086 142 2HG2 THR 19 2HG2 THR 19 27.666 18.873 -5.200 143 3HG2 THR 19 3HG2 THR 19 28.036 18.131 -3.612 144 H VAL 20 H VAL 20 30.112 20.670 -7.084 145 HA VAL 20 HA VAL 20 33.077 20.901 -6.872 146 HB VAL 20 HB VAL 20 33.369 22.079 -9.056 147 1HG1 VAL 20 1HG1 VAL 20 33.439 20.113 -10.578 148 2HG1 VAL 20 2HG1 VAL 20 33.941 19.673 -8.933 149 3HG1 VAL 20 3HG1 VAL 20 32.313 19.243 -9.514 150 1HG2 VAL 20 1HG2 VAL 20 30.541 21.253 -9.907 151 2HG2 VAL 20 2HG2 VAL 20 31.758 22.052 -10.949 152 3HG2 VAL 20 3HG2 VAL 20 31.074 22.906 -9.550 153 H LYS 21 H LYS 21 34.029 22.916 -6.776 154 HA LYS 21 HA LYS 21 33.631 24.890 -5.103 155 1HB LYS 21 1HB LYS 21 34.210 25.684 -8.018 156 2HB LYS 21 2HB LYS 21 34.714 26.561 -6.591 157 1HG LYS 21 2HG LYS 21 35.867 23.903 -7.571 158 2HG LYS 21 1HG LYS 21 36.544 25.505 -7.827 159 1HD LYS 21 2HD LYS 21 36.846 25.767 -5.349 160 2HD LYS 21 1HD LYS 21 36.195 24.148 -5.099 161 1HE LYS 21 2HE LYS 21 38.752 24.674 -6.779 162 2HE LYS 21 1HE LYS 21 38.781 24.465 -5.034 163 1HZ LYS 21 1HZ LYS 21 39.223 22.383 -6.149 164 2HZ LYS 21 2HZ LYS 21 37.817 22.252 -5.292 165 3HZ LYS 21 3HZ LYS 21 37.770 22.415 -6.936 166 HA PRO 22 HA PRO 22 29.913 27.515 -6.268 167 1HB PRO 22 1HB PRO 22 30.195 29.744 -4.662 168 2HB PRO 22 2HB PRO 22 29.657 28.154 -4.086 169 1HG PRO 22 1HG PRO 22 32.435 29.370 -3.843 170 2HG PRO 22 2HG PRO 22 31.494 28.510 -2.591 171 1HD PRO 22 2HD PRO 22 33.473 27.289 -4.161 172 2HD PRO 22 1HD PRO 22 32.086 26.387 -3.496 173 H DAL 23 H ALA 23 30.020 28.378 -8.273 174 HA DAL 23 HA ALA 23 32.503 29.875 -9.218 175 1HB DAL 23 1HB ALA 23 31.159 31.530 -10.495 176 2HB DAL 23 2HB ALA 23 29.649 30.851 -9.830 177 3HB DAL 23 3HB ALA 23 30.821 31.651 -8.748 178 H VAL 24 H VAL 24 32.522 27.344 -9.557 179 HA VAL 24 HA VAL 24 32.270 26.842 -12.486 180 HB VAL 24 HB VAL 24 33.169 24.950 -10.266 181 1HG1 VAL 24 1HG1 VAL 24 34.257 23.500 -12.049 182 2HG1 VAL 24 2HG1 VAL 24 33.671 24.597 -13.322 183 3HG1 VAL 24 3HG1 VAL 24 32.523 23.659 -12.347 184 1HG2 VAL 24 1HG2 VAL 24 34.784 26.826 -10.382 185 2HG2 VAL 24 2HG2 VAL 24 35.084 26.527 -12.107 186 3HG2 VAL 24 3HG2 VAL 24 35.570 25.320 -10.875 187 H THR 25 H THR 25 30.304 26.039 -13.323 188 HA THR 25 HA THR 25 28.274 24.790 -11.467 189 HB THR 25 HB THR 25 26.604 25.726 -12.981 190 HG1 THR 25 HG1 THR 25 27.135 27.585 -14.168 191 1HG2 THR 25 1HG2 THR 25 26.368 28.017 -12.014 192 2HG2 THR 25 2HG2 THR 25 28.054 27.948 -11.431 193 3HG2 THR 25 3HG2 THR 25 26.832 26.833 -10.762 194 H ILE 26 H ILE 26 28.807 22.920 -12.032 195 HA ILE 26 HA ILE 26 29.442 21.704 -14.478 196 HB ILE 26 HB ILE 26 29.756 21.117 -11.982 197 1HG1 ILE 26 2HG1 ILE 26 29.251 18.461 -13.445 198 2HG1 ILE 26 1HG1 ILE 26 30.386 19.571 -14.120 199 1HG2 ILE 26 1HG2 ILE 26 27.355 20.863 -11.222 200 2HG2 ILE 26 2HG2 ILE 26 27.227 19.354 -12.191 201 3HG2 ILE 26 3HG2 ILE 26 28.360 19.438 -10.817 202 1HD1 ILE 26 1HD1 ILE 26 31.701 19.689 -12.018 203 2HD1 ILE 26 2HD1 ILE 26 31.566 17.990 -12.585 204 3HD1 ILE 26 3HD1 ILE 26 30.560 18.588 -11.220 205 H ARG 27 H ARG 27 28.250 19.725 -15.465 206 HA ARG 27 HA ARG 27 25.304 19.962 -15.648 207 1HB ARG 27 1HB ARG 27 26.982 20.208 -18.194 208 2HB ARG 27 2HB ARG 27 25.276 19.641 -18.163 209 1HG ARG 27 1HG ARG 27 24.500 21.660 -17.303 210 2HG ARG 27 2HG ARG 27 26.179 22.334 -17.234 211 1HD ARG 27 2HD ARG 27 26.313 22.244 -19.738 212 2HD ARG 27 1HD ARG 27 24.673 21.567 -19.824 213 HE ARG 27 HE ARG 27 24.693 24.112 -18.317 214 1HH1 ARG 27 2HH1 ARG 27 24.640 22.941 -21.724 215 2HH1 ARG 27 1HH1 ARG 27 23.895 24.538 -22.236 216 1HH2 ARG 27 1HH2 ARG 27 23.861 25.832 -19.056 217 2HH2 ARG 27 2HH2 ARG 27 23.491 26.042 -20.841 218 H CYS 28 H CYS 28 24.978 18.170 -15.269 219 HA CYS 28 HA CYS 28 26.636 15.714 -16.107 220 1HB CYS 28 1HB CYS 28 26.143 15.795 -13.623 221 2HB CYS 28 2HB CYS 28 24.415 15.541 -13.998 222 H GLU 29 H GLU 29 25.918 15.535 -18.078 223 HA GLU 29 HA GLU 29 23.326 16.494 -19.084 224 1HB GLU 29 2HB GLU 29 25.589 15.030 -20.550 225 2HB GLU 29 1HB GLU 29 24.156 15.555 -21.399 226 1HG GLU 29 2HG GLU 29 26.003 17.521 -19.937 227 2HG GLU 29 1HG GLU 29 26.198 17.044 -21.621 Start of MODEL 14 1 1H SER 1 1H SER 1 24.732 9.094 -17.672 2 2H SER 1 2H SER 1 26.316 8.674 -17.883 3 3H SER 1 3H SER 1 25.584 9.698 -18.953 4 HA SER 1 HA SER 1 25.289 11.389 -17.247 5 1HB SER 1 1HB SER 1 26.820 9.354 -15.521 6 2HB SER 1 2HB SER 1 26.491 11.029 -15.045 7 HG SER 1 HG SER 1 24.926 9.578 -14.284 8 H LYS 2 H LYS 2 26.676 12.931 -17.825 9 HA LYS 2 HA LYS 2 29.664 12.462 -18.035 10 1HB LYS 2 2HB LYS 2 29.954 13.573 -20.154 11 2HB LYS 2 1HB LYS 2 29.148 12.022 -20.258 12 1HG LYS 2 2HG LYS 2 26.948 13.202 -20.708 13 2HG LYS 2 1HG LYS 2 27.771 14.759 -20.606 14 1HD LYS 2 2HD LYS 2 29.238 14.113 -22.581 15 2HD LYS 2 1HD LYS 2 28.414 12.555 -22.682 16 1HE LYS 2 1HE LYS 2 26.226 13.740 -23.173 17 2HE LYS 2 2HE LYS 2 27.054 15.305 -23.071 18 1HZ LYS 2 1HZ LYS 2 27.726 13.135 -25.003 19 2HZ LYS 2 2HZ LYS 2 26.909 14.527 -25.357 20 3HZ LYS 2 3HZ LYS 2 28.497 14.592 -24.907 21 H TYR 3 H TYR 3 30.731 14.088 -17.128 22 HA TYR 3 HA TYR 3 29.217 16.413 -15.965 23 1HB TYR 3 2HB TYR 3 30.932 16.870 -14.569 24 2HB TYR 3 1HB TYR 3 30.709 15.168 -14.503 25 HD1 TYR 3 HD1 TYR 3 32.542 13.972 -16.498 26 HD2 TYR 3 HD2 TYR 3 33.223 17.514 -14.164 27 HE1 TYR 3 HE1 TYR 3 34.940 13.724 -16.787 28 HE2 TYR 3 HE2 TYR 3 35.599 17.161 -14.376 29 HH TYR 3 HH TYR 3 36.946 14.495 -16.278 30 H GLU 4 H GLU 4 29.092 18.268 -17.110 31 HA GLU 4 HA GLU 4 31.525 19.176 -18.810 32 1HB GLU 4 2HB GLU 4 30.012 19.036 -20.422 33 2HB GLU 4 1HB GLU 4 28.606 19.306 -19.450 34 1HG GLU 4 1HG GLU 4 29.174 21.786 -19.350 35 2HG GLU 4 2HG GLU 4 30.533 21.478 -20.425 36 H TYR 5 H TYR 5 32.754 20.052 -17.261 37 HA TYR 5 HA TYR 5 31.486 21.912 -15.194 38 1HB TYR 5 2HB TYR 5 32.605 21.101 -13.454 39 2HB TYR 5 1HB TYR 5 32.485 19.615 -14.323 40 HD1 TYR 5 HD1 TYR 5 34.493 20.775 -12.042 41 HD2 TYR 5 HD2 TYR 5 34.883 19.556 -16.138 42 HE1 TYR 5 HE1 TYR 5 36.870 20.450 -11.729 43 HE2 TYR 5 HE2 TYR 5 37.287 19.268 -15.794 44 HH TYR 5 HH TYR 5 38.787 19.855 -12.639 45 H THR 6 H THR 6 31.831 23.720 -15.754 46 HA THR 6 HA THR 6 33.908 24.367 -17.848 47 HB THR 6 HB THR 6 31.616 26.272 -16.989 48 HG1 THR 6 HG1 THR 6 30.324 25.218 -18.490 49 1HG2 THR 6 1HG2 THR 6 32.744 25.543 -19.741 50 2HG2 THR 6 2HG2 THR 6 31.575 26.836 -19.382 51 3HG2 THR 6 3HG2 THR 6 33.289 26.969 -18.816 52 H ILE 7 H ILE 7 35.603 25.648 -17.413 53 HA ILE 7 HA ILE 7 35.860 26.777 -14.599 54 HB ILE 7 HB ILE 7 38.298 25.738 -16.007 55 1HG1 ILE 7 1HG1 ILE 7 37.031 23.860 -16.134 56 2HG1 ILE 7 2HG1 ILE 7 38.320 23.568 -14.966 57 1HG2 ILE 7 1HG2 ILE 7 37.730 26.008 -13.012 58 2HG2 ILE 7 2HG2 ILE 7 39.297 25.571 -13.752 59 3HG2 ILE 7 3HG2 ILE 7 38.619 27.200 -14.002 60 1HD1 ILE 7 1HD1 ILE 7 35.281 23.735 -14.454 61 2HD1 ILE 7 2HD1 ILE 7 36.506 23.403 -13.177 62 3HD1 ILE 7 3HD1 ILE 7 36.287 22.279 -14.544 63 HA DPR 8 HA PRO 8 37.571 30.474 -16.607 64 1HB DPR 8 2HB PRO 8 36.562 31.678 -14.947 65 2HB DPR 8 1HB PRO 8 35.649 32.422 -16.276 66 1HG DPR 8 1HG PRO 8 34.330 31.255 -14.179 67 2HG DPR 8 2HG PRO 8 33.728 31.021 -15.845 68 1HD DPR 8 2HD PRO 8 35.233 29.024 -14.124 69 2HD DPR 8 1HD PRO 8 34.041 28.719 -15.406 70 H SER 9 H SER 9 37.948 30.151 -18.689 71 HA SER 9 HA SER 9 35.876 30.765 -20.849 72 1HB SER 9 1HB SER 9 38.934 30.524 -21.015 73 2HB SER 9 2HB SER 9 37.862 30.846 -22.386 74 HG SER 9 HG SER 9 38.705 32.733 -21.486 75 H TYR 10 H TYR 10 37.388 28.076 -19.273 76 HA TYR 10 HA TYR 10 37.579 26.363 -21.752 77 1HB TYR 10 1HB TYR 10 38.832 26.402 -18.991 78 2HB TYR 10 2HB TYR 10 38.158 24.862 -19.263 79 HD1 TYR 10 HD1 TYR 10 40.735 27.260 -20.458 80 HD2 TYR 10 HD2 TYR 10 39.040 23.344 -21.042 81 HE1 TYR 10 HE1 TYR 10 42.679 26.576 -21.759 82 HE2 TYR 10 HE2 TYR 10 40.995 22.702 -22.332 83 HH TYR 10 HH TYR 10 42.956 23.325 -23.144 84 H THR 11 H THR 11 36.086 24.741 -22.289 85 HA THR 11 HA THR 11 34.056 23.903 -20.187 86 HB THR 11 HB THR 11 33.976 23.346 -23.205 87 HG1 THR 11 HG1 THR 11 32.615 25.154 -23.375 88 1HG2 THR 11 1HG2 THR 11 31.507 23.181 -22.921 89 2HG2 THR 11 2HG2 THR 11 32.285 22.111 -21.724 90 3HG2 THR 11 3HG2 THR 11 31.629 23.679 -21.212 91 H PHE 12 H PHE 12 34.767 22.255 -19.223 92 HA PHE 12 HA PHE 12 36.626 20.134 -20.533 93 1HB PHE 12 2HB PHE 12 36.073 20.694 -17.591 94 2HB PHE 12 1HB PHE 12 36.827 19.221 -18.118 95 HD1 PHE 12 HD1 PHE 12 37.270 23.000 -18.211 96 HD2 PHE 12 HD2 PHE 12 39.244 19.169 -18.199 97 HE1 PHE 12 HE1 PHE 12 39.342 24.040 -17.526 98 HE2 PHE 12 HE2 PHE 12 41.296 20.261 -17.518 99 HZ PHE 12 HZ PHE 12 41.321 22.695 -17.075 100 H ARG 13 H ARG 13 35.307 18.572 -21.402 101 HA ARG 13 HA ARG 13 32.735 17.738 -19.957 102 1HB ARG 13 2HB ARG 13 32.900 17.506 -22.970 103 2HB ARG 13 1HB ARG 13 31.508 17.479 -21.858 104 1HG ARG 13 1HG ARG 13 31.630 19.957 -21.673 105 2HG ARG 13 2HG ARG 13 33.044 19.969 -22.719 106 1HD ARG 13 1HD ARG 13 31.605 18.879 -24.584 107 2HD ARG 13 2HD ARG 13 30.201 19.059 -23.524 108 HE ARG 13 HE ARG 13 31.332 21.671 -23.680 109 1HH1 ARG 13 1HH2 ARG 13 30.051 19.420 -26.185 110 2HH1 ARG 13 2HH2 ARG 13 29.629 20.866 -27.233 111 1HH2 ARG 13 1HH1 ARG 13 30.799 23.169 -24.971 112 2HH2 ARG 13 2HH1 ARG 13 30.021 22.819 -26.595 113 H GLY 14 H GLY 14 32.781 15.671 -19.350 114 1HA GLY 14 1HA GLY 14 33.677 13.455 -21.094 115 2HA GLY 14 2HA GLY 14 34.865 13.732 -19.823 116 HA PRO 15 HA PRO 15 31.401 11.041 -17.923 117 1HB PRO 15 1HB PRO 15 32.589 8.679 -17.344 118 2HB PRO 15 2HB PRO 15 32.170 9.145 -19.008 119 1HG PRO 15 2HG PRO 15 34.868 9.334 -17.624 120 2HG PRO 15 1HG PRO 15 34.507 8.602 -19.225 121 1HD PRO 15 1HD PRO 15 35.430 11.256 -18.879 122 2HD PRO 15 2HD PRO 15 34.403 10.773 -20.256 123 H GLY 16 H GLY 16 31.055 10.199 -15.747 124 1HA GLY 16 1HA GLY 16 31.376 10.020 -13.377 125 2HA GLY 16 2HA GLY 16 32.963 10.761 -13.529 126 H CYS 17 H CYS 17 29.864 11.299 -12.511 127 HA CYS 17 HA CYS 17 30.049 14.343 -12.603 128 1HB CYS 17 1HB CYS 17 27.625 12.600 -11.853 129 2HB CYS 17 2HB CYS 17 27.648 14.361 -12.022 130 HA PRO 18 HA PRO 18 31.106 14.094 -8.061 131 1HB PRO 18 2HB PRO 18 33.370 15.602 -7.975 132 2HB PRO 18 1HB PRO 18 33.372 13.918 -8.541 133 1HG PRO 18 1HG PRO 18 33.417 16.462 -10.236 134 2HG PRO 18 2HG PRO 18 34.431 15.000 -10.426 135 1HD PRO 18 1HD PRO 18 32.014 15.456 -11.860 136 2HD PRO 18 2HD PRO 18 32.669 13.836 -11.517 137 H THR 19 H THR 19 31.365 15.965 -6.473 138 HA THR 19 HA THR 19 29.466 18.236 -7.042 139 HB THR 19 HB THR 19 30.287 18.833 -4.570 140 HG1 THR 19 HG1 THR 19 30.778 16.057 -4.662 141 1HG2 THR 19 1HG2 THR 19 28.347 16.588 -5.057 142 2HG2 THR 19 2HG2 THR 19 28.543 17.549 -3.532 143 3HG2 THR 19 3HG2 THR 19 28.028 18.354 -5.045 144 H VAL 20 H VAL 20 29.997 20.422 -6.713 145 HA VAL 20 HA VAL 20 32.882 21.110 -7.033 146 HB VAL 20 HB VAL 20 32.508 22.638 -8.988 147 1HG1 VAL 20 1HG1 VAL 20 31.913 19.732 -9.720 148 2HG1 VAL 20 2HG1 VAL 20 33.518 20.415 -9.368 149 3HG1 VAL 20 3HG1 VAL 20 32.621 20.958 -10.800 150 1HG2 VAL 20 1HG2 VAL 20 30.591 22.568 -10.526 151 2HG2 VAL 20 2HG2 VAL 20 30.041 23.026 -8.899 152 3HG2 VAL 20 3HG2 VAL 20 29.761 21.372 -9.493 153 H LYS 21 H LYS 21 33.457 23.416 -6.997 154 HA LYS 21 HA LYS 21 32.253 24.655 -4.568 155 1HB LYS 21 1HB LYS 21 34.276 26.064 -4.634 156 2HB LYS 21 2HB LYS 21 34.632 24.356 -4.633 157 1HG LYS 21 2HG LYS 21 36.303 25.504 -5.812 158 2HG LYS 21 1HG LYS 21 35.457 24.469 -6.953 159 1HD LYS 21 1HD LYS 21 34.254 26.336 -7.930 160 2HD LYS 21 2HD LYS 21 34.857 27.470 -6.719 161 1HE LYS 21 1HE LYS 21 37.250 27.069 -7.608 162 2HE LYS 21 2HE LYS 21 36.560 26.037 -8.875 163 1HZ LYS 21 1HZ LYS 21 36.865 28.322 -9.637 164 2HZ LYS 21 2HZ LYS 21 35.252 27.965 -9.628 165 3HZ LYS 21 3HZ LYS 21 35.894 28.916 -8.439 166 HA PRO 22 HA PRO 22 30.069 27.954 -6.894 167 1HB PRO 22 2HB PRO 22 30.441 30.386 -5.587 168 2HB PRO 22 1HB PRO 22 29.436 29.045 -5.011 169 1HG PRO 22 1HG PRO 22 32.278 29.721 -4.159 170 2HG PRO 22 2HG PRO 22 30.883 29.319 -3.118 171 1HD PRO 22 1HD PRO 22 32.797 27.461 -3.843 172 2HD PRO 22 2HD PRO 22 31.099 26.977 -3.602 173 H DAL 23 H ALA 23 30.501 28.872 -8.811 174 HA DAL 23 HA ALA 23 33.397 29.619 -9.523 175 1HB DAL 23 1HB ALA 23 32.558 31.316 -11.128 176 2HB DAL 23 2HB ALA 23 30.882 31.026 -10.589 177 3HB DAL 23 3HB ALA 23 32.078 31.715 -9.457 178 H VAL 24 H VAL 24 33.221 27.248 -9.668 179 HA VAL 24 HA VAL 24 32.707 26.235 -12.451 180 HB VAL 24 HB VAL 24 33.777 24.840 -9.941 181 1HG1 VAL 24 1HG2 VAL 24 34.335 22.795 -11.146 182 2HG1 VAL 24 2HG2 VAL 24 33.717 23.445 -12.704 183 3HG1 VAL 24 3HG2 VAL 24 32.612 23.128 -11.357 184 1HG2 VAL 24 1HG1 VAL 24 35.376 25.481 -12.517 185 2HG2 VAL 24 2HG1 VAL 24 35.408 26.434 -11.026 186 3HG2 VAL 24 3HG1 VAL 24 36.017 24.774 -10.998 187 H THR 25 H THR 25 30.669 25.417 -13.026 188 HA THR 25 HA THR 25 28.767 24.366 -10.959 189 HB THR 25 HB THR 25 26.979 25.449 -12.296 190 HG1 THR 25 HG1 THR 25 27.486 27.347 -13.414 191 1HG2 THR 25 1HG2 THR 25 26.932 27.682 -11.179 192 2HG2 THR 25 2HG2 THR 25 28.656 27.510 -10.751 193 3HG2 THR 25 3HG2 THR 25 27.445 26.408 -10.040 194 H ILE 26 H ILE 26 28.988 22.473 -11.653 195 HA ILE 26 HA ILE 26 29.582 21.421 -14.174 196 HB ILE 26 HB ILE 26 29.836 20.621 -11.697 197 1HG1 ILE 26 1HG1 ILE 26 29.304 18.070 -13.316 198 2HG1 ILE 26 2HG1 ILE 26 30.372 19.213 -14.029 199 1HG2 ILE 26 1HG2 ILE 26 27.405 20.365 -11.023 200 2HG2 ILE 26 2HG2 ILE 26 28.353 18.873 -10.735 201 3HG2 ILE 26 3HG2 ILE 26 27.259 18.972 -12.136 202 1HD1 ILE 26 1HD1 ILE 26 30.787 18.224 -11.155 203 2HD1 ILE 26 2HD1 ILE 26 31.623 17.562 -12.596 204 3HD1 ILE 26 3HD1 ILE 26 31.864 19.265 -12.107 205 H ARG 27 H ARG 27 28.349 19.560 -15.286 206 HA ARG 27 HA ARG 27 25.401 19.872 -15.461 207 1HB ARG 27 1HB ARG 27 27.099 20.131 -17.989 208 2HB ARG 27 2HB ARG 27 25.382 19.594 -17.981 209 1HG ARG 27 1HG ARG 27 24.619 21.593 -17.108 210 2HG ARG 27 2HG ARG 27 26.300 22.255 -16.982 211 1HD ARG 27 2HD ARG 27 26.493 22.210 -19.489 212 2HD ARG 27 1HD ARG 27 24.845 21.564 -19.623 213 HE ARG 27 HE ARG 27 24.454 23.912 -18.124 214 1HH1 ARG 27 2HH1 ARG 27 26.079 23.448 -21.307 215 2HH1 ARG 27 1HH1 ARG 27 25.633 25.170 -21.758 216 1HH2 ARG 27 2HH2 ARG 27 24.038 25.806 -18.785 217 2HH2 ARG 27 1HH2 ARG 27 24.568 26.395 -20.439 218 H CYS 28 H CYS 28 25.061 18.076 -15.080 219 HA CYS 28 HA CYS 28 26.662 15.605 -15.993 220 1HB CYS 28 2HB CYS 28 26.272 15.670 -13.486 221 2HB CYS 28 1HB CYS 28 24.528 15.438 -13.793 222 H GLU 29 H GLU 29 25.860 15.447 -17.930 223 HA GLU 29 HA GLU 29 23.258 16.473 -18.821 224 1HB GLU 29 1HB GLU 29 25.409 14.955 -20.392 225 2HB GLU 29 2HB GLU 29 23.957 15.529 -21.175 226 1HG GLU 29 2HG GLU 29 25.925 17.428 -19.784 227 2HG GLU 29 1HG GLU 29 26.031 16.958 -21.478 Start of MODEL 15 1 1H SER 1 1H SER 1 24.324 9.509 -18.096 2 2H SER 1 2H SER 1 25.176 10.147 -19.360 3 3H SER 1 3H SER 1 25.881 9.029 -18.369 4 HA SER 1 HA SER 1 24.993 11.740 -17.553 5 1HB SER 1 1HB SER 1 26.096 11.247 -15.388 6 2HB SER 1 2HB SER 1 24.776 10.117 -15.730 7 HG SER 1 HG SER 1 26.656 9.085 -14.988 8 H LYS 2 H LYS 2 26.434 13.269 -18.032 9 HA LYS 2 HA LYS 2 29.411 12.728 -18.268 10 1HB LYS 2 1HB LYS 2 27.851 14.091 -20.538 11 2HB LYS 2 2HB LYS 2 29.604 14.161 -20.365 12 1HG LYS 2 1HG LYS 2 29.794 11.684 -20.634 13 2HG LYS 2 2HG LYS 2 28.044 11.554 -20.804 14 1HD LYS 2 2HD LYS 2 28.117 12.971 -22.874 15 2HD LYS 2 1HD LYS 2 29.859 13.155 -22.733 16 1HE LYS 2 2HE LYS 2 28.490 10.391 -23.081 17 2HE LYS 2 1HE LYS 2 28.937 11.432 -24.423 18 1HZ LYS 2 1HZ LYS 2 31.258 11.335 -23.717 19 2HZ LYS 2 2HZ LYS 2 30.662 9.818 -23.986 20 3HZ LYS 2 3HZ LYS 2 30.875 10.359 -22.440 21 H TYR 3 H TYR 3 30.474 14.364 -17.376 22 HA TYR 3 HA TYR 3 28.956 16.700 -16.197 23 1HB TYR 3 2HB TYR 3 30.643 17.086 -14.735 24 2HB TYR 3 1HB TYR 3 30.379 15.390 -14.688 25 HD1 TYR 3 HD1 TYR 3 32.233 14.094 -16.575 26 HD2 TYR 3 HD2 TYR 3 32.935 17.696 -14.335 27 HE1 TYR 3 HE1 TYR 3 34.640 13.785 -16.776 28 HE2 TYR 3 HE2 TYR 3 35.317 17.310 -14.500 29 HH TYR 3 HH TYR 3 36.931 16.049 -15.296 30 H GLU 4 H GLU 4 29.007 18.577 -17.182 31 HA GLU 4 HA GLU 4 31.480 19.472 -18.842 32 1HB GLU 4 1HB GLU 4 29.956 19.506 -20.479 33 2HB GLU 4 2HB GLU 4 28.562 19.783 -19.492 34 1HG GLU 4 1HG GLU 4 29.256 22.228 -19.228 35 2HG GLU 4 2HG GLU 4 30.588 21.938 -20.337 36 H TYR 5 H TYR 5 32.700 20.259 -17.257 37 HA TYR 5 HA TYR 5 31.479 22.149 -15.202 38 1HB TYR 5 2HB TYR 5 32.615 21.412 -13.436 39 2HB TYR 5 1HB TYR 5 32.418 19.883 -14.235 40 HD1 TYR 5 HD1 TYR 5 34.851 19.797 -16.108 41 HD2 TYR 5 HD2 TYR 5 34.436 20.903 -11.980 42 HE1 TYR 5 HE1 TYR 5 37.265 19.524 -15.749 43 HE2 TYR 5 HE2 TYR 5 36.821 20.658 -11.681 44 HH TYR 5 HH TYR 5 38.931 19.618 -14.335 45 H THR 6 H THR 6 32.005 23.972 -15.556 46 HA THR 6 HA THR 6 34.179 24.608 -17.578 47 HB THR 6 HB THR 6 31.856 26.483 -16.751 48 HG1 THR 6 HG1 THR 6 31.814 24.437 -18.710 49 1HG2 THR 6 1HG2 THR 6 33.652 27.358 -18.345 50 2HG2 THR 6 2HG2 THR 6 32.010 27.241 -19.097 51 3HG2 THR 6 3HG2 THR 6 33.251 26.011 -19.442 52 H ILE 7 H ILE 7 35.808 25.926 -17.078 53 HA ILE 7 HA ILE 7 36.005 27.136 -14.271 54 HB ILE 7 HB ILE 7 38.190 25.400 -15.583 55 1HG1 ILE 7 2HG1 ILE 7 37.748 23.858 -13.333 56 2HG1 ILE 7 1HG1 ILE 7 36.190 24.652 -13.363 57 1HG2 ILE 7 1HG2 ILE 7 39.404 25.587 -13.402 58 2HG2 ILE 7 2HG2 ILE 7 39.099 27.182 -14.124 59 3HG2 ILE 7 3HG2 ILE 7 38.088 26.625 -12.760 60 1HD1 ILE 7 1HD1 ILE 7 36.006 23.640 -15.803 61 2HD1 ILE 7 2HD1 ILE 7 37.336 22.584 -15.231 62 3HD1 ILE 7 3HD1 ILE 7 35.789 22.675 -14.348 63 HA DPR 8 HA PRO 8 38.369 30.335 -16.431 64 1HB DPR 8 1HB PRO 8 37.842 31.580 -14.576 65 2HB DPR 8 2HB PRO 8 37.065 32.642 -15.771 66 1HG DPR 8 2HG PRO 8 35.658 31.670 -13.613 67 2HG DPR 8 1HG PRO 8 34.877 31.806 -15.214 68 1HD DPR 8 2HD PRO 8 35.761 29.300 -13.811 69 2HD DPR 8 1HD PRO 8 34.567 29.483 -15.116 70 H SER 9 H SER 9 38.301 29.805 -18.572 71 HA SER 9 HA SER 9 36.020 30.777 -20.347 72 1HB SER 9 1HB SER 9 39.026 31.105 -20.937 73 2HB SER 9 2HB SER 9 37.717 31.386 -22.091 74 HG SER 9 HG SER 9 36.861 32.932 -20.647 75 H TYR 10 H TYR 10 37.606 28.125 -19.165 76 HA TYR 10 HA TYR 10 37.770 26.655 -21.836 77 1HB TYR 10 1HB TYR 10 39.745 26.975 -19.944 78 2HB TYR 10 2HB TYR 10 38.969 25.630 -19.185 79 HD1 TYR 10 HD1 TYR 10 38.920 23.372 -20.421 80 HD2 TYR 10 HD2 TYR 10 40.977 26.774 -22.061 81 HE1 TYR 10 HE1 TYR 10 40.184 21.908 -21.919 82 HE2 TYR 10 HE2 TYR 10 42.207 25.281 -23.555 83 HH TYR 10 HH TYR 10 42.560 23.209 -24.209 84 H THR 11 H THR 11 36.219 25.148 -22.246 85 HA THR 11 HA THR 11 34.317 24.274 -20.064 86 HB THR 11 HB THR 11 34.111 23.768 -23.081 87 HG1 THR 11 HG1 THR 11 33.114 25.976 -21.610 88 1HG2 THR 11 1HG2 THR 11 31.659 23.662 -22.746 89 2HG2 THR 11 2HG2 THR 11 31.817 24.179 -21.045 90 3HG2 THR 11 3HG2 THR 11 32.399 22.578 -21.535 91 H PHE 12 H PHE 12 34.812 22.492 -19.135 92 HA PHE 12 HA PHE 12 36.640 20.359 -20.475 93 1HB PHE 12 1HB PHE 12 36.167 20.867 -17.518 94 2HB PHE 12 2HB PHE 12 37.007 19.471 -18.133 95 HD1 PHE 12 HD1 PHE 12 37.217 23.183 -17.664 96 HD2 PHE 12 HD2 PHE 12 39.387 19.682 -18.929 97 HE1 PHE 12 HE1 PHE 12 39.318 24.348 -17.358 98 HE2 PHE 12 HE2 PHE 12 41.467 20.908 -18.648 99 HZ PHE 12 HZ PHE 12 41.446 23.238 -17.828 100 H ARG 13 H ARG 13 35.348 18.819 -21.317 101 HA ARG 13 HA ARG 13 32.714 18.060 -19.950 102 1HB ARG 13 1HB ARG 13 32.926 18.008 -22.970 103 2HB ARG 13 2HB ARG 13 31.511 17.953 -21.901 104 1HG ARG 13 2HG ARG 13 31.745 20.386 -21.453 105 2HG ARG 13 1HG ARG 13 33.173 20.425 -22.448 106 1HD ARG 13 2HD ARG 13 31.440 21.302 -23.817 107 2HD ARG 13 1HD ARG 13 31.809 19.712 -24.474 108 HE ARG 13 HE ARG 13 29.535 19.515 -22.615 109 1HH1 ARG 13 1HH1 ARG 13 30.189 20.651 -25.970 110 2HH1 ARG 13 2HH1 ARG 13 28.423 20.370 -26.383 111 1HH2 ARG 13 2HH2 ARG 13 27.601 19.259 -23.241 112 2HH2 ARG 13 1HH2 ARG 13 27.078 19.644 -24.957 113 H GLY 14 H GLY 14 32.677 15.968 -19.391 114 1HA GLY 14 2HA GLY 14 33.496 13.766 -21.203 115 2HA GLY 14 1HA GLY 14 34.674 13.963 -19.910 116 HA PRO 15 HA PRO 15 31.103 11.306 -18.175 117 1HB PRO 15 2HB PRO 15 32.217 8.910 -17.624 118 2HB PRO 15 1HB PRO 15 31.891 9.444 -19.289 119 1HG PRO 15 1HG PRO 15 34.516 9.534 -17.762 120 2HG PRO 15 2HG PRO 15 34.224 8.862 -19.404 121 1HD PRO 15 2HD PRO 15 35.175 11.488 -18.922 122 2HD PRO 15 1HD PRO 15 34.213 11.068 -20.366 123 H GLY 16 H GLY 16 30.613 10.431 -16.045 124 1HA GLY 16 2HA GLY 16 30.786 10.183 -13.674 125 2HA GLY 16 1HA GLY 16 32.416 10.843 -13.717 126 H CYS 17 H CYS 17 29.337 11.512 -12.795 127 HA CYS 17 HA CYS 17 29.671 14.548 -12.812 128 1HB CYS 17 2HB CYS 17 27.152 12.931 -12.099 129 2HB CYS 17 1HB CYS 17 27.278 14.690 -12.231 130 HA PRO 18 HA PRO 18 30.705 14.195 -8.272 131 1HB PRO 18 1HB PRO 18 33.061 15.546 -8.171 132 2HB PRO 18 2HB PRO 18 32.961 13.878 -8.771 133 1HG PRO 18 2HG PRO 18 33.142 16.455 -10.412 134 2HG PRO 18 1HG PRO 18 34.083 14.948 -10.631 135 1HD PRO 18 2HD PRO 18 31.694 15.542 -12.059 136 2HD PRO 18 1HD PRO 18 32.267 13.887 -11.727 137 H THR 19 H THR 19 31.140 16.085 -6.687 138 HA THR 19 HA THR 19 29.322 18.425 -7.201 139 HB THR 19 HB THR 19 30.297 19.042 -4.805 140 HG1 THR 19 HG1 THR 19 31.887 17.428 -4.809 141 1HG2 THR 19 1HG2 THR 19 28.339 16.779 -5.096 142 2HG2 THR 19 2HG2 THR 19 28.009 18.544 -5.101 143 3HG2 THR 19 3HG2 THR 19 28.639 17.775 -3.611 144 H VAL 20 H VAL 20 29.979 20.610 -6.848 145 HA VAL 20 HA VAL 20 32.869 21.164 -7.308 146 HB VAL 20 HB VAL 20 32.450 22.907 -9.087 147 1HG1 VAL 20 1HG2 VAL 20 31.787 20.098 -10.047 148 2HG1 VAL 20 2HG2 VAL 20 33.412 20.740 -9.719 149 3HG1 VAL 20 3HG2 VAL 20 32.453 21.421 -11.049 150 1HG2 VAL 20 1HG1 VAL 20 29.979 23.298 -8.844 151 2HG2 VAL 20 2HG1 VAL 20 30.493 23.043 -10.525 152 3HG2 VAL 20 3HG1 VAL 20 29.665 21.733 -9.631 153 H LYS 21 H LYS 21 33.612 23.368 -7.024 154 HA LYS 21 HA LYS 21 32.461 24.499 -4.506 155 1HB LYS 21 1HB LYS 21 34.570 25.688 -4.333 156 2HB LYS 21 2HB LYS 21 34.799 23.973 -4.542 157 1HG LYS 21 1HG LYS 21 36.589 25.172 -5.456 158 2HG LYS 21 2HG LYS 21 35.791 24.284 -6.736 159 1HD LYS 21 2HD LYS 21 34.929 26.219 -7.806 160 2HD LYS 21 1HD LYS 21 35.104 27.239 -6.394 161 1HE LYS 21 1HE LYS 21 36.765 28.032 -7.871 162 2HE LYS 21 2HE LYS 21 37.644 27.146 -6.630 163 1HZ LYS 21 1HZ LYS 21 37.841 25.277 -8.208 164 2HZ LYS 21 2HZ LYS 21 38.486 26.660 -8.842 165 3HZ LYS 21 3HZ LYS 21 37.013 26.122 -9.362 166 HA PRO 22 HA PRO 22 30.468 28.034 -6.461 167 1HB PRO 22 1HB PRO 22 30.970 30.361 -5.011 168 2HB PRO 22 2HB PRO 22 29.949 29.009 -4.485 169 1HG PRO 22 2HG PRO 22 32.838 29.551 -3.712 170 2HG PRO 22 1HG PRO 22 31.478 29.100 -2.646 171 1HD PRO 22 2HD PRO 22 33.321 27.278 -3.592 172 2HD PRO 22 1HD PRO 22 31.628 26.795 -3.306 173 H DAL 23 H ALA 23 30.832 29.037 -8.330 174 HA DAL 23 HA ALA 23 33.702 29.749 -9.151 175 1HB DAL 23 1HB ALA 23 32.464 31.883 -8.889 176 2HB DAL 23 2HB ALA 23 32.841 31.572 -10.604 177 3HB DAL 23 3HB ALA 23 31.187 31.303 -9.992 178 H VAL 24 H VAL 24 33.330 27.321 -9.384 179 HA VAL 24 HA VAL 24 32.803 26.597 -12.235 180 HB VAL 24 HB VAL 24 33.568 24.778 -9.897 181 1HG1 VAL 24 1HG1 VAL 24 32.655 23.504 -11.919 182 2HG1 VAL 24 2HG1 VAL 24 34.335 23.070 -11.595 183 3HG1 VAL 24 3HG1 VAL 24 33.941 24.173 -12.941 184 1HG2 VAL 24 1HG2 VAL 24 35.988 24.762 -10.675 185 2HG2 VAL 24 2HG2 VAL 24 35.562 26.053 -11.848 186 3HG2 VAL 24 3HG2 VAL 24 35.418 26.340 -10.112 187 H THR 25 H THR 25 30.782 25.715 -12.897 188 HA THR 25 HA THR 25 28.827 24.656 -10.891 189 HB THR 25 HB THR 25 27.071 25.778 -12.220 190 HG1 THR 25 HG1 THR 25 27.603 27.701 -13.291 191 1HG2 THR 25 1HG2 THR 25 28.739 27.797 -10.611 192 2HG2 THR 25 2HG2 THR 25 27.514 26.687 -9.939 193 3HG2 THR 25 3HG2 THR 25 27.022 27.990 -11.055 194 H ILE 26 H ILE 26 29.057 22.757 -11.629 195 HA ILE 26 HA ILE 26 29.527 21.763 -14.211 196 HB ILE 26 HB ILE 26 29.879 20.895 -11.768 197 1HG1 ILE 26 2HG1 ILE 26 29.130 18.445 -13.484 198 2HG1 ILE 26 1HG1 ILE 26 30.302 19.536 -14.110 199 1HG2 ILE 26 1HG2 ILE 26 27.449 20.716 -10.996 200 2HG2 ILE 26 2HG2 ILE 26 27.202 19.366 -12.144 201 3HG2 ILE 26 3HG2 ILE 26 28.338 19.171 -10.789 202 1HD1 ILE 26 1HD1 ILE 26 31.370 17.678 -12.747 203 2HD1 ILE 26 2HD1 ILE 26 30.580 18.355 -11.289 204 3HD1 ILE 26 3HD1 ILE 26 31.769 19.327 -12.172 205 H ARG 27 H ARG 27 28.191 20.052 -15.330 206 HA ARG 27 HA ARG 27 25.243 20.383 -15.335 207 1HB ARG 27 1HB ARG 27 25.774 22.015 -16.965 208 2HB ARG 27 2HB ARG 27 26.727 20.795 -17.932 209 1HG ARG 27 1HG ARG 27 24.742 19.593 -18.410 210 2HG ARG 27 2HG ARG 27 23.751 20.700 -17.414 211 1HD ARG 27 1HD ARG 27 24.291 22.586 -19.029 212 2HD ARG 27 2HD ARG 27 25.244 21.461 -20.017 213 HE ARG 27 HE ARG 27 22.656 20.244 -19.739 214 1HH1 ARG 27 2HH2 ARG 27 23.832 23.283 -21.278 215 2HH1 ARG 27 1HH2 ARG 27 22.415 23.213 -22.442 216 1HH2 ARG 27 2HH1 ARG 27 21.136 20.317 -21.111 217 2HH2 ARG 27 1HH1 ARG 27 21.012 21.665 -22.350 218 H CYS 28 H CYS 28 24.892 18.618 -15.194 219 HA CYS 28 HA CYS 28 26.490 16.127 -16.097 220 1HB CYS 28 2HB CYS 28 25.959 16.110 -13.632 221 2HB CYS 28 1HB CYS 28 24.225 15.991 -14.013 222 H GLU 29 H GLU 29 25.749 15.400 -17.959 223 HA GLU 29 HA GLU 29 23.239 16.432 -19.196 224 1HB GLU 29 1HB GLU 29 25.480 14.623 -20.313 225 2HB GLU 29 2HB GLU 29 24.074 15.050 -21.272 226 1HG GLU 29 1HG GLU 29 24.628 17.474 -21.159 227 2HG GLU 29 2HG GLU 29 26.050 17.118 -20.170 Start of MODEL 16 1 1H SER 1 1H SER 1 26.593 8.614 -17.609 2 2H SER 1 2H SER 1 25.883 9.483 -18.822 3 3H SER 1 3H SER 1 24.979 8.960 -17.541 4 HA SER 1 HA SER 1 25.386 11.314 -17.320 5 1HB SER 1 1HB SER 1 26.908 9.559 -15.303 6 2HB SER 1 2HB SER 1 26.450 11.248 -15.022 7 HG SER 1 HG SER 1 24.925 9.782 -14.214 8 H LYS 2 H LYS 2 26.739 12.895 -17.878 9 HA LYS 2 HA LYS 2 29.747 12.551 -17.898 10 1HB LYS 2 2HB LYS 2 30.134 13.549 -20.038 11 2HB LYS 2 1HB LYS 2 29.357 11.982 -20.121 12 1HG LYS 2 2HG LYS 2 27.170 13.098 -20.751 13 2HG LYS 2 1HG LYS 2 27.958 14.674 -20.668 14 1HD LYS 2 2HD LYS 2 29.551 13.976 -22.524 15 2HD LYS 2 1HD LYS 2 28.762 12.398 -22.606 16 1HE LYS 2 1HE LYS 2 26.586 13.516 -23.275 17 2HE LYS 2 2HE LYS 2 27.378 15.101 -23.192 18 1HZ LYS 2 1HZ LYS 2 27.383 14.224 -25.447 19 2HZ LYS 2 2HZ LYS 2 28.940 14.342 -24.908 20 3HZ LYS 2 3HZ LYS 2 28.203 12.866 -24.985 21 H TYR 3 H TYR 3 30.712 14.245 -17.023 22 HA TYR 3 HA TYR 3 29.060 16.575 -16.049 23 1HB TYR 3 1HB TYR 3 30.705 17.075 -14.532 24 2HB TYR 3 2HB TYR 3 30.496 15.372 -14.431 25 HD1 TYR 3 HD1 TYR 3 32.977 17.861 -14.299 26 HD2 TYR 3 HD2 TYR 3 32.402 14.018 -16.138 27 HE1 TYR 3 HE1 TYR 3 35.375 17.537 -14.432 28 HE2 TYR 3 HE2 TYR 3 34.823 13.791 -16.349 29 HH TYR 3 HH TYR 3 37.029 16.270 -15.117 30 H GLU 4 H GLU 4 29.040 18.396 -17.184 31 HA GLU 4 HA GLU 4 31.503 19.284 -18.842 32 1HB GLU 4 2HB GLU 4 30.002 19.075 -20.481 33 2HB GLU 4 1HB GLU 4 28.574 19.333 -19.530 34 1HG GLU 4 1HG GLU 4 29.050 21.819 -19.490 35 2HG GLU 4 2HG GLU 4 30.453 21.532 -20.510 36 H TYR 5 H TYR 5 32.659 20.211 -17.279 37 HA TYR 5 HA TYR 5 31.320 22.191 -15.383 38 1HB TYR 5 2HB TYR 5 32.493 21.632 -13.571 39 2HB TYR 5 1HB TYR 5 32.367 20.046 -14.262 40 HD1 TYR 5 HD1 TYR 5 34.778 19.878 -16.114 41 HD2 TYR 5 HD2 TYR 5 34.360 21.383 -12.119 42 HE1 TYR 5 HE1 TYR 5 37.199 19.692 -15.743 43 HE2 TYR 5 HE2 TYR 5 36.745 21.203 -11.801 44 HH TYR 5 HH TYR 5 38.867 19.947 -14.354 45 H THR 6 H THR 6 31.750 24.021 -15.882 46 HA THR 6 HA THR 6 33.915 24.633 -17.922 47 HB THR 6 HB THR 6 31.506 26.451 -17.221 48 HG1 THR 6 HG1 THR 6 31.531 24.254 -19.007 49 1HG2 THR 6 1HG2 THR 6 33.247 27.263 -18.918 50 2HG2 THR 6 2HG2 THR 6 32.869 25.821 -19.892 51 3HG2 THR 6 3HG2 THR 6 31.592 27.023 -19.617 52 H ILE 7 H ILE 7 35.558 26.003 -17.456 53 HA ILE 7 HA ILE 7 35.593 27.536 -14.812 54 HB ILE 7 HB ILE 7 37.837 25.617 -15.703 55 1HG1 ILE 7 2HG1 ILE 7 37.204 24.375 -13.329 56 2HG1 ILE 7 1HG1 ILE 7 35.669 25.185 -13.560 57 1HG2 ILE 7 1HG2 ILE 7 38.897 26.067 -13.502 58 2HG2 ILE 7 2HG2 ILE 7 38.665 27.561 -14.435 59 3HG2 ILE 7 3HG2 ILE 7 37.560 27.187 -13.078 60 1HD1 ILE 7 1HD1 ILE 7 35.218 23.166 -14.432 61 2HD1 ILE 7 2HD1 ILE 7 35.767 23.844 -15.934 62 3HD1 ILE 7 3HD1 ILE 7 36.890 22.817 -14.994 63 HA DPR 8 HA PRO 8 38.148 30.402 -17.172 64 1HB DPR 8 2HB PRO 8 37.320 32.025 -15.792 65 2HB DPR 8 1HB PRO 8 36.664 32.730 -17.282 66 1HG DPR 8 2HG PRO 8 35.018 32.183 -15.162 67 2HG DPR 8 1HG PRO 8 34.465 31.836 -16.826 68 1HD DPR 8 1HD PRO 8 35.396 29.855 -14.732 69 2HD DPR 8 2HD PRO 8 34.253 29.614 -16.072 70 H SER 9 H SER 9 38.671 30.104 -19.206 71 HA SER 9 HA SER 9 36.843 30.710 -21.548 72 1HB SER 9 1HB SER 9 39.209 31.575 -21.551 73 2HB SER 9 2HB SER 9 39.804 29.907 -21.460 74 HG SER 9 HG SER 9 39.703 30.725 -23.576 75 H TYR 10 H TYR 10 37.660 27.874 -19.666 76 HA TYR 10 HA TYR 10 37.572 26.062 -22.126 77 1HB TYR 10 2HB TYR 10 38.862 25.865 -19.336 78 2HB TYR 10 1HB TYR 10 38.219 24.393 -19.936 79 HD1 TYR 10 HD1 TYR 10 39.100 23.247 -21.951 80 HD2 TYR 10 HD2 TYR 10 40.866 26.924 -20.558 81 HE1 TYR 10 HE1 TYR 10 41.097 22.768 -23.211 82 HE2 TYR 10 HE2 TYR 10 42.860 26.406 -21.839 83 HH TYR 10 HH TYR 10 43.134 23.455 -23.788 84 H THR 11 H THR 11 35.956 24.662 -22.473 85 HA THR 11 HA THR 11 33.906 24.062 -20.296 86 HB THR 11 HB THR 11 33.767 23.442 -23.303 87 HG1 THR 11 HG1 THR 11 32.672 25.674 -21.926 88 1HG2 THR 11 1HG2 THR 11 31.294 23.327 -22.989 89 2HG2 THR 11 2HG2 THR 11 32.102 22.214 -21.863 90 3HG2 THR 11 3HG2 THR 11 31.464 23.757 -21.259 91 H PHE 12 H PHE 12 34.694 22.452 -19.234 92 HA PHE 12 HA PHE 12 36.614 20.374 -20.506 93 1HB PHE 12 1HB PHE 12 36.045 20.922 -17.579 94 2HB PHE 12 2HB PHE 12 36.971 19.551 -18.115 95 HD1 PHE 12 HD1 PHE 12 37.053 23.217 -17.575 96 HD2 PHE 12 HD2 PHE 12 39.329 19.865 -19.025 97 HE1 PHE 12 HE1 PHE 12 39.116 24.399 -17.120 98 HE2 PHE 12 HE2 PHE 12 41.373 21.116 -18.615 99 HZ PHE 12 HZ PHE 12 41.275 23.379 -17.615 100 H ARG 13 H ARG 13 35.349 18.726 -21.312 101 HA ARG 13 HA ARG 13 32.773 17.869 -19.875 102 1HB ARG 13 2HB ARG 13 33.005 17.554 -22.869 103 2HB ARG 13 1HB ARG 13 31.587 17.553 -21.788 104 1HG ARG 13 2HG ARG 13 31.658 20.018 -21.677 105 2HG ARG 13 1HG ARG 13 33.117 20.036 -22.664 106 1HD ARG 13 1HD ARG 13 31.766 18.855 -24.555 107 2HD ARG 13 2HD ARG 13 30.320 19.069 -23.560 108 HE ARG 13 HE ARG 13 31.501 21.674 -23.798 109 1HH1 ARG 13 1HH1 ARG 13 30.137 19.332 -26.172 110 2HH1 ARG 13 2HH1 ARG 13 29.726 20.734 -27.282 111 1HH2 ARG 13 2HH2 ARG 13 30.975 23.119 -25.151 112 2HH2 ARG 13 1HH2 ARG 13 30.164 22.707 -26.745 113 H GLY 14 H GLY 14 32.891 15.846 -19.142 114 1HA GLY 14 2HA GLY 14 33.951 13.571 -20.763 115 2HA GLY 14 1HA GLY 14 35.013 13.957 -19.414 116 HA PRO 15 HA PRO 15 31.471 11.170 -17.787 117 1HB PRO 15 2HB PRO 15 32.629 8.814 -17.141 118 2HB PRO 15 1HB PRO 15 32.320 9.295 -18.824 119 1HG PRO 15 2HG PRO 15 34.914 9.497 -17.254 120 2HG PRO 15 1HG PRO 15 34.669 8.771 -18.880 121 1HD PRO 15 1HD PRO 15 35.549 11.425 -18.477 122 2HD PRO 15 2HD PRO 15 34.595 10.948 -19.907 123 H GLY 16 H GLY 16 30.942 10.325 -15.654 124 1HA GLY 16 2HA GLY 16 31.049 10.133 -13.278 125 2HA GLY 16 1HA GLY 16 32.659 10.841 -13.285 126 H CYS 17 H CYS 17 29.536 11.433 -12.467 127 HA CYS 17 HA CYS 17 29.804 14.482 -12.471 128 1HB CYS 17 2HB CYS 17 27.686 13.534 -13.362 129 2HB CYS 17 1HB CYS 17 27.347 12.727 -11.817 130 HA PRO 18 HA PRO 18 30.761 14.172 -7.908 131 1HB PRO 18 2HB PRO 18 33.092 15.567 -7.775 132 2HB PRO 18 1HB PRO 18 33.029 13.882 -8.332 133 1HG PRO 18 2HG PRO 18 33.257 16.408 -10.038 134 2HG PRO 18 1HG PRO 18 34.192 14.891 -10.195 135 1HD PRO 18 2HD PRO 18 31.825 15.483 -11.686 136 2HD PRO 18 1HD PRO 18 32.409 13.833 -11.344 137 H THR 19 H THR 19 31.049 16.059 -6.343 138 HA THR 19 HA THR 19 29.371 18.472 -7.075 139 HB THR 19 HB THR 19 30.037 19.050 -4.558 140 HG1 THR 19 HG1 THR 19 30.234 17.218 -3.288 141 1HG2 THR 19 1HG2 THR 19 28.110 17.968 -3.641 142 2HG2 THR 19 2HG2 THR 19 27.790 18.766 -5.210 143 3HG2 THR 19 3HG2 THR 19 27.943 16.977 -5.150 144 H VAL 20 H VAL 20 30.150 20.540 -7.038 145 HA VAL 20 HA VAL 20 33.117 20.851 -6.936 146 HB VAL 20 HB VAL 20 33.261 22.066 -9.110 147 1HG1 VAL 20 1HG2 VAL 20 33.900 19.674 -9.050 148 2HG1 VAL 20 2HG2 VAL 20 33.312 20.130 -10.661 149 3HG1 VAL 20 3HG2 VAL 20 32.259 19.211 -9.563 150 1HG2 VAL 20 1HG1 VAL 20 30.914 22.833 -9.463 151 2HG2 VAL 20 2HG1 VAL 20 31.575 22.046 -10.911 152 3HG2 VAL 20 3HG1 VAL 20 30.422 21.174 -9.861 153 H LYS 21 H LYS 21 34.027 22.896 -6.866 154 HA LYS 21 HA LYS 21 33.602 24.774 -5.065 155 1HB LYS 21 1HB LYS 21 34.185 25.715 -7.935 156 2HB LYS 21 2HB LYS 21 34.672 26.528 -6.466 157 1HG LYS 21 2HG LYS 21 35.853 23.940 -7.581 158 2HG LYS 21 1HG LYS 21 36.510 25.564 -7.750 159 1HD LYS 21 2HD LYS 21 36.803 25.684 -5.231 160 2HD LYS 21 1HD LYS 21 36.176 24.032 -5.115 161 1HE LYS 21 1HE LYS 21 38.125 23.180 -6.487 162 2HE LYS 21 2HE LYS 21 38.756 24.833 -6.622 163 1HZ LYS 21 1HZ LYS 21 38.929 24.899 -4.186 164 2HZ LYS 21 2HZ LYS 21 39.796 23.631 -4.793 165 3HZ LYS 21 3HZ LYS 21 38.340 23.360 -4.061 166 HA PRO 22 HA PRO 22 29.843 27.388 -6.101 167 1HB PRO 22 2HB PRO 22 30.123 29.583 -4.443 168 2HB PRO 22 1HB PRO 22 29.611 27.971 -3.902 169 1HG PRO 22 1HG PRO 22 32.383 29.207 -3.673 170 2HG PRO 22 2HG PRO 22 31.469 28.313 -2.425 171 1HD PRO 22 2HD PRO 22 33.429 27.136 -4.043 172 2HD PRO 22 1HD PRO 22 32.047 26.213 -3.397 173 H DAL 23 H ALA 23 29.903 28.297 -8.081 174 HA DAL 23 HA ALA 23 32.343 29.864 -9.033 175 1HB DAL 23 1HB ALA 23 29.455 30.773 -9.587 176 2HB DAL 23 2HB ALA 23 30.623 31.586 -8.510 177 3HB DAL 23 3HB ALA 23 30.935 31.502 -10.264 178 H VAL 24 H VAL 24 32.372 27.309 -9.402 179 HA VAL 24 HA VAL 24 32.117 26.860 -12.343 180 HB VAL 24 HB VAL 24 33.053 24.943 -10.159 181 1HG1 VAL 24 1HG2 VAL 24 32.385 23.675 -12.243 182 2HG1 VAL 24 2HG2 VAL 24 34.123 23.520 -11.968 183 3HG1 VAL 24 3HG2 VAL 24 33.510 24.628 -13.225 184 1HG2 VAL 24 1HG1 VAL 24 34.913 26.579 -12.003 185 2HG2 VAL 24 2HG1 VAL 24 34.653 26.824 -10.266 186 3HG2 VAL 24 3HG1 VAL 24 35.448 25.345 -10.818 187 H THR 25 H THR 25 30.139 26.087 -13.171 188 HA THR 25 HA THR 25 28.141 24.761 -11.333 189 HB THR 25 HB THR 25 26.446 25.727 -12.801 190 HG1 THR 25 HG1 THR 25 28.493 27.518 -13.553 191 1HG2 THR 25 1HG2 THR 25 26.686 26.766 -10.550 192 2HG2 THR 25 2HG2 THR 25 27.889 27.914 -11.197 193 3HG2 THR 25 3HG2 THR 25 26.197 27.983 -11.760 194 H ILE 26 H ILE 26 28.683 22.914 -11.962 195 HA ILE 26 HA ILE 26 29.307 21.788 -14.459 196 HB ILE 26 HB ILE 26 29.647 21.115 -11.976 197 1HG1 ILE 26 1HG1 ILE 26 29.146 18.500 -13.514 198 2HG1 ILE 26 2HG1 ILE 26 30.264 19.636 -14.170 199 1HG2 ILE 26 1HG2 ILE 26 27.130 19.341 -12.216 200 2HG2 ILE 26 2HG2 ILE 26 27.255 20.816 -11.200 201 3HG2 ILE 26 3HG2 ILE 26 28.276 19.387 -10.851 202 1HD1 ILE 26 1HD1 ILE 26 31.603 19.705 -12.081 203 2HD1 ILE 26 2HD1 ILE 26 30.474 18.586 -11.291 204 3HD1 ILE 26 3HD1 ILE 26 31.466 18.015 -12.674 205 H ARG 27 H ARG 27 28.175 20.014 -15.634 206 HA ARG 27 HA ARG 27 25.177 20.029 -15.630 207 1HB ARG 27 1HB ARG 27 25.554 21.658 -17.245 208 2HB ARG 27 2HB ARG 27 26.660 20.537 -18.181 209 1HG ARG 27 1HG ARG 27 24.823 19.151 -18.693 210 2HG ARG 27 2HG ARG 27 23.691 20.159 -17.759 211 1HD ARG 27 2HD ARG 27 25.237 21.192 -20.250 212 2HD ARG 27 1HD ARG 27 23.692 20.363 -20.370 213 HE ARG 27 HE ARG 27 22.535 22.258 -19.380 214 1HH1 ARG 27 2HH1 ARG 27 26.052 23.019 -19.513 215 2HH1 ARG 27 1HH1 ARG 27 25.657 24.787 -19.219 216 1HH2 ARG 27 2HH2 ARG 27 22.266 24.263 -19.059 217 2HH2 ARG 27 1HH2 ARG 27 23.680 25.431 -18.983 218 H CYS 28 H CYS 28 25.080 18.268 -15.215 219 HA CYS 28 HA CYS 28 26.783 15.838 -16.025 220 1HB CYS 28 1HB CYS 28 24.719 16.133 -13.761 221 2HB CYS 28 2HB CYS 28 25.626 14.653 -14.164 222 H GLU 29 H GLU 29 26.021 15.481 -18.041 223 HA GLU 29 HA GLU 29 23.191 15.885 -18.870 224 1HB GLU 29 2HB GLU 29 25.652 14.926 -20.455 225 2HB GLU 29 1HB GLU 29 24.065 15.064 -21.194 226 1HG GLU 29 1HG GLU 29 23.986 17.514 -20.763 227 2HG GLU 29 2HG GLU 29 25.573 17.444 -19.987 Start of MODEL 17 1 1H SER 1 1H SER 1 25.108 8.747 -17.008 2 2H SER 1 2H SER 1 25.997 9.176 -18.332 3 3H SER 1 3H SER 1 26.735 8.462 -17.039 4 HA SER 1 HA SER 1 25.419 11.125 -17.020 5 1HB SER 1 1HB SER 1 27.000 9.641 -14.837 6 2HB SER 1 2HB SER 1 26.473 11.329 -14.724 7 HG SER 1 HG SER 1 25.004 9.890 -13.778 8 H LYS 2 H LYS 2 26.710 12.699 -17.723 9 HA LYS 2 HA LYS 2 29.730 12.462 -17.729 10 1HB LYS 2 2HB LYS 2 30.072 13.247 -19.961 11 2HB LYS 2 1HB LYS 2 29.295 11.681 -19.902 12 1HG LYS 2 1HG LYS 2 27.095 12.736 -20.596 13 2HG LYS 2 2HG LYS 2 27.875 14.314 -20.657 14 1HD LYS 2 1HD LYS 2 29.426 13.496 -22.454 15 2HD LYS 2 2HD LYS 2 28.693 11.899 -22.410 16 1HE LYS 2 1HE LYS 2 27.090 14.458 -23.127 17 2HE LYS 2 2HE LYS 2 27.997 13.518 -24.300 18 1HZ LYS 2 1HZ LYS 2 26.635 11.575 -23.787 19 2HZ LYS 2 2HZ LYS 2 25.693 12.844 -24.269 20 3HZ LYS 2 3HZ LYS 2 25.762 12.426 -22.672 21 H TYR 3 H TYR 3 30.715 14.310 -17.129 22 HA TYR 3 HA TYR 3 28.972 16.634 -16.308 23 1HB TYR 3 2HB TYR 3 30.760 17.503 -15.039 24 2HB TYR 3 1HB TYR 3 30.400 15.900 -14.539 25 HD1 TYR 3 HD1 TYR 3 32.162 14.070 -14.854 26 HD2 TYR 3 HD2 TYR 3 32.977 18.107 -16.091 27 HE1 TYR 3 HE1 TYR 3 34.567 13.627 -14.829 28 HE2 TYR 3 HE2 TYR 3 35.350 17.595 -16.133 29 HH TYR 3 HH TYR 3 36.919 16.095 -15.774 30 H GLU 4 H GLU 4 29.059 18.575 -17.222 31 HA GLU 4 HA GLU 4 31.428 19.361 -19.073 32 1HB GLU 4 1HB GLU 4 29.908 19.164 -20.684 33 2HB GLU 4 2HB GLU 4 28.499 19.432 -19.705 34 1HG GLU 4 1HG GLU 4 29.035 21.946 -19.736 35 2HG GLU 4 2HG GLU 4 30.339 21.615 -20.867 36 H TYR 5 H TYR 5 32.641 20.338 -17.565 37 HA TYR 5 HA TYR 5 31.351 22.335 -15.669 38 1HB TYR 5 2HB TYR 5 32.395 21.710 -13.821 39 2HB TYR 5 1HB TYR 5 32.224 20.134 -14.535 40 HD1 TYR 5 HD1 TYR 5 34.049 21.211 -12.219 41 HD2 TYR 5 HD2 TYR 5 34.836 20.021 -16.261 42 HE1 TYR 5 HE1 TYR 5 36.395 20.942 -11.691 43 HE2 TYR 5 HE2 TYR 5 37.196 19.703 -15.667 44 HH TYR 5 HH TYR 5 38.385 20.325 -12.405 45 H THR 6 H THR 6 31.936 24.117 -15.979 46 HA THR 6 HA THR 6 34.208 24.719 -17.910 47 HB THR 6 HB THR 6 31.841 26.598 -17.243 48 HG1 THR 6 HG1 THR 6 30.805 25.654 -19.005 49 1HG2 THR 6 1HG2 THR 6 33.412 26.133 -19.838 50 2HG2 THR 6 2HG2 THR 6 33.731 27.479 -18.717 51 3HG2 THR 6 3HG2 THR 6 32.142 27.351 -19.575 52 H ILE 7 H ILE 7 35.791 26.037 -17.371 53 HA ILE 7 HA ILE 7 35.899 27.307 -14.584 54 HB ILE 7 HB ILE 7 38.105 25.563 -15.849 55 1HG1 ILE 7 2HG1 ILE 7 37.670 24.076 -13.567 56 2HG1 ILE 7 1HG1 ILE 7 36.119 24.882 -13.578 57 1HG2 ILE 7 1HG2 ILE 7 39.316 25.802 -13.667 58 2HG2 ILE 7 2HG2 ILE 7 39.014 27.377 -14.429 59 3HG2 ILE 7 3HG2 ILE 7 38.001 26.858 -13.053 60 1HD1 ILE 7 1HD1 ILE 7 35.769 22.816 -14.521 61 2HD1 ILE 7 2HD1 ILE 7 37.270 22.803 -15.471 62 3HD1 ILE 7 3HD1 ILE 7 35.873 23.791 -15.993 63 HA DPR 8 HA PRO 8 38.268 30.512 -16.743 64 1HB DPR 8 2HB PRO 8 37.697 31.780 -14.921 65 2HB DPR 8 1HB PRO 8 36.923 32.812 -16.142 66 1HG DPR 8 2HG PRO 8 35.500 31.856 -13.990 67 2HG DPR 8 1HG PRO 8 34.739 31.953 -15.603 68 1HD DPR 8 2HD PRO 8 35.647 29.483 -14.148 69 2HD DPR 8 1HD PRO 8 34.459 29.629 -15.463 70 H SER 9 H SER 9 38.278 30.025 -18.890 71 HA SER 9 HA SER 9 36.002 30.940 -20.712 72 1HB SER 9 1HB SER 9 39.018 31.277 -21.244 73 2HB SER 9 2HB SER 9 37.731 31.537 -22.428 74 HG SER 9 HG SER 9 37.992 32.872 -19.937 75 H TYR 10 H TYR 10 37.487 28.299 -19.458 76 HA TYR 10 HA TYR 10 37.654 26.757 -22.094 77 1HB TYR 10 2HB TYR 10 39.669 27.185 -20.244 78 2HB TYR 10 1HB TYR 10 38.936 25.848 -19.436 79 HD1 TYR 10 HD1 TYR 10 40.837 26.955 -22.413 80 HD2 TYR 10 HD2 TYR 10 38.955 23.553 -20.574 81 HE1 TYR 10 HE1 TYR 10 42.074 25.447 -23.883 82 HE2 TYR 10 HE2 TYR 10 40.222 22.075 -22.054 83 HH TYR 10 HH TYR 10 41.693 21.926 -23.686 84 H THR 11 H THR 11 36.157 25.139 -22.405 85 HA THR 11 HA THR 11 34.389 24.271 -20.113 86 HB THR 11 HB THR 11 34.095 23.565 -23.082 87 HG1 THR 11 HG1 THR 11 34.170 25.816 -22.814 88 1HG2 THR 11 1HG2 THR 11 31.646 23.389 -22.584 89 2HG2 THR 11 2HG2 THR 11 31.920 23.910 -20.897 90 3HG2 THR 11 3HG2 THR 11 32.547 22.343 -21.452 91 H PHE 12 H PHE 12 34.953 22.590 -19.158 92 HA PHE 12 HA PHE 12 36.874 20.462 -20.382 93 1HB PHE 12 1HB PHE 12 36.387 21.152 -17.450 94 2HB PHE 12 2HB PHE 12 37.256 19.734 -17.969 95 HD1 PHE 12 HD1 PHE 12 39.614 19.923 -18.825 96 HD2 PHE 12 HD2 PHE 12 37.407 23.474 -17.780 97 HE1 PHE 12 HE1 PHE 12 41.677 21.199 -18.679 98 HE2 PHE 12 HE2 PHE 12 39.494 24.688 -17.596 99 HZ PHE 12 HZ PHE 12 41.631 23.581 -18.034 100 H ARG 13 H ARG 13 35.619 18.812 -21.137 101 HA ARG 13 HA ARG 13 33.054 18.040 -19.651 102 1HB ARG 13 1HB ARG 13 33.225 17.726 -22.663 103 2HB ARG 13 2HB ARG 13 31.832 17.663 -21.555 104 1HG ARG 13 1HG ARG 13 31.922 20.150 -21.345 105 2HG ARG 13 2HG ARG 13 33.295 20.194 -22.440 106 1HD ARG 13 1HD ARG 13 31.864 19.105 -24.270 107 2HD ARG 13 2HD ARG 13 30.476 19.167 -23.175 108 HE ARG 13 HE ARG 13 31.433 21.850 -23.275 109 1HH1 ARG 13 2HH1 ARG 13 30.238 19.599 -25.822 110 2HH1 ARG 13 1HH1 ARG 13 29.699 21.046 -26.813 111 1HH2 ARG 13 2HH2 ARG 13 30.773 23.349 -24.505 112 2HH2 ARG 13 1HH2 ARG 13 29.980 22.999 -26.122 113 H GLY 14 H GLY 14 33.137 16.028 -18.897 114 1HA GLY 14 2HA GLY 14 34.344 13.725 -20.415 115 2HA GLY 14 1HA GLY 14 35.292 14.224 -19.023 116 HA PRO 15 HA PRO 15 31.614 11.331 -17.766 117 1HB PRO 15 2HB PRO 15 32.578 8.789 -17.566 118 2HB PRO 15 1HB PRO 15 32.130 9.545 -19.109 119 1HG PRO 15 2HG PRO 15 34.900 9.299 -17.866 120 2HG PRO 15 1HG PRO 15 34.402 8.843 -19.530 121 1HD PRO 15 2HD PRO 15 35.582 11.312 -18.940 122 2HD PRO 15 1HD PRO 15 34.355 11.152 -20.225 123 H GLY 16 H GLY 16 31.160 10.173 -15.813 124 1HA GLY 16 1HA GLY 16 31.208 9.789 -13.410 125 2HA GLY 16 2HA GLY 16 32.930 10.159 -13.441 126 H CYS 17 H CYS 17 29.759 11.473 -12.893 127 HA CYS 17 HA CYS 17 30.774 14.337 -12.697 128 1HB CYS 17 1HB CYS 17 28.760 15.090 -13.238 129 2HB CYS 17 2HB CYS 17 28.979 13.722 -14.308 130 HA PRO 18 HA PRO 18 30.014 14.087 -8.080 131 1HB PRO 18 1HB PRO 18 32.371 15.019 -7.121 132 2HB PRO 18 2HB PRO 18 32.227 13.375 -7.776 133 1HG PRO 18 2HG PRO 18 33.371 15.857 -9.164 134 2HG PRO 18 1HG PRO 18 34.100 14.224 -9.076 135 1HD PRO 18 2HD PRO 18 32.491 15.129 -11.237 136 2HD PRO 18 1HD PRO 18 32.661 13.415 -10.779 137 H THR 19 H THR 19 30.238 15.984 -6.414 138 HA THR 19 HA THR 19 28.992 18.515 -7.373 139 HB THR 19 HB THR 19 29.593 19.241 -4.930 140 HG1 THR 19 HG1 THR 19 31.157 17.631 -4.608 141 1HG2 THR 19 1HG2 THR 19 27.352 18.700 -5.455 142 2HG2 THR 19 2HG2 THR 19 27.674 16.949 -5.193 143 3HG2 THR 19 3HG2 THR 19 27.813 18.120 -3.822 144 H VAL 20 H VAL 20 29.949 20.585 -7.404 145 HA VAL 20 HA VAL 20 32.872 20.749 -6.917 146 HB VAL 20 HB VAL 20 33.467 21.896 -9.076 147 1HG1 VAL 20 1HG1 VAL 20 34.009 19.479 -8.780 148 2HG1 VAL 20 2HG1 VAL 20 32.502 19.037 -9.620 149 3HG1 VAL 20 3HG1 VAL 20 33.796 19.900 -10.487 150 1HG2 VAL 20 1HG2 VAL 20 30.776 21.019 -10.243 151 2HG2 VAL 20 2HG2 VAL 20 32.111 21.751 -11.179 152 3HG2 VAL 20 3HG2 VAL 20 31.275 22.692 -9.926 153 H LYS 21 H LYS 21 33.826 22.735 -6.730 154 HA LYS 21 HA LYS 21 33.332 24.740 -5.172 155 1HB LYS 21 2HB LYS 21 34.119 25.503 -8.042 156 2HB LYS 21 1HB LYS 21 34.530 26.391 -6.593 157 1HG LYS 21 2HG LYS 21 35.708 23.706 -7.458 158 2HG LYS 21 1HG LYS 21 36.417 25.297 -7.710 159 1HD LYS 21 1HD LYS 21 36.576 25.609 -5.200 160 2HD LYS 21 2HD LYS 21 35.893 23.989 -4.985 161 1HE LYS 21 2HE LYS 21 37.887 22.977 -6.172 162 2HE LYS 21 1HE LYS 21 38.574 24.597 -6.402 163 1HZ LYS 21 1HZ LYS 21 37.974 23.350 -3.760 164 2HZ LYS 21 2HZ LYS 21 39.475 23.523 -4.427 165 3HZ LYS 21 3HZ LYS 21 38.614 24.858 -3.973 166 HA PRO 22 HA PRO 22 29.751 27.421 -6.612 167 1HB PRO 22 1HB PRO 22 29.935 29.628 -4.962 168 2HB PRO 22 2HB PRO 22 29.323 28.042 -4.451 169 1HG PRO 22 1HG PRO 22 32.087 29.210 -3.953 170 2HG PRO 22 2HG PRO 22 31.031 28.343 -2.802 171 1HD PRO 22 1HD PRO 22 33.126 27.127 -4.229 172 2HD PRO 22 2HD PRO 22 31.688 26.228 -3.680 173 H DAL 23 H ALA 23 30.033 28.322 -8.585 174 HA DAL 23 HA ALA 23 32.632 29.761 -9.299 175 1HB DAL 23 1HB ALA 23 29.861 30.796 -10.149 176 2HB DAL 23 2HB ALA 23 31.436 31.451 -10.674 177 3HB DAL 23 3HB ALA 23 30.948 31.566 -8.962 178 H VAL 24 H VAL 24 32.626 27.232 -9.653 179 HA VAL 24 HA VAL 24 32.560 26.728 -12.606 180 HB VAL 24 HB VAL 24 33.343 24.862 -10.319 181 1HG1 VAL 24 1HG1 VAL 24 33.936 24.404 -13.343 182 2HG1 VAL 24 2HG1 VAL 24 34.455 23.350 -11.999 183 3HG1 VAL 24 3HG1 VAL 24 32.736 23.528 -12.382 184 1HG2 VAL 24 1HG2 VAL 24 34.989 26.706 -10.430 185 2HG2 VAL 24 2HG2 VAL 24 35.318 26.380 -12.145 186 3HG2 VAL 24 3HG2 VAL 24 35.770 25.187 -10.887 187 H THR 25 H THR 25 30.514 26.211 -13.445 188 HA THR 25 HA THR 25 28.403 24.998 -11.650 189 HB THR 25 HB THR 25 26.812 26.038 -13.148 190 HG1 THR 25 HG1 THR 25 28.993 27.646 -13.948 191 1HG2 THR 25 1HG2 THR 25 26.724 28.345 -12.191 192 2HG2 THR 25 2HG2 THR 25 28.403 28.172 -11.613 193 3HG2 THR 25 3HG2 THR 25 27.116 27.139 -10.936 194 H ILE 26 H ILE 26 28.914 23.112 -12.216 195 HA ILE 26 HA ILE 26 29.417 21.867 -14.673 196 HB ILE 26 HB ILE 26 29.847 21.256 -12.233 197 1HG1 ILE 26 2HG1 ILE 26 29.006 18.611 -13.556 198 2HG1 ILE 26 1HG1 ILE 26 30.148 19.601 -14.380 199 1HG2 ILE 26 1HG2 ILE 26 27.193 19.699 -12.164 200 2HG2 ILE 26 2HG2 ILE 26 28.458 19.719 -10.900 201 3HG2 ILE 26 3HG2 ILE 26 27.535 21.214 -11.257 202 1HD1 ILE 26 1HD1 ILE 26 31.367 17.999 -12.932 203 2HD1 ILE 26 2HD1 ILE 26 31.661 19.688 -12.391 204 3HD1 ILE 26 3HD1 ILE 26 30.527 18.674 -11.482 205 H ARG 27 H ARG 27 28.228 20.159 -15.778 206 HA ARG 27 HA ARG 27 25.218 20.164 -15.637 207 1HB ARG 27 2HB ARG 27 25.566 21.702 -17.366 208 2HB ARG 27 1HB ARG 27 26.622 20.509 -18.265 209 1HG ARG 27 1HG ARG 27 24.760 19.119 -18.630 210 2HG ARG 27 2HG ARG 27 23.669 20.188 -17.714 211 1HD ARG 27 1HD ARG 27 25.118 21.063 -20.321 212 2HD ARG 27 2HD ARG 27 23.560 20.248 -20.329 213 HE ARG 27 HE ARG 27 23.021 22.395 -18.625 214 1HH1 ARG 27 2HH1 ARG 27 24.428 22.383 -21.942 215 2HH1 ARG 27 1HH1 ARG 27 23.732 24.059 -22.217 216 1HH2 ARG 27 2HH2 ARG 27 22.316 24.260 -19.095 217 2HH2 ARG 27 1HH2 ARG 27 22.632 25.033 -20.729 218 H CYS 28 H CYS 28 25.172 18.455 -15.127 219 HA CYS 28 HA CYS 28 26.765 15.962 -16.029 220 1HB CYS 28 2HB CYS 28 26.872 16.124 -13.647 221 2HB CYS 28 1HB CYS 28 25.112 16.137 -13.442 222 H GLU 29 H GLU 29 25.756 15.213 -17.711 223 HA GLU 29 HA GLU 29 22.957 15.928 -18.442 224 1HB GLU 29 1HB GLU 29 25.098 14.351 -19.974 225 2HB GLU 29 2HB GLU 29 23.507 14.606 -20.645 226 1HG GLU 29 2HG GLU 29 25.362 16.937 -19.906 227 2HG GLU 29 1HG GLU 29 25.347 16.148 -21.481 Start of MODEL 18 1 1H SER 1 1H SER 1 24.827 8.615 -17.738 2 2H SER 1 2H SER 1 26.455 8.334 -17.759 3 3H SER 1 3H SER 1 25.746 9.172 -18.993 4 HA SER 1 HA SER 1 25.133 10.983 -17.510 5 1HB SER 1 1HB SER 1 26.664 9.292 -15.446 6 2HB SER 1 2HB SER 1 26.131 10.961 -15.181 7 HG SER 1 HG SER 1 23.997 10.268 -15.618 8 H LYS 2 H LYS 2 26.436 12.616 -18.030 9 HA LYS 2 HA LYS 2 29.460 12.372 -18.004 10 1HB LYS 2 2HB LYS 2 29.833 13.375 -20.146 11 2HB LYS 2 1HB LYS 2 29.033 11.827 -20.264 12 1HG LYS 2 1HG LYS 2 26.843 13.022 -20.839 13 2HG LYS 2 2HG LYS 2 27.702 14.540 -20.734 14 1HD LYS 2 1HD LYS 2 27.671 14.229 -23.008 15 2HD LYS 2 2HD LYS 2 29.297 13.704 -22.626 16 1HE LYS 2 2HE LYS 2 28.485 11.272 -22.771 17 2HE LYS 2 1HE LYS 2 26.866 11.863 -23.182 18 1HZ LYS 2 1HZ LYS 2 29.342 12.410 -24.757 19 2HZ LYS 2 2HZ LYS 2 27.833 12.962 -25.142 20 3HZ LYS 2 3HZ LYS 2 28.152 11.341 -25.171 21 H TYR 3 H TYR 3 30.444 14.141 -17.226 22 HA TYR 3 HA TYR 3 28.748 16.451 -16.257 23 1HB TYR 3 2HB TYR 3 30.393 17.050 -14.816 24 2HB TYR 3 1HB TYR 3 30.210 15.353 -14.610 25 HD1 TYR 3 HD1 TYR 3 32.647 17.813 -14.428 26 HD2 TYR 3 HD2 TYR 3 32.163 13.993 -16.344 27 HE1 TYR 3 HE1 TYR 3 35.047 17.501 -14.480 28 HE2 TYR 3 HE2 TYR 3 34.592 13.811 -16.517 29 HH TYR 3 HH TYR 3 36.538 14.686 -16.014 30 H GLU 4 H GLU 4 28.909 18.437 -17.099 31 HA GLU 4 HA GLU 4 31.350 19.232 -18.842 32 1HB GLU 4 1HB GLU 4 29.543 18.956 -20.316 33 2HB GLU 4 2HB GLU 4 28.401 19.878 -19.340 34 1HG GLU 4 1HG GLU 4 29.668 21.982 -19.809 35 2HG GLU 4 2HG GLU 4 30.859 21.068 -20.726 36 H TYR 5 H TYR 5 32.533 20.199 -17.312 37 HA TYR 5 HA TYR 5 31.219 22.149 -15.375 38 1HB TYR 5 2HB TYR 5 32.413 21.619 -13.577 39 2HB TYR 5 1HB TYR 5 32.206 20.027 -14.229 40 HD1 TYR 5 HD1 TYR 5 34.210 21.167 -12.075 41 HD2 TYR 5 HD2 TYR 5 34.693 19.924 -16.159 42 HE1 TYR 5 HE1 TYR 5 36.587 20.955 -11.735 43 HE2 TYR 5 HE2 TYR 5 37.100 19.648 -15.736 44 HH TYR 5 HH TYR 5 38.739 19.807 -14.309 45 H THR 6 H THR 6 31.699 23.980 -15.765 46 HA THR 6 HA THR 6 33.843 24.611 -17.820 47 HB THR 6 HB THR 6 31.482 26.463 -17.058 48 HG1 THR 6 HG1 THR 6 31.468 24.330 -18.921 49 1HG2 THR 6 1HG2 THR 6 31.610 27.119 -19.437 50 2HG2 THR 6 2HG2 THR 6 33.255 27.298 -18.703 51 3HG2 THR 6 3HG2 THR 6 32.869 25.896 -19.735 52 H ILE 7 H ILE 7 35.455 25.936 -17.354 53 HA ILE 7 HA ILE 7 35.631 27.264 -14.598 54 HB ILE 7 HB ILE 7 37.842 25.542 -15.895 55 1HG1 ILE 7 2HG1 ILE 7 37.537 24.057 -13.633 56 2HG1 ILE 7 1HG1 ILE 7 35.986 24.857 -13.539 57 1HG2 ILE 7 1HG2 ILE 7 37.755 26.886 -13.116 58 2HG2 ILE 7 2HG2 ILE 7 38.727 27.419 -14.513 59 3HG2 ILE 7 3HG2 ILE 7 39.095 25.866 -13.733 60 1HD1 ILE 7 1HD1 ILE 7 36.949 22.637 -15.315 61 2HD1 ILE 7 2HD1 ILE 7 35.723 23.733 -16.021 62 3HD1 ILE 7 3HD1 ILE 7 35.389 22.931 -14.498 63 HA DPR 8 HA PRO 8 37.826 30.482 -16.912 64 1HB DPR 8 1HB PRO 8 37.258 31.785 -15.110 65 2HB DPR 8 2HB PRO 8 36.415 32.752 -16.340 66 1HG DPR 8 2HG PRO 8 35.084 31.810 -14.122 67 2HG DPR 8 1HG PRO 8 34.278 31.835 -15.716 68 1HD DPR 8 2HD PRO 8 35.307 29.439 -14.219 69 2HD DPR 8 1HD PRO 8 34.085 29.506 -15.508 70 H SER 9 H SER 9 37.786 29.906 -19.037 71 HA SER 9 HA SER 9 35.431 30.664 -20.818 72 1HB SER 9 2HB SER 9 36.959 31.415 -22.564 73 2HB SER 9 1HB SER 9 37.219 32.391 -21.114 74 HG SER 9 HG SER 9 38.982 30.996 -20.616 75 H TYR 10 H TYR 10 37.110 28.142 -19.547 76 HA TYR 10 HA TYR 10 37.343 26.570 -22.156 77 1HB TYR 10 1HB TYR 10 39.322 27.099 -20.321 78 2HB TYR 10 2HB TYR 10 38.635 25.759 -19.476 79 HD1 TYR 10 HD1 TYR 10 38.706 23.433 -20.588 80 HD2 TYR 10 HD2 TYR 10 40.527 26.854 -22.453 81 HE1 TYR 10 HE1 TYR 10 40.033 21.965 -22.026 82 HE2 TYR 10 HE2 TYR 10 41.821 25.356 -23.884 83 HH TYR 10 HH TYR 10 42.288 23.276 -24.430 84 H THR 11 H THR 11 35.896 24.962 -22.473 85 HA THR 11 HA THR 11 33.989 24.159 -20.269 86 HB THR 11 HB THR 11 33.846 23.507 -23.260 87 HG1 THR 11 HG1 THR 11 34.049 25.752 -22.939 88 1HG2 THR 11 1HG2 THR 11 32.090 22.336 -22.029 89 2HG2 THR 11 2HG2 THR 11 31.328 23.675 -22.911 90 3HG2 THR 11 3HG2 THR 11 31.615 23.816 -21.154 91 H PHE 12 H PHE 12 34.608 22.475 -19.196 92 HA PHE 12 HA PHE 12 36.554 20.376 -20.411 93 1HB PHE 12 1HB PHE 12 36.083 21.086 -17.493 94 2HB PHE 12 2HB PHE 12 36.976 19.684 -17.999 95 HD1 PHE 12 HD1 PHE 12 39.294 19.913 -18.982 96 HD2 PHE 12 HD2 PHE 12 37.079 23.406 -17.770 97 HE1 PHE 12 HE1 PHE 12 41.347 21.204 -18.838 98 HE2 PHE 12 HE2 PHE 12 39.158 24.632 -17.584 99 HZ PHE 12 HZ PHE 12 41.296 23.559 -18.104 100 H ARG 13 H ARG 13 35.227 18.824 -21.243 101 HA ARG 13 HA ARG 13 32.847 17.841 -19.671 102 1HB ARG 13 2HB ARG 13 32.455 17.398 -22.556 103 2HB ARG 13 1HB ARG 13 31.473 18.127 -21.323 104 1HG ARG 13 2HG ARG 13 31.499 19.781 -22.811 105 2HG ARG 13 1HG ARG 13 32.739 20.283 -21.649 106 1HD ARG 13 1HD ARG 13 34.567 19.570 -23.184 107 2HD ARG 13 2HD ARG 13 33.393 18.915 -24.340 108 HE ARG 13 HE ARG 13 32.852 21.766 -23.774 109 1HH1 ARG 13 2HH2 ARG 13 34.922 19.695 -25.875 110 2HH1 ARG 13 1HH2 ARG 13 35.061 21.082 -27.068 111 1HH2 ARG 13 1HH1 ARG 13 33.113 23.212 -25.209 112 2HH2 ARG 13 2HH1 ARG 13 34.116 22.913 -26.717 113 H GLY 14 H GLY 14 32.790 15.768 -19.167 114 1HA GLY 14 2HA GLY 14 33.607 13.577 -20.954 115 2HA GLY 14 1HA GLY 14 34.820 13.771 -19.691 116 HA PRO 15 HA PRO 15 31.310 11.168 -17.781 117 1HB PRO 15 2HB PRO 15 32.460 8.805 -17.182 118 2HB PRO 15 1HB PRO 15 32.123 9.289 -18.859 119 1HG PRO 15 1HG PRO 15 34.751 9.448 -17.346 120 2HG PRO 15 2HG PRO 15 34.462 8.735 -18.971 121 1HD PRO 15 1HD PRO 15 35.375 11.390 -18.533 122 2HD PRO 15 2HD PRO 15 34.448 10.915 -19.982 123 H GLY 16 H GLY 16 30.863 10.354 -15.621 124 1HA GLY 16 1HA GLY 16 31.063 10.173 -13.245 125 2HA GLY 16 2HA GLY 16 32.701 10.808 -13.336 126 H CYS 17 H CYS 17 29.622 11.547 -12.414 127 HA CYS 17 HA CYS 17 29.973 14.575 -12.538 128 1HB CYS 17 1HB CYS 17 27.470 12.942 -11.793 129 2HB CYS 17 2HB CYS 17 27.559 14.700 -11.971 130 HA PRO 18 HA PRO 18 30.930 14.377 -7.962 131 1HB PRO 18 2HB PRO 18 33.287 15.728 -7.862 132 2HB PRO 18 1HB PRO 18 33.191 14.042 -8.411 133 1HG PRO 18 1HG PRO 18 33.415 16.563 -10.129 134 2HG PRO 18 2HG PRO 18 34.348 15.044 -10.287 135 1HD PRO 18 2HD PRO 18 31.986 15.610 -11.772 136 2HD PRO 18 1HD PRO 18 32.541 13.962 -11.378 137 H THR 19 H THR 19 31.314 16.274 -6.409 138 HA THR 19 HA THR 19 29.543 18.621 -7.015 139 HB THR 19 HB THR 19 30.524 19.277 -4.600 140 HG1 THR 19 HG1 THR 19 30.783 16.468 -4.597 141 1HG2 THR 19 1HG2 THR 19 28.389 17.188 -4.933 142 2HG2 THR 19 2HG2 THR 19 28.220 18.974 -4.977 143 3HG2 THR 19 3HG2 THR 19 28.723 18.183 -3.455 144 H VAL 20 H VAL 20 30.174 20.798 -6.756 145 HA VAL 20 HA VAL 20 33.021 21.307 -7.503 146 HB VAL 20 HB VAL 20 32.370 22.820 -9.414 147 1HG1 VAL 20 1HG1 VAL 20 31.595 19.930 -9.968 148 2HG1 VAL 20 2HG1 VAL 20 33.254 20.572 -9.880 149 3HG1 VAL 20 3HG1 VAL 20 32.158 21.130 -11.162 150 1HG2 VAL 20 1HG2 VAL 20 30.256 22.812 -10.592 151 2HG2 VAL 20 2HG2 VAL 20 29.946 23.256 -8.903 152 3HG2 VAL 20 3HG2 VAL 20 29.547 21.615 -9.466 153 H LYS 21 H LYS 21 33.865 23.356 -7.475 154 HA LYS 21 HA LYS 21 33.549 24.879 -5.158 155 1HB LYS 21 2HB LYS 21 34.611 26.095 -7.788 156 2HB LYS 21 1HB LYS 21 35.030 26.578 -6.162 157 1HG LYS 21 1HG LYS 21 35.991 24.098 -7.670 158 2HG LYS 21 2HG LYS 21 36.886 25.574 -7.346 159 1HD LYS 21 1HD LYS 21 36.747 25.026 -4.841 160 2HD LYS 21 2HD LYS 21 35.938 23.529 -5.303 161 1HE LYS 21 2HE LYS 21 38.164 22.844 -4.901 162 2HE LYS 21 1HE LYS 21 38.079 22.883 -6.657 163 1HZ LYS 21 1HZ LYS 21 39.253 25.014 -4.916 164 2HZ LYS 21 2HZ LYS 21 40.101 23.927 -5.825 165 3HZ LYS 21 3HZ LYS 21 39.186 25.086 -6.565 166 HA PRO 22 HA PRO 22 30.259 28.081 -6.086 167 1HB PRO 22 1HB PRO 22 31.798 30.054 -4.350 168 2HB PRO 22 2HB PRO 22 30.087 29.575 -4.289 169 1HG PRO 22 1HG PRO 22 31.829 28.603 -2.446 170 2HG PRO 22 2HG PRO 22 30.622 27.504 -3.173 171 1HD PRO 22 1HD PRO 22 33.569 27.828 -4.020 172 2HD PRO 22 2HD PRO 22 32.680 26.322 -3.646 173 H DAL 23 H ALA 23 30.441 28.747 -8.143 174 HA DAL 23 HA ALA 23 33.013 29.961 -9.237 175 1HB DAL 23 1HB ALA 23 31.799 31.659 -10.583 176 2HB DAL 23 2HB ALA 23 31.522 31.917 -8.839 177 3HB DAL 23 3HB ALA 23 30.250 31.172 -9.844 178 H VAL 24 H VAL 24 32.931 27.483 -9.492 179 HA VAL 24 HA VAL 24 32.356 26.787 -12.329 180 HB VAL 24 HB VAL 24 33.369 24.997 -10.074 181 1HG1 VAL 24 1HG1 VAL 24 34.190 23.354 -11.823 182 2HG1 VAL 24 2HG1 VAL 24 33.590 24.402 -13.134 183 3HG1 VAL 24 3HG1 VAL 24 32.456 23.621 -12.018 184 1HG2 VAL 24 1HG2 VAL 24 35.724 25.191 -10.973 185 2HG2 VAL 24 2HG2 VAL 24 35.063 26.747 -10.449 186 3HG2 VAL 24 3HG2 VAL 24 35.142 26.380 -12.181 187 H THR 25 H THR 25 30.394 25.802 -12.983 188 HA THR 25 HA THR 25 28.536 24.584 -10.965 189 HB THR 25 HB THR 25 26.709 25.626 -12.242 190 HG1 THR 25 HG1 THR 25 27.119 27.581 -13.312 191 1HG2 THR 25 1HG2 THR 25 28.305 27.719 -10.656 192 2HG2 THR 25 2HG2 THR 25 26.572 27.826 -11.063 193 3HG2 THR 25 3HG2 THR 25 27.153 26.544 -9.967 194 H ILE 26 H ILE 26 28.890 22.713 -11.720 195 HA ILE 26 HA ILE 26 29.326 21.723 -14.292 196 HB ILE 26 HB ILE 26 29.811 20.894 -11.888 197 1HG1 ILE 26 2HG1 ILE 26 28.919 18.429 -13.526 198 2HG1 ILE 26 1HG1 ILE 26 30.124 19.472 -14.180 199 1HG2 ILE 26 1HG2 ILE 26 28.322 19.199 -10.754 200 2HG2 ILE 26 2HG2 ILE 26 27.426 20.742 -10.948 201 3HG2 ILE 26 3HG2 ILE 26 27.101 19.362 -12.039 202 1HD1 ILE 26 1HD1 ILE 26 30.409 18.293 -11.361 203 2HD1 ILE 26 2HD1 ILE 26 31.131 17.564 -12.826 204 3HD1 ILE 26 3HD1 ILE 26 31.624 19.198 -12.276 205 H ARG 27 H ARG 27 28.061 19.999 -15.419 206 HA ARG 27 HA ARG 27 25.079 20.155 -15.316 207 1HB ARG 27 2HB ARG 27 25.481 21.775 -16.975 208 2HB ARG 27 1HB ARG 27 26.516 20.609 -17.925 209 1HG ARG 27 1HG ARG 27 24.642 19.284 -18.391 210 2HG ARG 27 2HG ARG 27 23.553 20.309 -17.424 211 1HD ARG 27 1HD ARG 27 25.047 21.324 -19.953 212 2HD ARG 27 2HD ARG 27 23.478 20.532 -20.030 213 HE ARG 27 HE ARG 27 23.109 22.653 -18.148 214 1HH1 ARG 27 2HH1 ARG 27 23.927 22.534 -21.654 215 2HH1 ARG 27 1HH1 ARG 27 23.155 24.184 -21.866 216 1HH2 ARG 27 2HH2 ARG 27 22.290 24.486 -18.557 217 2HH2 ARG 27 1HH2 ARG 27 22.302 25.199 -20.248 218 H CYS 28 H CYS 28 24.870 18.389 -15.058 219 HA CYS 28 HA CYS 28 26.510 15.933 -16.010 220 1HB CYS 28 2HB CYS 28 26.205 16.012 -13.505 221 2HB CYS 28 1HB CYS 28 24.455 15.769 -13.732 222 H GLU 29 H GLU 29 25.656 15.281 -17.828 223 HA GLU 29 HA GLU 29 22.932 16.109 -18.762 224 1HB GLU 29 1HB GLU 29 25.214 14.632 -20.218 225 2HB GLU 29 2HB GLU 29 23.671 14.960 -20.993 226 1HG GLU 29 1HG GLU 29 23.988 17.418 -20.772 227 2HG GLU 29 2HG GLU 29 25.541 17.161 -19.966 Start of MODEL 19 1 1H SER 1 1H SER 1 24.569 9.052 -18.111 2 2H SER 1 2H SER 1 26.169 8.640 -18.078 3 3H SER 1 3H SER 1 25.576 9.552 -19.321 4 HA SER 1 HA SER 1 25.051 11.377 -17.831 5 1HB SER 1 1HB SER 1 25.830 11.281 -15.479 6 2HB SER 1 2HB SER 1 24.629 10.029 -15.827 7 HG SER 1 HG SER 1 26.368 8.563 -16.117 8 H LYS 2 H LYS 2 26.480 12.913 -18.312 9 HA LYS 2 HA LYS 2 29.474 12.476 -18.152 10 1HB LYS 2 2HB LYS 2 29.996 13.444 -20.298 11 2HB LYS 2 1HB LYS 2 29.179 11.904 -20.411 12 1HG LYS 2 2HG LYS 2 27.045 13.118 -21.144 13 2HG LYS 2 1HG LYS 2 27.921 14.625 -21.029 14 1HD LYS 2 1HD LYS 2 28.013 14.259 -23.292 15 2HD LYS 2 2HD LYS 2 29.605 13.717 -22.806 16 1HE LYS 2 2HE LYS 2 28.761 11.295 -22.939 17 2HE LYS 2 1HE LYS 2 27.177 11.902 -23.454 18 1HZ LYS 2 1HZ LYS 2 28.270 12.937 -25.382 19 2HZ LYS 2 2HZ LYS 2 28.562 11.311 -25.355 20 3HZ LYS 2 3HZ LYS 2 29.746 12.370 -24.901 21 H TYR 3 H TYR 3 30.469 14.172 -17.280 22 HA TYR 3 HA TYR 3 28.861 16.541 -16.376 23 1HB TYR 3 1HB TYR 3 30.557 17.106 -14.938 24 2HB TYR 3 2HB TYR 3 30.269 15.425 -14.729 25 HD1 TYR 3 HD1 TYR 3 32.123 13.906 -16.390 26 HD2 TYR 3 HD2 TYR 3 32.856 17.758 -14.630 27 HE1 TYR 3 HE1 TYR 3 34.538 13.580 -16.597 28 HE2 TYR 3 HE2 TYR 3 35.238 17.305 -14.710 29 HH TYR 3 HH TYR 3 36.836 15.960 -15.361 30 H GLU 4 H GLU 4 29.063 18.566 -17.148 31 HA GLU 4 HA GLU 4 31.492 19.347 -18.902 32 1HB GLU 4 1HB GLU 4 29.913 19.308 -20.507 33 2HB GLU 4 2HB GLU 4 28.543 19.656 -19.488 34 1HG GLU 4 1HG GLU 4 29.331 22.115 -19.413 35 2HG GLU 4 2HG GLU 4 30.543 21.711 -20.621 36 H TYR 5 H TYR 5 32.711 20.249 -17.347 37 HA TYR 5 HA TYR 5 31.444 22.154 -15.340 38 1HB TYR 5 1HB TYR 5 32.555 21.478 -13.542 39 2HB TYR 5 2HB TYR 5 32.362 19.930 -14.299 40 HD1 TYR 5 HD1 TYR 5 34.322 20.993 -12.031 41 HD2 TYR 5 HD2 TYR 5 34.876 19.823 -16.128 42 HE1 TYR 5 HE1 TYR 5 36.677 20.668 -11.625 43 HE2 TYR 5 HE2 TYR 5 37.247 19.408 -15.633 44 HH TYR 5 HH TYR 5 38.610 19.991 -12.437 45 H THR 6 H THR 6 32.005 23.960 -15.646 46 HA THR 6 HA THR 6 34.230 24.594 -17.613 47 HB THR 6 HB THR 6 31.968 26.551 -16.816 48 HG1 THR 6 HG1 THR 6 31.846 24.489 -18.754 49 1HG2 THR 6 1HG2 THR 6 33.824 27.320 -18.408 50 2HG2 THR 6 2HG2 THR 6 33.354 25.987 -19.495 51 3HG2 THR 6 3HG2 THR 6 32.181 27.285 -19.165 52 H ILE 7 H ILE 7 35.876 25.858 -17.091 53 HA ILE 7 HA ILE 7 36.095 27.027 -14.270 54 HB ILE 7 HB ILE 7 38.265 25.324 -15.665 55 1HG1 ILE 7 2HG1 ILE 7 37.946 23.698 -13.531 56 2HG1 ILE 7 1HG1 ILE 7 36.424 24.532 -13.336 57 1HG2 ILE 7 1HG2 ILE 7 39.515 25.495 -13.475 58 2HG2 ILE 7 2HG2 ILE 7 38.188 26.499 -12.806 59 3HG2 ILE 7 3HG2 ILE 7 39.181 27.099 -14.160 60 1HD1 ILE 7 1HD1 ILE 7 35.720 22.712 -14.423 61 2HD1 ILE 7 2HD1 ILE 7 36.093 23.580 -15.903 62 3HD1 ILE 7 3HD1 ILE 7 37.264 22.396 -15.255 63 HA DPR 8 HA PRO 8 38.401 30.287 -16.405 64 1HB DPR 8 1HB PRO 8 37.867 31.505 -14.535 65 2HB DPR 8 2HB PRO 8 37.069 32.570 -15.713 66 1HG DPR 8 1HG PRO 8 35.687 31.556 -13.560 67 2HG DPR 8 2HG PRO 8 34.895 31.695 -15.156 68 1HD DPR 8 2HD PRO 8 35.832 29.188 -13.783 69 2HD DPR 8 1HD PRO 8 34.620 29.366 -15.072 70 H SER 9 H SER 9 38.342 29.801 -18.554 71 HA SER 9 HA SER 9 36.032 30.745 -20.307 72 1HB SER 9 2HB SER 9 39.027 31.171 -20.895 73 2HB SER 9 1HB SER 9 37.708 31.434 -22.043 74 HG SER 9 HG SER 9 37.995 32.704 -19.521 75 H TYR 10 H TYR 10 37.625 28.112 -19.162 76 HA TYR 10 HA TYR 10 37.805 26.663 -21.849 77 1HB TYR 10 2HB TYR 10 39.821 27.045 -20.017 78 2HB TYR 10 1HB TYR 10 39.101 25.689 -19.223 79 HD1 TYR 10 HD1 TYR 10 40.985 26.851 -22.183 80 HD2 TYR 10 HD2 TYR 10 39.093 23.415 -20.418 81 HE1 TYR 10 HE1 TYR 10 42.210 25.371 -23.692 82 HE2 TYR 10 HE2 TYR 10 40.350 21.966 -21.935 83 HH TYR 10 HH TYR 10 41.814 21.849 -23.575 84 H THR 11 H THR 11 36.311 25.079 -22.218 85 HA THR 11 HA THR 11 34.449 24.219 -20.005 86 HB THR 11 HB THR 11 34.246 23.599 -23.001 87 HG1 THR 11 HG1 THR 11 33.235 25.863 -21.628 88 1HG2 THR 11 1HG2 THR 11 31.806 23.464 -22.665 89 2HG2 THR 11 2HG2 THR 11 32.538 22.482 -21.368 90 3HG2 THR 11 3HG2 THR 11 31.938 24.106 -21.005 91 H PHE 12 H PHE 12 35.000 22.490 -19.018 92 HA PHE 12 HA PHE 12 36.885 20.355 -20.278 93 1HB PHE 12 1HB PHE 12 36.420 21.013 -17.335 94 2HB PHE 12 2HB PHE 12 37.260 19.585 -17.877 95 HD1 PHE 12 HD1 PHE 12 37.501 23.316 -17.641 96 HD2 PHE 12 HD2 PHE 12 39.611 19.724 -18.744 97 HE1 PHE 12 HE1 PHE 12 39.622 24.464 -17.416 98 HE2 PHE 12 HE2 PHE 12 41.707 20.938 -18.568 99 HZ PHE 12 HZ PHE 12 41.727 23.305 -17.870 100 H ARG 13 H ARG 13 35.665 18.654 -20.978 101 HA ARG 13 HA ARG 13 33.109 17.889 -19.492 102 1HB ARG 13 1HB ARG 13 33.153 17.876 -22.546 103 2HB ARG 13 2HB ARG 13 31.794 17.773 -21.408 104 1HG ARG 13 2HG ARG 13 32.119 20.187 -20.886 105 2HG ARG 13 1HG ARG 13 33.425 20.278 -22.031 106 1HD ARG 13 1HD ARG 13 30.569 19.460 -22.884 107 2HD ARG 13 2HD ARG 13 31.118 21.131 -22.814 108 HE ARG 13 HE ARG 13 33.068 19.954 -24.459 109 1HH1 ARG 13 1HH1 ARG 13 29.478 20.037 -24.752 110 2HH1 ARG 13 2HH1 ARG 13 29.649 19.917 -26.575 111 1HH2 ARG 13 1HH2 ARG 13 33.080 19.823 -26.503 112 2HH2 ARG 13 2HH2 ARG 13 31.529 19.805 -27.483 113 H GLY 14 H GLY 14 32.964 15.775 -19.060 114 1HA GLY 14 2HA GLY 14 33.770 13.626 -20.944 115 2HA GLY 14 1HA GLY 14 34.911 13.733 -19.607 116 HA PRO 15 HA PRO 15 31.218 11.123 -18.057 117 1HB PRO 15 2HB PRO 15 32.270 8.699 -17.505 118 2HB PRO 15 1HB PRO 15 32.018 9.260 -19.173 119 1HG PRO 15 1HG PRO 15 34.582 9.288 -17.543 120 2HG PRO 15 2HG PRO 15 34.344 8.640 -19.203 121 1HD PRO 15 1HD PRO 15 35.317 11.245 -18.654 122 2HD PRO 15 2HD PRO 15 34.405 10.858 -20.139 123 H GLY 16 H GLY 16 30.649 10.165 -15.897 124 1HA GLY 16 2HA GLY 16 30.810 9.990 -13.531 125 2HA GLY 16 1HA GLY 16 32.366 10.814 -13.535 126 H CYS 17 H CYS 17 29.451 11.194 -12.492 127 HA CYS 17 HA CYS 17 29.349 14.259 -12.707 128 1HB CYS 17 1HB CYS 17 27.319 12.669 -11.053 129 2HB CYS 17 2HB CYS 17 27.171 14.289 -11.737 130 HA PRO 18 HA PRO 18 31.475 14.245 -8.530 131 1HB PRO 18 1HB PRO 18 33.492 16.031 -8.990 132 2HB PRO 18 2HB PRO 18 33.574 14.337 -9.511 133 1HG PRO 18 1HG PRO 18 32.874 16.789 -11.209 134 2HG PRO 18 2HG PRO 18 34.016 15.471 -11.614 135 1HD PRO 18 1HD PRO 18 31.311 15.481 -12.477 136 2HD PRO 18 2HD PRO 18 32.239 13.996 -12.177 137 H THR 19 H THR 19 31.820 16.116 -7.026 138 HA THR 19 HA THR 19 29.686 18.258 -7.235 139 HB THR 19 HB THR 19 30.774 18.793 -4.847 140 HG1 THR 19 HG1 THR 19 31.296 16.033 -5.104 141 1HG2 THR 19 1HG2 THR 19 28.481 18.285 -5.098 142 2HG2 THR 19 2HG2 THR 19 28.826 16.529 -5.223 143 3HG2 THR 19 3HG2 THR 19 29.166 17.428 -3.686 144 H VAL 20 H VAL 20 30.170 20.445 -6.834 145 HA VAL 20 HA VAL 20 32.956 21.275 -7.507 146 HB VAL 20 HB VAL 20 32.224 22.944 -9.243 147 1HG1 VAL 20 1HG2 VAL 20 33.284 20.828 -9.950 148 2HG1 VAL 20 2HG2 VAL 20 31.681 20.086 -10.157 149 3HG1 VAL 20 3HG2 VAL 20 32.182 21.451 -11.191 150 1HG2 VAL 20 1HG1 VAL 20 29.755 23.111 -8.751 151 2HG2 VAL 20 2HG1 VAL 20 29.506 21.542 -9.553 152 3HG2 VAL 20 3HG1 VAL 20 30.155 22.939 -10.469 153 H LYS 21 H LYS 21 33.524 23.547 -7.266 154 HA LYS 21 HA LYS 21 32.410 24.597 -4.686 155 1HB LYS 21 1HB LYS 21 34.431 25.954 -4.620 156 2HB LYS 21 2HB LYS 21 34.753 24.232 -4.731 157 1HG LYS 21 1HG LYS 21 36.487 25.388 -5.776 158 2HG LYS 21 2HG LYS 21 35.636 24.485 -7.021 159 1HD LYS 21 1HD LYS 21 34.568 26.468 -7.913 160 2HD LYS 21 2HD LYS 21 35.121 27.481 -6.578 161 1HE LYS 21 1HE LYS 21 37.554 27.086 -7.345 162 2HE LYS 21 2HE LYS 21 36.922 26.183 -8.734 163 1HZ LYS 21 1HZ LYS 21 36.302 29.035 -8.103 164 2HZ LYS 21 2HZ LYS 21 35.715 28.205 -9.405 165 3HZ LYS 21 3HZ LYS 21 37.334 28.510 -9.282 166 HA PRO 22 HA PRO 22 30.229 28.134 -6.543 167 1HB PRO 22 2HB PRO 22 31.687 30.146 -4.748 168 2HB PRO 22 1HB PRO 22 29.948 29.953 -5.067 169 1HG PRO 22 1HG PRO 22 30.994 28.980 -2.768 170 2HG PRO 22 2HG PRO 22 29.831 27.972 -3.674 171 1HD PRO 22 1HD PRO 22 32.901 27.778 -3.730 172 2HD PRO 22 2HD PRO 22 31.709 26.462 -3.513 173 H DAL 23 H ALA 23 30.595 29.005 -8.500 174 HA DAL 23 HA ALA 23 33.434 29.787 -9.352 175 1HB DAL 23 1HB ALA 23 30.879 31.268 -10.199 176 2HB DAL 23 2HB ALA 23 32.522 31.561 -10.829 177 3HB DAL 23 3HB ALA 23 32.153 31.894 -9.116 178 H VAL 24 H VAL 24 33.156 27.367 -9.565 179 HA VAL 24 HA VAL 24 32.656 26.618 -12.416 180 HB VAL 24 HB VAL 24 33.570 24.875 -10.078 181 1HG1 VAL 24 1HG1 VAL 24 33.886 24.187 -13.106 182 2HG1 VAL 24 2HG1 VAL 24 34.393 23.166 -11.731 183 3HG1 VAL 24 3HG1 VAL 24 32.677 23.486 -12.016 184 1HG2 VAL 24 1HG2 VAL 24 35.291 26.600 -10.470 185 2HG2 VAL 24 2HG2 VAL 24 35.950 25.007 -10.874 186 3HG2 VAL 24 3HG2 VAL 24 35.449 26.142 -12.170 187 H THR 25 H THR 25 30.635 25.757 -13.059 188 HA THR 25 HA THR 25 28.737 24.609 -11.032 189 HB THR 25 HB THR 25 26.946 25.676 -12.328 190 HG1 THR 25 HG1 THR 25 28.981 27.431 -13.189 191 1HG2 THR 25 1HG2 THR 25 28.595 27.756 -10.777 192 2HG2 THR 25 2HG2 THR 25 27.411 26.624 -10.069 193 3HG2 THR 25 3HG2 THR 25 26.865 27.901 -11.189 194 H ILE 26 H ILE 26 29.064 22.718 -11.759 195 HA ILE 26 HA ILE 26 29.490 21.701 -14.325 196 HB ILE 26 HB ILE 26 29.971 20.878 -11.899 197 1HG1 ILE 26 1HG1 ILE 26 29.077 18.413 -13.541 198 2HG1 ILE 26 2HG1 ILE 26 30.265 19.461 -14.216 199 1HG2 ILE 26 1HG2 ILE 26 27.607 20.727 -10.947 200 2HG2 ILE 26 2HG2 ILE 26 28.504 19.184 -10.766 201 3HG2 ILE 26 3HG2 ILE 26 27.270 19.348 -12.037 202 1HD1 ILE 26 1HD1 ILE 26 31.380 17.643 -12.954 203 2HD1 ILE 26 2HD1 ILE 26 30.568 18.198 -11.444 204 3HD1 ILE 26 3HD1 ILE 26 31.749 19.246 -12.258 205 H ARG 27 H ARG 27 28.216 19.985 -15.447 206 HA ARG 27 HA ARG 27 25.245 20.017 -15.229 207 1HB ARG 27 1HB ARG 27 25.447 21.739 -16.792 208 2HB ARG 27 2HB ARG 27 26.530 20.720 -17.857 209 1HG ARG 27 2HG ARG 27 24.734 19.294 -18.352 210 2HG ARG 27 1HG ARG 27 23.613 20.194 -17.301 211 1HD ARG 27 1HD ARG 27 24.985 21.445 -19.791 212 2HD ARG 27 2HD ARG 27 23.485 20.542 -19.904 213 HE ARG 27 HE ARG 27 23.802 23.246 -18.574 214 1HH1 ARG 27 2HH2 ARG 27 21.448 20.667 -19.451 215 2HH1 ARG 27 1HH2 ARG 27 20.076 21.842 -19.126 216 1HH2 ARG 27 1HH1 ARG 27 22.160 24.428 -18.254 217 2HH2 ARG 27 2HH1 ARG 27 20.453 23.804 -18.502 218 H CYS 28 H CYS 28 25.145 18.208 -15.028 219 HA CYS 28 HA CYS 28 26.719 15.943 -16.406 220 1HB CYS 28 1HB CYS 28 26.619 15.927 -13.732 221 2HB CYS 28 2HB CYS 28 25.066 15.119 -13.992 222 H GLU 29 H GLU 29 25.622 15.478 -18.132 223 HA GLU 29 HA GLU 29 22.744 16.230 -18.510 224 1HB GLU 29 1HB GLU 29 24.819 15.093 -20.487 225 2HB GLU 29 2HB GLU 29 23.156 15.406 -20.958 226 1HG GLU 29 1HG GLU 29 23.390 17.837 -20.477 227 2HG GLU 29 2HG GLU 29 25.065 17.590 -19.967 Start of MODEL 20 1 1H SER 1 1H SER 1 25.246 9.178 -16.521 2 2H SER 1 2H SER 1 26.761 9.425 -15.911 3 3H SER 1 3H SER 1 26.549 9.220 -17.536 4 HA SER 1 HA SER 1 25.268 11.262 -17.702 5 1HB SER 1 2HB SER 1 24.372 11.160 -15.367 6 2HB SER 1 1HB SER 1 25.986 11.508 -14.719 7 HG SER 1 HG SER 1 24.680 13.356 -14.924 8 H LYS 2 H LYS 2 26.543 12.696 -18.700 9 HA LYS 2 HA LYS 2 29.549 12.676 -18.276 10 1HB LYS 2 2HB LYS 2 27.906 14.005 -20.496 11 2HB LYS 2 1HB LYS 2 29.659 14.116 -20.357 12 1HG LYS 2 1HG LYS 2 29.896 11.645 -20.631 13 2HG LYS 2 2HG LYS 2 28.143 11.485 -20.779 14 1HD LYS 2 1HD LYS 2 28.176 12.939 -22.859 15 2HD LYS 2 2HD LYS 2 29.928 13.108 -22.717 16 1HE LYS 2 1HE LYS 2 30.199 10.605 -23.023 17 2HE LYS 2 2HE LYS 2 28.439 10.435 -23.165 18 1HZ LYS 2 1HZ LYS 2 30.152 12.078 -24.970 19 2HZ LYS 2 2HZ LYS 2 28.513 11.919 -25.103 20 3HZ LYS 2 3HZ LYS 2 29.491 10.608 -25.336 21 H TYR 3 H TYR 3 30.569 14.327 -17.371 22 HA TYR 3 HA TYR 3 29.049 16.635 -16.151 23 1HB TYR 3 1HB TYR 3 30.812 17.023 -14.754 24 2HB TYR 3 2HB TYR 3 30.593 15.322 -14.716 25 HD1 TYR 3 HD1 TYR 3 32.323 13.959 -16.462 26 HD2 TYR 3 HD2 TYR 3 33.090 17.884 -14.896 27 HE1 TYR 3 HE1 TYR 3 34.713 13.707 -16.922 28 HE2 TYR 3 HE2 TYR 3 35.455 17.561 -15.313 29 HH TYR 3 HH TYR 3 37.028 16.253 -16.106 30 H GLU 4 H GLU 4 28.998 18.528 -17.173 31 HA GLU 4 HA GLU 4 31.402 19.482 -18.878 32 1HB GLU 4 1HB GLU 4 29.958 19.160 -20.560 33 2HB GLU 4 2HB GLU 4 28.498 19.350 -19.648 34 1HG GLU 4 2HG GLU 4 28.894 21.890 -19.646 35 2HG GLU 4 1HG GLU 4 30.253 21.626 -20.729 36 H TYR 5 H TYR 5 32.431 20.436 -17.206 37 HA TYR 5 HA TYR 5 31.004 22.685 -15.717 38 1HB TYR 5 1HB TYR 5 32.496 22.696 -13.950 39 2HB TYR 5 2HB TYR 5 31.661 21.234 -13.936 40 HD1 TYR 5 HD1 TYR 5 33.685 21.516 -12.062 41 HD2 TYR 5 HD2 TYR 5 34.293 20.327 -16.126 42 HE1 TYR 5 HE1 TYR 5 36.008 21.091 -11.583 43 HE2 TYR 5 HE2 TYR 5 36.672 19.893 -15.594 44 HH TYR 5 HH TYR 5 37.949 20.381 -12.345 45 H THR 6 H THR 6 31.642 24.397 -16.108 46 HA THR 6 HA THR 6 33.895 24.845 -18.133 47 HB THR 6 HB THR 6 31.642 26.894 -17.571 48 HG1 THR 6 HG1 THR 6 30.449 25.836 -19.154 49 1HG2 THR 6 1HG2 THR 6 33.527 27.435 -19.253 50 2HG2 THR 6 2HG2 THR 6 32.987 26.020 -20.180 51 3HG2 THR 6 3HG2 THR 6 31.868 27.375 -19.978 52 H ILE 7 H ILE 7 35.653 26.007 -17.576 53 HA ILE 7 HA ILE 7 35.692 27.631 -14.981 54 HB ILE 7 HB ILE 7 37.775 25.495 -15.737 55 1HG1 ILE 7 2HG1 ILE 7 36.989 24.434 -13.328 56 2HG1 ILE 7 1HG1 ILE 7 35.548 25.384 -13.621 57 1HG2 ILE 7 1HG2 ILE 7 38.836 25.938 -13.532 58 2HG2 ILE 7 2HG2 ILE 7 38.768 27.404 -14.532 59 3HG2 ILE 7 3HG2 ILE 7 37.608 27.200 -13.186 60 1HD1 ILE 7 1HD1 ILE 7 34.995 23.294 -14.313 61 2HD1 ILE 7 2HD1 ILE 7 36.600 22.881 -14.990 62 3HD1 ILE 7 3HD1 ILE 7 35.466 23.924 -15.893 63 HA DPR 8 HA PRO 8 38.500 30.240 -17.363 64 1HB DPR 8 2HB PRO 8 37.740 31.971 -16.072 65 2HB DPR 8 1HB PRO 8 37.166 32.650 -17.606 66 1HG DPR 8 2HG PRO 8 35.438 32.293 -15.510 67 2HG DPR 8 1HG PRO 8 34.905 31.911 -17.173 68 1HD DPR 8 1HD PRO 8 35.662 29.965 -14.979 69 2HD DPR 8 2HD PRO 8 34.539 29.738 -16.338 70 H SER 9 H SER 9 39.059 29.857 -19.357 71 HA SER 9 HA SER 9 37.355 30.462 -21.784 72 1HB SER 9 2HB SER 9 40.244 29.451 -21.530 73 2HB SER 9 1HB SER 9 39.433 29.826 -23.058 74 HG SER 9 HG SER 9 40.644 31.557 -22.280 75 H TYR 10 H TYR 10 37.952 27.639 -19.784 76 HA TYR 10 HA TYR 10 37.728 25.753 -22.181 77 1HB TYR 10 2HB TYR 10 38.861 25.490 -19.323 78 2HB TYR 10 1HB TYR 10 38.209 24.062 -20.022 79 HD1 TYR 10 HD1 TYR 10 41.003 26.485 -20.332 80 HD2 TYR 10 HD2 TYR 10 39.188 22.962 -22.030 81 HE1 TYR 10 HE1 TYR 10 43.065 25.927 -21.474 82 HE2 TYR 10 HE2 TYR 10 41.255 22.442 -23.148 83 HH TYR 10 HH TYR 10 43.361 23.051 -23.531 84 H THR 11 H THR 11 36.002 24.518 -22.518 85 HA THR 11 HA THR 11 33.875 24.126 -20.356 86 HB THR 11 HB THR 11 33.731 23.542 -23.367 87 HG1 THR 11 HG1 THR 11 32.720 25.770 -21.925 88 1HG2 THR 11 1HG2 THR 11 31.989 22.343 -21.955 89 2HG2 THR 11 2HG2 THR 11 31.414 23.905 -21.337 90 3HG2 THR 11 3HG2 THR 11 31.246 23.509 -23.075 91 H PHE 12 H PHE 12 34.561 22.510 -19.259 92 HA PHE 12 HA PHE 12 36.466 20.369 -20.426 93 1HB PHE 12 1HB PHE 12 35.782 21.016 -17.537 94 2HB PHE 12 2HB PHE 12 36.655 19.584 -17.978 95 HD1 PHE 12 HD1 PHE 12 39.001 19.754 -19.020 96 HD2 PHE 12 HD2 PHE 12 36.964 23.201 -17.426 97 HE1 PHE 12 HE1 PHE 12 41.124 20.853 -18.599 98 HE2 PHE 12 HE2 PHE 12 39.118 24.230 -16.978 99 HZ PHE 12 HZ PHE 12 41.189 23.082 -17.534 100 H ARG 13 H ARG 13 35.061 19.023 -21.520 101 HA ARG 13 HA ARG 13 32.491 18.030 -20.180 102 1HB ARG 13 1HB ARG 13 32.855 17.742 -23.162 103 2HB ARG 13 2HB ARG 13 31.405 17.683 -22.132 104 1HG ARG 13 1HG ARG 13 31.437 20.149 -21.926 105 2HG ARG 13 2HG ARG 13 32.908 20.236 -22.882 106 1HD ARG 13 2HD ARG 13 31.704 19.217 -24.865 107 2HD ARG 13 1HD ARG 13 30.214 19.131 -23.912 108 HE ARG 13 HE ARG 13 30.966 21.858 -23.738 109 1HH1 ARG 13 1HH2 ARG 13 30.268 19.741 -26.568 110 2HH1 ARG 13 2HH2 ARG 13 29.739 21.221 -27.514 111 1HH2 ARG 13 2HH1 ARG 13 30.342 23.402 -24.931 112 2HH2 ARG 13 1HH1 ARG 13 29.780 23.128 -26.656 113 H GLY 14 H GLY 14 32.565 15.940 -19.507 114 1HA GLY 14 2HA GLY 14 33.672 13.725 -21.143 115 2HA GLY 14 1HA GLY 14 34.749 14.088 -19.801 116 HA PRO 15 HA PRO 15 31.264 11.257 -18.124 117 1HB PRO 15 2HB PRO 15 32.411 8.854 -17.658 118 2HB PRO 15 1HB PRO 15 32.019 9.417 -19.299 119 1HG PRO 15 1HG PRO 15 34.699 9.498 -17.872 120 2HG PRO 15 2HG PRO 15 34.349 8.854 -19.513 121 1HD PRO 15 2HD PRO 15 35.303 11.476 -19.022 122 2HD PRO 15 1HD PRO 15 34.286 11.078 -20.433 123 H GLY 16 H GLY 16 30.851 10.353 -16.001 124 1HA GLY 16 2HA GLY 16 31.085 10.113 -13.626 125 2HA GLY 16 1HA GLY 16 32.709 10.779 -13.713 126 H CYS 17 H CYS 17 29.632 11.440 -12.747 127 HA CYS 17 HA CYS 17 29.943 14.478 -12.722 128 1HB CYS 17 2HB CYS 17 27.762 13.591 -13.462 129 2HB CYS 17 1HB CYS 17 27.536 12.711 -11.938 130 HA PRO 18 HA PRO 18 31.235 14.081 -8.239 131 1HB PRO 18 1HB PRO 18 33.437 15.685 -8.207 132 2HB PRO 18 2HB PRO 18 33.476 14.020 -8.822 133 1HG PRO 18 1HG PRO 18 33.350 16.610 -10.443 134 2HG PRO 18 2HG PRO 18 34.403 15.191 -10.725 135 1HD PRO 18 1HD PRO 18 31.903 15.604 -12.030 136 2HD PRO 18 2HD PRO 18 32.635 13.999 -11.768 137 H THR 19 H THR 19 31.444 15.882 -6.591 138 HA THR 19 HA THR 19 29.536 18.188 -7.076 139 HB THR 19 HB THR 19 30.212 18.641 -4.557 140 HG1 THR 19 HG1 THR 19 30.791 15.888 -4.750 141 1HG2 THR 19 1HG2 THR 19 28.371 16.354 -5.202 142 2HG2 THR 19 2HG2 THR 19 28.476 17.267 -3.640 143 3HG2 THR 19 3HG2 THR 19 27.986 18.107 -5.143 144 H VAL 20 H VAL 20 30.178 20.288 -7.002 145 HA VAL 20 HA VAL 20 33.063 20.900 -6.608 146 HB VAL 20 HB VAL 20 33.333 22.206 -8.733 147 1HG1 VAL 20 1HG1 VAL 20 33.945 20.375 -10.229 148 2HG1 VAL 20 2HG1 VAL 20 34.284 19.903 -8.562 149 3HG1 VAL 20 3HG1 VAL 20 32.844 19.257 -9.387 150 1HG2 VAL 20 1HG2 VAL 20 30.747 20.957 -9.806 151 2HG2 VAL 20 2HG2 VAL 20 31.012 22.675 -9.434 152 3HG2 VAL 20 3HG2 VAL 20 31.898 21.908 -10.767 153 H LYS 21 H LYS 21 33.729 23.249 -6.640 154 HA LYS 21 HA LYS 21 32.543 24.442 -4.477 155 1HB LYS 21 2HB LYS 21 34.403 25.405 -6.781 156 2HB LYS 21 1HB LYS 21 34.218 26.297 -5.316 157 1HG LYS 21 2HG LYS 21 35.097 24.445 -3.898 158 2HG LYS 21 1HG LYS 21 35.288 23.438 -5.351 159 1HD LYS 21 2HD LYS 21 36.796 25.058 -6.354 160 2HD LYS 21 1HD LYS 21 36.614 26.139 -4.931 161 1HE LYS 21 2HE LYS 21 37.710 24.372 -3.466 162 2HE LYS 21 1HE LYS 21 37.893 23.308 -4.876 163 1HZ LYS 21 1HZ LYS 21 39.910 24.586 -4.460 164 2HZ LYS 21 2HZ LYS 21 39.275 25.030 -5.919 165 3HZ LYS 21 3HZ LYS 21 39.105 26.021 -4.608 166 HA PRO 22 HA PRO 22 29.612 27.658 -6.068 167 1HB PRO 22 2HB PRO 22 30.016 29.919 -4.464 168 2HB PRO 22 1HB PRO 22 29.198 28.427 -3.978 169 1HG PRO 22 1HG PRO 22 31.840 29.413 -3.065 170 2HG PRO 22 2HG PRO 22 30.772 28.183 -2.346 171 1HD PRO 22 2HD PRO 22 33.122 27.816 -4.142 172 2HD PRO 22 1HD PRO 22 32.287 26.544 -3.250 173 H DAL 23 H ALA 23 29.819 28.606 -8.038 174 HA DAL 23 HA ALA 23 32.447 29.961 -8.841 175 1HB DAL 23 1HB ALA 23 30.805 31.786 -8.479 176 2HB DAL 23 2HB ALA 23 29.662 31.011 -9.609 177 3HB DAL 23 3HB ALA 23 31.223 31.634 -10.206 178 H VAL 24 H VAL 24 32.553 27.511 -9.187 179 HA VAL 24 HA VAL 24 32.231 26.884 -12.092 180 HB VAL 24 HB VAL 24 33.307 25.140 -9.829 181 1HG1 VAL 24 1HG1 VAL 24 33.621 24.617 -12.883 182 2HG1 VAL 24 2HG1 VAL 24 34.310 23.598 -11.578 183 3HG1 VAL 24 3HG1 VAL 24 32.560 23.739 -11.793 184 1HG2 VAL 24 1HG2 VAL 24 34.847 27.049 -10.155 185 2HG2 VAL 24 2HG2 VAL 24 35.654 25.547 -10.622 186 3HG2 VAL 24 3HG2 VAL 24 35.042 26.672 -11.877 187 H THR 25 H THR 25 30.259 26.011 -12.809 188 HA THR 25 HA THR 25 28.457 24.513 -10.918 189 HB THR 25 HB THR 25 26.601 25.442 -12.221 190 HG1 THR 25 HG1 THR 25 28.454 27.446 -12.935 191 1HG2 THR 25 1HG2 THR 25 27.963 27.613 -10.525 192 2HG2 THR 25 2HG2 THR 25 26.240 27.587 -10.990 193 3HG2 THR 25 3HG2 THR 25 26.892 26.325 -9.909 194 H ILE 26 H ILE 26 29.033 22.726 -11.718 195 HA ILE 26 HA ILE 26 29.529 21.823 -14.340 196 HB ILE 26 HB ILE 26 30.070 20.949 -11.977 197 1HG1 ILE 26 2HG1 ILE 26 29.354 18.373 -13.506 198 2HG1 ILE 26 1HG1 ILE 26 30.347 19.520 -14.328 199 1HG2 ILE 26 1HG2 ILE 26 27.491 19.242 -12.025 200 2HG2 ILE 26 2HG2 ILE 26 27.773 20.658 -10.961 201 3HG2 ILE 26 3HG2 ILE 26 28.781 19.192 -10.796 202 1HD1 ILE 26 1HD1 ILE 26 31.020 18.451 -11.543 203 2HD1 ILE 26 2HD1 ILE 26 31.819 17.954 -13.066 204 3HD1 ILE 26 3HD1 ILE 26 31.993 19.622 -12.442 205 H ARG 27 H ARG 27 28.302 20.090 -15.549 206 HA ARG 27 HA ARG 27 25.304 20.168 -15.349 207 1HB ARG 27 2HB ARG 27 25.654 21.852 -16.922 208 2HB ARG 27 1HB ARG 27 26.647 20.722 -17.966 209 1HG ARG 27 1HG ARG 27 24.717 19.435 -18.402 210 2HG ARG 27 2HG ARG 27 23.698 20.459 -17.360 211 1HD ARG 27 1HD ARG 27 25.121 21.515 -19.914 212 2HD ARG 27 2HD ARG 27 23.532 20.763 -19.957 213 HE ARG 27 HE ARG 27 23.260 22.822 -18.004 214 1HH1 ARG 27 2HH2 ARG 27 24.037 22.833 -21.521 215 2HH1 ARG 27 1HH2 ARG 27 23.314 24.515 -21.651 216 1HH2 ARG 27 1HH1 ARG 27 22.493 24.695 -18.322 217 2HH2 ARG 27 2HH1 ARG 27 22.510 25.481 -19.979 218 H CYS 28 H CYS 28 25.190 18.409 -14.977 219 HA CYS 28 HA CYS 28 26.762 15.959 -15.953 220 1HB CYS 28 1HB CYS 28 24.801 16.233 -13.591 221 2HB CYS 28 2HB CYS 28 25.666 14.749 -14.067 222 H GLU 29 H GLU 29 25.875 15.274 -17.786 223 HA GLU 29 HA GLU 29 23.231 16.099 -18.757 224 1HB GLU 29 2HB GLU 29 25.370 14.247 -20.003 225 2HB GLU 29 1HB GLU 29 23.868 14.594 -20.839 226 1HG GLU 29 1HG GLU 29 24.376 17.028 -20.925 227 2HG GLU 29 2HG GLU 29 25.896 16.757 -20.064 Start of MODEL 21 1 1H SER 1 1H SER 1 25.703 9.173 -18.654 2 2H SER 1 2H SER 1 24.582 8.807 -17.497 3 3H SER 1 3H SER 1 26.179 8.472 -17.236 4 HA SER 1 HA SER 1 24.969 11.167 -17.509 5 1HB SER 1 1HB SER 1 25.488 11.438 -15.097 6 2HB SER 1 2HB SER 1 24.364 10.101 -15.386 7 HG SER 1 HG SER 1 26.160 8.681 -15.275 8 H LYS 2 H LYS 2 26.401 12.692 -18.028 9 HA LYS 2 HA LYS 2 29.374 12.355 -17.528 10 1HB LYS 2 2HB LYS 2 30.093 13.047 -19.697 11 2HB LYS 2 1HB LYS 2 29.172 11.564 -19.776 12 1HG LYS 2 2HG LYS 2 27.234 12.781 -20.767 13 2HG LYS 2 1HG LYS 2 28.086 14.310 -20.669 14 1HD LYS 2 1HD LYS 2 29.149 11.915 -22.309 15 2HD LYS 2 2HD LYS 2 27.964 13.023 -22.946 16 1HE LYS 2 1HE LYS 2 30.731 13.982 -21.997 17 2HE LYS 2 2HE LYS 2 30.423 13.395 -23.631 18 1HZ LYS 2 1HZ LYS 2 30.256 15.797 -23.533 19 2HZ LYS 2 2HZ LYS 2 29.055 15.736 -22.400 20 3HZ LYS 2 3HZ LYS 2 28.780 15.168 -23.926 21 H TYR 3 H TYR 3 30.514 14.232 -17.198 22 HA TYR 3 HA TYR 3 28.846 16.587 -16.293 23 1HB TYR 3 2HB TYR 3 30.664 17.414 -15.087 24 2HB TYR 3 1HB TYR 3 30.344 15.798 -14.590 25 HD1 TYR 3 HD1 TYR 3 32.888 18.081 -15.981 26 HD2 TYR 3 HD2 TYR 3 32.052 13.927 -15.232 27 HE1 TYR 3 HE1 TYR 3 35.253 17.551 -16.154 28 HE2 TYR 3 HE2 TYR 3 34.448 13.463 -15.341 29 HH TYR 3 HH TYR 3 36.460 14.253 -15.690 30 H GLU 4 H GLU 4 28.968 18.547 -17.158 31 HA GLU 4 HA GLU 4 31.299 19.318 -19.049 32 1HB GLU 4 2HB GLU 4 29.727 19.168 -20.642 33 2HB GLU 4 1HB GLU 4 28.348 19.485 -19.627 34 1HG GLU 4 1HG GLU 4 28.956 21.972 -19.658 35 2HG GLU 4 2HG GLU 4 30.244 21.612 -20.801 36 H TYR 5 H TYR 5 32.527 20.295 -17.527 37 HA TYR 5 HA TYR 5 31.239 22.269 -15.608 38 1HB TYR 5 1HB TYR 5 32.349 21.688 -13.772 39 2HB TYR 5 2HB TYR 5 32.109 20.106 -14.442 40 HD1 TYR 5 HD1 TYR 5 34.711 19.999 -16.274 41 HD2 TYR 5 HD2 TYR 5 34.018 21.069 -12.173 42 HE1 TYR 5 HE1 TYR 5 37.081 19.640 -15.726 43 HE2 TYR 5 HE2 TYR 5 36.368 20.801 -11.713 44 HH TYR 5 HH TYR 5 38.339 20.189 -12.482 45 H THR 6 H THR 6 31.830 24.059 -15.907 46 HA THR 6 HA THR 6 34.061 24.660 -17.892 47 HB THR 6 HB THR 6 31.699 26.528 -17.177 48 HG1 THR 6 HG1 THR 6 30.647 25.592 -18.935 49 1HG2 THR 6 1HG2 THR 6 33.559 27.440 -18.663 50 2HG2 THR 6 2HG2 THR 6 31.965 27.301 -19.509 51 3HG2 THR 6 3HG2 THR 6 33.247 26.099 -19.793 52 H ILE 7 H ILE 7 35.654 25.988 -17.374 53 HA ILE 7 HA ILE 7 35.800 27.245 -14.581 54 HB ILE 7 HB ILE 7 37.983 25.487 -15.857 55 1HG1 ILE 7 1HG1 ILE 7 37.510 24.021 -13.535 56 2HG1 ILE 7 2HG1 ILE 7 35.952 24.810 -13.625 57 1HG2 ILE 7 1HG2 ILE 7 38.920 27.286 -14.447 58 2HG2 ILE 7 2HG2 ILE 7 37.916 26.774 -13.061 59 3HG2 ILE 7 3HG2 ILE 7 39.210 25.705 -13.691 60 1HD1 ILE 7 1HD1 ILE 7 35.676 22.733 -14.524 61 2HD1 ILE 7 2HD1 ILE 7 37.174 22.752 -15.480 62 3HD1 ILE 7 3HD1 ILE 7 35.754 23.720 -15.991 63 HA DPR 8 HA PRO 8 38.180 30.437 -16.744 64 1HB DPR 8 1HB PRO 8 37.630 31.710 -14.920 65 2HB DPR 8 2HB PRO 8 36.852 32.746 -16.136 66 1HG DPR 8 1HG PRO 8 35.440 31.798 -13.973 67 2HG DPR 8 2HG PRO 8 34.668 31.900 -15.580 68 1HD DPR 8 2HD PRO 8 35.574 29.424 -14.133 69 2HD DPR 8 1HD PRO 8 34.375 29.578 -15.436 70 H SER 9 H SER 9 38.185 29.975 -18.892 71 HA SER 9 HA SER 9 35.893 30.878 -20.699 72 1HB SER 9 1HB SER 9 38.903 31.250 -21.244 73 2HB SER 9 2HB SER 9 37.607 31.500 -22.421 74 HG SER 9 HG SER 9 38.211 33.410 -21.373 75 H TYR 10 H TYR 10 37.365 28.240 -19.458 76 HA TYR 10 HA TYR 10 37.552 26.707 -22.097 77 1HB TYR 10 1HB TYR 10 39.556 27.134 -20.238 78 2HB TYR 10 2HB TYR 10 38.823 25.795 -19.437 79 HD1 TYR 10 HD1 TYR 10 40.739 26.913 -22.398 80 HD2 TYR 10 HD2 TYR 10 38.846 23.501 -20.589 81 HE1 TYR 10 HE1 TYR 10 41.986 25.413 -23.868 82 HE2 TYR 10 HE2 TYR 10 40.123 22.031 -22.068 83 HH TYR 10 HH TYR 10 42.396 23.333 -24.459 84 H THR 11 H THR 11 36.058 25.107 -22.421 85 HA THR 11 HA THR 11 34.229 24.261 -20.167 86 HB THR 11 HB THR 11 33.994 23.589 -23.149 87 HG1 THR 11 HG1 THR 11 32.655 25.406 -23.303 88 1HG2 THR 11 1HG2 THR 11 31.708 24.066 -21.118 89 2HG2 THR 11 2HG2 THR 11 31.562 23.397 -22.767 90 3HG2 THR 11 3HG2 THR 11 32.343 22.452 -21.471 91 H PHE 12 H PHE 12 34.811 22.567 -19.176 92 HA PHE 12 HA PHE 12 36.725 20.441 -20.410 93 1HB PHE 12 2HB PHE 12 36.259 21.129 -17.473 94 2HB PHE 12 1HB PHE 12 37.120 19.710 -17.996 95 HD1 PHE 12 HD1 PHE 12 39.465 19.885 -18.897 96 HD2 PHE 12 HD2 PHE 12 37.299 23.441 -17.782 97 HE1 PHE 12 HE1 PHE 12 41.539 21.141 -18.754 98 HE2 PHE 12 HE2 PHE 12 39.399 24.633 -17.599 99 HZ PHE 12 HZ PHE 12 41.522 23.513 -18.073 100 H ARG 13 H ARG 13 35.526 18.698 -21.067 101 HA ARG 13 HA ARG 13 32.970 17.952 -19.562 102 1HB ARG 13 2HB ARG 13 33.042 17.841 -22.611 103 2HB ARG 13 1HB ARG 13 31.673 17.733 -21.488 104 1HG ARG 13 1HG ARG 13 31.919 20.173 -21.031 105 2HG ARG 13 2HG ARG 13 33.242 20.264 -22.165 106 1HD ARG 13 1HD ARG 13 30.402 19.392 -22.987 107 2HD ARG 13 2HD ARG 13 30.975 21.058 -23.015 108 HE ARG 13 HE ARG 13 31.845 18.876 -24.911 109 1HH1 ARG 13 1HH2 ARG 13 32.313 22.335 -24.029 110 2HH1 ARG 13 2HH2 ARG 13 33.125 22.613 -25.652 111 1HH2 ARG 13 1HH1 ARG 13 32.770 19.354 -26.673 112 2HH2 ARG 13 2HH1 ARG 13 33.361 21.054 -27.028 113 H GLY 14 H GLY 14 32.922 15.883 -18.998 114 1HA GLY 14 2HA GLY 14 33.896 13.638 -20.707 115 2HA GLY 14 1HA GLY 14 34.988 13.957 -19.366 116 HA PRO 15 HA PRO 15 31.246 11.239 -17.963 117 1HB PRO 15 1HB PRO 15 32.141 8.667 -17.796 118 2HB PRO 15 2HB PRO 15 31.670 9.440 -19.325 119 1HG PRO 15 1HG PRO 15 34.466 9.108 -18.164 120 2HG PRO 15 2HG PRO 15 33.905 8.671 -19.814 121 1HD PRO 15 1HD PRO 15 35.179 11.103 -19.252 122 2HD PRO 15 2HD PRO 15 33.914 10.983 -20.505 123 H GLY 16 H GLY 16 30.821 10.111 -15.990 124 1HA GLY 16 2HA GLY 16 30.941 9.740 -13.583 125 2HA GLY 16 1HA GLY 16 32.670 10.064 -13.672 126 H CYS 17 H CYS 17 29.568 11.455 -13.006 127 HA CYS 17 HA CYS 17 30.627 14.306 -12.927 128 1HB CYS 17 1HB CYS 17 28.599 15.073 -13.365 129 2HB CYS 17 2HB CYS 17 28.723 13.672 -14.403 130 HA PRO 18 HA PRO 18 30.171 14.088 -8.267 131 1HB PRO 18 2HB PRO 18 32.546 15.103 -7.453 132 2HB PRO 18 1HB PRO 18 32.418 13.466 -8.128 133 1HG PRO 18 2HG PRO 18 33.383 16.004 -9.536 134 2HG PRO 18 1HG PRO 18 34.156 14.389 -9.535 135 1HD PRO 18 1HD PRO 18 32.371 15.301 -11.556 136 2HD PRO 18 2HD PRO 18 32.641 13.586 -11.166 137 H THR 19 H THR 19 30.424 15.952 -6.586 138 HA THR 19 HA THR 19 28.895 18.367 -7.320 139 HB THR 19 HB THR 19 29.787 19.085 -4.935 140 HG1 THR 19 HG1 THR 19 30.401 17.358 -3.649 141 1HG2 THR 19 1HG2 THR 19 27.925 16.735 -5.105 142 2HG2 THR 19 2HG2 THR 19 28.176 17.838 -3.691 143 3HG2 THR 19 3HG2 THR 19 27.525 18.482 -5.231 144 H VAL 20 H VAL 20 29.582 20.589 -6.935 145 HA VAL 20 HA VAL 20 32.485 21.073 -7.361 146 HB VAL 20 HB VAL 20 32.156 22.833 -9.126 147 1HG1 VAL 20 1HG2 VAL 20 31.426 20.051 -10.117 148 2HG1 VAL 20 2HG2 VAL 20 33.060 20.671 -9.787 149 3HG1 VAL 20 3HG2 VAL 20 32.104 21.366 -11.117 150 1HG2 VAL 20 1HG1 VAL 20 29.685 23.300 -8.913 151 2HG2 VAL 20 2HG1 VAL 20 29.339 21.772 -9.759 152 3HG2 VAL 20 3HG1 VAL 20 30.239 23.082 -10.584 153 H LYS 21 H LYS 21 33.387 23.144 -6.912 154 HA LYS 21 HA LYS 21 32.375 24.287 -4.494 155 1HB LYS 21 2HB LYS 21 34.508 25.144 -4.421 156 2HB LYS 21 1HB LYS 21 34.640 23.572 -5.118 157 1HG LYS 21 2HG LYS 21 34.842 24.884 -7.455 158 2HG LYS 21 1HG LYS 21 34.981 26.353 -6.477 159 1HD LYS 21 1HD LYS 21 36.881 25.284 -5.225 160 2HD LYS 21 2HD LYS 21 36.713 23.849 -6.283 161 1HE LYS 21 2HE LYS 21 37.329 25.263 -8.300 162 2HE LYS 21 1HE LYS 21 37.484 26.694 -7.261 163 1HZ LYS 21 1HZ LYS 21 39.245 25.533 -6.030 164 2HZ LYS 21 2HZ LYS 21 39.629 25.631 -7.634 165 3HZ LYS 21 3HZ LYS 21 39.100 24.201 -6.996 166 HA PRO 22 HA PRO 22 30.497 28.236 -6.012 167 1HB PRO 22 1HB PRO 22 31.477 30.366 -4.557 168 2HB PRO 22 2HB PRO 22 30.463 29.073 -3.898 169 1HG PRO 22 2HG PRO 22 33.423 29.481 -3.504 170 2HG PRO 22 1HG PRO 22 32.220 28.798 -2.377 171 1HD PRO 22 2HD PRO 22 34.014 27.334 -4.164 172 2HD PRO 22 1HD PRO 22 32.724 26.597 -3.215 173 H DAL 23 H ALA 23 30.827 28.962 -8.068 174 HA DAL 23 HA ALA 23 33.633 29.667 -9.046 175 1HB DAL 23 1HB ALA 23 31.149 31.351 -9.698 176 2HB DAL 23 2HB ALA 23 32.514 31.841 -8.658 177 3HB DAL 23 3HB ALA 23 32.776 31.557 -10.400 178 H VAL 24 H VAL 24 33.240 27.284 -9.393 179 HA VAL 24 HA VAL 24 32.625 26.796 -12.254 180 HB VAL 24 HB VAL 24 33.470 24.795 -10.112 181 1HG1 VAL 24 1HG2 VAL 24 33.743 24.453 -13.206 182 2HG1 VAL 24 2HG2 VAL 24 34.234 23.256 -11.979 183 3HG1 VAL 24 3HG2 VAL 24 32.527 23.656 -12.190 184 1HG2 VAL 24 1HG1 VAL 24 35.295 26.428 -10.277 185 2HG2 VAL 24 2HG1 VAL 24 35.406 26.223 -12.033 186 3HG2 VAL 24 3HG1 VAL 24 35.862 24.885 -10.931 187 H THR 25 H THR 25 30.685 25.828 -13.016 188 HA THR 25 HA THR 25 28.669 24.728 -11.084 189 HB THR 25 HB THR 25 26.961 25.844 -12.459 190 HG1 THR 25 HG1 THR 25 29.075 27.554 -13.209 191 1HG2 THR 25 1HG2 THR 25 27.340 26.766 -10.173 192 2HG2 THR 25 2HG2 THR 25 28.583 27.873 -10.817 193 3HG2 THR 25 3HG2 THR 25 26.878 28.063 -11.309 194 H ILE 26 H ILE 26 28.973 22.835 -11.802 195 HA ILE 26 HA ILE 26 29.453 21.806 -14.368 196 HB ILE 26 HB ILE 26 29.861 20.965 -11.948 197 1HG1 ILE 26 2HG1 ILE 26 28.913 18.475 -13.510 198 2HG1 ILE 26 1HG1 ILE 26 30.059 19.491 -14.284 199 1HG2 ILE 26 1HG2 ILE 26 27.108 19.543 -12.113 200 2HG2 ILE 26 2HG2 ILE 26 28.319 19.337 -10.821 201 3HG2 ILE 26 3HG2 ILE 26 27.489 20.915 -11.032 202 1HD1 ILE 26 1HD1 ILE 26 30.499 18.366 -11.468 203 2HD1 ILE 26 2HD1 ILE 26 31.245 17.725 -12.975 204 3HD1 ILE 26 3HD1 ILE 26 31.638 19.369 -12.382 205 H ARG 27 H ARG 27 28.165 20.122 -15.491 206 HA ARG 27 HA ARG 27 25.177 20.289 -15.352 207 1HB ARG 27 1HB ARG 27 25.552 21.859 -17.037 208 2HB ARG 27 2HB ARG 27 26.555 20.659 -17.992 209 1HG ARG 27 1HG ARG 27 24.643 19.334 -18.388 210 2HG ARG 27 2HG ARG 27 23.606 20.400 -17.396 211 1HD ARG 27 1HD ARG 27 23.981 22.273 -19.075 212 2HD ARG 27 2HD ARG 27 24.976 21.182 -20.059 213 HE ARG 27 HE ARG 27 22.345 19.963 -19.541 214 1HH1 ARG 27 1HH2 ARG 27 23.803 22.446 -21.706 215 2HH1 ARG 27 2HH2 ARG 27 22.446 22.161 -22.907 216 1HH2 ARG 27 2HH1 ARG 27 20.905 19.768 -20.985 217 2HH2 ARG 27 1HH1 ARG 27 20.937 20.764 -22.527 218 H CYS 28 H CYS 28 25.018 18.545 -14.953 219 HA CYS 28 HA CYS 28 26.596 16.053 -15.902 220 1HB CYS 28 2HB CYS 28 26.707 16.160 -13.520 221 2HB CYS 28 1HB CYS 28 24.949 16.223 -13.309 222 H GLU 29 H GLU 29 25.587 15.377 -17.605 223 HA GLU 29 HA GLU 29 22.813 16.170 -18.337 224 1HB GLU 29 1HB GLU 29 24.932 14.549 -19.887 225 2HB GLU 29 2HB GLU 29 23.339 14.867 -20.555 226 1HG GLU 29 2HG GLU 29 23.716 17.326 -20.509 227 2HG GLU 29 1HG GLU 29 25.324 17.081 -19.814 Start of MODEL 22 1 1H SER 1 1H SER 1 25.739 9.614 -19.419 2 2H SER 1 2H SER 1 26.161 8.663 -18.136 3 3H SER 1 3H SER 1 24.580 9.086 -18.366 4 HA SER 1 HA SER 1 25.032 11.406 -17.954 5 1HB SER 1 1HB SER 1 26.049 9.493 -15.769 6 2HB SER 1 2HB SER 1 25.621 11.192 -15.499 7 HG SER 1 HG SER 1 23.917 9.184 -16.562 8 H LYS 2 H LYS 2 26.535 12.924 -18.214 9 HA LYS 2 HA LYS 2 29.477 12.427 -17.682 10 1HB LYS 2 1HB LYS 2 30.294 13.397 -19.711 11 2HB LYS 2 2HB LYS 2 29.394 11.930 -20.004 12 1HG LYS 2 2HG LYS 2 27.511 13.207 -20.965 13 2HG LYS 2 1HG LYS 2 28.268 14.740 -20.600 14 1HD LYS 2 2HD LYS 2 29.580 12.633 -22.472 15 2HD LYS 2 1HD LYS 2 28.342 13.747 -23.024 16 1HE LYS 2 2HE LYS 2 29.782 15.724 -22.481 17 2HE LYS 2 1HE LYS 2 31.055 14.644 -21.884 18 1HZ LYS 2 1HZ LYS 2 31.165 13.641 -24.111 19 2HZ LYS 2 2HZ LYS 2 29.979 14.647 -24.668 20 3HZ LYS 2 3HZ LYS 2 31.435 15.269 -24.196 21 H TYR 3 H TYR 3 30.587 14.170 -16.981 22 HA TYR 3 HA TYR 3 28.956 16.469 -15.897 23 1HB TYR 3 1HB TYR 3 30.580 16.969 -14.401 24 2HB TYR 3 2HB TYR 3 30.431 15.263 -14.347 25 HD1 TYR 3 HD1 TYR 3 32.822 17.934 -14.395 26 HD2 TYR 3 HD2 TYR 3 32.362 13.895 -15.802 27 HE1 TYR 3 HE1 TYR 3 35.231 17.656 -14.489 28 HE2 TYR 3 HE2 TYR 3 34.789 13.726 -16.009 29 HH TYR 3 HH TYR 3 36.918 16.374 -15.041 30 H GLU 4 H GLU 4 28.846 18.348 -17.048 31 HA GLU 4 HA GLU 4 31.286 19.191 -18.787 32 1HB GLU 4 2HB GLU 4 29.510 18.788 -20.219 33 2HB GLU 4 1HB GLU 4 28.317 19.660 -19.274 34 1HG GLU 4 2HG GLU 4 29.499 21.825 -19.814 35 2HG GLU 4 1HG GLU 4 30.681 20.915 -20.750 36 H TYR 5 H TYR 5 32.480 20.214 -17.319 37 HA TYR 5 HA TYR 5 31.187 22.224 -15.427 38 1HB TYR 5 1HB TYR 5 32.405 21.725 -13.633 39 2HB TYR 5 2HB TYR 5 32.235 20.119 -14.257 40 HD1 TYR 5 HD1 TYR 5 34.245 21.370 -12.169 41 HD2 TYR 5 HD2 TYR 5 34.663 20.006 -16.214 42 HE1 TYR 5 HE1 TYR 5 36.635 21.213 -11.870 43 HE2 TYR 5 HE2 TYR 5 37.091 19.836 -15.858 44 HH TYR 5 HH TYR 5 38.760 20.070 -14.470 45 H THR 6 H THR 6 31.592 24.016 -15.971 46 HA THR 6 HA THR 6 33.717 24.615 -18.064 47 HB THR 6 HB THR 6 31.289 26.397 -17.340 48 HG1 THR 6 HG1 THR 6 31.346 24.196 -19.123 49 1HG2 THR 6 1HG2 THR 6 31.325 26.950 -19.749 50 2HG2 THR 6 2HG2 THR 6 32.971 27.260 -19.056 51 3HG2 THR 6 3HG2 THR 6 32.649 25.805 -20.024 52 H ILE 7 H ILE 7 35.372 25.980 -17.626 53 HA ILE 7 HA ILE 7 35.427 27.579 -15.020 54 HB ILE 7 HB ILE 7 37.654 25.644 -15.912 55 1HG1 ILE 7 1HG1 ILE 7 37.102 24.463 -13.499 56 2HG1 ILE 7 2HG1 ILE 7 35.564 25.278 -13.689 57 1HG2 ILE 7 1HG2 ILE 7 37.451 27.286 -13.324 58 2HG2 ILE 7 2HG2 ILE 7 38.517 27.622 -14.721 59 3HG2 ILE 7 3HG2 ILE 7 38.777 26.155 -13.755 60 1HD1 ILE 7 1HD1 ILE 7 35.550 23.866 -16.020 61 2HD1 ILE 7 2HD1 ILE 7 35.089 23.217 -14.467 62 3HD1 ILE 7 3HD1 ILE 7 36.727 22.873 -15.116 63 HA DPR 8 HA PRO 8 37.919 30.395 -17.505 64 1HB DPR 8 1HB PRO 8 37.111 32.060 -16.155 65 2HB DPR 8 2HB PRO 8 36.416 32.715 -17.649 66 1HG DPR 8 2HG PRO 8 34.823 32.222 -15.477 67 2HG DPR 8 1HG PRO 8 34.236 31.817 -17.116 68 1HD DPR 8 2HD PRO 8 35.238 29.913 -14.985 69 2HD DPR 8 1HD PRO 8 34.058 29.621 -16.282 70 H SER 9 H SER 9 38.404 30.063 -19.523 71 HA SER 9 HA SER 9 36.554 30.591 -21.857 72 1HB SER 9 1HB SER 9 38.543 30.233 -23.250 73 2HB SER 9 2HB SER 9 38.879 31.430 -21.997 74 HG SER 9 HG SER 9 39.828 29.739 -20.763 75 H TYR 10 H TYR 10 37.431 27.785 -19.941 76 HA TYR 10 HA TYR 10 37.230 25.933 -22.367 77 1HB TYR 10 1HB TYR 10 38.514 25.697 -19.572 78 2HB TYR 10 2HB TYR 10 37.922 24.244 -20.274 79 HD1 TYR 10 HD1 TYR 10 38.848 23.260 -22.367 80 HD2 TYR 10 HD2 TYR 10 40.564 26.814 -20.632 81 HE1 TYR 10 HE1 TYR 10 40.894 22.862 -23.568 82 HE2 TYR 10 HE2 TYR 10 42.608 26.379 -21.857 83 HH TYR 10 HH TYR 10 42.958 23.576 -24.006 84 H THR 11 H THR 11 35.622 24.529 -22.636 85 HA THR 11 HA THR 11 33.573 23.998 -20.426 86 HB THR 11 HB THR 11 33.408 23.387 -23.427 87 HG1 THR 11 HG1 THR 11 32.114 25.255 -23.570 88 1HG2 THR 11 1HG2 THR 11 31.676 22.160 -22.254 89 2HG2 THR 11 2HG2 THR 11 30.883 23.531 -23.055 90 3HG2 THR 11 3HG2 THR 11 31.190 23.590 -21.297 91 H PHE 12 H PHE 12 34.486 22.453 -19.313 92 HA PHE 12 HA PHE 12 36.415 20.405 -20.610 93 1HB PHE 12 2HB PHE 12 35.952 21.032 -17.677 94 2HB PHE 12 1HB PHE 12 36.905 19.682 -18.205 95 HD1 PHE 12 HD1 PHE 12 36.945 23.306 -17.630 96 HD2 PHE 12 HD2 PHE 12 39.155 20.065 -19.400 97 HE1 PHE 12 HE1 PHE 12 39.025 24.489 -17.247 98 HE2 PHE 12 HE2 PHE 12 41.204 21.325 -19.067 99 HZ PHE 12 HZ PHE 12 41.149 23.529 -17.933 100 H ARG 13 H ARG 13 35.053 18.790 -21.394 101 HA ARG 13 HA ARG 13 32.720 17.794 -19.737 102 1HB ARG 13 2HB ARG 13 32.337 17.239 -22.603 103 2HB ARG 13 1HB ARG 13 31.328 17.953 -21.384 104 1HG ARG 13 1HG ARG 13 31.277 19.579 -22.908 105 2HG ARG 13 2HG ARG 13 32.504 20.165 -21.770 106 1HD ARG 13 2HD ARG 13 34.346 19.477 -23.301 107 2HD ARG 13 1HD ARG 13 33.186 18.759 -24.432 108 HE ARG 13 HE ARG 13 32.530 21.591 -23.927 109 1HH1 ARG 13 1HH1 ARG 13 34.729 19.588 -25.962 110 2HH1 ARG 13 2HH1 ARG 13 34.822 20.961 -27.175 111 1HH2 ARG 13 1HH2 ARG 13 32.746 23.025 -25.382 112 2HH2 ARG 13 2HH2 ARG 13 33.786 22.751 -26.868 113 H GLY 14 H GLY 14 32.979 15.832 -18.977 114 1HA GLY 14 2HA GLY 14 33.902 13.521 -20.647 115 2HA GLY 14 1HA GLY 14 35.027 13.912 -19.349 116 HA PRO 15 HA PRO 15 31.393 11.270 -17.619 117 1HB PRO 15 1HB PRO 15 32.373 8.779 -17.183 118 2HB PRO 15 2HB PRO 15 31.979 9.383 -18.807 119 1HG PRO 15 2HG PRO 15 34.700 9.265 -17.451 120 2HG PRO 15 1HG PRO 15 34.263 8.658 -19.084 121 1HD PRO 15 1HD PRO 15 35.412 11.191 -18.638 122 2HD PRO 15 2HD PRO 15 34.288 10.888 -19.990 123 H GLY 16 H GLY 16 30.946 10.286 -15.520 124 1HA GLY 16 1HA GLY 16 31.186 9.964 -13.150 125 2HA GLY 16 2HA GLY 16 32.820 10.613 -13.222 126 H CYS 17 H CYS 17 29.698 11.313 -12.299 127 HA CYS 17 HA CYS 17 30.038 14.342 -12.338 128 1HB CYS 17 1HB CYS 17 27.548 12.633 -11.708 129 2HB CYS 17 2HB CYS 17 27.593 14.395 -11.847 130 HA PRO 18 HA PRO 18 30.742 14.131 -7.725 131 1HB PRO 18 2HB PRO 18 33.104 15.456 -7.497 132 2HB PRO 18 1HB PRO 18 33.019 13.762 -8.027 133 1HG PRO 18 1HG PRO 18 33.410 16.249 -9.761 134 2HG PRO 18 2HG PRO 18 34.307 14.703 -9.841 135 1HD PRO 18 2HD PRO 18 32.038 15.331 -11.465 136 2HD PRO 18 1HD PRO 18 32.554 13.672 -11.065 137 H THR 19 H THR 19 31.026 16.046 -6.182 138 HA THR 19 HA THR 19 29.400 18.459 -6.986 139 HB THR 19 HB THR 19 30.085 19.124 -4.509 140 HG1 THR 19 HG1 THR 19 31.571 17.431 -4.250 141 1HG2 THR 19 1HG2 THR 19 27.833 18.728 -5.078 142 2HG2 THR 19 2HG2 THR 19 28.233 18.008 -3.488 143 3HG2 THR 19 3HG2 THR 19 28.061 16.950 -4.950 144 H VAL 20 H VAL 20 30.199 20.549 -6.987 145 HA VAL 20 HA VAL 20 33.162 20.851 -6.849 146 HB VAL 20 HB VAL 20 33.369 22.051 -9.029 147 1HG1 VAL 20 1HG1 VAL 20 33.471 20.104 -10.560 148 2HG1 VAL 20 2HG1 VAL 20 32.381 19.191 -9.493 149 3HG1 VAL 20 3HG1 VAL 20 34.006 19.657 -8.930 150 1HG2 VAL 20 1HG2 VAL 20 30.545 21.156 -9.823 151 2HG2 VAL 20 2HG2 VAL 20 31.717 21.982 -10.887 152 3HG2 VAL 20 3HG2 VAL 20 31.047 22.823 -9.474 153 H LYS 21 H LYS 21 34.066 22.882 -6.756 154 HA LYS 21 HA LYS 21 33.662 24.814 -5.037 155 1HB LYS 21 2HB LYS 21 34.162 25.680 -7.946 156 2HB LYS 21 1HB LYS 21 34.677 26.537 -6.511 157 1HG LYS 21 1HG LYS 21 35.866 23.927 -7.570 158 2HG LYS 21 2HG LYS 21 36.503 25.548 -7.805 159 1HD LYS 21 1HD LYS 21 36.851 25.764 -5.327 160 2HD LYS 21 2HD LYS 21 36.241 24.126 -5.101 161 1HE LYS 21 1HE LYS 21 38.750 24.744 -6.820 162 2HE LYS 21 2HE LYS 21 38.820 24.499 -5.081 163 1HZ LYS 21 1HZ LYS 21 37.815 22.468 -7.008 164 2HZ LYS 21 2HZ LYS 21 37.898 22.270 -5.370 165 3HZ LYS 21 3HZ LYS 21 39.284 22.451 -6.251 166 HA PRO 22 HA PRO 22 29.862 27.377 -6.063 167 1HB PRO 22 1HB PRO 22 30.134 29.582 -4.422 168 2HB PRO 22 2HB PRO 22 29.643 27.970 -3.865 169 1HG PRO 22 1HG PRO 22 32.401 29.240 -3.663 170 2HG PRO 22 2HG PRO 22 31.508 28.338 -2.405 171 1HD PRO 22 2HD PRO 22 33.473 27.186 -4.042 172 2HD PRO 22 1HD PRO 22 32.120 26.245 -3.365 173 H DAL 23 H ALA 23 29.915 28.262 -8.058 174 HA DAL 23 HA ALA 23 32.340 29.835 -9.030 175 1HB DAL 23 1HB ALA 23 30.623 31.562 -8.502 176 2HB DAL 23 2HB ALA 23 29.451 30.748 -9.573 177 3HB DAL 23 3HB ALA 23 30.930 31.473 -10.257 178 H VAL 24 H VAL 24 32.403 27.303 -9.403 179 HA VAL 24 HA VAL 24 32.116 26.845 -12.336 180 HB VAL 24 HB VAL 24 33.111 24.948 -10.160 181 1HG1 VAL 24 1HG1 VAL 24 33.484 24.618 -13.234 182 2HG1 VAL 24 2HG1 VAL 24 32.423 23.647 -12.209 183 3HG1 VAL 24 3HG1 VAL 24 34.175 23.533 -11.995 184 1HG2 VAL 24 1HG2 VAL 24 35.488 25.386 -10.887 185 2HG2 VAL 24 2HG2 VAL 24 34.894 26.610 -12.056 186 3HG2 VAL 24 3HG2 VAL 24 34.679 26.848 -10.313 187 H THR 25 H THR 25 30.159 26.025 -13.164 188 HA THR 25 HA THR 25 28.169 24.707 -11.312 189 HB THR 25 HB THR 25 26.470 25.632 -12.797 190 HG1 THR 25 HG1 THR 25 28.504 27.427 -13.580 191 1HG2 THR 25 1HG2 THR 25 27.893 27.861 -11.232 192 2HG2 THR 25 2HG2 THR 25 26.698 26.714 -10.566 193 3HG2 THR 25 3HG2 THR 25 26.201 27.905 -11.798 194 H ILE 26 H ILE 26 28.737 22.854 -11.907 195 HA ILE 26 HA ILE 26 29.320 21.669 -14.394 196 HB ILE 26 HB ILE 26 29.729 21.059 -11.908 197 1HG1 ILE 26 1HG1 ILE 26 29.127 18.394 -13.319 198 2HG1 ILE 26 2HG1 ILE 26 30.209 19.480 -14.095 199 1HG2 ILE 26 1HG2 ILE 26 27.363 20.827 -11.045 200 2HG2 ILE 26 2HG2 ILE 26 28.366 19.387 -10.688 201 3HG2 ILE 26 3HG2 ILE 26 27.173 19.325 -12.012 202 1HD1 ILE 26 1HD1 ILE 26 31.674 19.631 -12.086 203 2HD1 ILE 26 2HD1 ILE 26 30.581 18.556 -11.191 204 3HD1 ILE 26 3HD1 ILE 26 31.484 17.920 -12.608 205 H ARG 27 H ARG 27 28.088 19.666 -15.329 206 HA ARG 27 HA ARG 27 25.136 19.849 -15.316 207 1HB ARG 27 2HB ARG 27 26.607 20.117 -17.977 208 2HB ARG 27 1HB ARG 27 24.914 19.537 -17.808 209 1HG ARG 27 2HG ARG 27 24.221 21.571 -16.878 210 2HG ARG 27 1HG ARG 27 25.906 22.231 -16.982 211 1HD ARG 27 1HD ARG 27 25.787 22.096 -19.495 212 2HD ARG 27 2HD ARG 27 24.139 21.454 -19.402 213 HE ARG 27 HE ARG 27 24.993 24.291 -18.659 214 1HH1 ARG 27 2HH1 ARG 27 22.198 22.107 -19.279 215 2HH1 ARG 27 1HH1 ARG 27 21.090 23.570 -19.300 216 1HH2 ARG 27 1HH2 ARG 27 23.624 25.812 -18.712 217 2HH2 ARG 27 2HH2 ARG 27 21.839 25.501 -19.003 218 H CYS 28 H CYS 28 24.878 18.049 -14.917 219 HA CYS 28 HA CYS 28 26.511 15.630 -15.902 220 1HB CYS 28 1HB CYS 28 26.249 15.696 -13.386 221 2HB CYS 28 2HB CYS 28 24.500 15.403 -13.603 222 H GLU 29 H GLU 29 25.620 15.462 -17.805 223 HA GLU 29 HA GLU 29 22.937 16.382 -18.564 224 1HB GLU 29 1HB GLU 29 25.074 14.953 -20.239 225 2HB GLU 29 2HB GLU 29 23.563 15.463 -20.951 226 1HG GLU 29 2HG GLU 29 25.509 17.447 -19.651 227 2HG GLU 29 1HG GLU 29 25.558 16.980 -21.349 Start of MODEL 23 1 1H SER 1 1H SER 1 26.852 7.583 -15.923 2 2H SER 1 2H SER 1 28.346 7.637 -16.626 3 3H SER 1 3H SER 1 27.023 8.177 -17.455 4 HA SER 1 HA SER 1 26.675 9.975 -15.874 5 1HB SER 1 2HB SER 1 29.258 8.859 -14.631 6 2HB SER 1 1HB SER 1 28.515 10.406 -14.186 7 HG SER 1 HG SER 1 27.862 8.703 -12.845 8 H LYS 2 H LYS 2 27.231 11.767 -16.935 9 HA LYS 2 HA LYS 2 29.970 12.146 -18.193 10 1HB LYS 2 2HB LYS 2 29.154 13.018 -20.271 11 2HB LYS 2 1HB LYS 2 28.835 11.313 -20.055 12 1HG LYS 2 1HG LYS 2 26.361 11.841 -19.647 13 2HG LYS 2 2HG LYS 2 26.732 13.533 -19.878 14 1HD LYS 2 1HD LYS 2 25.854 13.004 -21.918 15 2HD LYS 2 2HD LYS 2 27.566 12.978 -22.274 16 1HE LYS 2 1HE LYS 2 27.495 10.409 -22.142 17 2HE LYS 2 2HE LYS 2 25.756 10.501 -21.814 18 1HZ LYS 2 1HZ LYS 2 27.095 11.551 -24.266 19 2HZ LYS 2 2HZ LYS 2 25.474 11.637 -23.962 20 3HZ LYS 2 3HZ LYS 2 26.197 10.167 -24.176 21 H TYR 3 H TYR 3 30.759 14.069 -17.748 22 HA TYR 3 HA TYR 3 28.919 16.235 -16.677 23 1HB TYR 3 1HB TYR 3 30.488 17.025 -15.185 24 2HB TYR 3 2HB TYR 3 30.311 15.333 -14.924 25 HD1 TYR 3 HD1 TYR 3 32.309 13.849 -16.403 26 HD2 TYR 3 HD2 TYR 3 32.738 17.809 -14.776 27 HE1 TYR 3 HE1 TYR 3 34.753 13.662 -16.470 28 HE2 TYR 3 HE2 TYR 3 35.137 17.462 -14.658 29 HH TYR 3 HH TYR 3 36.838 16.188 -15.167 30 H GLU 4 H GLU 4 29.140 18.343 -17.356 31 HA GLU 4 HA GLU 4 31.493 19.103 -19.195 32 1HB GLU 4 2HB GLU 4 30.081 18.966 -20.903 33 2HB GLU 4 1HB GLU 4 28.615 19.135 -19.994 34 1HG GLU 4 2HG GLU 4 29.044 21.669 -19.897 35 2HG GLU 4 1HG GLU 4 30.415 21.435 -20.969 36 H TYR 5 H TYR 5 32.641 20.059 -17.606 37 HA TYR 5 HA TYR 5 31.242 22.072 -15.792 38 1HB TYR 5 2HB TYR 5 32.362 21.585 -13.930 39 2HB TYR 5 1HB TYR 5 32.142 19.982 -14.556 40 HD1 TYR 5 HD1 TYR 5 33.969 20.887 -12.277 41 HD2 TYR 5 HD2 TYR 5 34.779 19.935 -16.382 42 HE1 TYR 5 HE1 TYR 5 36.316 20.665 -11.767 43 HE2 TYR 5 HE2 TYR 5 37.150 19.616 -15.788 44 HH TYR 5 HH TYR 5 38.667 19.668 -14.227 45 H THR 6 H THR 6 31.818 23.908 -16.056 46 HA THR 6 HA THR 6 34.065 24.549 -18.006 47 HB THR 6 HB THR 6 31.631 26.343 -17.341 48 HG1 THR 6 HG1 THR 6 30.644 25.376 -19.120 49 1HG2 THR 6 1HG2 THR 6 31.919 27.131 -19.661 50 2HG2 THR 6 2HG2 THR 6 33.234 25.962 -19.930 51 3HG2 THR 6 3HG2 THR 6 33.498 27.308 -18.793 52 H ILE 7 H ILE 7 35.625 25.891 -17.434 53 HA ILE 7 HA ILE 7 35.652 27.153 -14.638 54 HB ILE 7 HB ILE 7 37.906 25.445 -15.849 55 1HG1 ILE 7 2HG1 ILE 7 37.391 23.990 -13.518 56 2HG1 ILE 7 1HG1 ILE 7 35.815 24.736 -13.682 57 1HG2 ILE 7 1HG2 ILE 7 39.071 25.691 -13.653 58 2HG2 ILE 7 2HG2 ILE 7 38.773 27.264 -14.425 59 3HG2 ILE 7 3HG2 ILE 7 37.742 26.742 -13.061 60 1HD1 ILE 7 1HD1 ILE 7 35.678 23.622 -15.996 61 2HD1 ILE 7 2HD1 ILE 7 35.681 22.627 -14.532 62 3HD1 ILE 7 3HD1 ILE 7 37.158 22.727 -15.508 63 HA DPR 8 HA PRO 8 38.016 30.416 -16.704 64 1HB DPR 8 2HB PRO 8 37.370 31.660 -14.892 65 2HB DPR 8 1HB PRO 8 36.610 32.686 -16.127 66 1HG DPR 8 2HG PRO 8 35.147 31.688 -14.021 67 2HG DPR 8 1HG PRO 8 34.429 31.781 -15.655 68 1HD DPR 8 1HD PRO 8 35.348 29.319 -14.191 69 2HD DPR 8 2HD PRO 8 34.192 29.449 -15.536 70 H SER 9 H SER 9 38.119 30.001 -18.858 71 HA SER 9 HA SER 9 35.868 30.875 -20.735 72 1HB SER 9 2HB SER 9 38.891 31.280 -21.169 73 2HB SER 9 1HB SER 9 37.636 31.525 -22.389 74 HG SER 9 HG SER 9 37.790 32.837 -19.878 75 H TYR 10 H TYR 10 37.290 28.237 -19.454 76 HA TYR 10 HA TYR 10 37.574 26.716 -22.094 77 1HB TYR 10 2HB TYR 10 39.529 27.171 -20.181 78 2HB TYR 10 1HB TYR 10 38.802 25.811 -19.411 79 HD1 TYR 10 HD1 TYR 10 40.773 26.992 -22.310 80 HD2 TYR 10 HD2 TYR 10 38.888 23.530 -20.589 81 HE1 TYR 10 HE1 TYR 10 42.080 25.529 -23.763 82 HE2 TYR 10 HE2 TYR 10 40.226 22.098 -22.050 83 HH TYR 10 HH TYR 10 41.751 22.000 -23.635 84 H THR 11 H THR 11 36.115 25.091 -22.452 85 HA THR 11 HA THR 11 34.297 24.160 -20.221 86 HB THR 11 HB THR 11 34.113 23.501 -23.212 87 HG1 THR 11 HG1 THR 11 34.122 25.746 -22.893 88 1HG2 THR 11 1HG2 THR 11 31.658 23.250 -22.806 89 2HG2 THR 11 2HG2 THR 11 32.544 22.205 -21.663 90 3HG2 THR 11 3HG2 THR 11 31.855 23.744 -21.101 91 H PHE 12 H PHE 12 34.817 22.427 -19.281 92 HA PHE 12 HA PHE 12 36.861 20.406 -20.487 93 1HB PHE 12 2HB PHE 12 36.310 21.045 -17.562 94 2HB PHE 12 1HB PHE 12 37.218 19.652 -18.080 95 HD1 PHE 12 HD1 PHE 12 37.282 23.377 -17.797 96 HD2 PHE 12 HD2 PHE 12 39.572 19.915 -18.960 97 HE1 PHE 12 HE1 PHE 12 39.341 24.632 -17.569 98 HE2 PHE 12 HE2 PHE 12 41.605 21.232 -18.765 99 HZ PHE 12 HZ PHE 12 41.503 23.589 -18.036 100 H ARG 13 H ARG 13 35.675 18.773 -21.320 101 HA ARG 13 HA ARG 13 33.084 17.878 -19.951 102 1HB ARG 13 1HB ARG 13 33.393 17.643 -22.959 103 2HB ARG 13 2HB ARG 13 31.956 17.514 -21.918 104 1HG ARG 13 2HG ARG 13 31.953 19.997 -21.654 105 2HG ARG 13 1HG ARG 13 33.384 20.110 -22.666 106 1HD ARG 13 1HD ARG 13 32.093 19.032 -24.601 107 2HD ARG 13 2HD ARG 13 30.645 19.016 -23.586 108 HE ARG 13 HE ARG 13 31.634 21.737 -23.615 109 1HH1 ARG 13 1HH1 ARG 13 30.200 19.505 -26.054 110 2HH1 ARG 13 2HH1 ARG 13 29.595 20.960 -26.994 111 1HH2 ARG 13 1HH2 ARG 13 30.889 23.246 -24.783 112 2HH2 ARG 13 2HH2 ARG 13 29.957 22.909 -26.327 113 H GLY 14 H GLY 14 33.162 15.820 -19.282 114 1HA GLY 14 1HA GLY 14 34.313 13.601 -20.916 115 2HA GLY 14 2HA GLY 14 35.326 13.972 -19.526 116 HA PRO 15 HA PRO 15 31.842 11.044 -18.097 117 1HB PRO 15 1HB PRO 15 33.060 8.733 -17.436 118 2HB PRO 15 2HB PRO 15 32.861 9.260 -19.121 119 1HG PRO 15 2HG PRO 15 35.306 9.525 -17.343 120 2HG PRO 15 1HG PRO 15 35.223 8.846 -19.008 121 1HD PRO 15 1HD PRO 15 35.937 11.530 -18.434 122 2HD PRO 15 2HD PRO 15 35.151 11.055 -19.964 123 H GLY 16 H GLY 16 31.155 10.244 -16.083 124 1HA GLY 16 2HA GLY 16 30.962 10.024 -13.690 125 2HA GLY 16 1HA GLY 16 32.639 10.528 -13.541 126 H CYS 17 H CYS 17 29.455 11.523 -13.174 127 HA CYS 17 HA CYS 17 30.142 14.494 -12.970 128 1HB CYS 17 1HB CYS 17 28.120 15.066 -13.646 129 2HB CYS 17 2HB CYS 17 28.390 13.643 -14.620 130 HA PRO 18 HA PRO 18 29.522 14.029 -8.387 131 1HB PRO 18 1HB PRO 18 31.940 14.782 -7.431 132 2HB PRO 18 2HB PRO 18 31.691 13.187 -8.170 133 1HG PRO 18 1HG PRO 18 32.972 15.657 -9.435 134 2HG PRO 18 2HG PRO 18 33.574 13.972 -9.460 135 1HD PRO 18 2HD PRO 18 31.974 15.150 -11.515 136 2HD PRO 18 1HD PRO 18 32.085 13.400 -11.216 137 H THR 19 H THR 19 29.896 15.840 -6.652 138 HA THR 19 HA THR 19 28.602 18.374 -7.401 139 HB THR 19 HB THR 19 29.502 19.009 -4.985 140 HG1 THR 19 HG1 THR 19 30.987 17.301 -4.867 141 1HG2 THR 19 1HG2 THR 19 27.420 16.862 -5.244 142 2HG2 THR 19 2HG2 THR 19 27.736 17.916 -3.805 143 3HG2 THR 19 3HG2 THR 19 27.204 18.642 -5.354 144 H VAL 20 H VAL 20 29.400 20.508 -7.108 145 HA VAL 20 HA VAL 20 32.355 20.836 -7.411 146 HB VAL 20 HB VAL 20 32.131 22.592 -9.205 147 1HG1 VAL 20 1HG2 VAL 20 32.941 20.361 -9.813 148 2HG1 VAL 20 2HG2 VAL 20 31.282 19.846 -10.205 149 3HG1 VAL 20 3HG2 VAL 20 32.074 21.120 -11.167 150 1HG2 VAL 20 1HG1 VAL 20 29.289 21.655 -9.883 151 2HG2 VAL 20 2HG1 VAL 20 29.683 23.164 -9.024 152 3HG2 VAL 20 3HG1 VAL 20 30.273 22.925 -10.680 153 H LYS 21 H LYS 21 33.225 23.037 -7.172 154 HA LYS 21 HA LYS 21 32.163 24.170 -4.624 155 1HB LYS 21 1HB LYS 21 34.301 25.338 -4.517 156 2HB LYS 21 2HB LYS 21 34.462 23.592 -4.667 157 1HG LYS 21 1HG LYS 21 36.305 24.624 -5.672 158 2HG LYS 21 2HG LYS 21 35.392 23.815 -6.934 159 1HD LYS 21 1HD LYS 21 34.560 25.843 -7.848 160 2HD LYS 21 2HD LYS 21 35.037 26.838 -6.483 161 1HE LYS 21 1HE LYS 21 37.088 25.476 -8.363 162 2HE LYS 21 2HE LYS 21 36.451 27.103 -8.606 163 1HZ LYS 21 1HZ LYS 21 38.553 27.184 -7.458 164 2HZ LYS 21 2HZ LYS 21 37.985 26.267 -6.206 165 3HZ LYS 21 3HZ LYS 21 37.369 27.777 -6.470 166 HA PRO 22 HA PRO 22 30.294 27.913 -6.341 167 1HB PRO 22 2HB PRO 22 31.875 29.763 -4.477 168 2HB PRO 22 1HB PRO 22 30.126 29.673 -4.783 169 1HG PRO 22 1HG PRO 22 31.148 28.560 -2.536 170 2HG PRO 22 2HG PRO 22 29.918 27.654 -3.462 171 1HD PRO 22 2HD PRO 22 32.974 27.293 -3.583 172 2HD PRO 22 1HD PRO 22 31.715 26.038 -3.382 173 H DAL 23 H ALA 23 30.701 28.886 -8.243 174 HA DAL 23 HA ALA 23 33.583 29.528 -9.077 175 1HB DAL 23 1HB ALA 23 31.112 31.188 -9.835 176 2HB DAL 23 2HB ALA 23 32.765 31.416 -10.461 177 3HB DAL 23 3HB ALA 23 32.424 31.689 -8.733 178 H VAL 24 H VAL 24 33.178 27.142 -9.400 179 HA VAL 24 HA VAL 24 32.610 26.551 -12.269 180 HB VAL 24 HB VAL 24 33.439 24.645 -10.031 181 1HG1 VAL 24 1HG2 VAL 24 33.710 24.140 -13.098 182 2HG1 VAL 24 2HG2 VAL 24 32.493 23.405 -12.037 183 3HG1 VAL 24 3HG2 VAL 24 34.199 23.010 -11.805 184 1HG2 VAL 24 1HG1 VAL 24 35.838 24.699 -10.862 185 2HG2 VAL 24 2HG1 VAL 24 35.250 26.265 -10.280 186 3HG2 VAL 24 3HG1 VAL 24 35.366 25.996 -12.013 187 H THR 25 H THR 25 30.619 25.643 -12.972 188 HA THR 25 HA THR 25 28.658 24.509 -11.015 189 HB THR 25 HB THR 25 26.903 25.660 -12.318 190 HG1 THR 25 HG1 THR 25 28.204 26.396 -13.994 191 1HG2 THR 25 1HG2 THR 25 27.324 26.499 -10.006 192 2HG2 THR 25 2HG2 THR 25 26.829 27.834 -11.082 193 3HG2 THR 25 3HG2 THR 25 28.545 27.639 -10.633 194 H ILE 26 H ILE 26 28.906 22.630 -11.819 195 HA ILE 26 HA ILE 26 29.513 21.744 -14.378 196 HB ILE 26 HB ILE 26 29.799 20.761 -12.014 197 1HG1 ILE 26 2HG1 ILE 26 28.957 18.346 -13.756 198 2HG1 ILE 26 1HG1 ILE 26 30.107 19.419 -14.434 199 1HG2 ILE 26 1HG2 ILE 26 27.078 19.316 -12.418 200 2HG2 ILE 26 2HG2 ILE 26 28.220 19.037 -11.080 201 3HG2 ILE 26 3HG2 ILE 26 27.377 20.616 -11.227 202 1HD1 ILE 26 1HD1 ILE 26 31.635 19.203 -12.509 203 2HD1 ILE 26 2HD1 ILE 26 30.470 18.182 -11.646 204 3HD1 ILE 26 3HD1 ILE 26 31.233 17.572 -13.153 205 H ARG 27 H ARG 27 28.314 19.998 -15.557 206 HA ARG 27 HA ARG 27 25.394 20.310 -15.976 207 1HB ARG 27 2HB ARG 27 27.579 20.177 -18.202 208 2HB ARG 27 1HB ARG 27 26.102 19.260 -18.374 209 1HG ARG 27 2HG ARG 27 25.739 20.987 -19.665 210 2HG ARG 27 1HG ARG 27 24.706 21.214 -18.257 211 1HD ARG 27 1HD ARG 27 26.348 23.030 -17.436 212 2HD ARG 27 2HD ARG 27 27.338 22.755 -18.882 213 HE ARG 27 HE ARG 27 24.765 23.283 -19.942 214 1HH1 ARG 27 1HH1 ARG 27 26.871 25.229 -17.759 215 2HH1 ARG 27 2HH1 ARG 27 26.086 26.757 -18.405 216 1HH2 ARG 27 1HH2 ARG 27 23.996 25.081 -20.553 217 2HH2 ARG 27 2HH2 ARG 27 24.588 26.674 -19.862 218 H CYS 28 H CYS 28 24.869 18.360 -15.736 219 HA CYS 28 HA CYS 28 26.802 15.946 -15.902 220 1HB CYS 28 2HB CYS 28 26.152 16.074 -13.663 221 2HB CYS 28 1HB CYS 28 24.402 16.137 -14.020 222 H GLU 29 H GLU 29 26.325 16.723 -18.018 223 HA GLU 29 HA GLU 29 24.504 15.034 -19.592 224 1HB GLU 29 2HB GLU 29 23.213 16.628 -20.869 225 2HB GLU 29 1HB GLU 29 22.702 16.378 -19.213 226 1HG GLU 29 1HG GLU 29 23.729 18.504 -18.516 227 2HG GLU 29 2HG GLU 29 24.293 18.783 -20.182 Start of MODEL 24 1 1H SER 1 1H SER 1 24.376 9.432 -17.642 2 2H SER 1 2H SER 1 25.204 10.000 -18.954 3 3H SER 1 3H SER 1 25.939 8.964 -17.897 4 HA SER 1 HA SER 1 25.011 11.713 -17.254 5 1HB SER 1 2HB SER 1 26.542 9.654 -15.558 6 2HB SER 1 1HB SER 1 26.267 11.340 -15.087 7 HG SER 1 HG SER 1 24.693 9.936 -14.266 8 H LYS 2 H LYS 2 26.441 13.224 -17.821 9 HA LYS 2 HA LYS 2 29.418 12.690 -18.080 10 1HB LYS 2 2HB LYS 2 27.807 13.925 -20.389 11 2HB LYS 2 1HB LYS 2 29.562 14.011 -20.253 12 1HG LYS 2 1HG LYS 2 29.755 11.521 -20.395 13 2HG LYS 2 2HG LYS 2 28.003 11.382 -20.529 14 1HD LYS 2 2HD LYS 2 28.038 12.690 -22.669 15 2HD LYS 2 1HD LYS 2 29.782 12.883 -22.568 16 1HE LYS 2 1HE LYS 2 28.414 10.104 -22.751 17 2HE LYS 2 2HE LYS 2 28.836 11.075 -24.151 18 1HZ LYS 2 1HZ LYS 2 30.571 9.488 -23.662 19 2HZ LYS 2 2HZ LYS 2 31.168 11.018 -23.481 20 3HZ LYS 2 3HZ LYS 2 30.809 10.108 -22.149 21 H TYR 3 H TYR 3 30.490 14.389 -17.296 22 HA TYR 3 HA TYR 3 28.951 16.752 -16.199 23 1HB TYR 3 1HB TYR 3 30.685 17.276 -14.845 24 2HB TYR 3 2HB TYR 3 30.424 15.582 -14.648 25 HD1 TYR 3 HD1 TYR 3 32.973 17.778 -14.248 26 HD2 TYR 3 HD2 TYR 3 32.282 14.326 -16.714 27 HE1 TYR 3 HE1 TYR 3 35.341 17.402 -14.431 28 HE2 TYR 3 HE2 TYR 3 34.680 14.051 -16.961 29 HH TYR 3 HH TYR 3 36.967 16.209 -15.315 30 H GLU 4 H GLU 4 28.973 18.609 -17.215 31 HA GLU 4 HA GLU 4 31.387 19.460 -18.965 32 1HB GLU 4 1HB GLU 4 29.860 19.368 -20.580 33 2HB GLU 4 2HB GLU 4 28.465 19.663 -19.595 34 1HG GLU 4 2HG GLU 4 29.097 22.138 -19.493 35 2HG GLU 4 1HG GLU 4 30.431 21.802 -20.590 36 H TYR 5 H TYR 5 32.626 20.327 -17.408 37 HA TYR 5 HA TYR 5 31.365 22.194 -15.343 38 1HB TYR 5 1HB TYR 5 32.498 21.415 -13.594 39 2HB TYR 5 2HB TYR 5 32.326 19.912 -14.436 40 HD1 TYR 5 HD1 TYR 5 34.362 20.979 -12.171 41 HD2 TYR 5 HD2 TYR 5 34.725 19.809 -16.282 42 HE1 TYR 5 HE1 TYR 5 36.729 20.594 -11.860 43 HE2 TYR 5 HE2 TYR 5 37.121 19.447 -15.937 44 HH TYR 5 HH TYR 5 38.630 19.955 -12.773 45 H THR 6 H THR 6 31.780 24.022 -15.852 46 HA THR 6 HA THR 6 33.859 24.620 -17.963 47 HB THR 6 HB THR 6 31.631 26.593 -17.097 48 HG1 THR 6 HG1 THR 6 30.296 25.580 -18.589 49 1HG2 THR 6 1HG2 THR 6 32.723 25.818 -19.851 50 2HG2 THR 6 2HG2 THR 6 31.600 27.151 -19.492 51 3HG2 THR 6 3HG2 THR 6 33.319 27.228 -18.933 52 H ILE 7 H ILE 7 35.581 25.868 -17.536 53 HA ILE 7 HA ILE 7 35.883 26.969 -14.714 54 HB ILE 7 HB ILE 7 38.281 25.870 -16.147 55 1HG1 ILE 7 1HG1 ILE 7 36.959 24.026 -16.255 56 2HG1 ILE 7 2HG1 ILE 7 38.255 23.701 -15.104 57 1HG2 ILE 7 1HG2 ILE 7 38.664 27.324 -14.145 58 2HG2 ILE 7 2HG2 ILE 7 39.301 25.677 -13.902 59 3HG2 ILE 7 3HG2 ILE 7 37.754 26.156 -13.145 60 1HD1 ILE 7 1HD1 ILE 7 36.465 23.594 -13.290 61 2HD1 ILE 7 2HD1 ILE 7 36.199 22.470 -14.650 62 3HD1 ILE 7 3HD1 ILE 7 35.230 23.952 -14.551 63 HA DPR 8 HA PRO 8 37.660 30.639 -16.721 64 1HB DPR 8 1HB PRO 8 36.675 31.864 -15.061 65 2HB DPR 8 2HB PRO 8 35.771 32.621 -16.388 66 1HG DPR 8 1HG PRO 8 34.439 31.478 -14.285 67 2HG DPR 8 2HG PRO 8 33.828 31.252 -15.950 68 1HD DPR 8 2HD PRO 8 35.308 29.233 -14.231 69 2HD DPR 8 1HD PRO 8 34.105 28.945 -15.506 70 H SER 9 H SER 9 38.029 30.332 -18.805 71 HA SER 9 HA SER 9 35.960 30.969 -20.956 72 1HB SER 9 1HB SER 9 37.859 31.125 -22.495 73 2HB SER 9 2HB SER 9 38.088 32.220 -21.128 74 HG SER 9 HG SER 9 39.947 31.017 -21.621 75 H TYR 10 H TYR 10 37.417 28.258 -19.395 76 HA TYR 10 HA TYR 10 37.585 26.541 -21.871 77 1HB TYR 10 1HB TYR 10 38.824 26.560 -19.104 78 2HB TYR 10 2HB TYR 10 38.123 25.033 -19.377 79 HD1 TYR 10 HD1 TYR 10 40.750 27.381 -20.562 80 HD2 TYR 10 HD2 TYR 10 38.987 23.496 -21.147 81 HE1 TYR 10 HE1 TYR 10 42.688 26.659 -21.852 82 HE2 TYR 10 HE2 TYR 10 40.937 22.815 -22.427 83 HH TYR 10 HH TYR 10 43.655 25.039 -22.984 84 H THR 11 H THR 11 36.052 24.963 -22.421 85 HA THR 11 HA THR 11 34.004 24.155 -20.325 86 HB THR 11 HB THR 11 33.921 23.608 -23.345 87 HG1 THR 11 HG1 THR 11 34.054 25.847 -22.992 88 1HG2 THR 11 1HG2 THR 11 31.577 23.983 -21.358 89 2HG2 THR 11 2HG2 THR 11 31.450 23.492 -23.069 90 3HG2 THR 11 3HG2 THR 11 32.202 22.403 -21.873 91 H PHE 12 H PHE 12 34.685 22.492 -19.362 92 HA PHE 12 HA PHE 12 36.501 20.336 -20.676 93 1HB PHE 12 2HB PHE 12 35.952 20.902 -17.733 94 2HB PHE 12 1HB PHE 12 36.677 19.414 -18.260 95 HD1 PHE 12 HD1 PHE 12 37.199 23.183 -18.340 96 HD2 PHE 12 HD2 PHE 12 39.093 19.312 -18.346 97 HE1 PHE 12 HE1 PHE 12 39.291 24.176 -17.649 98 HE2 PHE 12 HE2 PHE 12 41.166 20.357 -17.658 99 HZ PHE 12 HZ PHE 12 41.241 22.788 -17.201 100 H ARG 13 H ARG 13 35.154 18.795 -21.547 101 HA ARG 13 HA ARG 13 32.560 18.020 -20.114 102 1HB ARG 13 1HB ARG 13 32.729 17.785 -23.124 103 2HB ARG 13 2HB ARG 13 31.332 17.791 -22.017 104 1HG ARG 13 1HG ARG 13 31.502 20.260 -21.830 105 2HG ARG 13 2HG ARG 13 32.928 20.248 -22.859 106 1HD ARG 13 2HD ARG 13 31.487 19.189 -24.743 107 2HD ARG 13 1HD ARG 13 30.075 19.403 -23.699 108 HE ARG 13 HE ARG 13 31.266 21.987 -23.840 109 1HH1 ARG 13 2HH1 ARG 13 29.982 19.766 -26.369 110 2HH1 ARG 13 1HH1 ARG 13 29.611 21.222 -27.424 111 1HH2 ARG 13 1HH2 ARG 13 30.790 23.497 -25.139 112 2HH2 ARG 13 2HH2 ARG 13 30.034 23.165 -26.778 113 H GLY 14 H GLY 14 32.533 15.943 -19.513 114 1HA GLY 14 1HA GLY 14 33.359 13.713 -21.257 115 2HA GLY 14 2HA GLY 14 34.580 13.957 -20.013 116 HA PRO 15 HA PRO 15 31.144 11.305 -18.035 117 1HB PRO 15 1HB PRO 15 32.367 8.992 -17.373 118 2HB PRO 15 2HB PRO 15 31.975 9.407 -19.057 119 1HG PRO 15 1HG PRO 15 34.636 9.690 -17.620 120 2HG PRO 15 2HG PRO 15 34.324 8.908 -19.209 121 1HD PRO 15 2HD PRO 15 35.183 11.594 -18.910 122 2HD PRO 15 1HD PRO 15 34.205 11.049 -20.300 123 H GLY 16 H GLY 16 30.758 10.552 -15.841 124 1HA GLY 16 1HA GLY 16 31.030 10.431 -13.470 125 2HA GLY 16 2HA GLY 16 32.632 11.140 -13.612 126 H CYS 17 H CYS 17 29.554 11.747 -12.621 127 HA CYS 17 HA CYS 17 29.826 14.792 -12.696 128 1HB CYS 17 2HB CYS 17 27.343 13.138 -11.937 129 2HB CYS 17 1HB CYS 17 27.432 14.895 -12.118 130 HA PRO 18 HA PRO 18 30.898 14.444 -8.162 131 1HB PRO 18 1HB PRO 18 33.255 15.800 -8.078 132 2HB PRO 18 2HB PRO 18 33.148 14.127 -8.665 133 1HG PRO 18 1HG PRO 18 33.336 16.688 -10.327 134 2HG PRO 18 2HG PRO 18 34.263 15.172 -10.542 135 1HD PRO 18 2HD PRO 18 31.867 15.779 -11.957 136 2HD PRO 18 1HD PRO 18 32.431 14.124 -11.631 137 H THR 19 H THR 19 31.309 16.299 -6.564 138 HA THR 19 HA THR 19 29.543 18.677 -7.104 139 HB THR 19 HB THR 19 30.485 19.231 -4.650 140 HG1 THR 19 HG1 THR 19 31.906 17.465 -4.599 141 1HG2 THR 19 1HG2 THR 19 28.183 18.974 -5.084 142 2HG2 THR 19 2HG2 THR 19 28.328 17.186 -5.101 143 3HG2 THR 19 3HG2 THR 19 28.644 18.122 -3.581 144 H VAL 20 H VAL 20 30.196 20.832 -6.776 145 HA VAL 20 HA VAL 20 33.074 21.338 -7.395 146 HB VAL 20 HB VAL 20 32.520 22.876 -9.317 147 1HG1 VAL 20 1HG2 VAL 20 32.398 21.207 -11.096 148 2HG1 VAL 20 2HG2 VAL 20 33.424 20.631 -9.767 149 3HG1 VAL 20 3HG2 VAL 20 31.771 19.995 -9.948 150 1HG2 VAL 20 1HG1 VAL 20 30.087 23.332 -8.935 151 2HG2 VAL 20 2HG1 VAL 20 29.701 21.687 -9.497 152 3HG2 VAL 20 3HG1 VAL 20 30.451 22.866 -10.612 153 H LYS 21 H LYS 21 33.837 23.441 -7.478 154 HA LYS 21 HA LYS 21 33.336 24.889 -5.029 155 1HB LYS 21 2HB LYS 21 35.323 24.953 -7.357 156 2HB LYS 21 1HB LYS 21 35.013 26.528 -6.762 157 1HG LYS 21 2HG LYS 21 36.967 25.748 -5.809 158 2HG LYS 21 1HG LYS 21 35.793 25.996 -4.520 159 1HD LYS 21 1HD LYS 21 35.391 23.581 -4.346 160 2HD LYS 21 2HD LYS 21 36.500 23.247 -5.684 161 1HE LYS 21 1HE LYS 21 38.425 24.188 -4.298 162 2HE LYS 21 2HE LYS 21 37.300 24.494 -2.959 163 1HZ LYS 21 1HZ LYS 21 36.808 22.101 -2.906 164 2HZ LYS 21 2HZ LYS 21 37.857 21.816 -4.150 165 3HZ LYS 21 3HZ LYS 21 38.426 22.364 -2.699 166 HA PRO 22 HA PRO 22 30.633 28.385 -6.312 167 1HB PRO 22 2HB PRO 22 31.489 30.551 -4.827 168 2HB PRO 22 1HB PRO 22 30.609 29.157 -4.171 169 1HG PRO 22 2HG PRO 22 33.584 29.727 -3.994 170 2HG PRO 22 1HG PRO 22 32.502 29.080 -2.730 171 1HD PRO 22 1HD PRO 22 34.182 27.508 -4.408 172 2HD PRO 22 2HD PRO 22 32.759 26.845 -3.594 173 H DAL 23 H ALA 23 30.897 28.957 -8.383 174 HA DAL 23 HA ALA 23 33.595 29.877 -9.478 175 1HB DAL 23 1HB ALA 23 32.548 31.594 -10.935 176 2HB DAL 23 2HB ALA 23 30.951 31.275 -10.203 177 3HB DAL 23 3HB ALA 23 32.265 31.964 -9.212 178 H VAL 24 H VAL 24 33.381 27.468 -9.631 179 HA VAL 24 HA VAL 24 32.697 26.587 -12.402 180 HB VAL 24 HB VAL 24 33.771 25.014 -10.012 181 1HG1 VAL 24 1HG1 VAL 24 34.287 23.049 -11.412 182 2HG1 VAL 24 2HG1 VAL 24 32.563 23.415 -11.542 183 3HG1 VAL 24 3HG1 VAL 24 33.638 23.843 -12.885 184 1HG2 VAL 24 1HG2 VAL 24 35.360 25.823 -12.545 185 2HG2 VAL 24 2HG2 VAL 24 35.442 26.626 -10.963 186 3HG2 VAL 24 3HG2 VAL 24 36.002 24.955 -11.115 187 H THR 25 H THR 25 30.642 25.787 -12.964 188 HA THR 25 HA THR 25 28.773 24.694 -10.893 189 HB THR 25 HB THR 25 26.970 25.855 -12.136 190 HG1 THR 25 HG1 THR 25 28.202 26.545 -13.880 191 1HG2 THR 25 1HG2 THR 25 26.987 28.044 -10.930 192 2HG2 THR 25 2HG2 THR 25 27.510 26.718 -9.858 193 3HG2 THR 25 3HG2 THR 25 28.718 27.829 -10.556 194 H ILE 26 H ILE 26 28.947 22.819 -11.669 195 HA ILE 26 HA ILE 26 29.424 21.860 -14.252 196 HB ILE 26 HB ILE 26 29.754 20.960 -11.817 197 1HG1 ILE 26 2HG1 ILE 26 29.040 18.515 -13.541 198 2HG1 ILE 26 1HG1 ILE 26 30.185 19.628 -14.185 199 1HG2 ILE 26 1HG2 ILE 26 28.237 19.228 -10.854 200 2HG2 ILE 26 2HG2 ILE 26 27.096 19.422 -12.207 201 3HG2 ILE 26 3HG2 ILE 26 27.336 20.766 -11.051 202 1HD1 ILE 26 1HD1 ILE 26 31.273 17.770 -12.817 203 2HD1 ILE 26 2HD1 ILE 26 30.550 18.498 -11.356 204 3HD1 ILE 26 3HD1 ILE 26 31.705 19.435 -12.323 205 H ARG 27 H ARG 27 28.135 20.139 -15.402 206 HA ARG 27 HA ARG 27 25.173 20.412 -15.406 207 1HB ARG 27 1HB ARG 27 25.685 22.013 -17.066 208 2HB ARG 27 2HB ARG 27 26.659 20.785 -18.005 209 1HG ARG 27 1HG ARG 27 24.700 19.544 -18.466 210 2HG ARG 27 2HG ARG 27 23.685 20.648 -17.492 211 1HD ARG 27 1HD ARG 27 24.189 22.516 -19.137 212 2HD ARG 27 2HD ARG 27 25.166 21.395 -20.104 213 HE ARG 27 HE ARG 27 22.631 20.104 -19.841 214 1HH1 ARG 27 1HH1 ARG 27 23.638 23.238 -21.306 215 2HH1 ARG 27 2HH1 ARG 27 22.206 23.136 -22.449 216 1HH2 ARG 27 1HH2 ARG 27 21.087 20.145 -21.186 217 2HH2 ARG 27 2HH2 ARG 27 20.879 21.521 -22.382 218 H CYS 28 H CYS 28 24.871 18.648 -15.190 219 HA CYS 28 HA CYS 28 26.512 16.162 -16.032 220 1HB CYS 28 1HB CYS 28 26.054 16.230 -13.560 221 2HB CYS 28 2HB CYS 28 24.313 16.047 -13.883 222 H GLU 29 H GLU 29 25.750 15.375 -17.854 223 HA GLU 29 HA GLU 29 23.210 16.317 -19.075 224 1HB GLU 29 1HB GLU 29 25.439 14.470 -20.156 225 2HB GLU 29 2HB GLU 29 24.015 14.847 -21.109 226 1HG GLU 29 2HG GLU 29 24.553 17.277 -21.111 227 2HG GLU 29 1HG GLU 29 25.994 16.973 -20.132 Start of MODEL 25 1 1H SER 1 1H SER 1 26.448 8.672 -17.686 2 2H SER 1 2H SER 1 24.843 9.030 -17.519 3 3H SER 1 3H SER 1 25.677 9.569 -18.840 4 HA SER 1 HA SER 1 25.285 11.376 -17.279 5 1HB SER 1 1HB SER 1 26.903 9.570 -15.386 6 2HB SER 1 2HB SER 1 26.478 11.257 -15.047 7 HG SER 1 HG SER 1 24.657 9.152 -15.608 8 H LYS 2 H LYS 2 26.617 12.956 -17.882 9 HA LYS 2 HA LYS 2 29.618 12.585 -18.095 10 1HB LYS 2 2HB LYS 2 29.863 13.647 -20.238 11 2HB LYS 2 1HB LYS 2 29.100 12.073 -20.299 12 1HG LYS 2 1HG LYS 2 26.869 13.173 -20.768 13 2HG LYS 2 2HG LYS 2 27.642 14.759 -20.703 14 1HD LYS 2 2HD LYS 2 29.122 14.114 -22.670 15 2HD LYS 2 1HD LYS 2 28.345 12.530 -22.733 16 1HE LYS 2 2HE LYS 2 26.120 13.637 -23.240 17 2HE LYS 2 1HE LYS 2 26.901 15.228 -23.178 18 1HZ LYS 2 1HZ LYS 2 27.631 13.035 -25.062 19 2HZ LYS 2 2HZ LYS 2 26.771 14.393 -25.444 20 3HZ LYS 2 3HZ LYS 2 28.358 14.517 -25.004 21 H TYR 3 H TYR 3 30.649 14.252 -17.237 22 HA TYR 3 HA TYR 3 29.074 16.595 -16.161 23 1HB TYR 3 1HB TYR 3 30.785 17.113 -14.758 24 2HB TYR 3 2HB TYR 3 30.550 15.413 -14.612 25 HD1 TYR 3 HD1 TYR 3 32.430 14.178 -16.608 26 HD2 TYR 3 HD2 TYR 3 33.069 17.675 -14.199 27 HE1 TYR 3 HE1 TYR 3 34.840 13.872 -16.759 28 HE2 TYR 3 HE2 TYR 3 35.440 17.281 -14.292 29 HH TYR 3 HH TYR 3 36.828 14.597 -16.144 30 H GLU 4 H GLU 4 29.085 18.478 -17.164 31 HA GLU 4 HA GLU 4 31.507 19.357 -18.899 32 1HB GLU 4 2HB GLU 4 29.964 19.317 -20.510 33 2HB GLU 4 1HB GLU 4 28.569 19.545 -19.503 34 1HG GLU 4 1HG GLU 4 29.169 22.028 -19.320 35 2HG GLU 4 2HG GLU 4 30.464 21.759 -20.476 36 H TYR 5 H TYR 5 32.741 20.228 -17.343 37 HA TYR 5 HA TYR 5 31.474 22.078 -15.268 38 1HB TYR 5 1HB TYR 5 32.587 21.283 -13.512 39 2HB TYR 5 2HB TYR 5 32.420 19.787 -14.358 40 HD1 TYR 5 HD1 TYR 5 34.435 20.845 -12.075 41 HD2 TYR 5 HD2 TYR 5 34.852 19.708 -16.194 42 HE1 TYR 5 HE1 TYR 5 36.794 20.447 -11.735 43 HE2 TYR 5 HE2 TYR 5 37.239 19.326 -15.812 44 HH TYR 5 HH TYR 5 38.705 19.807 -12.627 45 H THR 6 H THR 6 31.877 23.886 -15.803 46 HA THR 6 HA THR 6 33.974 24.463 -17.911 47 HB THR 6 HB THR 6 31.683 26.393 -17.116 48 HG1 THR 6 HG1 THR 6 30.798 24.338 -17.496 49 1HG2 THR 6 1HG2 THR 6 32.932 25.690 -19.825 50 2HG2 THR 6 2HG2 THR 6 31.739 26.980 -19.503 51 3HG2 THR 6 3HG2 THR 6 33.422 27.114 -18.856 52 H ILE 7 H ILE 7 35.687 25.675 -17.438 53 HA ILE 7 HA ILE 7 35.916 26.777 -14.610 54 HB ILE 7 HB ILE 7 38.333 25.754 -16.062 55 1HG1 ILE 7 2HG1 ILE 7 37.024 23.880 -16.145 56 2HG1 ILE 7 1HG1 ILE 7 38.332 23.572 -15.006 57 1HG2 ILE 7 1HG2 ILE 7 37.830 26.014 -13.051 58 2HG2 ILE 7 2HG2 ILE 7 39.376 25.566 -13.824 59 3HG2 ILE 7 3HG2 ILE 7 38.711 27.205 -14.048 60 1HD1 ILE 7 1HD1 ILE 7 35.305 23.813 -14.434 61 2HD1 ILE 7 2HD1 ILE 7 36.289 22.339 -14.513 62 3HD1 ILE 7 3HD1 ILE 7 36.542 23.487 -13.170 63 HA DPR 8 HA PRO 8 37.732 30.493 -16.443 64 1HB DPR 8 2HB PRO 8 36.910 31.512 -14.557 65 2HB DPR 8 1HB PRO 8 36.014 32.501 -15.732 66 1HG DPR 8 1HG PRO 8 34.689 31.170 -13.727 67 2HG DPR 8 2HG PRO 8 33.988 31.246 -15.368 68 1HD DPR 8 2HD PRO 8 35.293 28.869 -14.033 69 2HD DPR 8 1HD PRO 8 34.100 28.893 -15.350 70 H SER 9 H SER 9 37.777 29.858 -18.569 71 HA SER 9 HA SER 9 35.541 30.637 -20.473 72 1HB SER 9 2HB SER 9 38.507 31.373 -20.879 73 2HB SER 9 1HB SER 9 37.240 31.514 -22.106 74 HG SER 9 HG SER 9 36.108 32.895 -20.682 75 H TYR 10 H TYR 10 37.352 28.219 -19.237 76 HA TYR 10 HA TYR 10 37.896 26.746 -21.873 77 1HB TYR 10 2HB TYR 10 39.790 27.352 -20.376 78 2HB TYR 10 1HB TYR 10 39.047 26.460 -19.053 79 HD1 TYR 10 HD1 TYR 10 38.790 24.306 -21.930 80 HD2 TYR 10 HD2 TYR 10 41.605 25.902 -19.109 81 HE1 TYR 10 HE1 TYR 10 40.331 22.427 -22.370 82 HE2 TYR 10 HE2 TYR 10 43.096 24.044 -19.565 83 HH TYR 10 HH TYR 10 42.270 21.498 -21.890 84 H THR 11 H THR 11 36.438 25.180 -22.306 85 HA THR 11 HA THR 11 34.525 24.237 -20.194 86 HB THR 11 HB THR 11 34.449 23.626 -23.204 87 HG1 THR 11 HG1 THR 11 34.662 25.858 -22.881 88 1HG2 THR 11 1HG2 THR 11 32.063 24.176 -21.320 89 2HG2 THR 11 2HG2 THR 11 32.655 22.540 -21.657 90 3HG2 THR 11 3HG2 THR 11 32.001 23.538 -22.985 91 H PHE 12 H PHE 12 34.813 22.372 -19.312 92 HA PHE 12 HA PHE 12 36.712 20.215 -20.515 93 1HB PHE 12 2HB PHE 12 36.144 20.859 -17.586 94 2HB PHE 12 1HB PHE 12 36.941 19.401 -18.100 95 HD1 PHE 12 HD1 PHE 12 37.279 23.203 -18.446 96 HD2 PHE 12 HD2 PHE 12 39.343 19.458 -17.908 97 HE1 PHE 12 HE1 PHE 12 39.299 24.379 -17.824 98 HE2 PHE 12 HE2 PHE 12 41.337 20.685 -17.274 99 HZ PHE 12 HZ PHE 12 41.292 23.148 -17.141 100 H ARG 13 H ARG 13 35.444 18.614 -21.309 101 HA ARG 13 HA ARG 13 32.803 17.903 -19.944 102 1HB ARG 13 1HB ARG 13 32.969 18.012 -22.975 103 2HB ARG 13 2HB ARG 13 31.570 17.834 -21.896 104 1HG ARG 13 1HG ARG 13 31.907 20.234 -21.211 105 2HG ARG 13 2HG ARG 13 33.205 20.374 -22.359 106 1HD ARG 13 1HD ARG 13 30.328 19.640 -23.210 107 2HD ARG 13 2HD ARG 13 30.936 21.292 -23.093 108 HE ARG 13 HE ARG 13 32.818 20.144 -24.801 109 1HH1 ARG 13 1HH2 ARG 13 29.226 20.268 -25.042 110 2HH1 ARG 13 2HH2 ARG 13 29.369 20.206 -26.871 111 1HH2 ARG 13 1HH1 ARG 13 32.800 20.080 -26.853 112 2HH2 ARG 13 2HH1 ARG 13 31.235 20.108 -27.810 113 H GLY 14 H GLY 14 32.838 15.835 -19.384 114 1HA GLY 14 1HA GLY 14 33.508 13.628 -21.242 115 2HA GLY 14 2HA GLY 14 34.787 13.822 -20.046 116 HA PRO 15 HA PRO 15 31.347 11.193 -18.041 117 1HB PRO 15 2HB PRO 15 32.539 8.844 -17.436 118 2HB PRO 15 1HB PRO 15 32.136 9.304 -19.106 119 1HG PRO 15 1HG PRO 15 34.816 9.517 -17.690 120 2HG PRO 15 2HG PRO 15 34.478 8.774 -19.291 121 1HD PRO 15 1HD PRO 15 35.381 11.434 -18.957 122 2HD PRO 15 2HD PRO 15 34.363 10.939 -20.336 123 H GLY 16 H GLY 16 30.955 10.380 -15.875 124 1HA GLY 16 2HA GLY 16 31.222 10.202 -13.501 125 2HA GLY 16 1HA GLY 16 32.821 10.922 -13.620 126 H CYS 17 H CYS 17 29.708 11.504 -12.660 127 HA CYS 17 HA CYS 17 29.979 14.546 -12.694 128 1HB CYS 17 2HB CYS 17 27.494 12.868 -12.002 129 2HB CYS 17 1HB CYS 17 27.576 14.631 -12.123 130 HA PRO 18 HA PRO 18 30.982 14.189 -8.149 131 1HB PRO 18 1HB PRO 18 33.298 15.609 -8.019 132 2HB PRO 18 2HB PRO 18 33.246 13.936 -8.613 133 1HG PRO 18 1HG PRO 18 33.399 16.506 -10.263 134 2HG PRO 18 2HG PRO 18 34.363 15.012 -10.468 135 1HD PRO 18 2HD PRO 18 31.976 15.578 -11.916 136 2HD PRO 18 1HD PRO 18 32.575 13.931 -11.598 137 H THR 19 H THR 19 31.302 16.036 -6.535 138 HA THR 19 HA THR 19 29.480 18.370 -7.080 139 HB THR 19 HB THR 19 30.349 18.933 -4.614 140 HG1 THR 19 HG1 THR 19 30.748 16.142 -4.723 141 1HG2 THR 19 1HG2 THR 19 28.333 16.755 -5.087 142 2HG2 THR 19 2HG2 THR 19 28.072 18.531 -5.064 143 3HG2 THR 19 3HG2 THR 19 28.579 17.703 -3.561 144 H VAL 20 H VAL 20 30.082 20.542 -6.738 145 HA VAL 20 HA VAL 20 32.979 21.126 -7.151 146 HB VAL 20 HB VAL 20 32.587 22.689 -9.069 147 1HG1 VAL 20 1HG1 VAL 20 31.820 19.823 -9.804 148 2HG1 VAL 20 2HG1 VAL 20 33.471 20.426 -9.523 149 3HG1 VAL 20 3HG1 VAL 20 32.532 21.030 -10.904 150 1HG2 VAL 20 1HG2 VAL 20 30.145 23.188 -8.863 151 2HG2 VAL 20 2HG2 VAL 20 29.763 21.561 -9.474 152 3HG2 VAL 20 3HG2 VAL 20 30.611 22.738 -10.518 153 H LYS 21 H LYS 21 33.672 23.392 -7.065 154 HA LYS 21 HA LYS 21 32.532 24.636 -4.594 155 1HB LYS 21 2HB LYS 21 34.605 25.943 -4.585 156 2HB LYS 21 1HB LYS 21 34.859 24.206 -4.577 157 1HG LYS 21 1HG LYS 21 36.653 25.239 -5.684 158 2HG LYS 21 2HG LYS 21 35.783 24.260 -6.857 159 1HD LYS 21 2HD LYS 21 34.746 26.220 -7.879 160 2HD LYS 21 1HD LYS 21 35.415 27.303 -6.654 161 1HE LYS 21 2HE LYS 21 37.782 26.696 -7.472 162 2HE LYS 21 1HE LYS 21 37.047 25.695 -8.738 163 1HZ LYS 21 1HZ LYS 21 37.558 27.928 -9.538 164 2HZ LYS 21 2HZ LYS 21 36.605 28.626 -8.384 165 3HZ LYS 21 3HZ LYS 21 35.922 27.703 -9.571 166 HA PRO 22 HA PRO 22 30.512 28.175 -6.627 167 1HB PRO 22 2HB PRO 22 32.036 30.212 -4.912 168 2HB PRO 22 1HB PRO 22 30.293 30.063 -5.229 169 1HG PRO 22 2HG PRO 22 31.304 29.162 -2.885 170 2HG PRO 22 1HG PRO 22 30.106 28.156 -3.746 171 1HD PRO 22 2HD PRO 22 33.169 27.851 -3.795 172 2HD PRO 22 1HD PRO 22 31.932 26.590 -3.510 173 H DAL 23 H ALA 23 30.888 29.064 -8.584 174 HA DAL 23 HA ALA 23 33.763 29.708 -9.462 175 1HB DAL 23 1HB ALA 23 32.877 31.430 -11.010 176 2HB DAL 23 2HB ALA 23 32.510 31.838 -9.314 177 3HB DAL 23 3HB ALA 23 31.229 31.187 -10.374 178 H VAL 24 H VAL 24 33.469 27.328 -9.572 179 HA VAL 24 HA VAL 24 32.840 26.363 -12.346 180 HB VAL 24 HB VAL 24 33.934 24.901 -9.885 181 1HG1 VAL 24 1HG2 VAL 24 34.405 22.858 -11.143 182 2HG1 VAL 24 2HG2 VAL 24 32.685 23.239 -11.286 183 3HG1 VAL 24 3HG2 VAL 24 33.753 23.554 -12.666 184 1HG2 VAL 24 1HG1 VAL 24 36.143 24.785 -11.000 185 2HG2 VAL 24 2HG1 VAL 24 35.486 25.532 -12.492 186 3HG2 VAL 24 3HG1 VAL 24 35.583 26.463 -10.988 187 H THR 25 H THR 25 30.766 25.617 -12.875 188 HA THR 25 HA THR 25 28.916 24.529 -10.786 189 HB THR 25 HB THR 25 27.097 25.679 -12.022 190 HG1 THR 25 HG1 THR 25 29.158 27.401 -12.878 191 1HG2 THR 25 1HG2 THR 25 27.108 27.867 -10.815 192 2HG2 THR 25 2HG2 THR 25 28.842 27.662 -10.450 193 3HG2 THR 25 3HG2 THR 25 27.644 26.543 -9.746 194 H ILE 26 H ILE 26 29.083 22.651 -11.563 195 HA ILE 26 HA ILE 26 29.564 21.694 -14.148 196 HB ILE 26 HB ILE 26 29.864 20.781 -11.704 197 1HG1 ILE 26 1HG1 ILE 26 29.188 18.332 -13.429 198 2HG1 ILE 26 2HG1 ILE 26 30.307 19.456 -14.090 199 1HG2 ILE 26 1HG2 ILE 26 27.218 19.244 -12.148 200 2HG2 ILE 26 2HG2 ILE 26 27.438 20.579 -10.980 201 3HG2 ILE 26 3HG2 ILE 26 28.338 19.040 -10.779 202 1HD1 ILE 26 1HD1 ILE 26 31.432 17.626 -12.718 203 2HD1 ILE 26 2HD1 ILE 26 30.700 18.342 -11.256 204 3HD1 ILE 26 3HD1 ILE 26 31.842 19.302 -12.217 205 H ARG 27 H ARG 27 28.269 19.984 -15.319 206 HA ARG 27 HA ARG 27 25.310 20.256 -15.305 207 1HB ARG 27 2HB ARG 27 25.803 21.903 -16.919 208 2HB ARG 27 1HB ARG 27 26.757 20.701 -17.913 209 1HG ARG 27 1HG ARG 27 24.799 19.489 -18.398 210 2HG ARG 27 2HG ARG 27 23.794 20.537 -17.354 211 1HD ARG 27 1HD ARG 27 24.275 22.492 -18.919 212 2HD ARG 27 2HD ARG 27 25.214 21.407 -19.961 213 HE ARG 27 HE ARG 27 22.606 20.197 -19.609 214 1HH1 ARG 27 2HH1 ARG 27 23.865 23.141 -21.262 215 2HH1 ARG 27 1HH1 ARG 27 22.442 23.069 -22.419 216 1HH2 ARG 27 1HH2 ARG 27 21.085 20.263 -20.980 217 2HH2 ARG 27 2HH2 ARG 27 20.996 21.567 -22.268 218 H CYS 28 H CYS 28 25.012 18.492 -15.120 219 HA CYS 28 HA CYS 28 26.596 16.018 -16.106 220 1HB CYS 28 1HB CYS 28 26.259 16.038 -13.596 221 2HB CYS 28 2HB CYS 28 24.508 15.847 -13.855 222 H GLU 29 H GLU 29 25.717 15.361 -17.929 223 HA GLU 29 HA GLU 29 23.075 16.345 -18.899 224 1HB GLU 29 2HB GLU 29 25.232 14.659 -20.283 225 2HB GLU 29 1HB GLU 29 23.742 15.059 -21.098 226 1HG GLU 29 1HG GLU 29 25.662 17.225 -20.072 227 2HG GLU 29 2HG GLU 29 25.774 16.489 -21.667 Start of MODEL 26 1 1H SER 1 1H SER 1 24.393 8.926 -18.586 2 2H SER 1 2H SER 1 25.917 8.477 -18.134 3 3H SER 1 3H SER 1 25.681 9.280 -19.558 4 HA SER 1 HA SER 1 24.914 11.260 -18.402 5 1HB SER 1 2HB SER 1 25.605 9.597 -15.907 6 2HB SER 1 1HB SER 1 25.226 11.328 -15.887 7 HG SER 1 HG SER 1 23.413 10.031 -15.493 8 H LYS 2 H LYS 2 26.494 12.729 -18.555 9 HA LYS 2 HA LYS 2 29.340 12.153 -17.696 10 1HB LYS 2 2HB LYS 2 30.436 12.845 -19.703 11 2HB LYS 2 1HB LYS 2 29.408 11.472 -19.969 12 1HG LYS 2 2HG LYS 2 29.196 12.626 -21.959 13 2HG LYS 2 1HG LYS 2 27.693 13.001 -21.127 14 1HD LYS 2 1HD LYS 2 28.653 15.241 -20.455 15 2HD LYS 2 2HD LYS 2 30.158 14.868 -21.273 16 1HE LYS 2 1HE LYS 2 27.436 15.002 -22.759 17 2HE LYS 2 2HE LYS 2 28.454 16.405 -22.472 18 1HZ LYS 2 1HZ LYS 2 30.246 15.351 -23.725 19 2HZ LYS 2 2HZ LYS 2 29.320 14.013 -24.010 20 3HZ LYS 2 3HZ LYS 2 28.880 15.473 -24.645 21 H TYR 3 H TYR 3 30.503 13.956 -17.062 22 HA TYR 3 HA TYR 3 28.820 16.248 -16.136 23 1HB TYR 3 1HB TYR 3 30.595 16.952 -14.786 24 2HB TYR 3 2HB TYR 3 30.254 15.289 -14.488 25 HD1 TYR 3 HD1 TYR 3 32.082 13.589 -14.904 26 HD2 TYR 3 HD2 TYR 3 32.773 17.715 -15.899 27 HE1 TYR 3 HE1 TYR 3 34.485 13.184 -15.034 28 HE2 TYR 3 HE2 TYR 3 35.146 17.241 -16.102 29 HH TYR 3 HH TYR 3 36.751 15.754 -15.923 30 H GLU 4 H GLU 4 28.891 18.327 -16.925 31 HA GLU 4 HA GLU 4 31.270 19.130 -18.763 32 1HB GLU 4 2HB GLU 4 29.431 18.865 -20.156 33 2HB GLU 4 1HB GLU 4 28.317 19.779 -19.144 34 1HG GLU 4 1HG GLU 4 29.577 21.889 -19.652 35 2HG GLU 4 2HG GLU 4 30.725 20.967 -20.617 36 H TYR 5 H TYR 5 32.537 20.014 -17.264 37 HA TYR 5 HA TYR 5 31.372 21.963 -15.233 38 1HB TYR 5 2HB TYR 5 32.545 21.265 -13.490 39 2HB TYR 5 1HB TYR 5 32.354 19.723 -14.259 40 HD1 TYR 5 HD1 TYR 5 34.419 20.897 -12.078 41 HD2 TYR 5 HD2 TYR 5 34.774 19.627 -16.167 42 HE1 TYR 5 HE1 TYR 5 36.800 20.642 -11.800 43 HE2 TYR 5 HE2 TYR 5 37.177 19.315 -15.813 44 HH TYR 5 HH TYR 5 38.861 19.449 -14.429 45 H THR 6 H THR 6 31.820 23.746 -15.665 46 HA THR 6 HA THR 6 33.922 24.408 -17.755 47 HB THR 6 HB THR 6 31.576 26.231 -16.887 48 HG1 THR 6 HG1 THR 6 30.411 25.248 -18.544 49 1HG2 THR 6 1HG2 THR 6 31.651 26.968 -19.246 50 2HG2 THR 6 2HG2 THR 6 32.928 25.779 -19.605 51 3HG2 THR 6 3HG2 THR 6 33.303 27.148 -18.527 52 H ILE 7 H ILE 7 35.586 25.648 -17.270 53 HA ILE 7 HA ILE 7 35.829 26.913 -14.486 54 HB ILE 7 HB ILE 7 38.008 25.251 -15.909 55 1HG1 ILE 7 2HG1 ILE 7 37.806 23.684 -13.709 56 2HG1 ILE 7 1HG1 ILE 7 36.266 24.481 -13.494 57 1HG2 ILE 7 1HG2 ILE 7 39.332 25.521 -13.779 58 2HG2 ILE 7 2HG2 ILE 7 38.926 27.094 -14.498 59 3HG2 ILE 7 3HG2 ILE 7 38.004 26.508 -13.088 60 1HD1 ILE 7 1HD1 ILE 7 35.570 22.623 -14.521 61 2HD1 ILE 7 2HD1 ILE 7 35.905 23.438 -16.030 62 3HD1 ILE 7 3HD1 ILE 7 37.111 22.298 -15.363 63 HA DPR 8 HA PRO 8 37.935 30.219 -16.764 64 1HB DPR 8 2HB PRO 8 37.432 31.449 -14.891 65 2HB DPR 8 1HB PRO 8 36.547 32.462 -16.053 66 1HG DPR 8 1HG PRO 8 35.294 31.435 -13.828 67 2HG DPR 8 2HG PRO 8 34.433 31.521 -15.391 68 1HD DPR 8 1HD PRO 8 35.509 29.070 -14.022 69 2HD DPR 8 2HD PRO 8 34.245 29.186 -15.268 70 H SER 9 H SER 9 37.793 29.668 -18.896 71 HA SER 9 HA SER 9 35.382 30.499 -20.566 72 1HB SER 9 2HB SER 9 38.332 31.010 -21.296 73 2HB SER 9 1HB SER 9 36.956 31.203 -22.389 74 HG SER 9 HG SER 9 37.310 32.539 -19.911 75 H TYR 10 H TYR 10 37.133 27.952 -19.443 76 HA TYR 10 HA TYR 10 37.255 26.457 -22.104 77 1HB TYR 10 1HB TYR 10 39.314 26.933 -20.346 78 2HB TYR 10 2HB TYR 10 38.664 25.569 -19.509 79 HD1 TYR 10 HD1 TYR 10 40.420 26.743 -22.539 80 HD2 TYR 10 HD2 TYR 10 38.682 23.274 -20.683 81 HE1 TYR 10 HE1 TYR 10 41.645 25.284 -24.066 82 HE2 TYR 10 HE2 TYR 10 39.939 21.845 -22.219 83 HH TYR 10 HH TYR 10 41.359 21.753 -23.899 84 H THR 11 H THR 11 35.802 24.848 -22.405 85 HA THR 11 HA THR 11 33.973 24.006 -20.153 86 HB THR 11 HB THR 11 33.733 23.393 -23.147 87 HG1 THR 11 HG1 THR 11 33.965 25.635 -22.811 88 1HG2 THR 11 1HG2 THR 11 31.231 23.577 -22.722 89 2HG2 THR 11 2HG2 THR 11 32.008 22.227 -21.872 90 3HG2 THR 11 3HG2 THR 11 31.569 23.703 -20.972 91 H PHE 12 H PHE 12 34.621 22.307 -19.124 92 HA PHE 12 HA PHE 12 36.501 20.206 -20.441 93 1HB PHE 12 2HB PHE 12 36.163 20.867 -17.491 94 2HB PHE 12 1HB PHE 12 37.011 19.462 -18.065 95 HD1 PHE 12 HD1 PHE 12 39.306 19.663 -19.074 96 HD2 PHE 12 HD2 PHE 12 37.168 23.193 -17.834 97 HE1 PHE 12 HE1 PHE 12 41.380 20.925 -18.983 98 HE2 PHE 12 HE2 PHE 12 39.269 24.387 -17.691 99 HZ PHE 12 HZ PHE 12 41.378 23.283 -18.255 100 H ARG 13 H ARG 13 35.110 18.690 -21.245 101 HA ARG 13 HA ARG 13 32.776 17.732 -19.590 102 1HB ARG 13 2HB ARG 13 32.301 17.287 -22.465 103 2HB ARG 13 1HB ARG 13 31.352 18.013 -21.202 104 1HG ARG 13 1HG ARG 13 31.340 19.673 -22.687 105 2HG ARG 13 2HG ARG 13 32.604 20.167 -21.548 106 1HD ARG 13 2HD ARG 13 34.397 19.460 -23.133 107 2HD ARG 13 1HD ARG 13 33.192 18.823 -24.267 108 HE ARG 13 HE ARG 13 32.690 21.675 -23.651 109 1HH1 ARG 13 1HH1 ARG 13 34.662 19.605 -25.845 110 2HH1 ARG 13 2HH1 ARG 13 34.779 21.006 -27.024 111 1HH2 ARG 13 1HH2 ARG 13 32.921 23.135 -25.075 112 2HH2 ARG 13 2HH2 ARG 13 33.869 22.844 -26.618 113 H GLY 14 H GLY 14 32.817 15.685 -19.000 114 1HA GLY 14 2HA GLY 14 33.789 13.438 -20.699 115 2HA GLY 14 1HA GLY 14 34.936 13.828 -19.423 116 HA PRO 15 HA PRO 15 31.308 11.094 -17.726 117 1HB PRO 15 1HB PRO 15 32.133 8.493 -17.760 118 2HB PRO 15 2HB PRO 15 31.501 9.330 -19.193 119 1HG PRO 15 1HG PRO 15 34.410 8.877 -18.407 120 2HG PRO 15 2HG PRO 15 33.635 8.516 -19.986 121 1HD PRO 15 1HD PRO 15 35.044 10.887 -19.506 122 2HD PRO 15 2HD PRO 15 33.632 10.847 -20.597 123 H GLY 16 H GLY 16 31.117 9.832 -15.760 124 1HA GLY 16 2HA GLY 16 31.595 9.317 -13.421 125 2HA GLY 16 1HA GLY 16 33.269 9.800 -13.686 126 H CYS 17 H CYS 17 30.121 10.906 -12.746 127 HA CYS 17 HA CYS 17 30.718 13.809 -12.855 128 1HB CYS 17 1HB CYS 17 28.220 12.265 -11.975 129 2HB CYS 17 2HB CYS 17 28.333 14.023 -12.106 130 HA PRO 18 HA PRO 18 31.537 14.146 -8.221 131 1HB PRO 18 1HB PRO 18 33.482 16.058 -8.246 132 2HB PRO 18 2HB PRO 18 33.836 14.367 -8.655 133 1HG PRO 18 1HG PRO 18 33.389 16.713 -10.578 134 2HG PRO 18 2HG PRO 18 34.717 15.512 -10.613 135 1HD PRO 18 2HD PRO 18 32.353 15.220 -12.158 136 2HD PRO 18 1HD PRO 18 33.299 13.849 -11.532 137 H THR 19 H THR 19 31.440 16.317 -6.912 138 HA THR 19 HA THR 19 29.486 18.305 -8.183 139 HB THR 19 HB THR 19 28.227 17.315 -6.521 140 HG1 THR 19 HG1 THR 19 27.699 19.226 -5.474 141 1HG2 THR 19 1HG2 THR 19 29.832 16.611 -4.708 142 2HG2 THR 19 2HG2 THR 19 30.153 18.336 -4.346 143 3HG2 THR 19 3HG2 THR 19 28.519 17.653 -4.073 144 H VAL 20 H VAL 20 29.750 20.459 -7.573 145 HA VAL 20 HA VAL 20 32.740 21.247 -7.493 146 HB VAL 20 HB VAL 20 32.315 22.962 -9.238 147 1HG1 VAL 20 1HG2 VAL 20 32.398 21.478 -11.237 148 2HG1 VAL 20 2HG2 VAL 20 31.757 20.144 -10.224 149 3HG1 VAL 20 3HG2 VAL 20 33.351 20.840 -9.879 150 1HG2 VAL 20 1HG1 VAL 20 29.851 23.330 -9.103 151 2HG2 VAL 20 2HG1 VAL 20 29.575 21.754 -9.884 152 3HG2 VAL 20 3HG1 VAL 20 30.423 23.058 -10.762 153 H LYS 21 H LYS 21 33.371 23.249 -7.072 154 HA LYS 21 HA LYS 21 32.170 24.440 -4.628 155 1HB LYS 21 2HB LYS 21 34.317 24.722 -4.150 156 2HB LYS 21 1HB LYS 21 34.778 23.827 -5.539 157 1HG LYS 21 1HG LYS 21 34.980 26.780 -5.058 158 2HG LYS 21 2HG LYS 21 36.220 25.557 -5.340 159 1HD LYS 21 1HD LYS 21 35.357 25.399 -7.762 160 2HD LYS 21 2HD LYS 21 34.303 26.765 -7.420 161 1HE LYS 21 2HE LYS 21 37.387 26.921 -7.149 162 2HE LYS 21 1HE LYS 21 36.538 27.221 -8.660 163 1HZ LYS 21 1HZ LYS 21 36.112 28.788 -6.168 164 2HZ LYS 21 2HZ LYS 21 36.965 29.280 -7.495 165 3HZ LYS 21 3HZ LYS 21 35.333 29.046 -7.601 166 HA PRO 22 HA PRO 22 30.294 28.159 -6.440 167 1HB PRO 22 1HB PRO 22 31.844 30.195 -4.786 168 2HB PRO 22 2HB PRO 22 30.097 29.885 -4.873 169 1HG PRO 22 1HG PRO 22 31.547 29.063 -2.719 170 2HG PRO 22 2HG PRO 22 30.281 27.998 -3.395 171 1HD PRO 22 2HD PRO 22 33.309 27.855 -4.002 172 2HD PRO 22 1HD PRO 22 32.224 26.539 -3.467 173 H DAL 23 H ALA 23 30.672 28.936 -8.456 174 HA DAL 23 HA ALA 23 33.510 29.628 -9.359 175 1HB DAL 23 1HB ALA 23 32.354 31.796 -9.066 176 2HB DAL 23 2HB ALA 23 32.669 31.469 -10.790 177 3HB DAL 23 3HB ALA 23 31.025 31.260 -10.130 178 H VAL 24 H VAL 24 33.166 27.251 -9.650 179 HA VAL 24 HA VAL 24 32.602 26.618 -12.497 180 HB VAL 24 HB VAL 24 33.420 24.743 -10.231 181 1HG1 VAL 24 1HG1 VAL 24 32.545 23.490 -12.270 182 2HG1 VAL 24 2HG1 VAL 24 33.808 24.218 -13.282 183 3HG1 VAL 24 3HG1 VAL 24 34.241 23.100 -11.963 184 1HG2 VAL 24 1HG2 VAL 24 35.413 26.059 -12.184 185 2HG2 VAL 24 2HG2 VAL 24 35.833 24.822 -10.959 186 3HG2 VAL 24 3HG2 VAL 24 35.234 26.408 -10.457 187 H THR 25 H THR 25 30.750 25.402 -13.259 188 HA THR 25 HA THR 25 28.665 24.496 -11.307 189 HB THR 25 HB THR 25 26.996 25.438 -12.839 190 HG1 THR 25 HG1 THR 25 29.115 27.094 -13.694 191 1HG2 THR 25 1HG2 THR 25 26.849 27.766 -11.928 192 2HG2 THR 25 2HG2 THR 25 28.539 27.652 -11.367 193 3HG2 THR 25 3HG2 THR 25 27.289 26.600 -10.651 194 H ILE 26 H ILE 26 29.025 22.523 -11.825 195 HA ILE 26 HA ILE 26 29.524 21.296 -14.300 196 HB ILE 26 HB ILE 26 30.034 20.678 -11.848 197 1HG1 ILE 26 1HG1 ILE 26 29.142 18.064 -13.215 198 2HG1 ILE 26 2HG1 ILE 26 30.260 19.071 -14.058 199 1HG2 ILE 26 1HG2 ILE 26 27.361 19.116 -11.742 200 2HG2 ILE 26 2HG2 ILE 26 28.649 19.104 -10.517 201 3HG2 ILE 26 3HG2 ILE 26 27.720 20.601 -10.805 202 1HD1 ILE 26 1HD1 ILE 26 30.779 18.111 -11.219 203 2HD1 ILE 26 2HD1 ILE 26 31.496 17.422 -12.733 204 3HD1 ILE 26 3HD1 ILE 26 31.857 19.105 -12.199 205 H ARG 27 H ARG 27 28.300 19.543 -15.401 206 HA ARG 27 HA ARG 27 25.328 19.509 -15.103 207 1HB ARG 27 1HB ARG 27 26.542 20.127 -17.818 208 2HB ARG 27 2HB ARG 27 24.887 19.465 -17.561 209 1HG ARG 27 1HG ARG 27 24.194 21.325 -16.367 210 2HG ARG 27 2HG ARG 27 25.830 22.089 -16.494 211 1HD ARG 27 1HD ARG 27 25.536 22.257 -19.000 212 2HD ARG 27 2HD ARG 27 23.925 21.524 -18.870 213 HE ARG 27 HE ARG 27 24.034 23.847 -17.101 214 1HH1 ARG 27 1HH1 ARG 27 23.847 23.236 -20.647 215 2HH1 ARG 27 2HH1 ARG 27 23.055 24.876 -20.863 216 1HH2 ARG 27 2HH2 ARG 27 23.142 25.644 -17.517 217 2HH2 ARG 27 1HH2 ARG 27 22.689 26.128 -19.228 218 H CYS 28 H CYS 28 25.310 17.731 -14.705 219 HA CYS 28 HA CYS 28 26.764 15.390 -16.077 220 1HB CYS 28 2HB CYS 28 26.876 15.360 -13.549 221 2HB CYS 28 1HB CYS 28 25.121 15.038 -13.522 222 H GLU 29 H GLU 29 25.615 15.279 -17.833 223 HA GLU 29 HA GLU 29 22.881 16.213 -18.188 224 1HB GLU 29 2HB GLU 29 24.715 14.757 -20.169 225 2HB GLU 29 1HB GLU 29 23.132 15.311 -20.655 226 1HG GLU 29 1HG GLU 29 25.293 17.231 -19.628 227 2HG GLU 29 2HG GLU 29 25.084 16.786 -21.319 Start of MODEL 27 1 1H SER 1 1H SER 1 26.273 8.592 -17.150 2 2H SER 1 2H SER 1 24.671 8.908 -17.402 3 3H SER 1 3H SER 1 25.776 9.256 -18.579 4 HA SER 1 HA SER 1 25.041 11.277 -17.469 5 1HB SER 1 2HB SER 1 26.203 9.872 -14.991 6 2HB SER 1 1HB SER 1 25.708 11.573 -15.042 7 HG SER 1 HG SER 1 23.627 10.869 -15.674 8 H LYS 2 H LYS 2 26.472 12.798 -18.007 9 HA LYS 2 HA LYS 2 29.450 12.461 -17.544 10 1HB LYS 2 1HB LYS 2 30.139 13.137 -19.731 11 2HB LYS 2 2HB LYS 2 29.212 11.657 -19.786 12 1HG LYS 2 1HG LYS 2 27.266 12.871 -20.750 13 2HG LYS 2 2HG LYS 2 28.106 14.401 -20.669 14 1HD LYS 2 1HD LYS 2 29.152 11.989 -22.327 15 2HD LYS 2 2HD LYS 2 27.936 13.099 -22.927 16 1HE LYS 2 1HE LYS 2 29.518 15.033 -22.775 17 2HE LYS 2 2HE LYS 2 30.779 13.964 -22.136 18 1HZ LYS 2 1HZ LYS 2 29.471 13.664 -24.801 19 2HZ LYS 2 2HZ LYS 2 30.646 12.668 -24.204 20 3HZ LYS 2 3HZ LYS 2 30.992 14.250 -24.534 21 H TYR 3 H TYR 3 30.608 14.345 -17.253 22 HA TYR 3 HA TYR 3 28.938 16.679 -16.296 23 1HB TYR 3 2HB TYR 3 30.781 17.507 -15.106 24 2HB TYR 3 1HB TYR 3 30.447 15.894 -14.614 25 HD1 TYR 3 HD1 TYR 3 32.090 13.983 -15.415 26 HD2 TYR 3 HD2 TYR 3 33.041 18.157 -15.858 27 HE1 TYR 3 HE1 TYR 3 34.471 13.464 -15.544 28 HE2 TYR 3 HE2 TYR 3 35.395 17.578 -16.047 29 HH TYR 3 HH TYR 3 36.906 15.981 -16.027 30 H GLU 4 H GLU 4 29.032 18.637 -17.156 31 HA GLU 4 HA GLU 4 31.349 19.444 -19.053 32 1HB GLU 4 1HB GLU 4 29.822 19.346 -20.675 33 2HB GLU 4 2HB GLU 4 28.415 19.521 -19.677 34 1HG GLU 4 2HG GLU 4 28.924 22.050 -19.531 35 2HG GLU 4 1HG GLU 4 30.211 21.796 -20.702 36 H TYR 5 H TYR 5 32.575 20.408 -17.518 37 HA TYR 5 HA TYR 5 31.269 22.398 -15.624 38 1HB TYR 5 2HB TYR 5 32.431 21.887 -13.789 39 2HB TYR 5 1HB TYR 5 32.054 20.309 -14.389 40 HD1 TYR 5 HD1 TYR 5 34.005 21.042 -12.169 41 HD2 TYR 5 HD2 TYR 5 34.669 20.089 -16.299 42 HE1 TYR 5 HE1 TYR 5 36.346 20.695 -11.714 43 HE2 TYR 5 HE2 TYR 5 37.040 19.670 -15.767 44 HH TYR 5 HH TYR 5 38.305 20.070 -12.505 45 H THR 6 H THR 6 31.880 24.185 -15.911 46 HA THR 6 HA THR 6 34.099 24.778 -17.912 47 HB THR 6 HB THR 6 31.859 26.759 -17.105 48 HG1 THR 6 HG1 THR 6 30.903 24.765 -17.607 49 1HG2 THR 6 1HG2 THR 6 32.010 27.484 -19.442 50 2HG2 THR 6 2HG2 THR 6 33.697 27.463 -18.786 51 3HG2 THR 6 3HG2 THR 6 33.108 26.151 -19.833 52 H ILE 7 H ILE 7 35.832 26.011 -17.376 53 HA ILE 7 HA ILE 7 35.973 27.370 -14.642 54 HB ILE 7 HB ILE 7 38.081 25.358 -15.640 55 1HG1 ILE 7 1HG1 ILE 7 37.316 24.083 -13.282 56 2HG1 ILE 7 2HG1 ILE 7 35.828 24.960 -13.580 57 1HG2 ILE 7 1HG2 ILE 7 37.925 26.806 -12.938 58 2HG2 ILE 7 2HG2 ILE 7 39.172 25.613 -13.429 59 3HG2 ILE 7 3HG2 ILE 7 39.049 27.166 -14.282 60 1HD1 ILE 7 1HD1 ILE 7 35.817 23.734 -15.898 61 2HD1 ILE 7 2HD1 ILE 7 35.480 22.876 -14.389 62 3HD1 ILE 7 3HD1 ILE 7 37.083 22.700 -15.163 63 HA DPR 8 HA PRO 8 38.697 30.200 -16.852 64 1HB DPR 8 2HB PRO 8 37.978 31.797 -15.381 65 2HB DPR 8 1HB PRO 8 37.358 32.619 -16.824 66 1HG DPR 8 2HG PRO 8 35.694 32.060 -14.722 67 2HG DPR 8 1HG PRO 8 35.112 31.836 -16.397 68 1HD DPR 8 2HD PRO 8 35.935 29.695 -14.420 69 2HD DPR 8 1HD PRO 8 34.769 29.595 -15.757 70 H SER 9 H SER 9 39.195 30.006 -18.894 71 HA SER 9 HA SER 9 37.411 30.840 -21.196 72 1HB SER 9 2HB SER 9 40.316 29.842 -21.131 73 2HB SER 9 1HB SER 9 39.453 30.353 -22.589 74 HG SER 9 HG SER 9 39.120 32.380 -21.603 75 H TYR 10 H TYR 10 38.061 27.847 -19.487 76 HA TYR 10 HA TYR 10 37.759 26.193 -22.048 77 1HB TYR 10 1HB TYR 10 39.076 25.700 -19.299 78 2HB TYR 10 2HB TYR 10 38.393 24.328 -20.069 79 HD1 TYR 10 HD1 TYR 10 39.216 23.430 -22.247 80 HD2 TYR 10 HD2 TYR 10 41.173 26.753 -20.320 81 HE1 TYR 10 HE1 TYR 10 41.218 22.984 -23.504 82 HE2 TYR 10 HE2 TYR 10 43.170 26.272 -21.604 83 HH TYR 10 HH TYR 10 44.140 24.995 -23.119 84 H THR 11 H THR 11 36.065 24.874 -22.379 85 HA THR 11 HA THR 11 34.057 24.307 -20.149 86 HB THR 11 HB THR 11 33.810 23.778 -23.163 87 HG1 THR 11 HG1 THR 11 32.517 25.645 -23.208 88 1HG2 THR 11 1HG2 THR 11 32.135 22.554 -21.618 89 2HG2 THR 11 2HG2 THR 11 31.537 24.134 -21.090 90 3HG2 THR 11 3HG2 THR 11 31.359 23.639 -22.798 91 H PHE 12 H PHE 12 34.862 22.681 -19.135 92 HA PHE 12 HA PHE 12 36.719 20.589 -20.465 93 1HB PHE 12 1HB PHE 12 36.204 21.144 -17.515 94 2HB PHE 12 2HB PHE 12 37.048 19.729 -18.056 95 HD1 PHE 12 HD1 PHE 12 39.365 19.905 -19.095 96 HD2 PHE 12 HD2 PHE 12 37.357 23.378 -17.524 97 HE1 PHE 12 HE1 PHE 12 41.495 21.014 -18.741 98 HE2 PHE 12 HE2 PHE 12 39.511 24.409 -17.115 99 HZ PHE 12 HZ PHE 12 41.582 23.253 -17.705 100 H ARG 13 H ARG 13 35.479 18.898 -21.241 101 HA ARG 13 HA ARG 13 32.900 18.075 -19.801 102 1HB ARG 13 2HB ARG 13 33.080 17.971 -22.834 103 2HB ARG 13 1HB ARG 13 31.669 17.862 -21.762 104 1HG ARG 13 2HG ARG 13 31.756 20.290 -21.340 105 2HG ARG 13 1HG ARG 13 33.204 20.410 -22.298 106 1HD ARG 13 1HD ARG 13 31.450 21.190 -23.705 107 2HD ARG 13 2HD ARG 13 31.953 19.637 -24.360 108 HE ARG 13 HE ARG 13 29.636 19.261 -22.586 109 1HH1 ARG 13 1HH1 ARG 13 30.327 20.471 -25.907 110 2HH1 ARG 13 2HH1 ARG 13 28.602 20.070 -26.387 111 1HH2 ARG 13 1HH2 ARG 13 27.749 18.873 -23.284 112 2HH2 ARG 13 2HH2 ARG 13 27.261 19.236 -25.015 113 H GLY 14 H GLY 14 32.884 16.008 -19.224 114 1HA GLY 14 2HA GLY 14 33.950 13.777 -20.898 115 2HA GLY 14 1HA GLY 14 35.001 14.133 -19.533 116 HA PRO 15 HA PRO 15 31.251 11.367 -18.206 117 1HB PRO 15 2HB PRO 15 32.110 8.778 -18.142 118 2HB PRO 15 1HB PRO 15 31.610 9.607 -19.631 119 1HG PRO 15 2HG PRO 15 34.430 9.201 -18.558 120 2HG PRO 15 1HG PRO 15 33.818 8.824 -20.205 121 1HD PRO 15 2HD PRO 15 35.142 11.219 -19.607 122 2HD PRO 15 1HD PRO 15 33.836 11.159 -20.821 123 H GLY 16 H GLY 16 30.849 10.189 -16.261 124 1HA GLY 16 2HA GLY 16 31.016 9.742 -13.869 125 2HA GLY 16 1HA GLY 16 32.747 10.042 -13.984 126 H CYS 17 H CYS 17 29.685 11.455 -13.204 127 HA CYS 17 HA CYS 17 30.773 14.291 -13.085 128 1HB CYS 17 1HB CYS 17 28.739 15.092 -13.411 129 2HB CYS 17 2HB CYS 17 28.808 13.722 -14.496 130 HA PRO 18 HA PRO 18 30.532 13.927 -8.418 131 1HB PRO 18 1HB PRO 18 32.916 14.995 -7.685 132 2HB PRO 18 2HB PRO 18 32.797 13.367 -8.384 133 1HG PRO 18 1HG PRO 18 33.626 15.956 -9.789 134 2HG PRO 18 2HG PRO 18 34.445 14.365 -9.852 135 1HD PRO 18 2HD PRO 18 32.557 15.244 -11.782 136 2HD PRO 18 1HD PRO 18 32.866 13.531 -11.410 137 H THR 19 H THR 19 30.797 15.739 -6.693 138 HA THR 19 HA THR 19 29.195 18.136 -7.337 139 HB THR 19 HB THR 19 30.087 18.774 -4.910 140 HG1 THR 19 HG1 THR 19 31.701 17.184 -4.867 141 1HG2 THR 19 1HG2 THR 19 27.820 18.246 -5.266 142 2HG2 THR 19 2HG2 THR 19 28.170 16.485 -5.230 143 3HG2 THR 19 3HG2 THR 19 28.423 17.504 -3.752 144 H VAL 20 H VAL 20 29.805 20.339 -6.858 145 HA VAL 20 HA VAL 20 32.679 20.963 -7.352 146 HB VAL 20 HB VAL 20 32.174 22.781 -9.030 147 1HG1 VAL 20 1HG1 VAL 20 32.104 21.370 -11.067 148 2HG1 VAL 20 2HG1 VAL 20 33.167 20.700 -9.809 149 3HG1 VAL 20 3HG1 VAL 20 31.557 19.994 -10.074 150 1HG2 VAL 20 1HG2 VAL 20 30.185 22.975 -10.385 151 2HG2 VAL 20 2HG2 VAL 20 29.396 21.590 -9.568 152 3HG2 VAL 20 3HG2 VAL 20 29.700 23.105 -8.683 153 H LYS 21 H LYS 21 33.391 23.185 -6.994 154 HA LYS 21 HA LYS 21 32.275 24.168 -4.396 155 1HB LYS 21 2HB LYS 21 34.359 25.421 -4.237 156 2HB LYS 21 1HB LYS 21 34.604 23.693 -4.439 157 1HG LYS 21 1HG LYS 21 36.399 24.823 -5.395 158 2HG LYS 21 2HG LYS 21 35.529 24.031 -6.700 159 1HD LYS 21 2HD LYS 21 34.577 26.094 -7.510 160 2HD LYS 21 1HD LYS 21 35.113 27.015 -6.103 161 1HE LYS 21 2HE LYS 21 37.561 26.581 -6.812 162 2HE LYS 21 1HE LYS 21 36.947 25.793 -8.276 163 1HZ LYS 21 1HZ LYS 21 36.402 28.618 -7.475 164 2HZ LYS 21 2HZ LYS 21 37.454 28.136 -8.654 165 3HZ LYS 21 3HZ LYS 21 35.831 27.898 -8.848 166 HA PRO 22 HA PRO 22 30.302 27.896 -6.110 167 1HB PRO 22 2HB PRO 22 31.781 29.743 -4.162 168 2HB PRO 22 1HB PRO 22 30.045 29.627 -4.531 169 1HG PRO 22 1HG PRO 22 31.006 28.491 -2.268 170 2HG PRO 22 2HG PRO 22 29.829 27.580 -3.254 171 1HD PRO 22 1HD PRO 22 32.892 27.278 -3.265 172 2HD PRO 22 2HD PRO 22 31.650 25.996 -3.138 173 H DAL 23 H ALA 23 30.771 28.859 -8.003 174 HA DAL 23 HA ALA 23 33.666 29.559 -8.721 175 1HB DAL 23 1HB ALA 23 32.482 31.708 -8.388 176 2HB DAL 23 2HB ALA 23 31.214 31.216 -9.543 177 3HB DAL 23 3HB ALA 23 32.887 31.464 -10.108 178 H VAL 24 H VAL 24 33.298 27.184 -9.104 179 HA VAL 24 HA VAL 24 32.860 26.646 -12.008 180 HB VAL 24 HB VAL 24 33.653 24.735 -9.758 181 1HG1 VAL 24 1HG2 VAL 24 33.890 24.166 -12.809 182 2HG1 VAL 24 2HG2 VAL 24 32.713 23.443 -11.705 183 3HG1 VAL 24 3HG2 VAL 24 34.432 23.078 -11.495 184 1HG2 VAL 24 1HG1 VAL 24 36.051 24.812 -10.617 185 2HG2 VAL 24 2HG1 VAL 24 35.446 26.376 -10.057 186 3HG2 VAL 24 3HG1 VAL 24 35.546 26.080 -11.786 187 H THR 25 H THR 25 30.892 25.823 -12.827 188 HA THR 25 HA THR 25 28.802 24.715 -10.972 189 HB THR 25 HB THR 25 27.163 25.910 -12.356 190 HG1 THR 25 HG1 THR 25 27.805 27.831 -13.374 191 1HG2 THR 25 1HG2 THR 25 28.810 27.857 -10.641 192 2HG2 THR 25 2HG2 THR 25 27.123 28.108 -11.166 193 3HG2 THR 25 3HG2 THR 25 27.520 26.777 -10.046 194 H ILE 26 H ILE 26 29.090 22.840 -11.717 195 HA ILE 26 HA ILE 26 29.576 21.837 -14.298 196 HB ILE 26 HB ILE 26 29.939 20.951 -11.873 197 1HG1 ILE 26 2HG1 ILE 26 28.974 18.469 -13.439 198 2HG1 ILE 26 1HG1 ILE 26 30.086 19.483 -14.257 199 1HG2 ILE 26 1HG2 ILE 26 28.371 19.329 -10.791 200 2HG2 ILE 26 2HG2 ILE 26 27.568 20.924 -10.985 201 3HG2 ILE 26 3HG2 ILE 26 27.173 19.575 -12.089 202 1HD1 ILE 26 1HD1 ILE 26 31.723 19.386 -12.382 203 2HD1 ILE 26 2HD1 ILE 26 30.610 18.376 -11.448 204 3HD1 ILE 26 3HD1 ILE 26 31.327 17.740 -12.968 205 H ARG 27 H ARG 27 28.261 20.175 -15.434 206 HA ARG 27 HA ARG 27 25.277 20.356 -15.272 207 1HB ARG 27 1HB ARG 27 25.638 21.947 -16.941 208 2HB ARG 27 2HB ARG 27 26.616 20.752 -17.928 209 1HG ARG 27 2HG ARG 27 24.690 19.445 -18.311 210 2HG ARG 27 1HG ARG 27 23.676 20.502 -17.284 211 1HD ARG 27 2HD ARG 27 24.028 22.398 -18.941 212 2HD ARG 27 1HD ARG 27 25.003 21.319 -19.959 213 HE ARG 27 HE ARG 27 22.381 20.095 -19.418 214 1HH1 ARG 27 1HH2 ARG 27 23.794 22.629 -21.554 215 2HH1 ARG 27 2HH2 ARG 27 22.412 22.370 -22.734 216 1HH2 ARG 27 1HH1 ARG 27 20.912 19.933 -20.837 217 2HH2 ARG 27 2HH1 ARG 27 20.912 20.963 -22.355 218 H CYS 28 H CYS 28 25.122 18.604 -14.884 219 HA CYS 28 HA CYS 28 26.688 16.125 -15.882 220 1HB CYS 28 1HB CYS 28 26.849 16.199 -13.513 221 2HB CYS 28 2HB CYS 28 25.098 16.274 -13.257 222 H GLU 29 H GLU 29 25.655 15.473 -17.579 223 HA GLU 29 HA GLU 29 22.872 16.269 -18.261 224 1HB GLU 29 1HB GLU 29 24.967 14.659 -19.856 225 2HB GLU 29 2HB GLU 29 23.365 14.984 -20.499 226 1HG GLU 29 2HG GLU 29 23.745 17.442 -20.437 227 2HG GLU 29 1HG GLU 29 25.362 17.191 -19.766 Start of MODEL 28 1 1H SER 1 1H SER 1 25.761 9.316 -18.526 2 2H SER 1 2H SER 1 26.348 8.581 -17.168 3 3H SER 1 3H SER 1 24.739 8.936 -17.285 4 HA SER 1 HA SER 1 25.147 11.292 -17.283 5 1HB SER 1 2HB SER 1 25.872 11.508 -14.920 6 2HB SER 1 1HB SER 1 24.714 10.187 -15.138 7 HG SER 1 HG SER 1 27.544 9.942 -15.011 8 H LYS 2 H LYS 2 26.545 12.810 -17.896 9 HA LYS 2 HA LYS 2 29.542 12.468 -17.622 10 1HB LYS 2 2HB LYS 2 30.104 13.197 -19.846 11 2HB LYS 2 1HB LYS 2 29.237 11.680 -19.845 12 1HG LYS 2 1HG LYS 2 27.148 12.893 -20.692 13 2HG LYS 2 2HG LYS 2 28.070 14.377 -20.695 14 1HD LYS 2 2HD LYS 2 28.157 13.816 -22.919 15 2HD LYS 2 1HD LYS 2 29.732 13.276 -22.378 16 1HE LYS 2 1HE LYS 2 28.824 10.875 -22.310 17 2HE LYS 2 2HE LYS 2 27.260 11.477 -22.887 18 1HZ LYS 2 1HZ LYS 2 28.638 10.690 -24.720 19 2HZ LYS 2 2HZ LYS 2 29.848 11.752 -24.349 20 3HZ LYS 2 3HZ LYS 2 28.391 12.315 -24.888 21 H TYR 3 H TYR 3 30.667 14.340 -17.237 22 HA TYR 3 HA TYR 3 28.984 16.666 -16.308 23 1HB TYR 3 2HB TYR 3 30.822 17.502 -15.114 24 2HB TYR 3 1HB TYR 3 30.497 15.887 -14.624 25 HD1 TYR 3 HD1 TYR 3 33.080 18.165 -15.857 26 HD2 TYR 3 HD2 TYR 3 32.149 13.985 -15.431 27 HE1 TYR 3 HE1 TYR 3 35.436 17.599 -16.043 28 HE2 TYR 3 HE2 TYR 3 34.532 13.478 -15.561 29 HH TYR 3 HH TYR 3 36.566 14.247 -15.827 30 H GLU 4 H GLU 4 29.054 18.617 -17.179 31 HA GLU 4 HA GLU 4 31.378 19.449 -19.059 32 1HB GLU 4 1HB GLU 4 29.852 19.338 -20.683 33 2HB GLU 4 2HB GLU 4 28.444 19.512 -19.689 34 1HG GLU 4 2HG GLU 4 28.938 22.040 -19.545 35 2HG GLU 4 1HG GLU 4 30.238 21.794 -20.704 36 H TYR 5 H TYR 5 32.592 20.412 -17.516 37 HA TYR 5 HA TYR 5 31.271 22.396 -15.626 38 1HB TYR 5 1HB TYR 5 32.449 21.906 -13.794 39 2HB TYR 5 2HB TYR 5 32.071 20.324 -14.384 40 HD1 TYR 5 HD1 TYR 5 34.679 20.104 -16.306 41 HD2 TYR 5 HD2 TYR 5 34.033 21.071 -12.177 42 HE1 TYR 5 HE1 TYR 5 37.059 19.708 -15.785 43 HE2 TYR 5 HE2 TYR 5 36.378 20.744 -11.733 44 HH TYR 5 HH TYR 5 38.338 20.134 -12.532 45 H THR 6 H THR 6 31.851 24.182 -15.938 46 HA THR 6 HA THR 6 34.072 24.795 -17.931 47 HB THR 6 HB THR 6 31.793 26.739 -17.142 48 HG1 THR 6 HG1 THR 6 31.665 24.643 -19.041 49 1HG2 THR 6 1HG2 THR 6 31.947 27.454 -19.488 50 2HG2 THR 6 2HG2 THR 6 33.092 26.154 -19.853 51 3HG2 THR 6 3HG2 THR 6 33.622 27.487 -18.803 52 H ILE 7 H ILE 7 35.792 26.038 -17.383 53 HA ILE 7 HA ILE 7 35.895 27.418 -14.657 54 HB ILE 7 HB ILE 7 38.023 25.412 -15.623 55 1HG1 ILE 7 2HG1 ILE 7 37.253 24.146 -13.269 56 2HG1 ILE 7 1HG1 ILE 7 35.766 25.024 -13.571 57 1HG2 ILE 7 1HG2 ILE 7 39.098 25.690 -13.406 58 2HG2 ILE 7 2HG2 ILE 7 38.972 27.237 -14.271 59 3HG2 ILE 7 3HG2 ILE 7 37.840 26.879 -12.933 60 1HD1 ILE 7 1HD1 ILE 7 35.386 22.958 -14.386 61 2HD1 ILE 7 2HD1 ILE 7 37.009 22.730 -15.108 62 3HD1 ILE 7 3HD1 ILE 7 35.787 23.777 -15.897 63 HA DPR 8 HA PRO 8 38.620 30.253 -16.862 64 1HB DPR 8 1HB PRO 8 37.879 31.854 -15.404 65 2HB DPR 8 2HB PRO 8 37.265 32.664 -16.857 66 1HG DPR 8 2HG PRO 8 35.588 32.106 -14.765 67 2HG DPR 8 1HG PRO 8 35.021 31.869 -16.443 68 1HD DPR 8 2HD PRO 8 35.841 29.744 -14.448 69 2HD DPR 8 1HD PRO 8 34.687 29.629 -15.794 70 H SER 9 H SER 9 39.135 30.051 -18.897 71 HA SER 9 HA SER 9 37.367 30.860 -21.218 72 1HB SER 9 1HB SER 9 40.275 29.876 -21.123 73 2HB SER 9 2HB SER 9 39.422 30.375 -22.592 74 HG SER 9 HG SER 9 39.072 32.407 -21.620 75 H TYR 10 H TYR 10 38.022 27.879 -19.490 76 HA TYR 10 HA TYR 10 37.750 26.212 -22.046 77 1HB TYR 10 1HB TYR 10 39.036 25.733 -19.280 78 2HB TYR 10 2HB TYR 10 38.371 24.357 -20.058 79 HD1 TYR 10 HD1 TYR 10 41.136 26.803 -20.278 80 HD2 TYR 10 HD2 TYR 10 39.230 23.459 -22.221 81 HE1 TYR 10 HE1 TYR 10 43.152 26.337 -21.539 82 HE2 TYR 10 HE2 TYR 10 41.251 23.029 -23.455 83 HH TYR 10 HH TYR 10 44.150 25.066 -23.041 84 H THR 11 H THR 11 36.061 24.892 -22.393 85 HA THR 11 HA THR 11 34.037 24.314 -20.180 86 HB THR 11 HB THR 11 33.815 23.786 -23.196 87 HG1 THR 11 HG1 THR 11 33.995 26.005 -22.764 88 1HG2 THR 11 1HG2 THR 11 31.527 24.131 -21.138 89 2HG2 THR 11 2HG2 THR 11 31.361 23.638 -22.848 90 3HG2 THR 11 3HG2 THR 11 32.135 22.555 -21.665 91 H PHE 12 H PHE 12 34.849 22.695 -19.160 92 HA PHE 12 HA PHE 12 36.722 20.612 -20.484 93 1HB PHE 12 1HB PHE 12 36.191 21.157 -17.538 94 2HB PHE 12 2HB PHE 12 37.054 19.754 -18.079 95 HD1 PHE 12 HD1 PHE 12 37.318 23.396 -17.506 96 HD2 PHE 12 HD2 PHE 12 39.376 19.967 -19.109 97 HE1 PHE 12 HE1 PHE 12 39.457 24.447 -17.070 98 HE2 PHE 12 HE2 PHE 12 41.490 21.093 -18.718 99 HZ PHE 12 HZ PHE 12 41.543 23.319 -17.653 100 H ARG 13 H ARG 13 35.491 18.921 -21.266 101 HA ARG 13 HA ARG 13 32.914 18.080 -19.832 102 1HB ARG 13 1HB ARG 13 33.102 17.972 -22.864 103 2HB ARG 13 2HB ARG 13 31.690 17.861 -21.794 104 1HG ARG 13 2HG ARG 13 31.766 20.292 -21.381 105 2HG ARG 13 1HG ARG 13 33.216 20.413 -22.338 106 1HD ARG 13 2HD ARG 13 31.461 21.181 -23.751 107 2HD ARG 13 1HD ARG 13 31.969 19.626 -24.398 108 HE ARG 13 HE ARG 13 29.602 19.405 -22.595 109 1HH1 ARG 13 2HH2 ARG 13 30.484 20.008 -26.035 110 2HH1 ARG 13 1HH2 ARG 13 28.791 19.504 -26.532 111 1HH2 ARG 13 2HH1 ARG 13 27.760 18.874 -23.318 112 2HH2 ARG 13 1HH1 ARG 13 27.374 18.913 -25.112 113 H GLY 14 H GLY 14 32.918 16.013 -19.249 114 1HA GLY 14 2HA GLY 14 34.014 13.789 -20.915 115 2HA GLY 14 1HA GLY 14 35.056 14.163 -19.550 116 HA PRO 15 HA PRO 15 31.342 11.347 -18.227 117 1HB PRO 15 2HB PRO 15 32.232 8.768 -18.172 118 2HB PRO 15 1HB PRO 15 31.717 9.595 -19.657 119 1HG PRO 15 1HG PRO 15 34.546 9.221 -18.594 120 2HG PRO 15 2HG PRO 15 33.933 8.841 -20.240 121 1HD PRO 15 2HD PRO 15 35.229 11.250 -19.642 122 2HD PRO 15 1HD PRO 15 33.918 11.177 -20.850 123 H GLY 16 H GLY 16 30.959 10.159 -16.285 124 1HA GLY 16 1HA GLY 16 31.134 9.717 -13.891 125 2HA GLY 16 2HA GLY 16 32.862 10.036 -14.010 126 H CYS 17 H CYS 17 29.784 11.418 -13.230 127 HA CYS 17 HA CYS 17 30.844 14.264 -13.118 128 1HB CYS 17 2HB CYS 17 28.802 15.046 -13.447 129 2HB CYS 17 1HB CYS 17 28.887 13.676 -14.532 130 HA PRO 18 HA PRO 18 30.598 13.899 -8.451 131 1HB PRO 18 1HB PRO 18 32.966 15.002 -7.714 132 2HB PRO 18 2HB PRO 18 32.870 13.371 -8.409 133 1HG PRO 18 2HG PRO 18 33.669 15.967 -9.818 134 2HG PRO 18 1HG PRO 18 34.507 14.387 -9.876 135 1HD PRO 18 1HD PRO 18 32.612 15.240 -11.811 136 2HD PRO 18 2HD PRO 18 32.942 13.531 -11.437 137 H THR 19 H THR 19 30.826 15.709 -6.725 138 HA THR 19 HA THR 19 29.201 18.089 -7.376 139 HB THR 19 HB THR 19 30.057 18.727 -4.938 140 HG1 THR 19 HG1 THR 19 31.689 17.156 -4.882 141 1HG2 THR 19 1HG2 THR 19 27.800 18.173 -5.321 142 2HG2 THR 19 2HG2 THR 19 28.172 16.417 -5.286 143 3HG2 THR 19 3HG2 THR 19 28.395 17.433 -3.803 144 H VAL 20 H VAL 20 29.784 20.296 -6.888 145 HA VAL 20 HA VAL 20 32.658 20.951 -7.331 146 HB VAL 20 HB VAL 20 32.171 22.753 -9.033 147 1HG1 VAL 20 1HG1 VAL 20 31.603 19.948 -10.066 148 2HG1 VAL 20 2HG1 VAL 20 33.200 20.676 -9.779 149 3HG1 VAL 20 3HG1 VAL 20 32.148 21.322 -11.061 150 1HG2 VAL 20 1HG2 VAL 20 29.410 21.527 -9.569 151 2HG2 VAL 20 2HG2 VAL 20 29.703 23.089 -8.764 152 3HG2 VAL 20 3HG2 VAL 20 30.192 22.865 -10.459 153 H LYS 21 H LYS 21 33.335 23.183 -6.961 154 HA LYS 21 HA LYS 21 32.157 24.142 -4.384 155 1HB LYS 21 1HB LYS 21 34.218 25.430 -4.189 156 2HB LYS 21 2HB LYS 21 34.494 23.707 -4.393 157 1HG LYS 21 1HG LYS 21 36.285 24.875 -5.320 158 2HG LYS 21 2HG LYS 21 35.448 24.068 -6.637 159 1HD LYS 21 1HD LYS 21 34.466 26.115 -7.456 160 2HD LYS 21 2HD LYS 21 34.974 27.043 -6.043 161 1HE LYS 21 1HE LYS 21 37.435 26.648 -6.730 162 2HE LYS 21 2HE LYS 21 36.847 25.851 -8.200 163 1HZ LYS 21 1HZ LYS 21 35.703 27.937 -8.782 164 2HZ LYS 21 2HZ LYS 21 36.249 28.667 -7.404 165 3HZ LYS 21 3HZ LYS 21 37.320 28.202 -8.573 166 HA PRO 22 HA PRO 22 30.155 27.853 -6.112 167 1HB PRO 22 2HB PRO 22 31.577 29.710 -4.132 168 2HB PRO 22 1HB PRO 22 29.849 29.571 -4.528 169 1HG PRO 22 2HG PRO 22 30.792 28.438 -2.256 170 2HG PRO 22 1HG PRO 22 29.642 27.515 -3.264 171 1HD PRO 22 2HD PRO 22 32.710 27.257 -3.231 172 2HD PRO 22 1HD PRO 22 31.485 25.957 -3.127 173 H DAL 23 H ALA 23 30.650 28.816 -7.998 174 HA DAL 23 HA ALA 23 33.548 29.553 -8.661 175 1HB DAL 23 1HB ALA 23 32.776 31.455 -10.057 176 2HB DAL 23 2HB ALA 23 32.336 31.690 -8.344 177 3HB DAL 23 3HB ALA 23 31.095 31.188 -9.524 178 H VAL 24 H VAL 24 33.205 27.175 -9.055 179 HA VAL 24 HA VAL 24 32.841 26.648 -11.971 180 HB VAL 24 HB VAL 24 33.613 24.741 -9.712 181 1HG1 VAL 24 1HG2 VAL 24 34.423 23.082 -11.426 182 2HG1 VAL 24 2HG2 VAL 24 33.882 24.152 -12.755 183 3HG1 VAL 24 3HG2 VAL 24 32.703 23.425 -11.655 184 1HG2 VAL 24 1HG1 VAL 24 36.016 24.842 -10.549 185 2HG2 VAL 24 2HG1 VAL 24 35.390 26.407 -10.014 186 3HG2 VAL 24 3HG1 VAL 24 35.509 26.089 -11.737 187 H THR 25 H THR 25 31.003 25.756 -12.824 188 HA THR 25 HA THR 25 28.874 24.553 -11.078 189 HB THR 25 HB THR 25 28.141 26.569 -10.912 190 HG1 THR 25 HG1 THR 25 26.065 26.297 -11.783 191 1HG2 THR 25 1HG2 THR 25 28.905 27.964 -12.892 192 2HG2 THR 25 2HG2 THR 25 27.141 28.111 -12.666 193 3HG2 THR 25 3HG2 THR 25 27.792 27.062 -13.954 194 H ILE 26 H ILE 26 29.096 22.894 -11.792 195 HA ILE 26 HA ILE 26 29.545 21.808 -14.360 196 HB ILE 26 HB ILE 26 29.929 20.958 -11.929 197 1HG1 ILE 26 1HG1 ILE 26 28.986 18.456 -13.472 198 2HG1 ILE 26 2HG1 ILE 26 30.104 19.472 -14.283 199 1HG2 ILE 26 1HG2 ILE 26 28.382 19.335 -10.818 200 2HG2 ILE 26 2HG2 ILE 26 27.559 20.917 -11.029 201 3HG2 ILE 26 3HG2 ILE 26 27.177 19.548 -12.114 202 1HD1 ILE 26 1HD1 ILE 26 31.717 19.399 -12.392 203 2HD1 ILE 26 2HD1 ILE 26 30.603 18.387 -11.462 204 3HD1 ILE 26 3HD1 ILE 26 31.341 17.746 -12.972 205 H ARG 27 H ARG 27 28.259 20.164 -15.523 206 HA ARG 27 HA ARG 27 25.265 20.280 -15.334 207 1HB ARG 27 2HB ARG 27 25.612 21.871 -17.015 208 2HB ARG 27 1HB ARG 27 26.618 20.688 -17.982 209 1HG ARG 27 2HG ARG 27 24.733 19.358 -18.369 210 2HG ARG 27 1HG ARG 27 23.674 20.388 -17.374 211 1HD ARG 27 2HD ARG 27 25.066 21.388 -19.966 212 2HD ARG 27 1HD ARG 27 23.503 20.582 -19.977 213 HE ARG 27 HE ARG 27 23.031 22.645 -18.149 214 1HH1 ARG 27 2HH2 ARG 27 24.324 22.783 -21.508 215 2HH1 ARG 27 1HH2 ARG 27 23.630 24.473 -21.680 216 1HH2 ARG 27 1HH1 ARG 27 22.322 24.534 -18.506 217 2HH2 ARG 27 2HH1 ARG 27 22.587 25.382 -20.112 218 H CYS 28 H CYS 28 25.151 18.533 -14.929 219 HA CYS 28 HA CYS 28 26.731 16.064 -15.933 220 1HB CYS 28 1HB CYS 28 26.911 16.145 -13.563 221 2HB CYS 28 2HB CYS 28 25.160 16.204 -13.295 222 H GLU 29 H GLU 29 25.687 15.451 -17.634 223 HA GLU 29 HA GLU 29 22.864 16.185 -18.249 224 1HB GLU 29 2HB GLU 29 24.986 14.713 -19.936 225 2HB GLU 29 1HB GLU 29 23.361 15.003 -20.537 226 1HG GLU 29 1HG GLU 29 23.656 17.469 -20.392 227 2HG GLU 29 2HG GLU 29 25.293 17.252 -19.761 Start of MODEL 29 1 1H SER 1 1H SER 1 24.727 9.112 -17.567 2 2H SER 1 2H SER 1 25.676 9.594 -18.831 3 3H SER 1 3H SER 1 26.329 8.707 -17.599 4 HA SER 1 HA SER 1 25.210 11.444 -17.351 5 1HB SER 1 1HB SER 1 26.098 11.393 -15.035 6 2HB SER 1 2HB SER 1 24.886 10.132 -15.306 7 HG SER 1 HG SER 1 26.615 8.665 -15.648 8 H LYS 2 H LYS 2 26.611 12.983 -17.901 9 HA LYS 2 HA LYS 2 29.611 12.563 -17.847 10 1HB LYS 2 2HB LYS 2 30.062 13.532 -19.996 11 2HB LYS 2 1HB LYS 2 29.275 11.970 -20.069 12 1HG LYS 2 2HG LYS 2 27.112 13.091 -20.771 13 2HG LYS 2 1HG LYS 2 27.911 14.663 -20.700 14 1HD LYS 2 2HD LYS 2 29.539 13.917 -22.504 15 2HD LYS 2 1HD LYS 2 28.739 12.344 -22.575 16 1HE LYS 2 1HE LYS 2 26.589 13.467 -23.315 17 2HE LYS 2 2HE LYS 2 27.393 15.047 -23.244 18 1HZ LYS 2 1HZ LYS 2 28.988 14.242 -24.908 19 2HZ LYS 2 2HZ LYS 2 28.239 12.771 -24.975 20 3HZ LYS 2 3HZ LYS 2 27.442 14.127 -25.481 21 H TYR 3 H TYR 3 30.558 14.238 -16.941 22 HA TYR 3 HA TYR 3 28.913 16.560 -15.980 23 1HB TYR 3 1HB TYR 3 30.562 17.028 -14.450 24 2HB TYR 3 2HB TYR 3 30.364 15.329 -14.395 25 HD1 TYR 3 HD1 TYR 3 32.283 14.005 -16.081 26 HD2 TYR 3 HD2 TYR 3 32.823 17.860 -14.248 27 HE1 TYR 3 HE1 TYR 3 34.708 13.817 -16.313 28 HE2 TYR 3 HE2 TYR 3 35.221 17.559 -14.385 29 HH TYR 3 HH TYR 3 36.666 14.703 -15.892 30 H GLU 4 H GLU 4 28.864 18.467 -17.079 31 HA GLU 4 HA GLU 4 31.330 19.312 -18.775 32 1HB GLU 4 1HB GLU 4 29.523 18.953 -20.207 33 2HB GLU 4 2HB GLU 4 28.367 19.862 -19.246 34 1HG GLU 4 1HG GLU 4 29.607 21.986 -19.773 35 2HG GLU 4 2HG GLU 4 30.768 21.055 -20.714 36 H TYR 5 H TYR 5 32.516 20.218 -17.221 37 HA TYR 5 HA TYR 5 31.259 22.239 -15.312 38 1HB TYR 5 2HB TYR 5 32.480 21.685 -13.532 39 2HB TYR 5 1HB TYR 5 32.270 20.095 -14.179 40 HD1 TYR 5 HD1 TYR 5 34.655 19.906 -16.146 41 HD2 TYR 5 HD2 TYR 5 34.370 21.372 -12.124 42 HE1 TYR 5 HE1 TYR 5 37.088 19.713 -15.853 43 HE2 TYR 5 HE2 TYR 5 36.757 21.162 -11.877 44 HH TYR 5 HH TYR 5 38.660 20.544 -12.803 45 H THR 6 H THR 6 31.662 24.021 -15.883 46 HA THR 6 HA THR 6 33.806 24.611 -17.957 47 HB THR 6 HB THR 6 31.372 26.384 -17.236 48 HG1 THR 6 HG1 THR 6 30.675 24.263 -17.656 49 1HG2 THR 6 1HG2 THR 6 33.047 27.292 -18.916 50 2HG2 THR 6 2HG2 THR 6 32.782 25.842 -19.908 51 3HG2 THR 6 3HG2 THR 6 31.423 26.951 -19.647 52 H ILE 7 H ILE 7 35.473 25.949 -17.497 53 HA ILE 7 HA ILE 7 35.525 27.542 -14.886 54 HB ILE 7 HB ILE 7 37.732 25.585 -15.775 55 1HG1 ILE 7 1HG1 ILE 7 37.159 24.408 -13.366 56 2HG1 ILE 7 2HG1 ILE 7 35.636 25.251 -13.553 57 1HG2 ILE 7 1HG2 ILE 7 38.619 27.544 -14.576 58 2HG2 ILE 7 2HG2 ILE 7 37.544 27.220 -13.182 59 3HG2 ILE 7 3HG2 ILE 7 38.853 26.069 -13.614 60 1HD1 ILE 7 1HD1 ILE 7 36.753 22.826 -14.976 61 2HD1 ILE 7 2HD1 ILE 7 35.114 23.207 -14.343 62 3HD1 ILE 7 3HD1 ILE 7 35.605 23.844 -15.889 63 HA DPR 8 HA PRO 8 38.056 30.348 -17.354 64 1HB DPR 8 2HB PRO 8 37.262 32.015 -16.001 65 2HB DPR 8 1HB PRO 8 36.576 32.681 -17.494 66 1HG DPR 8 1HG PRO 8 34.973 32.197 -15.327 67 2HG DPR 8 2HG PRO 8 34.386 31.802 -16.969 68 1HD DPR 8 1HD PRO 8 35.365 29.882 -14.841 69 2HD DPR 8 2HD PRO 8 34.186 29.605 -16.141 70 H SER 9 H SER 9 38.542 30.014 -19.375 71 HA SER 9 HA SER 9 36.695 30.558 -21.711 72 1HB SER 9 1HB SER 9 39.649 29.724 -21.607 73 2HB SER 9 2HB SER 9 38.746 30.071 -23.090 74 HG SER 9 HG SER 9 39.886 31.862 -22.336 75 H TYR 10 H TYR 10 37.555 27.747 -19.790 76 HA TYR 10 HA TYR 10 37.370 25.893 -22.209 77 1HB TYR 10 2HB TYR 10 38.578 25.643 -19.383 78 2HB TYR 10 1HB TYR 10 37.970 24.197 -20.086 79 HD1 TYR 10 HD1 TYR 10 40.657 26.732 -20.432 80 HD2 TYR 10 HD2 TYR 10 38.933 23.164 -22.132 81 HE1 TYR 10 HE1 TYR 10 42.711 26.263 -21.629 82 HE2 TYR 10 HE2 TYR 10 40.990 22.733 -23.305 83 HH TYR 10 HH TYR 10 43.063 23.424 -23.730 84 H THR 11 H THR 11 35.736 24.540 -22.536 85 HA THR 11 HA THR 11 33.623 24.020 -20.383 86 HB THR 11 HB THR 11 33.508 23.480 -23.400 87 HG1 THR 11 HG1 THR 11 32.275 25.389 -23.535 88 1HG2 THR 11 1HG2 THR 11 31.247 23.728 -21.320 89 2HG2 THR 11 2HG2 THR 11 31.710 22.288 -22.271 90 3HG2 THR 11 3HG2 THR 11 30.984 23.690 -23.085 91 H PHE 12 H PHE 12 34.492 22.426 -19.281 92 HA PHE 12 HA PHE 12 36.373 20.354 -20.608 93 1HB PHE 12 2HB PHE 12 35.892 20.899 -17.666 94 2HB PHE 12 1HB PHE 12 36.831 19.553 -18.233 95 HD1 PHE 12 HD1 PHE 12 39.100 19.956 -19.401 96 HD2 PHE 12 HD2 PHE 12 36.921 23.141 -17.501 97 HE1 PHE 12 HE1 PHE 12 41.164 21.181 -19.013 98 HE2 PHE 12 HE2 PHE 12 39.014 24.288 -17.067 99 HZ PHE 12 HZ PHE 12 41.128 23.342 -17.796 100 H ARG 13 H ARG 13 34.980 18.794 -21.443 101 HA ARG 13 HA ARG 13 32.601 17.818 -19.837 102 1HB ARG 13 1HB ARG 13 32.212 17.361 -22.714 103 2HB ARG 13 2HB ARG 13 31.228 18.085 -21.482 104 1HG ARG 13 2HG ARG 13 31.241 19.755 -22.955 105 2HG ARG 13 1HG ARG 13 32.503 20.259 -21.818 106 1HD ARG 13 2HD ARG 13 34.300 19.527 -23.375 107 2HD ARG 13 1HD ARG 13 33.103 18.886 -24.514 108 HE ARG 13 HE ARG 13 32.556 21.723 -23.946 109 1HH1 ARG 13 2HH1 ARG 13 34.710 19.702 -26.011 110 2HH1 ARG 13 1HH1 ARG 13 34.855 21.099 -27.191 111 1HH2 ARG 13 2HH2 ARG 13 32.830 23.185 -25.366 112 2HH2 ARG 13 1HH2 ARG 13 33.873 22.913 -26.850 113 H GLY 14 H GLY 14 32.800 15.813 -19.146 114 1HA GLY 14 2HA GLY 14 33.620 13.543 -20.896 115 2HA GLY 14 1HA GLY 14 34.830 13.873 -19.659 116 HA PRO 15 HA PRO 15 31.362 11.192 -17.725 117 1HB PRO 15 1HB PRO 15 32.476 8.772 -17.258 118 2HB PRO 15 2HB PRO 15 32.033 9.317 -18.891 119 1HG PRO 15 2HG PRO 15 34.771 9.363 -17.568 120 2HG PRO 15 1HG PRO 15 34.346 8.703 -19.185 121 1HD PRO 15 2HD PRO 15 35.367 11.305 -18.782 122 2HD PRO 15 1HD PRO 15 34.272 10.911 -20.134 123 H GLY 16 H GLY 16 31.013 10.267 -15.591 124 1HA GLY 16 1HA GLY 16 31.355 9.965 -13.236 125 2HA GLY 16 2HA GLY 16 32.960 10.671 -13.370 126 H CYS 17 H CYS 17 29.878 11.248 -12.301 127 HA CYS 17 HA CYS 17 30.105 14.289 -12.323 128 1HB CYS 17 1HB CYS 17 28.000 13.221 -13.159 129 2HB CYS 17 2HB CYS 17 27.710 12.481 -11.570 130 HA PRO 18 HA PRO 18 31.138 14.082 -7.772 131 1HB PRO 18 2HB PRO 18 33.431 15.546 -7.701 132 2HB PRO 18 1HB PRO 18 33.404 13.844 -8.208 133 1HG PRO 18 2HG PRO 18 33.562 16.322 -9.987 134 2HG PRO 18 1HG PRO 18 34.518 14.816 -10.115 135 1HD PRO 18 2HD PRO 18 32.119 15.339 -11.586 136 2HD PRO 18 1HD PRO 18 32.735 13.705 -11.230 137 H THR 19 H THR 19 31.379 16.003 -6.251 138 HA THR 19 HA THR 19 29.622 18.347 -7.019 139 HB THR 19 HB THR 19 30.291 18.988 -4.510 140 HG1 THR 19 HG1 THR 19 30.559 16.181 -4.465 141 1HG2 THR 19 1HG2 THR 19 28.047 18.666 -5.160 142 2HG2 THR 19 2HG2 THR 19 28.223 16.881 -5.078 143 3HG2 THR 19 3HG2 THR 19 28.375 17.893 -3.581 144 H VAL 20 H VAL 20 30.312 20.447 -6.988 145 HA VAL 20 HA VAL 20 33.269 20.872 -6.970 146 HB VAL 20 HB VAL 20 33.310 22.065 -9.152 147 1HG1 VAL 20 1HG1 VAL 20 34.025 19.702 -9.108 148 2HG1 VAL 20 2HG1 VAL 20 33.346 20.104 -10.697 149 3HG1 VAL 20 3HG1 VAL 20 32.377 19.177 -9.535 150 1HG2 VAL 20 1HG2 VAL 20 30.934 22.767 -9.440 151 2HG2 VAL 20 2HG2 VAL 20 31.582 21.996 -10.901 152 3HG2 VAL 20 3HG2 VAL 20 30.477 21.094 -9.829 153 H LYS 21 H LYS 21 34.099 22.968 -6.950 154 HA LYS 21 HA LYS 21 33.583 24.796 -5.096 155 1HB LYS 21 1HB LYS 21 34.200 25.807 -7.936 156 2HB LYS 21 2HB LYS 21 34.631 26.600 -6.439 157 1HG LYS 21 2HG LYS 21 35.914 24.078 -7.592 158 2HG LYS 21 1HG LYS 21 36.525 25.725 -7.702 159 1HD LYS 21 1HD LYS 21 36.758 25.782 -5.172 160 2HD LYS 21 2HD LYS 21 36.181 24.109 -5.119 161 1HE LYS 21 1HE LYS 21 38.185 23.358 -6.470 162 2HE LYS 21 2HE LYS 21 38.767 25.033 -6.542 163 1HZ LYS 21 1HZ LYS 21 38.884 25.032 -4.102 164 2HZ LYS 21 2HZ LYS 21 39.803 23.809 -4.725 165 3HZ LYS 21 3HZ LYS 21 38.341 23.473 -4.035 166 HA PRO 22 HA PRO 22 29.752 27.283 -6.159 167 1HB PRO 22 2HB PRO 22 29.946 29.497 -4.514 168 2HB PRO 22 1HB PRO 22 29.492 27.871 -3.967 169 1HG PRO 22 1HG PRO 22 32.219 29.205 -3.742 170 2HG PRO 22 2HG PRO 22 31.333 28.291 -2.488 171 1HD PRO 22 1HD PRO 22 33.333 27.162 -4.085 172 2HD PRO 22 2HD PRO 22 31.974 26.202 -3.446 173 H DAL 23 H ALA 23 29.780 28.175 -8.143 174 HA DAL 23 HA ALA 23 32.141 29.857 -9.101 175 1HB DAL 23 1HB ALA 23 29.206 30.593 -9.668 176 2HB DAL 23 2HB ALA 23 30.325 31.484 -8.600 177 3HB DAL 23 3HB ALA 23 30.642 31.399 -10.353 178 H VAL 24 H VAL 24 32.204 27.245 -9.420 179 HA VAL 24 HA VAL 24 32.097 26.812 -12.379 180 HB VAL 24 HB VAL 24 33.031 24.936 -10.155 181 1HG1 VAL 24 1HG1 VAL 24 33.533 24.589 -13.205 182 2HG1 VAL 24 2HG1 VAL 24 32.453 23.603 -12.211 183 3HG1 VAL 24 3HG1 VAL 24 34.197 23.532 -11.927 184 1HG2 VAL 24 1HG2 VAL 24 34.851 26.622 -11.998 185 2HG2 VAL 24 2HG2 VAL 24 35.424 25.429 -10.789 186 3HG2 VAL 24 3HG2 VAL 24 34.559 26.881 -10.270 187 H THR 25 H THR 25 30.141 26.065 -13.270 188 HA THR 25 HA THR 25 28.085 24.746 -11.489 189 HB THR 25 HB THR 25 26.450 25.672 -13.026 190 HG1 THR 25 HG1 THR 25 26.999 27.525 -14.219 191 1HG2 THR 25 1HG2 THR 25 26.194 27.970 -12.081 192 2HG2 THR 25 2HG2 THR 25 27.870 27.909 -11.470 193 3HG2 THR 25 3HG2 THR 25 26.640 26.796 -10.813 194 H ILE 26 H ILE 26 28.693 22.891 -12.034 195 HA ILE 26 HA ILE 26 29.314 21.649 -14.468 196 HB ILE 26 HB ILE 26 29.681 21.095 -11.967 197 1HG1 ILE 26 1HG1 ILE 26 29.075 18.415 -13.353 198 2HG1 ILE 26 2HG1 ILE 26 30.210 19.476 -14.095 199 1HG2 ILE 26 1HG2 ILE 26 27.117 19.368 -12.055 200 2HG2 ILE 26 2HG2 ILE 26 28.294 19.458 -10.721 201 3HG2 ILE 26 3HG2 ILE 26 27.300 20.891 -11.124 202 1HD1 ILE 26 1HD1 ILE 26 30.467 18.580 -11.174 203 2HD1 ILE 26 2HD1 ILE 26 31.610 19.609 -12.064 204 3HD1 ILE 26 3HD1 ILE 26 31.382 17.891 -12.557 205 H ARG 27 H ARG 27 28.181 19.742 -15.545 206 HA ARG 27 HA ARG 27 25.215 19.683 -15.403 207 1HB ARG 27 1HB ARG 27 26.520 20.190 -18.093 208 2HB ARG 27 2HB ARG 27 24.878 19.486 -17.866 209 1HG ARG 27 1HG ARG 27 24.079 21.379 -16.807 210 2HG ARG 27 2HG ARG 27 25.695 22.191 -16.907 211 1HD ARG 27 2HD ARG 27 25.501 22.221 -19.428 212 2HD ARG 27 1HD ARG 27 23.910 21.442 -19.325 213 HE ARG 27 HE ARG 27 23.867 23.853 -17.678 214 1HH1 ARG 27 1HH1 ARG 27 23.866 23.063 -21.193 215 2HH1 ARG 27 2HH1 ARG 27 23.034 24.663 -21.528 216 1HH2 ARG 27 1HH2 ARG 27 22.940 25.596 -18.224 217 2HH2 ARG 27 2HH2 ARG 27 22.553 25.981 -19.976 218 H CYS 28 H CYS 28 25.172 17.891 -14.920 219 HA CYS 28 HA CYS 28 26.829 15.558 -15.997 220 1HB CYS 28 1HB CYS 28 24.968 15.694 -13.538 221 2HB CYS 28 2HB CYS 28 25.902 14.270 -14.061 222 H GLU 29 H GLU 29 25.826 15.497 -17.975 223 HA GLU 29 HA GLU 29 23.049 16.143 -18.489 224 1HB GLU 29 1HB GLU 29 25.161 14.902 -20.340 225 2HB GLU 29 2HB GLU 29 23.569 15.298 -20.937 226 1HG GLU 29 1HG GLU 29 25.442 17.415 -19.746 227 2HG GLU 29 2HG GLU 29 25.401 16.972 -21.450 Start of MODEL 30 1 1H SER 1 1H SER 1 25.156 8.647 -17.742 2 2H SER 1 2H SER 1 26.760 8.467 -18.093 3 3H SER 1 3H SER 1 25.799 9.389 -19.070 4 HA SER 1 HA SER 1 25.405 10.983 -17.299 5 1HB SER 1 2HB SER 1 26.694 10.796 -15.191 6 2HB SER 1 1HB SER 1 25.604 9.421 -15.424 7 HG SER 1 HG SER 1 28.382 9.491 -16.027 8 H LYS 2 H LYS 2 26.495 12.744 -17.918 9 HA LYS 2 HA LYS 2 29.490 12.722 -18.352 10 1HB LYS 2 2HB LYS 2 29.519 13.895 -20.417 11 2HB LYS 2 1HB LYS 2 28.809 12.300 -20.557 12 1HG LYS 2 2HG LYS 2 26.495 13.395 -20.761 13 2HG LYS 2 1HG LYS 2 27.264 14.973 -20.677 14 1HD LYS 2 1HD LYS 2 28.585 14.423 -22.795 15 2HD LYS 2 2HD LYS 2 27.770 12.865 -22.854 16 1HE LYS 2 1HE LYS 2 26.593 14.139 -24.416 17 2HE LYS 2 2HE LYS 2 25.504 14.150 -23.039 18 1HZ LYS 2 1HZ LYS 2 26.364 16.401 -22.501 19 2HZ LYS 2 2HZ LYS 2 27.372 16.357 -23.809 20 3HZ LYS 2 3HZ LYS 2 25.735 16.348 -24.027 21 H TYR 3 H TYR 3 30.384 14.413 -17.416 22 HA TYR 3 HA TYR 3 28.670 16.688 -16.348 23 1HB TYR 3 2HB TYR 3 30.379 17.370 -14.925 24 2HB TYR 3 1HB TYR 3 29.960 15.723 -14.623 25 HD1 TYR 3 HD1 TYR 3 32.640 18.022 -15.924 26 HD2 TYR 3 HD2 TYR 3 31.746 13.943 -14.915 27 HE1 TYR 3 HE1 TYR 3 35.008 17.474 -15.946 28 HE2 TYR 3 HE2 TYR 3 34.140 13.456 -14.871 29 HH TYR 3 HH TYR 3 36.175 14.218 -15.184 30 H GLU 4 H GLU 4 28.796 18.650 -17.222 31 HA GLU 4 HA GLU 4 31.250 19.447 -18.951 32 1HB GLU 4 1HB GLU 4 29.811 19.336 -20.632 33 2HB GLU 4 2HB GLU 4 28.359 19.543 -19.709 34 1HG GLU 4 2HG GLU 4 28.829 22.045 -19.592 35 2HG GLU 4 1HG GLU 4 30.222 21.796 -20.630 36 H TYR 5 H TYR 5 32.446 20.347 -17.391 37 HA TYR 5 HA TYR 5 31.146 22.363 -15.514 38 1HB TYR 5 1HB TYR 5 32.189 21.719 -13.660 39 2HB TYR 5 2HB TYR 5 31.917 20.164 -14.379 40 HD1 TYR 5 HD1 TYR 5 34.530 19.962 -16.141 41 HD2 TYR 5 HD2 TYR 5 33.804 21.029 -12.049 42 HE1 TYR 5 HE1 TYR 5 36.877 19.519 -15.562 43 HE2 TYR 5 HE2 TYR 5 36.134 20.648 -11.541 44 HH TYR 5 HH TYR 5 38.096 19.978 -12.285 45 H THR 6 H THR 6 31.780 24.153 -15.769 46 HA THR 6 HA THR 6 34.050 24.743 -17.703 47 HB THR 6 HB THR 6 31.869 26.789 -16.899 48 HG1 THR 6 HG1 THR 6 31.601 24.711 -18.801 49 1HG2 THR 6 1HG2 THR 6 33.083 26.132 -19.629 50 2HG2 THR 6 2HG2 THR 6 33.751 27.406 -18.579 51 3HG2 THR 6 3HG2 THR 6 32.065 27.524 -19.223 52 H ILE 7 H ILE 7 35.781 25.974 -17.156 53 HA ILE 7 HA ILE 7 35.944 27.260 -14.392 54 HB ILE 7 HB ILE 7 38.041 25.252 -15.440 55 1HG1 ILE 7 2HG1 ILE 7 37.282 23.879 -13.162 56 2HG1 ILE 7 1HG1 ILE 7 35.804 24.792 -13.378 57 1HG2 ILE 7 1HG2 ILE 7 39.111 25.443 -13.201 58 2HG2 ILE 7 2HG2 ILE 7 38.996 27.021 -14.008 59 3HG2 ILE 7 3HG2 ILE 7 37.853 26.618 -12.694 60 1HD1 ILE 7 1HD1 ILE 7 36.965 22.553 -15.055 61 2HD1 ILE 7 2HD1 ILE 7 35.357 22.781 -14.308 62 3HD1 ILE 7 3HD1 ILE 7 35.763 23.664 -15.779 63 HA DPR 8 HA PRO 8 38.707 30.108 -16.518 64 1HB DPR 8 2HB PRO 8 37.979 31.684 -15.030 65 2HB DPR 8 1HB PRO 8 37.385 32.536 -16.467 66 1HG DPR 8 1HG PRO 8 35.688 31.954 -14.398 67 2HG DPR 8 2HG PRO 8 35.127 31.758 -16.084 68 1HD DPR 8 2HD PRO 8 35.917 29.583 -14.131 69 2HD DPR 8 1HD PRO 8 34.762 29.511 -15.479 70 H SER 9 H SER 9 39.232 29.944 -18.563 71 HA SER 9 HA SER 9 37.482 30.837 -20.866 72 1HB SER 9 1HB SER 9 39.480 30.488 -22.246 73 2HB SER 9 2HB SER 9 39.859 31.530 -20.872 74 HG SER 9 HG SER 9 40.321 28.727 -21.047 75 H TYR 10 H TYR 10 38.063 27.823 -19.201 76 HA TYR 10 HA TYR 10 37.794 26.200 -21.784 77 1HB TYR 10 2HB TYR 10 39.135 25.704 -19.048 78 2HB TYR 10 1HB TYR 10 38.418 24.331 -19.780 79 HD1 TYR 10 HD1 TYR 10 41.218 26.721 -20.137 80 HD2 TYR 10 HD2 TYR 10 39.187 23.379 -21.949 81 HE1 TYR 10 HE1 TYR 10 43.183 26.190 -21.453 82 HE2 TYR 10 HE2 TYR 10 41.157 22.883 -23.240 83 HH TYR 10 HH TYR 10 43.252 23.463 -23.723 84 H THR 11 H THR 11 36.106 24.880 -22.132 85 HA THR 11 HA THR 11 34.085 24.303 -19.921 86 HB THR 11 HB THR 11 33.853 23.794 -22.943 87 HG1 THR 11 HG1 THR 11 34.047 26.012 -22.490 88 1HG2 THR 11 1HG2 THR 11 32.185 22.537 -21.484 89 2HG2 THR 11 2HG2 THR 11 31.386 23.704 -22.563 90 3HG2 THR 11 3HG2 THR 11 31.605 24.082 -20.829 91 H PHE 12 H PHE 12 34.789 22.624 -18.934 92 HA PHE 12 HA PHE 12 36.661 20.537 -20.256 93 1HB PHE 12 2HB PHE 12 36.099 21.067 -17.308 94 2HB PHE 12 1HB PHE 12 36.902 19.626 -17.847 95 HD1 PHE 12 HD1 PHE 12 39.262 19.707 -18.745 96 HD2 PHE 12 HD2 PHE 12 37.306 23.299 -17.393 97 HE1 PHE 12 HE1 PHE 12 41.411 20.774 -18.378 98 HE2 PHE 12 HE2 PHE 12 39.474 24.291 -16.967 99 HZ PHE 12 HZ PHE 12 41.531 23.057 -17.446 100 H ARG 13 H ARG 13 35.346 18.994 -21.179 101 HA ARG 13 HA ARG 13 32.720 18.170 -19.825 102 1HB ARG 13 1HB ARG 13 33.027 17.947 -22.821 103 2HB ARG 13 2HB ARG 13 31.584 17.877 -21.778 104 1HG ARG 13 1HG ARG 13 31.647 20.331 -21.496 105 2HG ARG 13 2HG ARG 13 33.110 20.430 -22.468 106 1HD ARG 13 2HD ARG 13 31.850 19.441 -24.460 107 2HD ARG 13 1HD ARG 13 30.376 19.414 -23.483 108 HE ARG 13 HE ARG 13 31.248 22.111 -23.332 109 1HH1 ARG 13 2HH1 ARG 13 30.422 20.010 -26.141 110 2HH1 ARG 13 1HH1 ARG 13 29.948 21.508 -27.090 111 1HH2 ARG 13 2HH2 ARG 13 30.679 23.674 -24.527 112 2HH2 ARG 13 1HH2 ARG 13 30.084 23.415 -26.244 113 H GLY 14 H GLY 14 32.833 16.161 -19.066 114 1HA GLY 14 2HA GLY 14 34.084 13.874 -20.579 115 2HA GLY 14 1HA GLY 14 35.002 14.384 -19.170 116 HA PRO 15 HA PRO 15 31.261 11.521 -17.986 117 1HB PRO 15 2HB PRO 15 32.091 8.926 -17.973 118 2HB PRO 15 1HB PRO 15 31.626 9.796 -19.449 119 1HG PRO 15 1HG PRO 15 34.423 9.334 -18.337 120 2HG PRO 15 2HG PRO 15 33.836 9.004 -20.003 121 1HD PRO 15 1HD PRO 15 35.173 11.369 -19.324 122 2HD PRO 15 2HD PRO 15 33.888 11.350 -20.562 123 H GLY 16 H GLY 16 30.796 10.337 -16.108 124 1HA GLY 16 2HA GLY 16 30.884 9.761 -13.740 125 2HA GLY 16 1HA GLY 16 32.631 9.971 -13.817 126 H CYS 17 H CYS 17 29.630 11.557 -13.096 127 HA CYS 17 HA CYS 17 30.499 14.272 -13.050 128 1HB CYS 17 2HB CYS 17 27.995 13.105 -11.747 129 2HB CYS 17 1HB CYS 17 28.313 14.815 -12.066 130 HA PRO 18 HA PRO 18 32.077 14.351 -8.603 131 1HB PRO 18 2HB PRO 18 33.955 16.330 -8.799 132 2HB PRO 18 1HB PRO 18 34.231 14.691 -9.419 133 1HG PRO 18 2HG PRO 18 33.421 17.185 -11.007 134 2HG PRO 18 1HG PRO 18 34.713 16.011 -11.405 135 1HD PRO 18 2HD PRO 18 32.084 15.823 -12.476 136 2HD PRO 18 1HD PRO 18 33.134 14.427 -12.202 137 H THR 19 H THR 19 32.141 16.134 -6.982 138 HA THR 19 HA THR 19 29.866 18.120 -7.291 139 HB THR 19 HB THR 19 30.811 18.508 -4.712 140 HG1 THR 19 HG1 THR 19 32.045 16.606 -4.833 141 1HG2 THR 19 1HG2 THR 19 28.495 16.763 -5.533 142 2HG2 THR 19 2HG2 THR 19 28.795 17.449 -3.888 143 3HG2 THR 19 3HG2 THR 19 28.505 18.532 -5.279 144 H VAL 20 H VAL 20 30.099 20.284 -6.914 145 HA VAL 20 HA VAL 20 32.860 21.300 -7.587 146 HB VAL 20 HB VAL 20 31.862 23.099 -9.010 147 1HG1 VAL 20 1HG1 VAL 20 31.563 21.767 -11.069 148 2HG1 VAL 20 2HG1 VAL 20 32.848 21.089 -10.045 149 3HG1 VAL 20 3HG1 VAL 20 31.251 20.312 -10.083 150 1HG2 VAL 20 1HG2 VAL 20 29.608 23.078 -9.979 151 2HG2 VAL 20 2HG2 VAL 20 29.492 23.196 -8.210 152 3HG2 VAL 20 3HG2 VAL 20 29.157 21.644 -9.014 153 H LYS 21 H LYS 21 33.488 23.442 -7.123 154 HA LYS 21 HA LYS 21 32.570 24.372 -4.407 155 1HB LYS 21 2HB LYS 21 34.644 25.609 -4.323 156 2HB LYS 21 1HB LYS 21 34.913 23.917 -4.641 157 1HG LYS 21 2HG LYS 21 36.593 25.212 -5.620 158 2HG LYS 21 1HG LYS 21 35.721 24.382 -6.891 159 1HD LYS 21 2HD LYS 21 34.747 26.349 -7.779 160 2HD LYS 21 1HD LYS 21 34.971 27.285 -6.319 161 1HE LYS 21 2HE LYS 21 36.508 28.238 -7.828 162 2HE LYS 21 1HE LYS 21 37.495 27.305 -6.708 163 1HZ LYS 21 1HZ LYS 21 38.209 27.005 -8.997 164 2HZ LYS 21 2HZ LYS 21 37.656 25.558 -8.424 165 3HZ LYS 21 3HZ LYS 21 36.726 26.445 -9.462 166 HA PRO 22 HA PRO 22 30.317 27.893 -6.096 167 1HB PRO 22 1HB PRO 22 30.854 30.189 -4.606 168 2HB PRO 22 2HB PRO 22 29.906 28.794 -4.061 169 1HG PRO 22 2HG PRO 22 32.829 29.386 -3.467 170 2HG PRO 22 1HG PRO 22 31.555 28.872 -2.325 171 1HD PRO 22 1HD PRO 22 33.362 27.113 -3.435 172 2HD PRO 22 2HD PRO 22 31.694 26.593 -3.078 173 H DAL 23 H ALA 23 30.584 28.830 -8.013 174 HA DAL 23 HA ALA 23 33.360 29.690 -8.949 175 1HB DAL 23 1HB ALA 23 32.420 31.569 -10.276 176 2HB DAL 23 2HB ALA 23 32.118 31.804 -8.533 177 3HB DAL 23 3HB ALA 23 30.797 31.261 -9.602 178 H VAL 24 H VAL 24 32.933 27.251 -9.254 179 HA VAL 24 HA VAL 24 32.507 26.746 -12.155 180 HB VAL 24 HB VAL 24 33.196 24.764 -9.938 181 1HG1 VAL 24 1HG1 VAL 24 32.359 23.615 -12.044 182 2HG1 VAL 24 2HG1 VAL 24 34.048 23.188 -11.733 183 3HG1 VAL 24 3HG1 VAL 24 33.634 24.376 -13.003 184 1HG2 VAL 24 1HG2 VAL 24 35.034 26.381 -10.023 185 2HG2 VAL 24 2HG2 VAL 24 35.632 24.826 -10.612 186 3HG2 VAL 24 3HG2 VAL 24 35.253 26.153 -11.760 187 H THR 25 H THR 25 30.659 25.822 -12.982 188 HA THR 25 HA THR 25 28.555 24.648 -11.195 189 HB THR 25 HB THR 25 27.800 26.668 -11.074 190 HG1 THR 25 HG1 THR 25 26.383 24.986 -11.412 191 1HG2 THR 25 1HG2 THR 25 27.428 27.073 -14.126 192 2HG2 THR 25 2HG2 THR 25 28.538 28.016 -13.095 193 3HG2 THR 25 3HG2 THR 25 26.774 28.149 -12.862 194 H ILE 26 H ILE 26 28.744 22.987 -11.864 195 HA ILE 26 HA ILE 26 29.325 21.842 -14.355 196 HB ILE 26 HB ILE 26 29.571 21.059 -11.887 197 1HG1 ILE 26 1HG1 ILE 26 28.769 18.499 -13.410 198 2HG1 ILE 26 2HG1 ILE 26 29.884 19.520 -14.213 199 1HG2 ILE 26 1HG2 ILE 26 26.862 19.595 -12.200 200 2HG2 ILE 26 2HG2 ILE 26 27.158 20.992 -11.126 201 3HG2 ILE 26 3HG2 ILE 26 27.994 19.431 -10.833 202 1HD1 ILE 26 1HD1 ILE 26 31.102 17.867 -12.842 203 2HD1 ILE 26 2HD1 ILE 26 30.319 18.525 -11.350 204 3HD1 ILE 26 3HD1 ILE 26 31.436 19.540 -12.283 205 H ARG 27 H ARG 27 28.197 20.270 -15.673 206 HA ARG 27 HA ARG 27 25.146 20.279 -15.645 207 1HB ARG 27 2HB ARG 27 25.766 21.844 -17.331 208 2HB ARG 27 1HB ARG 27 26.743 20.536 -18.161 209 1HG ARG 27 2HG ARG 27 24.504 19.368 -18.460 210 2HG ARG 27 1HG ARG 27 23.759 20.856 -17.832 211 1HD ARG 27 2HD ARG 27 23.522 21.105 -20.157 212 2HD ARG 27 1HD ARG 27 24.940 22.107 -19.841 213 HE ARG 27 HE ARG 27 26.042 19.583 -20.522 214 1HH1 ARG 27 1HH1 ARG 27 23.755 21.721 -22.303 215 2HH1 ARG 27 2HH1 ARG 27 24.359 21.011 -23.884 216 1HH2 ARG 27 2HH2 ARG 27 26.601 18.896 -22.371 217 2HH2 ARG 27 1HH2 ARG 27 25.843 19.537 -23.913 218 H CYS 28 H CYS 28 25.224 18.600 -14.942 219 HA CYS 28 HA CYS 28 26.561 16.008 -15.965 220 1HB CYS 28 2HB CYS 28 26.820 16.243 -13.514 221 2HB CYS 28 1HB CYS 28 25.056 16.181 -13.291 222 H GLU 29 H GLU 29 25.312 15.041 -17.429 223 HA GLU 29 HA GLU 29 22.971 16.091 -18.422 224 1HB GLU 29 2HB GLU 29 22.728 14.416 -20.044 225 2HB GLU 29 1HB GLU 29 24.418 14.806 -19.806 226 1HG GLU 29 2HG GLU 29 24.779 12.738 -18.564 227 2HG GLU 29 1HG GLU 29 23.048 12.343 -18.649 Start of MODEL 31 1 1H SER 1 1H SER 1 26.650 8.531 -18.139 2 2H SER 1 2H SER 1 25.882 9.362 -19.344 3 3H SER 1 3H SER 1 25.016 8.765 -18.070 4 HA SER 1 HA SER 1 25.260 11.137 -17.822 5 1HB SER 1 2HB SER 1 25.164 9.677 -15.792 6 2HB SER 1 1HB SER 1 26.928 9.497 -15.823 7 HG SER 1 HG SER 1 27.068 11.774 -15.622 8 H LYS 2 H LYS 2 26.508 12.823 -18.337 9 HA LYS 2 HA LYS 2 29.538 12.651 -18.340 10 1HB LYS 2 1HB LYS 2 29.895 13.739 -20.413 11 2HB LYS 2 2HB LYS 2 29.045 12.227 -20.627 12 1HG LYS 2 2HG LYS 2 26.890 13.563 -21.088 13 2HG LYS 2 1HG LYS 2 27.831 15.026 -20.918 14 1HD LYS 2 1HD LYS 2 27.719 14.799 -23.202 15 2HD LYS 2 2HD LYS 2 29.336 14.220 -22.889 16 1HE LYS 2 2HE LYS 2 26.894 12.360 -23.348 17 2HE LYS 2 1HE LYS 2 27.912 12.977 -24.652 18 1HZ LYS 2 1HZ LYS 2 28.898 11.288 -22.407 19 2HZ LYS 2 2HZ LYS 2 29.831 11.878 -23.636 20 3HZ LYS 2 3HZ LYS 2 28.635 10.784 -23.959 21 H TYR 3 H TYR 3 30.475 14.366 -17.448 22 HA TYR 3 HA TYR 3 28.779 16.656 -16.406 23 1HB TYR 3 1HB TYR 3 30.437 17.216 -14.945 24 2HB TYR 3 2HB TYR 3 30.237 15.517 -14.780 25 HD1 TYR 3 HD1 TYR 3 32.151 14.170 -16.549 26 HD2 TYR 3 HD2 TYR 3 32.700 17.994 -14.664 27 HE1 TYR 3 HE1 TYR 3 34.583 13.955 -16.742 28 HE2 TYR 3 HE2 TYR 3 35.103 17.652 -14.739 29 HH TYR 3 HH TYR 3 36.764 16.401 -15.424 30 H GLU 4 H GLU 4 28.960 18.646 -17.212 31 HA GLU 4 HA GLU 4 31.421 19.448 -18.925 32 1HB GLU 4 1HB GLU 4 29.947 19.363 -20.587 33 2HB GLU 4 2HB GLU 4 28.505 19.678 -19.684 34 1HG GLU 4 1HG GLU 4 30.558 21.857 -20.368 35 2HG GLU 4 2HG GLU 4 29.234 21.386 -21.445 36 H TYR 5 H TYR 5 32.586 20.454 -17.446 37 HA TYR 5 HA TYR 5 31.264 22.446 -15.555 38 1HB TYR 5 2HB TYR 5 32.459 21.974 -13.727 39 2HB TYR 5 1HB TYR 5 32.131 20.379 -14.309 40 HD1 TYR 5 HD1 TYR 5 34.143 21.284 -12.150 41 HD2 TYR 5 HD2 TYR 5 34.661 20.148 -16.256 42 HE1 TYR 5 HE1 TYR 5 36.504 20.975 -11.769 43 HE2 TYR 5 HE2 TYR 5 37.060 19.808 -15.811 44 HH TYR 5 HH TYR 5 38.676 19.865 -14.344 45 H THR 6 H THR 6 31.805 24.243 -15.928 46 HA THR 6 HA THR 6 34.009 24.839 -17.943 47 HB THR 6 HB THR 6 31.698 26.761 -17.193 48 HG1 THR 6 HG1 THR 6 30.824 24.720 -17.659 49 1HG2 THR 6 1HG2 THR 6 31.835 27.409 -19.569 50 2HG2 THR 6 2HG2 THR 6 33.035 26.142 -19.882 51 3HG2 THR 6 3HG2 THR 6 33.498 27.523 -18.861 52 H ILE 7 H ILE 7 35.718 26.109 -17.425 53 HA ILE 7 HA ILE 7 35.815 27.554 -14.733 54 HB ILE 7 HB ILE 7 37.951 25.540 -15.673 55 1HG1 ILE 7 2HG1 ILE 7 37.238 24.300 -13.310 56 2HG1 ILE 7 1HG1 ILE 7 35.747 25.184 -13.558 57 1HG2 ILE 7 1HG2 ILE 7 39.045 25.882 -13.469 58 2HG2 ILE 7 2HG2 ILE 7 38.896 27.407 -14.367 59 3HG2 ILE 7 3HG2 ILE 7 37.778 27.068 -13.013 60 1HD1 ILE 7 1HD1 ILE 7 36.885 22.808 -15.040 61 2HD1 ILE 7 2HD1 ILE 7 35.249 23.170 -14.402 62 3HD1 ILE 7 3HD1 ILE 7 35.757 23.888 -15.917 63 HA DPR 8 HA PRO 8 38.503 30.365 -17.006 64 1HB DPR 8 1HB PRO 8 37.744 31.992 -15.588 65 2HB DPR 8 2HB PRO 8 37.122 32.760 -17.060 66 1HG DPR 8 2HG PRO 8 35.450 32.234 -14.956 67 2HG DPR 8 1HG PRO 8 34.886 31.948 -16.628 68 1HD DPR 8 2HD PRO 8 35.736 29.884 -14.580 69 2HD DPR 8 1HD PRO 8 34.579 29.722 -15.919 70 H SER 9 H SER 9 39.023 30.123 -19.037 71 HA SER 9 HA SER 9 37.246 30.859 -21.376 72 1HB SER 9 2HB SER 9 40.170 29.926 -21.257 73 2HB SER 9 1HB SER 9 39.311 30.378 -22.737 74 HG SER 9 HG SER 9 39.709 32.036 -20.471 75 H TYR 10 H TYR 10 37.933 27.929 -19.579 76 HA TYR 10 HA TYR 10 37.725 26.199 -22.094 77 1HB TYR 10 2HB TYR 10 38.961 25.801 -19.295 78 2HB TYR 10 1HB TYR 10 38.305 24.398 -20.035 79 HD1 TYR 10 HD1 TYR 10 39.205 23.418 -22.140 80 HD2 TYR 10 HD2 TYR 10 41.058 26.862 -20.325 81 HE1 TYR 10 HE1 TYR 10 41.237 22.967 -23.349 82 HE2 TYR 10 HE2 TYR 10 43.085 26.374 -21.559 83 HH TYR 10 HH TYR 10 43.327 23.608 -23.768 84 H THR 11 H THR 11 36.039 24.896 -22.464 85 HA THR 11 HA THR 11 33.972 24.330 -20.286 86 HB THR 11 HB THR 11 33.798 23.815 -23.308 87 HG1 THR 11 HG1 THR 11 34.000 26.034 -22.872 88 1HG2 THR 11 1HG2 THR 11 32.079 22.606 -21.833 89 2HG2 THR 11 2HG2 THR 11 31.334 23.715 -23.006 90 3HG2 THR 11 3HG2 THR 11 31.482 24.178 -21.285 91 H PHE 12 H PHE 12 34.766 22.697 -19.252 92 HA PHE 12 HA PHE 12 36.635 20.606 -20.569 93 1HB PHE 12 2HB PHE 12 36.068 21.126 -17.628 94 2HB PHE 12 1HB PHE 12 36.946 19.729 -18.172 95 HD1 PHE 12 HD1 PHE 12 39.282 19.976 -19.185 96 HD2 PHE 12 HD2 PHE 12 37.190 23.355 -17.527 97 HE1 PHE 12 HE1 PHE 12 41.386 21.117 -18.772 98 HE2 PHE 12 HE2 PHE 12 39.317 24.423 -17.076 99 HZ PHE 12 HZ PHE 12 41.413 23.332 -17.671 100 H ARG 13 H ARG 13 35.423 18.893 -21.342 101 HA ARG 13 HA ARG 13 32.841 18.055 -19.925 102 1HB ARG 13 2HB ARG 13 32.978 18.047 -22.966 103 2HB ARG 13 1HB ARG 13 31.605 17.883 -21.850 104 1HG ARG 13 1HG ARG 13 31.925 20.321 -21.291 105 2HG ARG 13 2HG ARG 13 33.159 20.430 -22.509 106 1HD ARG 13 2HD ARG 13 30.273 19.556 -23.194 107 2HD ARG 13 1HD ARG 13 30.795 21.237 -23.168 108 HE ARG 13 HE ARG 13 32.669 20.112 -24.914 109 1HH1 ARG 13 1HH1 ARG 13 29.070 20.004 -24.995 110 2HH1 ARG 13 2HH1 ARG 13 29.139 19.850 -26.822 111 1HH2 ARG 13 1HH2 ARG 13 32.569 19.936 -26.953 112 2HH2 ARG 13 2HH2 ARG 13 30.967 19.815 -27.838 113 H GLY 14 H GLY 14 32.777 15.975 -19.429 114 1HA GLY 14 1HA GLY 14 33.539 13.793 -21.249 115 2HA GLY 14 2HA GLY 14 34.782 13.967 -20.014 116 HA PRO 15 HA PRO 15 31.291 11.326 -18.117 117 1HB PRO 15 1HB PRO 15 32.438 8.938 -17.603 118 2HB PRO 15 2HB PRO 15 32.052 9.467 -19.256 119 1HG PRO 15 2HG PRO 15 34.729 9.572 -17.822 120 2HG PRO 15 1HG PRO 15 34.384 8.900 -19.453 121 1HD PRO 15 1HD PRO 15 35.333 11.531 -18.998 122 2HD PRO 15 2HD PRO 15 34.331 11.105 -20.411 123 H GLY 16 H GLY 16 30.888 10.440 -15.981 124 1HA GLY 16 2HA GLY 16 31.108 10.191 -13.616 125 2HA GLY 16 1HA GLY 16 32.765 10.771 -13.723 126 H CYS 17 H CYS 17 29.697 11.595 -12.754 127 HA CYS 17 HA CYS 17 30.157 14.600 -12.775 128 1HB CYS 17 1HB CYS 17 27.627 13.024 -11.996 129 2HB CYS 17 2HB CYS 17 27.763 14.783 -12.122 130 HA PRO 18 HA PRO 18 31.209 14.320 -8.226 131 1HB PRO 18 2HB PRO 18 33.488 15.809 -8.145 132 2HB PRO 18 1HB PRO 18 33.475 14.125 -8.708 133 1HG PRO 18 1HG PRO 18 33.526 16.669 -10.407 134 2HG PRO 18 2HG PRO 18 34.539 15.206 -10.597 135 1HD PRO 18 1HD PRO 18 32.130 15.648 -12.038 136 2HD PRO 18 2HD PRO 18 32.774 14.028 -11.656 137 H THR 19 H THR 19 31.483 16.184 -6.642 138 HA THR 19 HA THR 19 29.596 18.458 -7.194 139 HB THR 19 HB THR 19 30.507 19.068 -4.737 140 HG1 THR 19 HG1 THR 19 30.909 17.217 -3.542 141 1HG2 THR 19 1HG2 THR 19 28.457 16.916 -5.195 142 2HG2 THR 19 2HG2 THR 19 28.723 17.864 -3.672 143 3HG2 THR 19 3HG2 THR 19 28.223 18.694 -5.174 144 H VAL 20 H VAL 20 30.115 20.645 -6.821 145 HA VAL 20 HA VAL 20 32.945 21.337 -7.500 146 HB VAL 20 HB VAL 20 32.235 22.934 -9.314 147 1HG1 VAL 20 1HG2 VAL 20 31.594 20.059 -10.080 148 2HG1 VAL 20 2HG2 VAL 20 32.122 21.366 -11.175 149 3HG1 VAL 20 3HG2 VAL 20 33.224 20.761 -9.921 150 1HG2 VAL 20 1HG1 VAL 20 29.790 23.219 -8.795 151 2HG2 VAL 20 2HG1 VAL 20 30.148 22.934 -10.507 152 3HG2 VAL 20 3HG1 VAL 20 29.472 21.615 -9.501 153 H LYS 21 H LYS 21 33.614 23.463 -7.422 154 HA LYS 21 HA LYS 21 33.031 24.693 -4.867 155 1HB LYS 21 1HB LYS 21 35.065 25.014 -7.125 156 2HB LYS 21 2HB LYS 21 34.678 26.528 -6.422 157 1HG LYS 21 1HG LYS 21 36.642 25.746 -5.457 158 2HG LYS 21 2HG LYS 21 35.422 25.836 -4.194 159 1HD LYS 21 2HD LYS 21 35.122 23.432 -4.215 160 2HD LYS 21 1HD LYS 21 36.245 23.212 -5.555 161 1HE LYS 21 1HE LYS 21 37.110 24.381 -2.806 162 2HE LYS 21 2HE LYS 21 37.096 22.657 -3.157 163 1HZ LYS 21 1HZ LYS 21 39.281 23.588 -3.534 164 2HZ LYS 21 2HZ LYS 21 38.710 24.649 -4.664 165 3HZ LYS 21 3HZ LYS 21 38.676 23.025 -4.964 166 HA PRO 22 HA PRO 22 30.188 28.149 -5.891 167 1HB PRO 22 2HB PRO 22 30.931 30.229 -4.237 168 2HB PRO 22 1HB PRO 22 30.113 28.748 -3.700 169 1HG PRO 22 1HG PRO 22 33.060 29.436 -3.459 170 2HG PRO 22 2HG PRO 22 32.004 28.655 -2.251 171 1HD PRO 22 1HD PRO 22 33.753 27.276 -4.016 172 2HD PRO 22 2HD PRO 22 32.342 26.502 -3.281 173 H DAL 23 H ALA 23 30.487 28.787 -7.934 174 HA DAL 23 HA ALA 23 33.120 29.950 -8.919 175 1HB DAL 23 1HB ALA 23 32.011 31.709 -10.278 176 2HB DAL 23 2HB ALA 23 31.686 31.952 -8.540 177 3HB DAL 23 3HB ALA 23 30.422 31.268 -9.597 178 H VAL 24 H VAL 24 32.975 27.491 -9.228 179 HA VAL 24 HA VAL 24 32.502 26.890 -12.104 180 HB VAL 24 HB VAL 24 33.429 25.034 -9.865 181 1HG1 VAL 24 1HG1 VAL 24 33.693 24.498 -12.927 182 2HG1 VAL 24 2HG1 VAL 24 32.552 23.698 -11.834 183 3HG1 VAL 24 3HG1 VAL 24 34.285 23.424 -11.626 184 1HG2 VAL 24 1HG2 VAL 24 35.140 26.768 -10.155 185 2HG2 VAL 24 2HG2 VAL 24 35.812 25.242 -10.744 186 3HG2 VAL 24 3HG2 VAL 24 35.230 26.487 -11.898 187 H THR 25 H THR 25 30.568 25.956 -12.883 188 HA THR 25 HA THR 25 28.591 24.711 -10.995 189 HB THR 25 HB THR 25 26.850 25.812 -12.337 190 HG1 THR 25 HG1 THR 25 28.906 27.615 -13.030 191 1HG2 THR 25 1HG2 THR 25 27.194 26.675 -10.024 192 2HG2 THR 25 2HG2 THR 25 26.691 27.990 -11.120 193 3HG2 THR 25 3HG2 THR 25 28.400 27.843 -10.628 194 H ILE 26 H ILE 26 28.964 22.858 -11.769 195 HA ILE 26 HA ILE 26 29.470 21.905 -14.356 196 HB ILE 26 HB ILE 26 29.887 21.024 -11.949 197 1HG1 ILE 26 1HG1 ILE 26 28.973 18.558 -13.582 198 2HG1 ILE 26 2HG1 ILE 26 30.141 19.593 -14.297 199 1HG2 ILE 26 1HG2 ILE 26 28.363 19.338 -10.862 200 2HG2 ILE 26 2HG2 ILE 26 27.500 20.901 -11.042 201 3HG2 ILE 26 3HG2 ILE 26 27.157 19.543 -12.154 202 1HD1 ILE 26 1HD1 ILE 26 31.685 19.397 -12.383 203 2HD1 ILE 26 2HD1 ILE 26 31.256 17.761 -12.979 204 3HD1 ILE 26 3HD1 ILE 26 30.513 18.420 -11.486 205 H ARG 27 H ARG 27 28.196 20.205 -15.522 206 HA ARG 27 HA ARG 27 25.206 20.381 -15.423 207 1HB ARG 27 2HB ARG 27 25.631 22.016 -17.042 208 2HB ARG 27 1HB ARG 27 26.618 20.835 -18.033 209 1HG ARG 27 1HG ARG 27 24.674 19.564 -18.489 210 2HG ARG 27 2HG ARG 27 23.658 20.627 -17.471 211 1HD ARG 27 2HD ARG 27 24.098 22.541 -19.086 212 2HD ARG 27 1HD ARG 27 25.079 21.459 -20.093 213 HE ARG 27 HE ARG 27 22.413 20.289 -19.649 214 1HH1 ARG 27 2HH1 ARG 27 23.958 22.808 -21.710 215 2HH1 ARG 27 1HH1 ARG 27 22.610 22.597 -22.937 216 1HH2 ARG 27 2HH2 ARG 27 20.988 20.178 -21.117 217 2HH2 ARG 27 1HH2 ARG 27 21.064 21.224 -22.623 218 H CYS 28 H CYS 28 25.029 18.641 -15.090 219 HA CYS 28 HA CYS 28 26.484 16.140 -16.196 220 1HB CYS 28 2HB CYS 28 26.445 16.228 -13.645 221 2HB CYS 28 1HB CYS 28 24.680 16.041 -13.692 222 H GLU 29 H GLU 29 25.309 15.168 -17.762 223 HA GLU 29 HA GLU 29 23.051 16.335 -18.868 224 1HB GLU 29 1HB GLU 29 22.876 14.729 -20.569 225 2HB GLU 29 2HB GLU 29 24.552 15.114 -20.237 226 1HG GLU 29 1HG GLU 29 24.859 12.985 -19.069 227 2HG GLU 29 2HG GLU 29 23.136 12.598 -19.263 Start of MODEL 32 1 1H SER 1 1H SER 1 25.714 9.507 -19.650 2 2H SER 1 2H SER 1 26.243 8.557 -18.406 3 3H SER 1 3H SER 1 24.641 8.945 -18.527 4 HA SER 1 HA SER 1 25.063 11.264 -18.129 5 1HB SER 1 2HB SER 1 25.693 11.090 -15.736 6 2HB SER 1 1HB SER 1 24.538 9.835 -16.209 7 HG SER 1 HG SER 1 26.316 8.406 -16.441 8 H LYS 2 H LYS 2 26.494 12.847 -18.443 9 HA LYS 2 HA LYS 2 29.475 12.430 -18.092 10 1HB LYS 2 1HB LYS 2 30.148 13.513 -20.114 11 2HB LYS 2 2HB LYS 2 29.324 12.002 -20.411 12 1HG LYS 2 1HG LYS 2 27.344 13.165 -21.283 13 2HG LYS 2 2HG LYS 2 27.974 14.738 -20.861 14 1HD LYS 2 1HD LYS 2 29.423 12.852 -22.855 15 2HD LYS 2 2HD LYS 2 28.067 13.866 -23.326 16 1HE LYS 2 2HE LYS 2 29.329 15.945 -22.730 17 2HE LYS 2 1HE LYS 2 30.715 14.967 -22.215 18 1HZ LYS 2 1HZ LYS 2 30.854 14.077 -24.488 19 2HZ LYS 2 2HZ LYS 2 30.968 15.725 -24.504 20 3HZ LYS 2 3HZ LYS 2 29.563 14.989 -24.968 21 H TYR 3 H TYR 3 30.476 14.108 -17.266 22 HA TYR 3 HA TYR 3 28.862 16.438 -16.206 23 1HB TYR 3 2HB TYR 3 30.503 16.935 -14.708 24 2HB TYR 3 1HB TYR 3 30.249 15.242 -14.581 25 HD1 TYR 3 HD1 TYR 3 32.796 17.683 -14.446 26 HD2 TYR 3 HD2 TYR 3 32.160 13.789 -16.153 27 HE1 TYR 3 HE1 TYR 3 35.183 17.249 -14.439 28 HE2 TYR 3 HE2 TYR 3 34.586 13.510 -16.324 29 HH TYR 3 HH TYR 3 36.558 14.315 -15.835 30 H GLU 4 H GLU 4 29.066 18.470 -16.965 31 HA GLU 4 HA GLU 4 31.516 19.249 -18.691 32 1HB GLU 4 2HB GLU 4 30.021 19.213 -20.353 33 2HB GLU 4 1HB GLU 4 28.604 19.505 -19.396 34 1HG GLU 4 2HG GLU 4 29.259 21.970 -19.231 35 2HG GLU 4 1HG GLU 4 30.607 21.639 -20.310 36 H TYR 5 H TYR 5 32.710 20.110 -17.152 37 HA TYR 5 HA TYR 5 31.472 22.050 -15.159 38 1HB TYR 5 2HB TYR 5 32.712 21.470 -13.405 39 2HB TYR 5 1HB TYR 5 32.459 19.896 -14.080 40 HD1 TYR 5 HD1 TYR 5 34.823 19.644 -16.054 41 HD2 TYR 5 HD2 TYR 5 34.614 21.102 -12.016 42 HE1 TYR 5 HE1 TYR 5 37.211 19.217 -15.723 43 HE2 TYR 5 HE2 TYR 5 36.983 20.750 -11.771 44 HH TYR 5 HH TYR 5 38.835 19.972 -12.682 45 H THR 6 H THR 6 31.979 23.879 -15.519 46 HA THR 6 HA THR 6 34.099 24.512 -17.599 47 HB THR 6 HB THR 6 31.843 26.459 -16.765 48 HG1 THR 6 HG1 THR 6 30.587 25.488 -18.356 49 1HG2 THR 6 1HG2 THR 6 33.101 25.791 -19.483 50 2HG2 THR 6 2HG2 THR 6 33.613 27.175 -18.479 51 3HG2 THR 6 3HG2 THR 6 31.934 27.096 -19.149 52 H ILE 7 H ILE 7 35.785 25.736 -17.125 53 HA ILE 7 HA ILE 7 36.053 26.978 -14.340 54 HB ILE 7 HB ILE 7 38.194 25.272 -15.765 55 1HG1 ILE 7 2HG1 ILE 7 38.017 23.652 -13.679 56 2HG1 ILE 7 1HG1 ILE 7 36.519 24.464 -13.311 57 1HG2 ILE 7 1HG2 ILE 7 38.193 26.494 -12.926 58 2HG2 ILE 7 2HG2 ILE 7 39.517 25.504 -13.620 59 3HG2 ILE 7 3HG2 ILE 7 39.135 27.092 -14.317 60 1HD1 ILE 7 1HD1 ILE 7 37.098 22.251 -15.152 61 2HD1 ILE 7 2HD1 ILE 7 36.120 23.499 -15.965 62 3HD1 ILE 7 3HD1 ILE 7 35.550 22.831 -14.458 63 HA DPR 8 HA PRO 8 38.259 30.232 -16.575 64 1HB DPR 8 1HB PRO 8 37.725 31.470 -14.716 65 2HB DPR 8 2HB PRO 8 36.898 32.503 -15.903 66 1HG DPR 8 2HG PRO 8 35.553 31.505 -13.720 67 2HG DPR 8 1HG PRO 8 34.744 31.601 -15.310 68 1HD DPR 8 2HD PRO 8 35.741 29.135 -13.904 69 2HD DPR 8 1HD PRO 8 34.512 29.266 -15.183 70 H SER 9 H SER 9 38.190 29.724 -18.719 71 HA SER 9 HA SER 9 35.846 30.612 -20.456 72 1HB SER 9 1HB SER 9 38.828 31.080 -21.077 73 2HB SER 9 2HB SER 9 37.494 31.307 -22.214 74 HG SER 9 HG SER 9 37.782 32.610 -19.710 75 H TYR 10 H TYR 10 37.438 28.005 -19.285 76 HA TYR 10 HA TYR 10 37.639 26.531 -21.959 77 1HB TYR 10 1HB TYR 10 39.664 26.945 -20.154 78 2HB TYR 10 2HB TYR 10 38.958 25.599 -19.327 79 HD1 TYR 10 HD1 TYR 10 40.834 26.709 -22.301 80 HD2 TYR 10 HD2 TYR 10 38.906 23.308 -20.509 81 HE1 TYR 10 HE1 TYR 10 42.048 25.205 -23.795 82 HE2 TYR 10 HE2 TYR 10 40.155 21.832 -22.010 83 HH TYR 10 HH TYR 10 41.621 21.687 -23.646 84 H THR 11 H THR 11 36.139 24.954 -22.301 85 HA THR 11 HA THR 11 34.307 24.098 -20.064 86 HB THR 11 HB THR 11 34.082 23.442 -23.056 87 HG1 THR 11 HG1 THR 11 34.238 25.686 -22.743 88 1HG2 THR 11 1HG2 THR 11 31.838 23.846 -20.959 89 2HG2 THR 11 2HG2 THR 11 32.433 22.261 -21.500 90 3HG2 THR 11 3HG2 THR 11 31.623 23.346 -22.661 91 H PHE 12 H PHE 12 34.780 22.327 -19.099 92 HA PHE 12 HA PHE 12 36.656 20.186 -20.362 93 1HB PHE 12 2HB PHE 12 36.191 20.831 -17.424 94 2HB PHE 12 1HB PHE 12 36.997 19.387 -17.968 95 HD1 PHE 12 HD1 PHE 12 39.372 19.477 -18.742 96 HD2 PHE 12 HD2 PHE 12 37.298 23.132 -17.793 97 HE1 PHE 12 HE1 PHE 12 41.483 20.663 -18.559 98 HE2 PHE 12 HE2 PHE 12 39.431 24.258 -17.568 99 HZ PHE 12 HZ PHE 12 41.530 23.050 -17.940 100 H ARG 13 H ARG 13 35.371 18.630 -21.180 101 HA ARG 13 HA ARG 13 32.767 17.848 -19.778 102 1HB ARG 13 1HB ARG 13 32.967 17.616 -22.776 103 2HB ARG 13 2HB ARG 13 31.559 17.637 -21.686 104 1HG ARG 13 2HG ARG 13 31.749 20.104 -21.484 105 2HG ARG 13 1HG ARG 13 33.190 20.084 -22.495 106 1HD ARG 13 2HD ARG 13 31.766 19.048 -24.404 107 2HD ARG 13 1HD ARG 13 30.342 19.269 -23.378 108 HE ARG 13 HE ARG 13 31.627 21.837 -23.523 109 1HH1 ARG 13 2HH2 ARG 13 30.090 19.664 -25.952 110 2HH1 ARG 13 1HH2 ARG 13 29.704 21.131 -26.984 111 1HH2 ARG 13 1HH1 ARG 13 31.121 23.363 -24.792 112 2HH2 ARG 13 2HH1 ARG 13 30.244 23.058 -26.375 113 H GLY 14 H GLY 14 32.879 15.798 -19.062 114 1HA GLY 14 1HA GLY 14 33.899 13.535 -20.754 115 2HA GLY 14 2HA GLY 14 34.934 13.869 -19.372 116 HA PRO 15 HA PRO 15 31.271 11.143 -17.884 117 1HB PRO 15 2HB PRO 15 32.287 8.684 -17.424 118 2HB PRO 15 1HB PRO 15 32.028 9.307 -19.069 119 1HG PRO 15 1HG PRO 15 34.609 9.236 -17.466 120 2HG PRO 15 2HG PRO 15 34.343 8.648 -19.144 121 1HD PRO 15 1HD PRO 15 35.366 11.216 -18.521 122 2HD PRO 15 2HD PRO 15 34.430 10.894 -20.006 123 H GLY 16 H GLY 16 30.697 10.127 -15.773 124 1HA GLY 16 1HA GLY 16 30.867 9.857 -13.401 125 2HA GLY 16 2HA GLY 16 32.423 10.683 -13.381 126 H CYS 17 H CYS 17 29.441 11.033 -12.385 127 HA CYS 17 HA CYS 17 29.313 14.092 -12.581 128 1HB CYS 17 2HB CYS 17 27.216 12.362 -11.129 129 2HB CYS 17 1HB CYS 17 27.040 14.005 -11.744 130 HA PRO 18 HA PRO 18 30.902 14.315 -8.198 131 1HB PRO 18 1HB PRO 18 33.016 16.006 -8.521 132 2HB PRO 18 2HB PRO 18 33.125 14.273 -8.901 133 1HG PRO 18 2HG PRO 18 32.775 16.596 -10.851 134 2HG PRO 18 1HG PRO 18 33.887 15.203 -10.992 135 1HD PRO 18 2HD PRO 18 31.295 15.295 -12.198 136 2HD PRO 18 1HD PRO 18 32.138 13.792 -11.763 137 H THR 19 H THR 19 31.144 16.447 -6.923 138 HA THR 19 HA THR 19 29.330 18.658 -8.005 139 HB THR 19 HB THR 19 28.049 17.792 -6.306 140 HG1 THR 19 HG1 THR 19 29.310 20.191 -5.556 141 1HG2 THR 19 1HG2 THR 19 28.516 17.972 -3.870 142 2HG2 THR 19 2HG2 THR 19 30.211 18.445 -4.215 143 3HG2 THR 19 3HG2 THR 19 29.639 16.798 -4.627 144 H VAL 20 H VAL 20 29.896 20.725 -7.430 145 HA VAL 20 HA VAL 20 32.950 21.160 -7.426 146 HB VAL 20 HB VAL 20 32.686 22.886 -9.196 147 1HG1 VAL 20 1HG2 VAL 20 33.468 20.637 -9.817 148 2HG1 VAL 20 2HG2 VAL 20 31.797 20.135 -10.163 149 3HG1 VAL 20 3HG2 VAL 20 32.582 21.389 -11.165 150 1HG2 VAL 20 1HG1 VAL 20 29.822 21.952 -9.769 151 2HG2 VAL 20 2HG1 VAL 20 30.770 23.155 -10.688 152 3HG2 VAL 20 3HG1 VAL 20 30.271 23.501 -9.019 153 H LYS 21 H LYS 21 33.729 23.399 -7.186 154 HA LYS 21 HA LYS 21 32.638 24.582 -4.669 155 1HB LYS 21 1HB LYS 21 34.705 25.894 -4.653 156 2HB LYS 21 2HB LYS 21 34.963 24.157 -4.694 157 1HG LYS 21 2HG LYS 21 36.740 25.224 -5.806 158 2HG LYS 21 1HG LYS 21 35.851 24.277 -6.988 159 1HD LYS 21 1HD LYS 21 34.844 26.224 -7.973 160 2HD LYS 21 2HD LYS 21 35.408 27.312 -6.715 161 1HE LYS 21 2HE LYS 21 37.328 25.840 -8.652 162 2HE LYS 21 1HE LYS 21 36.647 27.436 -8.962 163 1HZ LYS 21 1HZ LYS 21 38.831 27.626 -7.992 164 2HZ LYS 21 2HZ LYS 21 38.377 26.799 -6.636 165 3HZ LYS 21 3HZ LYS 21 37.717 28.278 -6.961 166 HA PRO 22 HA PRO 22 30.517 28.108 -6.532 167 1HB PRO 22 1HB PRO 22 32.017 30.147 -4.797 168 2HB PRO 22 2HB PRO 22 30.271 29.941 -5.067 169 1HG PRO 22 2HG PRO 22 31.389 29.006 -2.785 170 2HG PRO 22 1HG PRO 22 30.203 27.982 -3.643 171 1HD PRO 22 1HD PRO 22 33.273 27.797 -3.797 172 2HD PRO 22 2HD PRO 22 32.094 26.481 -3.515 173 H DAL 23 H ALA 23 30.757 29.164 -8.429 174 HA DAL 23 HA ALA 23 33.559 29.960 -9.406 175 1HB DAL 23 1HB ALA 23 32.529 31.718 -10.817 176 2HB DAL 23 2HB ALA 23 30.927 31.375 -10.116 177 3HB DAL 23 3HB ALA 23 32.232 32.026 -9.087 178 H VAL 24 H VAL 24 33.318 27.552 -9.605 179 HA VAL 24 HA VAL 24 32.680 26.728 -12.401 180 HB VAL 24 HB VAL 24 33.689 25.068 -10.037 181 1HG1 VAL 24 1HG1 VAL 24 32.683 23.560 -11.813 182 2HG1 VAL 24 2HG1 VAL 24 34.407 23.251 -11.590 183 3HG1 VAL 24 3HG1 VAL 24 33.837 24.169 -13.013 184 1HG2 VAL 24 1HG2 VAL 24 35.462 26.155 -12.322 185 2HG2 VAL 24 2HG2 VAL 24 36.017 25.145 -10.949 186 3HG2 VAL 24 3HG2 VAL 24 35.388 26.778 -10.671 187 H THR 25 H THR 25 30.742 25.598 -12.996 188 HA THR 25 HA THR 25 28.867 24.571 -10.912 189 HB THR 25 HB THR 25 27.033 25.540 -12.243 190 HG1 THR 25 HG1 THR 25 27.443 27.439 -13.414 191 1HG2 THR 25 1HG2 THR 25 26.895 27.802 -11.176 192 2HG2 THR 25 2HG2 THR 25 28.630 27.715 -10.768 193 3HG2 THR 25 3HG2 THR 25 27.479 26.578 -10.017 194 H ILE 26 H ILE 26 29.170 22.619 -11.584 195 HA ILE 26 HA ILE 26 29.548 21.572 -14.152 196 HB ILE 26 HB ILE 26 30.138 20.789 -11.749 197 1HG1 ILE 26 2HG1 ILE 26 29.149 18.331 -13.349 198 2HG1 ILE 26 1HG1 ILE 26 30.365 19.349 -14.029 199 1HG2 ILE 26 1HG2 ILE 26 27.822 20.649 -10.671 200 2HG2 ILE 26 2HG2 ILE 26 27.437 19.247 -11.720 201 3HG2 ILE 26 3HG2 ILE 26 28.736 19.117 -10.516 202 1HD1 ILE 26 1HD1 ILE 26 31.878 19.054 -12.113 203 2HD1 ILE 26 2HD1 ILE 26 31.392 17.449 -12.761 204 3HD1 ILE 26 3HD1 ILE 26 30.662 18.092 -11.258 205 H ARG 27 H ARG 27 28.229 19.826 -15.176 206 HA ARG 27 HA ARG 27 25.281 19.899 -14.929 207 1HB ARG 27 1HB ARG 27 25.455 21.656 -16.462 208 2HB ARG 27 2HB ARG 27 26.512 20.659 -17.574 209 1HG ARG 27 2HG ARG 27 24.677 19.231 -18.050 210 2HG ARG 27 1HG ARG 27 23.603 20.151 -16.954 211 1HD ARG 27 2HD ARG 27 23.892 22.188 -18.491 212 2HD ARG 27 1HD ARG 27 24.899 21.198 -19.566 213 HE ARG 27 HE ARG 27 22.480 19.712 -19.297 214 1HH1 ARG 27 1HH1 ARG 27 23.167 23.020 -20.551 215 2HH1 ARG 27 2HH1 ARG 27 21.690 22.890 -21.632 216 1HH2 ARG 27 1HH2 ARG 27 20.870 19.732 -20.563 217 2HH2 ARG 27 2HH2 ARG 27 20.495 21.174 -21.635 218 H CYS 28 H CYS 28 25.114 18.071 -14.842 219 HA CYS 28 HA CYS 28 26.698 15.873 -16.288 220 1HB CYS 28 2HB CYS 28 26.448 15.725 -13.604 221 2HB CYS 28 1HB CYS 28 24.973 14.848 -14.030 222 H GLU 29 H GLU 29 25.674 15.438 -18.074 223 HA GLU 29 HA GLU 29 22.816 16.220 -18.543 224 1HB GLU 29 1HB GLU 29 24.982 15.144 -20.460 225 2HB GLU 29 2HB GLU 29 23.342 15.464 -20.998 226 1HG GLU 29 1HG GLU 29 23.540 17.881 -20.436 227 2HG GLU 29 2HG GLU 29 25.191 17.626 -19.856 Start of MODEL 33 1 1H SER 1 1H SER 1 25.522 9.638 -19.053 2 2H SER 1 2H SER 1 24.634 9.040 -17.795 3 3H SER 1 3H SER 1 26.218 8.605 -17.968 4 HA SER 1 HA SER 1 25.196 11.321 -17.353 5 1HB SER 1 1HB SER 1 26.213 10.993 -15.114 6 2HB SER 1 2HB SER 1 24.951 9.797 -15.450 7 HG SER 1 HG SER 1 26.828 8.878 -14.565 8 H LYS 2 H LYS 2 26.607 12.879 -17.824 9 HA LYS 2 HA LYS 2 29.609 12.432 -17.949 10 1HB LYS 2 1HB LYS 2 28.049 13.643 -20.310 11 2HB LYS 2 2HB LYS 2 29.795 13.781 -20.111 12 1HG LYS 2 1HG LYS 2 30.062 11.300 -20.247 13 2HG LYS 2 2HG LYS 2 28.318 11.118 -20.454 14 1HD LYS 2 1HD LYS 2 28.421 12.463 -22.604 15 2HD LYS 2 2HD LYS 2 30.165 12.655 -22.403 16 1HE LYS 2 2HE LYS 2 30.466 10.143 -22.569 17 2HE LYS 2 1HE LYS 2 28.715 9.949 -22.770 18 1HZ LYS 2 1HZ LYS 2 30.485 11.512 -24.590 19 2HZ LYS 2 2HZ LYS 2 28.854 11.332 -24.777 20 3HZ LYS 2 3HZ LYS 2 29.850 10.020 -24.905 21 H TYR 3 H TYR 3 30.638 14.198 -17.163 22 HA TYR 3 HA TYR 3 28.993 16.495 -16.102 23 1HB TYR 3 2HB TYR 3 30.730 17.137 -14.783 24 2HB TYR 3 1HB TYR 3 30.517 15.450 -14.532 25 HD1 TYR 3 HD1 TYR 3 32.342 14.004 -16.340 26 HD2 TYR 3 HD2 TYR 3 33.008 17.836 -14.501 27 HE1 TYR 3 HE1 TYR 3 34.757 13.733 -16.574 28 HE2 TYR 3 HE2 TYR 3 35.397 17.474 -14.675 29 HH TYR 3 HH TYR 3 37.020 16.176 -15.379 30 H GLU 4 H GLU 4 29.021 18.451 -16.988 31 HA GLU 4 HA GLU 4 31.365 19.336 -18.827 32 1HB GLU 4 1HB GLU 4 29.767 19.218 -20.387 33 2HB GLU 4 2HB GLU 4 28.400 19.462 -19.339 34 1HG GLU 4 1HG GLU 4 28.933 21.957 -19.281 35 2HG GLU 4 2HG GLU 4 30.221 21.678 -20.446 36 H TYR 5 H TYR 5 32.617 20.335 -17.370 37 HA TYR 5 HA TYR 5 31.369 22.226 -15.344 38 1HB TYR 5 2HB TYR 5 32.547 21.612 -13.565 39 2HB TYR 5 1HB TYR 5 32.342 20.044 -14.284 40 HD1 TYR 5 HD1 TYR 5 34.844 20.008 -16.194 41 HD2 TYR 5 HD2 TYR 5 34.322 21.083 -12.065 42 HE1 TYR 5 HE1 TYR 5 37.237 19.660 -15.744 43 HE2 TYR 5 HE2 TYR 5 36.690 20.823 -11.706 44 HH TYR 5 HH TYR 5 38.856 19.732 -14.292 45 H THR 6 H THR 6 31.897 24.033 -15.652 46 HA THR 6 HA THR 6 34.045 24.711 -17.693 47 HB THR 6 HB THR 6 31.740 26.592 -16.838 48 HG1 THR 6 HG1 THR 6 30.562 25.671 -18.519 49 1HG2 THR 6 1HG2 THR 6 33.099 26.110 -19.546 50 2HG2 THR 6 2HG2 THR 6 33.533 27.450 -18.452 51 3HG2 THR 6 3HG2 THR 6 31.880 27.357 -19.182 52 H ILE 7 H ILE 7 35.654 26.050 -17.234 53 HA ILE 7 HA ILE 7 35.925 27.251 -14.430 54 HB ILE 7 HB ILE 7 38.086 25.553 -15.838 55 1HG1 ILE 7 2HG1 ILE 7 37.779 23.982 -13.608 56 2HG1 ILE 7 1HG1 ILE 7 36.221 24.769 -13.517 57 1HG2 ILE 7 1HG2 ILE 7 39.020 27.347 -14.389 58 2HG2 ILE 7 2HG2 ILE 7 38.067 26.762 -12.998 59 3HG2 ILE 7 3HG2 ILE 7 39.379 25.754 -13.690 60 1HD1 ILE 7 1HD1 ILE 7 37.244 22.723 -15.474 61 2HD1 ILE 7 2HD1 ILE 7 35.768 22.793 -14.483 62 3HD1 ILE 7 3HD1 ILE 7 35.870 23.768 -15.949 63 HA DPR 8 HA PRO 8 38.177 30.501 -16.630 64 1HB DPR 8 1HB PRO 8 37.666 31.745 -14.775 65 2HB DPR 8 2HB PRO 8 36.837 32.785 -15.952 66 1HG DPR 8 1HG PRO 8 35.506 31.791 -13.758 67 2HG DPR 8 2HG PRO 8 34.682 31.899 -15.340 68 1HD DPR 8 1HD PRO 8 35.670 29.421 -13.951 69 2HD DPR 8 2HD PRO 8 34.428 29.571 -15.214 70 H SER 9 H SER 9 38.127 30.073 -18.781 71 HA SER 9 HA SER 9 35.763 30.941 -20.504 72 1HB SER 9 1HB SER 9 37.565 32.679 -20.685 73 2HB SER 9 2HB SER 9 38.734 31.425 -21.148 74 HG SER 9 HG SER 9 36.305 32.055 -22.483 75 H TYR 10 H TYR 10 37.305 28.327 -19.350 76 HA TYR 10 HA TYR 10 37.498 26.850 -22.024 77 1HB TYR 10 1HB TYR 10 39.536 27.297 -20.220 78 2HB TYR 10 2HB TYR 10 38.856 25.932 -19.410 79 HD1 TYR 10 HD1 TYR 10 38.874 23.650 -20.601 80 HD2 TYR 10 HD2 TYR 10 40.680 27.116 -22.399 81 HE1 TYR 10 HE1 TYR 10 40.140 22.221 -22.128 82 HE2 TYR 10 HE2 TYR 10 41.914 25.656 -23.917 83 HH TYR 10 HH TYR 10 41.587 22.127 -23.784 84 H THR 11 H THR 11 36.025 25.244 -22.342 85 HA THR 11 HA THR 11 34.223 24.371 -20.081 86 HB THR 11 HB THR 11 33.970 23.729 -23.069 87 HG1 THR 11 HG1 THR 11 32.644 25.557 -23.200 88 1HG2 THR 11 1HG2 THR 11 31.543 23.544 -22.687 89 2HG2 THR 11 2HG2 THR 11 31.690 24.205 -21.036 90 3HG2 THR 11 3HG2 THR 11 32.316 22.590 -21.394 91 H PHE 12 H PHE 12 34.810 22.642 -19.097 92 HA PHE 12 HA PHE 12 36.726 20.552 -20.387 93 1HB PHE 12 2HB PHE 12 36.320 21.216 -17.436 94 2HB PHE 12 1HB PHE 12 37.174 19.803 -17.992 95 HD1 PHE 12 HD1 PHE 12 39.495 19.984 -18.933 96 HD2 PHE 12 HD2 PHE 12 37.349 23.538 -17.774 97 HE1 PHE 12 HE1 PHE 12 41.572 21.239 -18.823 98 HE2 PHE 12 HE2 PHE 12 39.453 24.727 -17.615 99 HZ PHE 12 HZ PHE 12 41.567 23.607 -18.131 100 H ARG 13 H ARG 13 35.526 18.827 -21.055 101 HA ARG 13 HA ARG 13 33.023 18.005 -19.505 102 1HB ARG 13 1HB ARG 13 33.005 18.029 -22.560 103 2HB ARG 13 2HB ARG 13 31.671 17.830 -21.408 104 1HG ARG 13 1HG ARG 13 31.891 20.248 -20.820 105 2HG ARG 13 2HG ARG 13 33.174 20.425 -21.983 106 1HD ARG 13 1HD ARG 13 30.331 19.537 -22.791 107 2HD ARG 13 2HD ARG 13 30.866 21.218 -22.721 108 HE ARG 13 HE ARG 13 32.780 20.046 -24.423 109 1HH1 ARG 13 1HH1 ARG 13 29.189 20.244 -24.634 110 2HH1 ARG 13 2HH1 ARG 13 29.317 20.176 -26.463 111 1HH2 ARG 13 2HH2 ARG 13 32.746 19.980 -26.470 112 2HH2 ARG 13 1HH2 ARG 13 31.174 20.039 -27.416 113 H GLY 14 H GLY 14 32.964 15.901 -19.058 114 1HA GLY 14 1HA GLY 14 33.777 13.765 -20.956 115 2HA GLY 14 2HA GLY 14 34.952 13.920 -19.654 116 HA PRO 15 HA PRO 15 31.399 11.158 -18.072 117 1HB PRO 15 2HB PRO 15 32.586 8.812 -17.441 118 2HB PRO 15 1HB PRO 15 32.301 9.318 -19.121 119 1HG PRO 15 1HG PRO 15 34.859 9.539 -17.495 120 2HG PRO 15 2HG PRO 15 34.660 8.838 -19.139 121 1HD PRO 15 2HD PRO 15 35.484 11.499 -18.674 122 2HD PRO 15 1HD PRO 15 34.562 11.032 -20.129 123 H GLY 16 H GLY 16 30.837 10.271 -15.963 124 1HA GLY 16 1HA GLY 16 30.884 10.080 -13.576 125 2HA GLY 16 2HA GLY 16 32.480 10.821 -13.540 126 H CYS 17 H CYS 17 29.330 11.353 -12.814 127 HA CYS 17 HA CYS 17 29.501 14.400 -12.899 128 1HB CYS 17 2HB CYS 17 27.076 12.601 -12.276 129 2HB CYS 17 1HB CYS 17 27.063 14.368 -12.352 130 HA PRO 18 HA PRO 18 30.250 14.343 -8.298 131 1HB PRO 18 2HB PRO 18 32.521 15.837 -8.138 132 2HB PRO 18 1HB PRO 18 32.548 14.117 -8.585 133 1HG PRO 18 2HG PRO 18 32.783 16.534 -10.437 134 2HG PRO 18 1HG PRO 18 33.767 15.040 -10.450 135 1HD PRO 18 2HD PRO 18 31.460 15.471 -12.087 136 2HD PRO 18 1HD PRO 18 32.074 13.861 -11.631 137 H THR 19 H THR 19 30.387 16.333 -6.869 138 HA THR 19 HA THR 19 28.856 18.707 -8.044 139 HB THR 19 HB THR 19 27.520 17.868 -6.351 140 HG1 THR 19 HG1 THR 19 27.749 20.053 -6.729 141 1HG2 THR 19 1HG2 THR 19 29.689 18.445 -4.242 142 2HG2 THR 19 2HG2 THR 19 27.978 18.027 -3.908 143 3HG2 THR 19 3HG2 THR 19 29.068 16.819 -4.660 144 H VAL 20 H VAL 20 29.505 20.774 -7.311 145 HA VAL 20 HA VAL 20 32.574 21.060 -7.251 146 HB VAL 20 HB VAL 20 32.447 22.834 -9.013 147 1HG1 VAL 20 1HG1 VAL 20 31.592 20.097 -10.019 148 2HG1 VAL 20 2HG1 VAL 20 32.407 21.350 -10.997 149 3HG1 VAL 20 3HG1 VAL 20 33.244 20.611 -9.611 150 1HG2 VAL 20 1HG2 VAL 20 30.035 23.491 -8.948 151 2HG2 VAL 20 2HG2 VAL 20 29.607 21.967 -9.763 152 3HG2 VAL 20 3HG2 VAL 20 30.635 23.174 -10.590 153 H LYS 21 H LYS 21 33.483 23.070 -6.887 154 HA LYS 21 HA LYS 21 32.480 24.363 -4.426 155 1HB LYS 21 1HB LYS 21 34.647 24.930 -4.121 156 2HB LYS 21 2HB LYS 21 34.909 23.525 -5.105 157 1HG LYS 21 2HG LYS 21 35.340 26.444 -5.759 158 2HG LYS 21 1HG LYS 21 36.542 25.188 -5.612 159 1HD LYS 21 2HD LYS 21 34.434 25.272 -7.827 160 2HD LYS 21 1HD LYS 21 35.899 26.218 -7.922 161 1HE LYS 21 2HE LYS 21 36.006 23.126 -7.607 162 2HE LYS 21 1HE LYS 21 35.803 23.869 -9.179 163 1HZ LYS 21 1HZ LYS 21 38.129 23.427 -8.727 164 2HZ LYS 21 2HZ LYS 21 38.115 24.368 -7.369 165 3HZ LYS 21 3HZ LYS 21 37.911 25.059 -8.856 166 HA PRO 22 HA PRO 22 30.671 28.140 -6.174 167 1HB PRO 22 2HB PRO 22 31.505 30.367 -4.766 168 2HB PRO 22 1HB PRO 22 30.545 29.040 -4.097 169 1HG PRO 22 2HG PRO 22 33.478 29.594 -3.668 170 2HG PRO 22 1HG PRO 22 32.283 28.917 -2.529 171 1HD PRO 22 1HD PRO 22 34.153 27.445 -4.195 172 2HD PRO 22 2HD PRO 22 32.814 26.699 -3.299 173 H DAL 23 H ALA 23 30.900 29.055 -8.150 174 HA DAL 23 HA ALA 23 33.676 29.856 -9.180 175 1HB DAL 23 1HB ALA 23 32.655 31.667 -10.529 176 2HB DAL 23 2HB ALA 23 31.063 31.351 -9.791 177 3HB DAL 23 3HB ALA 23 32.413 31.947 -8.786 178 H VAL 24 H VAL 24 33.366 27.448 -9.423 179 HA VAL 24 HA VAL 24 32.739 26.766 -12.250 180 HB VAL 24 HB VAL 24 33.707 24.968 -9.972 181 1HG1 VAL 24 1HG1 VAL 24 32.700 23.573 -11.838 182 2HG1 VAL 24 2HG1 VAL 24 33.839 24.269 -13.007 183 3HG1 VAL 24 3HG1 VAL 24 34.427 23.252 -11.664 184 1HG2 VAL 24 1HG2 VAL 24 36.062 25.074 -11.021 185 2HG2 VAL 24 2HG2 VAL 24 35.424 26.299 -12.150 186 3HG2 VAL 24 3HG2 VAL 24 35.465 26.624 -10.407 187 H THR 25 H THR 25 30.817 25.692 -12.936 188 HA THR 25 HA THR 25 28.840 24.663 -10.936 189 HB THR 25 HB THR 25 27.093 25.715 -12.312 190 HG1 THR 25 HG1 THR 25 27.612 27.609 -13.447 191 1HG2 THR 25 1HG2 THR 25 28.718 27.813 -10.760 192 2HG2 THR 25 2HG2 THR 25 27.002 27.968 -11.225 193 3HG2 THR 25 3HG2 THR 25 27.501 26.711 -10.061 194 H ILE 26 H ILE 26 29.139 22.735 -11.618 195 HA ILE 26 HA ILE 26 29.538 21.684 -14.196 196 HB ILE 26 HB ILE 26 30.074 20.889 -11.781 197 1HG1 ILE 26 2HG1 ILE 26 29.171 18.376 -13.336 198 2HG1 ILE 26 1HG1 ILE 26 30.286 19.434 -14.107 199 1HG2 ILE 26 1HG2 ILE 26 27.739 20.729 -10.768 200 2HG2 ILE 26 2HG2 ILE 26 28.674 19.216 -10.584 201 3HG2 ILE 26 3HG2 ILE 26 27.398 19.317 -11.817 202 1HD1 ILE 26 1HD1 ILE 26 31.888 19.324 -12.232 203 2HD1 ILE 26 2HD1 ILE 26 30.790 18.299 -11.306 204 3HD1 ILE 26 3HD1 ILE 26 31.522 17.668 -12.820 205 H ARG 27 H ARG 27 28.161 19.907 -15.206 206 HA ARG 27 HA ARG 27 25.230 20.159 -15.050 207 1HB ARG 27 2HB ARG 27 25.626 21.806 -16.735 208 2HB ARG 27 1HB ARG 27 26.605 20.632 -17.716 209 1HG ARG 27 1HG ARG 27 24.710 19.343 -18.146 210 2HG ARG 27 2HG ARG 27 23.655 20.357 -17.130 211 1HD ARG 27 2HD ARG 27 25.087 21.415 -19.675 212 2HD ARG 27 1HD ARG 27 23.516 20.624 -19.731 213 HE ARG 27 HE ARG 27 23.306 22.763 -17.784 214 1HH1 ARG 27 1HH2 ARG 27 23.622 22.507 -21.364 215 2HH1 ARG 27 2HH2 ARG 27 22.785 24.131 -21.530 216 1HH2 ARG 27 2HH1 ARG 27 22.389 24.559 -18.146 217 2HH2 ARG 27 1HH1 ARG 27 22.143 25.198 -19.849 218 H CYS 28 H CYS 28 24.821 18.377 -15.098 219 HA CYS 28 HA CYS 28 26.491 15.949 -16.038 220 1HB CYS 28 1HB CYS 28 25.760 15.781 -13.621 221 2HB CYS 28 2HB CYS 28 24.067 15.662 -14.151 222 H GLU 29 H GLU 29 25.847 15.099 -17.894 223 HA GLU 29 HA GLU 29 23.491 16.186 -19.364 224 1HB GLU 29 1HB GLU 29 25.750 14.281 -20.223 225 2HB GLU 29 2HB GLU 29 24.460 14.696 -21.320 226 1HG GLU 29 2HG GLU 29 26.310 16.820 -20.099 227 2HG GLU 29 1HG GLU 29 26.646 15.967 -21.603 Start of MODEL 34 1 1H SER 1 1H SER 1 25.204 9.747 -18.577 2 2H SER 1 2H SER 1 24.529 9.161 -17.188 3 3H SER 1 3H SER 1 26.068 8.729 -17.604 4 HA SER 1 HA SER 1 25.143 11.450 -16.866 5 1HB SER 1 1HB SER 1 26.500 11.151 -14.812 6 2HB SER 1 2HB SER 1 25.207 9.947 -14.931 7 HG SER 1 HG SER 1 26.761 8.488 -15.773 8 H LYS 2 H LYS 2 26.451 13.005 -17.585 9 HA LYS 2 HA LYS 2 29.406 12.582 -18.111 10 1HB LYS 2 1HB LYS 2 27.582 13.724 -20.307 11 2HB LYS 2 2HB LYS 2 29.342 13.830 -20.304 12 1HG LYS 2 1HG LYS 2 29.530 11.326 -20.403 13 2HG LYS 2 2HG LYS 2 27.772 11.195 -20.424 14 1HD LYS 2 2HD LYS 2 27.712 12.512 -22.613 15 2HD LYS 2 1HD LYS 2 29.466 12.606 -22.570 16 1HE LYS 2 2HE LYS 2 29.065 10.873 -24.080 17 2HE LYS 2 1HE LYS 2 29.524 9.993 -22.632 18 1HZ LYS 2 1HZ LYS 2 27.576 9.028 -23.702 19 2HZ LYS 2 2HZ LYS 2 27.120 9.606 -22.223 20 3HZ LYS 2 3HZ LYS 2 26.726 10.440 -23.594 21 H TYR 3 H TYR 3 30.462 14.352 -17.425 22 HA TYR 3 HA TYR 3 28.882 16.702 -16.351 23 1HB TYR 3 1HB TYR 3 30.734 17.459 -15.164 24 2HB TYR 3 2HB TYR 3 30.396 15.835 -14.715 25 HD1 TYR 3 HD1 TYR 3 32.917 18.114 -16.195 26 HD2 TYR 3 HD2 TYR 3 32.090 13.977 -15.359 27 HE1 TYR 3 HE1 TYR 3 35.273 17.578 -16.425 28 HE2 TYR 3 HE2 TYR 3 34.487 13.506 -15.514 29 HH TYR 3 HH TYR 3 36.829 16.028 -16.313 30 H GLU 4 H GLU 4 28.960 18.655 -17.211 31 HA GLU 4 HA GLU 4 31.286 19.474 -19.093 32 1HB GLU 4 2HB GLU 4 29.719 19.374 -20.683 33 2HB GLU 4 1HB GLU 4 28.339 19.646 -19.658 34 1HG GLU 4 2HG GLU 4 28.910 22.140 -19.624 35 2HG GLU 4 1HG GLU 4 30.215 21.825 -20.765 36 H TYR 5 H TYR 5 32.542 20.403 -17.572 37 HA TYR 5 HA TYR 5 31.296 22.337 -15.587 38 1HB TYR 5 1HB TYR 5 32.381 21.667 -13.769 39 2HB TYR 5 2HB TYR 5 32.090 20.118 -14.494 40 HD1 TYR 5 HD1 TYR 5 34.009 20.929 -12.186 41 HD2 TYR 5 HD2 TYR 5 34.701 19.983 -16.316 42 HE1 TYR 5 HE1 TYR 5 36.344 20.554 -11.715 43 HE2 TYR 5 HE2 TYR 5 37.049 19.507 -15.761 44 HH TYR 5 HH TYR 5 38.295 19.888 -12.489 45 H THR 6 H THR 6 31.943 24.109 -15.796 46 HA THR 6 HA THR 6 34.205 24.732 -17.738 47 HB THR 6 HB THR 6 31.942 26.690 -16.948 48 HG1 THR 6 HG1 THR 6 30.816 25.863 -18.712 49 1HG2 THR 6 1HG2 THR 6 32.232 27.509 -19.261 50 2HG2 THR 6 2HG2 THR 6 33.846 27.518 -18.443 51 3HG2 THR 6 3HG2 THR 6 33.422 26.228 -19.597 52 H ILE 7 H ILE 7 35.851 25.978 -17.168 53 HA ILE 7 HA ILE 7 36.040 27.102 -14.324 54 HB ILE 7 HB ILE 7 38.170 25.330 -15.673 55 1HG1 ILE 7 2HG1 ILE 7 37.660 23.761 -13.448 56 2HG1 ILE 7 1HG1 ILE 7 36.132 24.611 -13.466 57 1HG2 ILE 7 1HG2 ILE 7 38.117 26.490 -12.818 58 2HG2 ILE 7 2HG2 ILE 7 39.148 27.039 -14.169 59 3HG2 ILE 7 3HG2 ILE 7 39.389 25.417 -13.486 60 1HD1 ILE 7 1HD1 ILE 7 35.731 22.622 -14.466 61 2HD1 ILE 7 2HD1 ILE 7 35.875 23.653 -15.896 62 3HD1 ILE 7 3HD1 ILE 7 37.233 22.585 -15.415 63 HA DPR 8 HA PRO 8 38.530 30.298 -16.345 64 1HB DPR 8 1HB PRO 8 38.000 31.515 -14.476 65 2HB DPR 8 2HB PRO 8 37.268 32.623 -15.656 66 1HG DPR 8 1HG PRO 8 35.804 31.636 -13.547 67 2HG DPR 8 2HG PRO 8 35.052 31.824 -15.157 68 1HD DPR 8 1HD PRO 8 35.868 29.267 -13.798 69 2HD DPR 8 2HD PRO 8 34.687 29.507 -15.106 70 H SER 9 H SER 9 38.539 29.914 -18.508 71 HA SER 9 HA SER 9 36.296 30.955 -20.300 72 1HB SER 9 2HB SER 9 39.320 31.283 -20.796 73 2HB SER 9 1HB SER 9 38.044 31.612 -21.974 74 HG SER 9 HG SER 9 38.301 32.825 -19.421 75 H TYR 10 H TYR 10 37.683 28.233 -19.154 76 HA TYR 10 HA TYR 10 37.880 26.811 -21.855 77 1HB TYR 10 1HB TYR 10 39.868 27.101 -19.960 78 2HB TYR 10 2HB TYR 10 39.084 25.756 -19.216 79 HD1 TYR 10 HD1 TYR 10 41.077 26.917 -22.107 80 HD2 TYR 10 HD2 TYR 10 39.039 23.506 -20.458 81 HE1 TYR 10 HE1 TYR 10 42.291 25.431 -23.618 82 HE2 TYR 10 HE2 TYR 10 40.285 22.051 -21.977 83 HH TYR 10 HH TYR 10 42.634 23.363 -24.288 84 H THR 11 H THR 11 36.347 25.272 -22.269 85 HA THR 11 HA THR 11 34.434 24.421 -20.092 86 HB THR 11 HB THR 11 34.256 23.846 -23.099 87 HG1 THR 11 HG1 THR 11 33.272 26.113 -21.711 88 1HG2 THR 11 1HG2 THR 11 31.809 23.756 -22.792 89 2HG2 THR 11 2HG2 THR 11 31.937 24.368 -21.120 90 3HG2 THR 11 3HG2 THR 11 32.510 22.739 -21.505 91 H PHE 12 H PHE 12 34.913 22.655 -19.137 92 HA PHE 12 HA PHE 12 36.782 20.509 -20.405 93 1HB PHE 12 2HB PHE 12 36.296 21.123 -17.454 94 2HB PHE 12 1HB PHE 12 37.109 19.688 -18.012 95 HD1 PHE 12 HD1 PHE 12 37.437 23.401 -17.681 96 HD2 PHE 12 HD2 PHE 12 39.468 19.792 -18.876 97 HE1 PHE 12 HE1 PHE 12 39.583 24.495 -17.426 98 HE2 PHE 12 HE2 PHE 12 41.591 20.953 -18.663 99 HZ PHE 12 HZ PHE 12 41.663 23.300 -17.906 100 H ARG 13 H ARG 13 35.527 18.846 -21.143 101 HA ARG 13 HA ARG 13 32.936 18.125 -19.688 102 1HB ARG 13 1HB ARG 13 33.040 18.173 -22.738 103 2HB ARG 13 2HB ARG 13 31.650 18.011 -21.648 104 1HG ARG 13 2HG ARG 13 31.907 20.405 -21.021 105 2HG ARG 13 1HG ARG 13 33.262 20.562 -22.103 106 1HD ARG 13 2HD ARG 13 30.444 19.774 -23.087 107 2HD ARG 13 1HD ARG 13 31.019 21.438 -22.952 108 HE ARG 13 HE ARG 13 32.992 20.213 -24.567 109 1HH1 ARG 13 1HH2 ARG 13 29.438 20.636 -24.977 110 2HH1 ARG 13 2HH2 ARG 13 29.670 20.616 -26.797 111 1HH2 ARG 13 1HH1 ARG 13 33.074 20.211 -26.614 112 2HH2 ARG 13 2HH1 ARG 13 31.568 20.393 -27.646 113 H GLY 14 H GLY 14 32.890 16.046 -19.160 114 1HA GLY 14 2HA GLY 14 33.770 13.827 -20.946 115 2HA GLY 14 1HA GLY 14 34.925 14.109 -19.652 116 HA PRO 15 HA PRO 15 31.250 11.370 -18.141 117 1HB PRO 15 2HB PRO 15 32.143 8.799 -18.070 118 2HB PRO 15 1HB PRO 15 31.633 9.611 -19.565 119 1HG PRO 15 2HG PRO 15 34.458 9.244 -18.491 120 2HG PRO 15 1HG PRO 15 33.850 8.853 -20.136 121 1HD PRO 15 2HD PRO 15 35.145 11.267 -19.537 122 2HD PRO 15 1HD PRO 15 33.855 11.180 -20.766 123 H GLY 16 H GLY 16 30.877 10.215 -16.192 124 1HA GLY 16 1HA GLY 16 31.064 9.782 -13.797 125 2HA GLY 16 2HA GLY 16 32.792 10.097 -13.926 126 H CYS 17 H CYS 17 29.717 11.491 -13.144 127 HA CYS 17 HA CYS 17 30.776 14.339 -13.057 128 1HB CYS 17 1HB CYS 17 28.736 15.113 -13.379 129 2HB CYS 17 2HB CYS 17 28.798 13.725 -14.439 130 HA PRO 18 HA PRO 18 30.584 14.006 -8.380 131 1HB PRO 18 2HB PRO 18 32.955 15.126 -7.681 132 2HB PRO 18 1HB PRO 18 32.861 13.488 -8.361 133 1HG PRO 18 1HG PRO 18 33.623 16.079 -9.803 134 2HG PRO 18 2HG PRO 18 34.477 14.506 -9.854 135 1HD PRO 18 2HD PRO 18 32.557 15.314 -11.782 136 2HD PRO 18 1HD PRO 18 32.900 13.614 -11.379 137 H THR 19 H THR 19 30.835 15.845 -6.678 138 HA THR 19 HA THR 19 29.199 18.214 -7.356 139 HB THR 19 HB THR 19 30.085 18.895 -4.934 140 HG1 THR 19 HG1 THR 19 30.618 16.124 -4.939 141 1HG2 THR 19 1HG2 THR 19 28.412 17.639 -3.770 142 2HG2 THR 19 2HG2 THR 19 27.820 18.369 -5.293 143 3HG2 THR 19 3HG2 THR 19 28.165 16.608 -5.240 144 H VAL 20 H VAL 20 29.786 20.427 -6.926 145 HA VAL 20 HA VAL 20 32.650 21.065 -7.459 146 HB VAL 20 HB VAL 20 32.105 22.825 -9.186 147 1HG1 VAL 20 1HG1 VAL 20 32.061 21.378 -11.171 148 2HG1 VAL 20 2HG1 VAL 20 33.098 20.700 -9.899 149 3HG1 VAL 20 3HG1 VAL 20 31.478 20.017 -10.171 150 1HG2 VAL 20 1HG2 VAL 20 30.093 22.948 -10.523 151 2HG2 VAL 20 2HG2 VAL 20 29.334 21.583 -9.645 152 3HG2 VAL 20 3HG2 VAL 20 29.632 23.131 -8.820 153 H LYS 21 H LYS 21 33.354 23.296 -7.165 154 HA LYS 21 HA LYS 21 32.219 24.372 -4.607 155 1HB LYS 21 1HB LYS 21 34.311 25.610 -4.459 156 2HB LYS 21 2HB LYS 21 34.539 23.872 -4.590 157 1HG LYS 21 2HG LYS 21 36.365 24.940 -5.553 158 2HG LYS 21 1HG LYS 21 35.508 24.114 -6.845 159 1HD LYS 21 2HD LYS 21 34.601 26.162 -7.746 160 2HD LYS 21 1HD LYS 21 35.128 27.125 -6.364 161 1HE LYS 21 1HE LYS 21 37.577 26.636 -7.007 162 2HE LYS 21 2HE LYS 21 36.985 25.785 -8.445 163 1HZ LYS 21 1HZ LYS 21 35.906 27.870 -9.142 164 2HZ LYS 21 2HZ LYS 21 36.454 28.651 -7.794 165 3HZ LYS 21 3HZ LYS 21 37.527 28.102 -8.925 166 HA PRO 22 HA PRO 22 30.284 28.036 -6.465 167 1HB PRO 22 1HB PRO 22 31.771 29.950 -4.587 168 2HB PRO 22 2HB PRO 22 30.036 29.837 -4.961 169 1HG PRO 22 1HG PRO 22 30.971 28.779 -2.651 170 2HG PRO 22 2HG PRO 22 29.793 27.839 -3.610 171 1HD PRO 22 1HD PRO 22 32.853 27.513 -3.583 172 2HD PRO 22 2HD PRO 22 31.600 26.246 -3.424 173 H DAL 23 H ALA 23 30.749 28.932 -8.390 174 HA DAL 23 HA ALA 23 33.644 29.598 -9.140 175 1HB DAL 23 1HB ALA 23 31.192 31.226 -10.020 176 2HB DAL 23 2HB ALA 23 32.865 31.452 -10.595 177 3HB DAL 23 3HB ALA 23 32.462 31.760 -8.886 178 H VAL 24 H VAL 24 33.240 27.194 -9.420 179 HA VAL 24 HA VAL 24 32.826 26.558 -12.309 180 HB VAL 24 HB VAL 24 33.546 24.692 -9.998 181 1HG1 VAL 24 1HG1 VAL 24 33.960 24.132 -13.040 182 2HG1 VAL 24 2HG1 VAL 24 32.699 23.410 -12.022 183 3HG1 VAL 24 3HG1 VAL 24 34.396 23.029 -11.704 184 1HG2 VAL 24 1HG2 VAL 24 35.979 24.740 -10.710 185 2HG2 VAL 24 2HG2 VAL 24 35.360 26.316 -10.194 186 3HG2 VAL 24 3HG2 VAL 24 35.563 26.006 -11.916 187 H THR 25 H THR 25 30.807 25.793 -13.072 188 HA THR 25 HA THR 25 28.751 24.724 -11.153 189 HB THR 25 HB THR 25 27.090 25.891 -12.526 190 HG1 THR 25 HG1 THR 25 28.451 26.503 -14.207 191 1HG2 THR 25 1HG2 THR 25 28.776 27.877 -10.896 192 2HG2 THR 25 2HG2 THR 25 27.502 26.811 -10.245 193 3HG2 THR 25 3HG2 THR 25 27.078 28.116 -11.386 194 H ILE 26 H ILE 26 29.034 22.831 -11.862 195 HA ILE 26 HA ILE 26 29.492 21.782 -14.419 196 HB ILE 26 HB ILE 26 29.885 20.943 -11.988 197 1HG1 ILE 26 1HG1 ILE 26 28.922 18.449 -13.537 198 2HG1 ILE 26 2HG1 ILE 26 30.059 19.455 -14.333 199 1HG2 ILE 26 1HG2 ILE 26 28.346 19.329 -10.860 200 2HG2 ILE 26 2HG2 ILE 26 27.523 20.910 -11.071 201 3HG2 ILE 26 3HG2 ILE 26 27.130 19.536 -12.147 202 1HD1 ILE 26 1HD1 ILE 26 31.257 17.699 -13.030 203 2HD1 ILE 26 2HD1 ILE 26 30.527 18.346 -11.517 204 3HD1 ILE 26 3HD1 ILE 26 31.660 19.345 -12.440 205 H ARG 27 H ARG 27 28.206 20.179 -15.607 206 HA ARG 27 HA ARG 27 25.204 20.289 -15.387 207 1HB ARG 27 2HB ARG 27 25.567 21.873 -17.074 208 2HB ARG 27 1HB ARG 27 26.541 20.664 -18.045 209 1HG ARG 27 2HG ARG 27 24.624 19.371 -18.404 210 2HG ARG 27 1HG ARG 27 23.599 20.427 -17.402 211 1HD ARG 27 1HD ARG 27 24.975 21.385 -20.016 212 2HD ARG 27 2HD ARG 27 23.395 20.613 -20.002 213 HE ARG 27 HE ARG 27 23.251 22.814 -18.127 214 1HH1 ARG 27 2HH2 ARG 27 23.502 22.444 -21.701 215 2HH1 ARG 27 1HH2 ARG 27 22.679 24.072 -21.903 216 1HH2 ARG 27 2HH1 ARG 27 22.348 24.609 -18.528 217 2HH2 ARG 27 1HH1 ARG 27 22.080 25.197 -20.245 218 H CYS 28 H CYS 28 25.121 18.562 -14.923 219 HA CYS 28 HA CYS 28 26.702 16.075 -15.862 220 1HB CYS 28 1HB CYS 28 26.829 16.199 -13.491 221 2HB CYS 28 2HB CYS 28 25.077 16.271 -13.256 222 H GLU 29 H GLU 29 25.700 15.218 -17.495 223 HA GLU 29 HA GLU 29 23.031 16.028 -18.396 224 1HB GLU 29 2HB GLU 29 25.061 14.047 -19.594 225 2HB GLU 29 1HB GLU 29 23.541 14.343 -20.392 226 1HG GLU 29 2HG GLU 29 25.561 16.588 -19.849 227 2HG GLU 29 1HG GLU 29 25.554 15.593 -21.302 Start of MODEL 35 1 1H SER 1 1H SER 1 26.554 8.304 -17.467 2 2H SER 1 2H SER 1 24.933 8.577 -17.304 3 3H SER 1 3H SER 1 25.730 9.115 -18.648 4 HA SER 1 HA SER 1 25.242 10.951 -17.149 5 1HB SER 1 2HB SER 1 26.967 9.308 -15.203 6 2HB SER 1 1HB SER 1 26.449 10.979 -14.922 7 HG SER 1 HG SER 1 24.747 8.756 -15.397 8 H LYS 2 H LYS 2 26.481 12.582 -17.814 9 HA LYS 2 HA LYS 2 29.495 12.370 -18.036 10 1HB LYS 2 2HB LYS 2 29.687 13.337 -20.215 11 2HB LYS 2 1HB LYS 2 28.955 11.747 -20.224 12 1HG LYS 2 2HG LYS 2 26.690 12.785 -20.712 13 2HG LYS 2 1HG LYS 2 27.428 14.385 -20.705 14 1HD LYS 2 1HD LYS 2 28.915 13.683 -22.665 15 2HD LYS 2 2HD LYS 2 28.134 12.109 -22.651 16 1HE LYS 2 2HE LYS 2 27.057 13.218 -24.399 17 2HE LYS 2 1HE LYS 2 25.865 13.324 -23.113 18 1HZ LYS 2 1HZ LYS 2 26.649 15.632 -22.711 19 2HZ LYS 2 2HZ LYS 2 27.754 15.496 -23.932 20 3HZ LYS 2 3HZ LYS 2 26.138 15.434 -24.270 21 H TYR 3 H TYR 3 30.469 14.155 -17.303 22 HA TYR 3 HA TYR 3 28.759 16.474 -16.363 23 1HB TYR 3 2HB TYR 3 30.433 17.197 -14.969 24 2HB TYR 3 1HB TYR 3 30.113 15.532 -14.636 25 HD1 TYR 3 HD1 TYR 3 32.655 17.971 -15.965 26 HD2 TYR 3 HD2 TYR 3 31.984 13.843 -14.965 27 HE1 TYR 3 HE1 TYR 3 35.041 17.531 -16.059 28 HE2 TYR 3 HE2 TYR 3 34.396 13.473 -14.987 29 HH TYR 3 HH TYR 3 36.383 14.334 -15.348 30 H GLU 4 H GLU 4 28.909 18.453 -17.162 31 HA GLU 4 HA GLU 4 31.285 19.256 -18.983 32 1HB GLU 4 1HB GLU 4 29.490 18.899 -20.442 33 2HB GLU 4 2HB GLU 4 28.316 19.794 -19.480 34 1HG GLU 4 2HG GLU 4 29.517 21.934 -19.995 35 2HG GLU 4 1HG GLU 4 30.718 21.031 -20.913 36 H TYR 5 H TYR 5 32.464 20.249 -17.457 37 HA TYR 5 HA TYR 5 31.130 22.257 -15.595 38 1HB TYR 5 1HB TYR 5 32.343 21.818 -13.776 39 2HB TYR 5 2HB TYR 5 32.041 20.213 -14.347 40 HD1 TYR 5 HD1 TYR 5 34.560 19.965 -16.289 41 HD2 TYR 5 HD2 TYR 5 34.066 21.241 -12.221 42 HE1 TYR 5 HE1 TYR 5 36.962 19.658 -15.847 43 HE2 TYR 5 HE2 TYR 5 36.430 20.976 -11.851 44 HH TYR 5 HH TYR 5 38.369 20.345 -12.689 45 H THR 6 H THR 6 31.630 24.058 -16.023 46 HA THR 6 HA THR 6 33.812 24.647 -18.063 47 HB THR 6 HB THR 6 31.471 26.541 -17.339 48 HG1 THR 6 HG1 THR 6 31.409 24.361 -19.145 49 1HG2 THR 6 1HG2 THR 6 33.241 27.301 -19.036 50 2HG2 THR 6 2HG2 THR 6 31.576 27.136 -19.730 51 3HG2 THR 6 3HG2 THR 6 32.800 25.888 -20.023 52 H ILE 7 H ILE 7 35.512 25.940 -17.567 53 HA ILE 7 HA ILE 7 35.584 27.458 -14.915 54 HB ILE 7 HB ILE 7 37.753 25.456 -15.801 55 1HG1 ILE 7 1HG1 ILE 7 37.069 24.250 -13.419 56 2HG1 ILE 7 2HG1 ILE 7 35.562 25.107 -13.673 57 1HG2 ILE 7 1HG2 ILE 7 38.661 27.370 -14.539 58 2HG2 ILE 7 2HG2 ILE 7 37.548 27.041 -13.179 59 3HG2 ILE 7 3HG2 ILE 7 38.839 25.869 -13.606 60 1HD1 ILE 7 1HD1 ILE 7 35.603 23.757 -16.018 61 2HD1 ILE 7 2HD1 ILE 7 35.074 23.081 -14.495 62 3HD1 ILE 7 3HD1 ILE 7 36.721 22.704 -15.096 63 HA DPR 8 HA PRO 8 38.245 30.229 -17.261 64 1HB DPR 8 2HB PRO 8 37.468 31.888 -15.888 65 2HB DPR 8 1HB PRO 8 36.843 32.611 -17.381 66 1HG DPR 8 1HG PRO 8 35.170 32.126 -15.268 67 2HG DPR 8 2HG PRO 8 34.613 31.790 -16.933 68 1HD DPR 8 1HD PRO 8 35.477 29.789 -14.828 69 2HD DPR 8 2HD PRO 8 34.324 29.581 -16.165 70 H SER 9 H SER 9 38.773 29.934 -19.273 71 HA SER 9 HA SER 9 37.015 30.600 -21.641 72 1HB SER 9 1HB SER 9 39.027 30.198 -22.988 73 2HB SER 9 2HB SER 9 39.376 31.345 -21.692 74 HG SER 9 HG SER 9 40.954 29.729 -21.892 75 H TYR 10 H TYR 10 37.715 27.709 -19.780 76 HA TYR 10 HA TYR 10 37.484 25.934 -22.265 77 1HB TYR 10 1HB TYR 10 38.737 25.573 -19.469 78 2HB TYR 10 2HB TYR 10 38.110 24.164 -20.224 79 HD1 TYR 10 HD1 TYR 10 39.025 23.225 -22.346 80 HD2 TYR 10 HD2 TYR 10 40.837 26.653 -20.460 81 HE1 TYR 10 HE1 TYR 10 41.074 22.800 -23.533 82 HE2 TYR 10 HE2 TYR 10 42.882 26.192 -21.672 83 HH TYR 10 HH TYR 10 43.930 24.900 -23.122 84 H THR 11 H THR 11 35.837 24.581 -22.572 85 HA THR 11 HA THR 11 33.752 24.080 -20.390 86 HB THR 11 HB THR 11 33.607 23.508 -23.400 87 HG1 THR 11 HG1 THR 11 32.350 25.403 -23.526 88 1HG2 THR 11 1HG2 THR 11 31.371 23.696 -21.287 89 2HG2 THR 11 2HG2 THR 11 31.077 23.703 -23.049 90 3HG2 THR 11 3HG2 THR 11 31.842 22.293 -22.291 91 H PHE 12 H PHE 12 34.599 22.502 -19.286 92 HA PHE 12 HA PHE 12 36.508 20.426 -20.559 93 1HB PHE 12 2HB PHE 12 35.984 21.041 -17.630 94 2HB PHE 12 1HB PHE 12 36.896 19.659 -18.138 95 HD1 PHE 12 HD1 PHE 12 39.185 19.939 -19.258 96 HD2 PHE 12 HD2 PHE 12 37.059 23.295 -17.599 97 HE1 PHE 12 HE1 PHE 12 41.273 21.114 -18.876 98 HE2 PHE 12 HE2 PHE 12 39.173 24.393 -17.164 99 HZ PHE 12 HZ PHE 12 41.276 23.327 -17.767 100 H ARG 13 H ARG 13 35.127 18.866 -21.420 101 HA ARG 13 HA ARG 13 32.755 17.878 -19.834 102 1HB ARG 13 1HB ARG 13 32.421 17.362 -22.714 103 2HB ARG 13 2HB ARG 13 31.394 18.072 -21.506 104 1HG ARG 13 2HG ARG 13 31.394 19.720 -23.008 105 2HG ARG 13 1HG ARG 13 32.599 20.271 -21.832 106 1HD ARG 13 1HD ARG 13 34.471 19.584 -23.332 107 2HD ARG 13 2HD ARG 13 33.327 18.904 -24.503 108 HE ARG 13 HE ARG 13 32.705 21.738 -23.956 109 1HH1 ARG 13 2HH2 ARG 13 34.909 19.736 -25.987 110 2HH1 ARG 13 1HH2 ARG 13 35.050 21.132 -27.169 111 1HH2 ARG 13 2HH1 ARG 13 32.975 23.197 -25.375 112 2HH2 ARG 13 1HH1 ARG 13 34.040 22.934 -26.846 113 H GLY 14 H GLY 14 32.877 15.880 -19.124 114 1HA GLY 14 1HA GLY 14 33.984 13.586 -20.696 115 2HA GLY 14 2HA GLY 14 35.047 14.079 -19.384 116 HA PRO 15 HA PRO 15 31.398 11.283 -17.825 117 1HB PRO 15 2HB PRO 15 32.278 8.703 -17.722 118 2HB PRO 15 1HB PRO 15 31.726 9.487 -19.217 119 1HG PRO 15 2HG PRO 15 34.584 9.129 -18.223 120 2HG PRO 15 1HG PRO 15 33.924 8.703 -19.838 121 1HD PRO 15 1HD PRO 15 35.244 11.121 -19.347 122 2HD PRO 15 2HD PRO 15 33.902 11.018 -20.517 123 H GLY 16 H GLY 16 31.067 10.123 -15.855 124 1HA GLY 16 2HA GLY 16 31.297 9.699 -13.473 125 2HA GLY 16 1HA GLY 16 33.024 9.992 -13.648 126 H CYS 17 H CYS 17 29.998 11.433 -12.790 127 HA CYS 17 HA CYS 17 30.773 14.236 -12.952 128 1HB CYS 17 1HB CYS 17 28.287 12.977 -11.704 129 2HB CYS 17 2HB CYS 17 28.539 14.702 -12.005 130 HA PRO 18 HA PRO 18 32.297 14.409 -8.484 131 1HB PRO 18 1HB PRO 18 34.195 16.365 -8.703 132 2HB PRO 18 2HB PRO 18 34.468 14.712 -9.282 133 1HG PRO 18 2HG PRO 18 33.680 17.175 -10.934 134 2HG PRO 18 1HG PRO 18 34.983 15.998 -11.288 135 1HD PRO 18 2HD PRO 18 32.384 15.761 -12.405 136 2HD PRO 18 1HD PRO 18 33.425 14.376 -12.039 137 H THR 19 H THR 19 32.382 16.265 -6.912 138 HA THR 19 HA THR 19 30.094 18.222 -7.247 139 HB THR 19 HB THR 19 31.161 18.810 -4.767 140 HG1 THR 19 HG1 THR 19 32.503 16.980 -4.838 141 1HG2 THR 19 1HG2 THR 19 29.275 17.702 -3.734 142 2HG2 THR 19 2HG2 THR 19 28.831 18.664 -5.172 143 3HG2 THR 19 3HG2 THR 19 28.909 16.883 -5.304 144 H VAL 20 H VAL 20 30.326 20.446 -6.903 145 HA VAL 20 HA VAL 20 33.027 21.486 -7.748 146 HB VAL 20 HB VAL 20 31.959 23.042 -9.410 147 1HG1 VAL 20 1HG2 VAL 20 31.857 21.516 -11.302 148 2HG1 VAL 20 2HG2 VAL 20 33.126 21.008 -10.174 149 3HG1 VAL 20 3HG2 VAL 20 31.577 20.131 -10.210 150 1HG2 VAL 20 1HG1 VAL 20 29.363 21.412 -9.349 151 2HG2 VAL 20 2HG1 VAL 20 29.563 23.046 -8.670 152 3HG2 VAL 20 3HG1 VAL 20 29.764 22.791 -10.415 153 H LYS 21 H LYS 21 33.534 23.596 -7.597 154 HA LYS 21 HA LYS 21 32.963 24.768 -4.989 155 1HB LYS 21 2HB LYS 21 34.954 25.155 -7.269 156 2HB LYS 21 1HB LYS 21 34.498 26.664 -6.599 157 1HG LYS 21 1HG LYS 21 36.513 25.989 -5.650 158 2HG LYS 21 2HG LYS 21 35.311 26.073 -4.371 159 1HD LYS 21 1HD LYS 21 35.115 23.612 -4.333 160 2HD LYS 21 2HD LYS 21 36.254 23.475 -5.670 161 1HE LYS 21 1HE LYS 21 37.586 22.943 -3.793 162 2HE LYS 21 2HE LYS 21 38.048 24.609 -4.117 163 1HZ LYS 21 1HZ LYS 21 36.510 25.287 -2.312 164 2HZ LYS 21 2HZ LYS 21 36.100 23.711 -2.032 165 3HZ LYS 21 3HZ LYS 21 37.646 24.223 -1.759 166 HA PRO 22 HA PRO 22 29.949 28.086 -6.027 167 1HB PRO 22 2HB PRO 22 30.614 30.225 -4.417 168 2HB PRO 22 1HB PRO 22 29.869 28.718 -3.846 169 1HG PRO 22 2HG PRO 22 32.783 29.544 -3.647 170 2HG PRO 22 1HG PRO 22 31.776 28.732 -2.418 171 1HD PRO 22 1HD PRO 22 33.572 27.414 -4.183 172 2HD PRO 22 2HD PRO 22 32.211 26.583 -3.417 173 H DAL 23 H ALA 23 30.215 28.673 -8.091 174 HA DAL 23 HA ALA 23 32.782 29.926 -9.124 175 1HB DAL 23 1HB ALA 23 31.602 31.625 -10.502 176 2HB DAL 23 2HB ALA 23 30.035 31.143 -9.799 177 3HB DAL 23 3HB ALA 23 31.285 31.887 -8.765 178 H VAL 24 H VAL 24 32.704 27.453 -9.390 179 HA VAL 24 HA VAL 24 32.254 26.806 -12.261 180 HB VAL 24 HB VAL 24 33.234 25.007 -9.997 181 1HG1 VAL 24 1HG2 VAL 24 34.126 23.390 -11.727 182 2HG1 VAL 24 2HG2 VAL 24 33.509 24.424 -13.049 183 3HG1 VAL 24 3HG2 VAL 24 32.387 23.618 -11.942 184 1HG2 VAL 24 1HG1 VAL 24 34.994 26.466 -12.064 185 2HG2 VAL 24 2HG1 VAL 24 34.893 26.790 -10.329 186 3HG2 VAL 24 3HG1 VAL 24 35.606 25.267 -10.878 187 H THR 25 H THR 25 30.305 25.885 -13.016 188 HA THR 25 HA THR 25 28.365 24.618 -11.097 189 HB THR 25 HB THR 25 26.599 25.646 -12.454 190 HG1 THR 25 HG1 THR 25 27.049 27.598 -13.515 191 1HG2 THR 25 1HG2 THR 25 26.398 27.852 -11.295 192 2HG2 THR 25 2HG2 THR 25 28.112 27.756 -10.810 193 3HG2 THR 25 3HG2 THR 25 26.936 26.578 -10.167 194 H ILE 26 H ILE 26 28.799 22.760 -11.827 195 HA ILE 26 HA ILE 26 29.319 21.752 -14.388 196 HB ILE 26 HB ILE 26 29.766 20.942 -11.964 197 1HG1 ILE 26 1HG1 ILE 26 28.890 18.417 -13.519 198 2HG1 ILE 26 2HG1 ILE 26 30.030 19.456 -14.274 199 1HG2 ILE 26 1HG2 ILE 26 28.295 19.269 -10.806 200 2HG2 ILE 26 2HG2 ILE 26 27.067 19.413 -12.090 201 3HG2 ILE 26 3HG2 ILE 26 27.403 20.810 -11.027 202 1HD1 ILE 26 1HD1 ILE 26 30.454 18.342 -11.454 203 2HD1 ILE 26 2HD1 ILE 26 31.592 19.343 -12.371 204 3HD1 ILE 26 3HD1 ILE 26 31.210 17.697 -12.958 205 H ARG 27 H ARG 27 28.133 20.068 -15.578 206 HA ARG 27 HA ARG 27 25.121 20.004 -15.368 207 1HB ARG 27 1HB ARG 27 25.399 21.629 -17.015 208 2HB ARG 27 2HB ARG 27 26.447 20.496 -18.003 209 1HG ARG 27 1HG ARG 27 24.589 19.106 -18.394 210 2HG ARG 27 2HG ARG 27 23.512 20.114 -17.396 211 1HD ARG 27 1HD ARG 27 24.885 21.141 -19.989 212 2HD ARG 27 2HD ARG 27 23.337 20.307 -20.002 213 HE ARG 27 HE ARG 27 22.834 22.365 -18.169 214 1HH1 ARG 27 2HH1 ARG 27 24.088 22.509 -21.543 215 2HH1 ARG 27 1HH1 ARG 27 23.355 24.182 -21.719 216 1HH2 ARG 27 1HH2 ARG 27 22.080 24.235 -18.531 217 2HH2 ARG 27 2HH2 ARG 27 22.308 25.078 -20.145 218 H CYS 28 H CYS 28 25.173 18.285 -14.863 219 HA CYS 28 HA CYS 28 26.714 15.824 -15.952 220 1HB CYS 28 2HB CYS 28 26.981 16.025 -13.516 221 2HB CYS 28 1HB CYS 28 25.225 15.832 -13.280 222 H GLU 29 H GLU 29 25.593 15.236 -17.597 223 HA GLU 29 HA GLU 29 22.737 15.893 -18.046 224 1HB GLU 29 1HB GLU 29 24.765 14.437 -19.831 225 2HB GLU 29 2HB GLU 29 23.121 14.693 -20.358 226 1HG GLU 29 1HG GLU 29 24.991 17.021 -19.651 227 2HG GLU 29 2HG GLU 29 24.857 16.313 -21.258 Start of MODEL 36 1 1H SER 1 1H SER 1 26.362 8.537 -17.983 2 2H SER 1 2H SER 1 25.712 9.447 -19.199 3 3H SER 1 3H SER 1 24.755 8.918 -17.960 4 HA SER 1 HA SER 1 25.200 11.250 -17.677 5 1HB SER 1 1HB SER 1 26.062 11.150 -15.351 6 2HB SER 1 2HB SER 1 24.872 9.879 -15.671 7 HG SER 1 HG SER 1 27.700 9.595 -15.742 8 H LYS 2 H LYS 2 26.585 12.821 -18.174 9 HA LYS 2 HA LYS 2 29.590 12.443 -18.095 10 1HB LYS 2 1HB LYS 2 30.044 13.471 -20.227 11 2HB LYS 2 2HB LYS 2 29.268 11.911 -20.357 12 1HG LYS 2 2HG LYS 2 27.089 13.063 -21.035 13 2HG LYS 2 1HG LYS 2 27.906 14.601 -20.885 14 1HD LYS 2 1HD LYS 2 27.970 14.307 -23.157 15 2HD LYS 2 2HD LYS 2 29.593 13.823 -22.713 16 1HE LYS 2 1HE LYS 2 28.857 11.371 -22.910 17 2HE LYS 2 2HE LYS 2 27.239 11.920 -23.381 18 1HZ LYS 2 1HZ LYS 2 28.251 13.063 -25.292 19 2HZ LYS 2 2HZ LYS 2 29.759 12.552 -24.852 20 3HZ LYS 2 3HZ LYS 2 28.618 11.453 -25.321 21 H TYR 3 H TYR 3 30.532 14.126 -17.187 22 HA TYR 3 HA TYR 3 28.865 16.429 -16.195 23 1HB TYR 3 2HB TYR 3 30.479 16.900 -14.677 24 2HB TYR 3 1HB TYR 3 30.244 15.207 -14.585 25 HD1 TYR 3 HD1 TYR 3 32.734 17.640 -14.288 26 HD2 TYR 3 HD2 TYR 3 32.200 13.877 -16.298 27 HE1 TYR 3 HE1 TYR 3 35.134 17.297 -14.343 28 HE2 TYR 3 HE2 TYR 3 34.632 13.672 -16.482 29 HH TYR 3 HH TYR 3 36.803 16.063 -15.049 30 H GLU 4 H GLU 4 28.923 18.397 -17.141 31 HA GLU 4 HA GLU 4 31.411 19.236 -18.806 32 1HB GLU 4 1HB GLU 4 29.935 19.131 -20.468 33 2HB GLU 4 2HB GLU 4 28.504 19.357 -19.518 34 1HG GLU 4 1HG GLU 4 29.027 21.851 -19.383 35 2HG GLU 4 2HG GLU 4 30.383 21.585 -20.470 36 H TYR 5 H TYR 5 32.593 20.078 -17.205 37 HA TYR 5 HA TYR 5 31.326 22.138 -15.348 38 1HB TYR 5 2HB TYR 5 32.477 21.572 -13.529 39 2HB TYR 5 1HB TYR 5 32.221 19.990 -14.180 40 HD1 TYR 5 HD1 TYR 5 34.306 21.185 -12.055 41 HD2 TYR 5 HD2 TYR 5 34.660 19.669 -16.059 42 HE1 TYR 5 HE1 TYR 5 36.673 20.849 -11.725 43 HE2 TYR 5 HE2 TYR 5 37.049 19.299 -15.661 44 HH TYR 5 HH TYR 5 38.720 19.436 -14.256 45 H THR 6 H THR 6 31.842 23.926 -15.722 46 HA THR 6 HA THR 6 34.057 24.540 -17.708 47 HB THR 6 HB THR 6 31.724 26.440 -16.981 48 HG1 THR 6 HG1 THR 6 30.605 25.468 -18.675 49 1HG2 THR 6 1HG2 THR 6 33.569 27.258 -18.554 50 2HG2 THR 6 2HG2 THR 6 31.943 27.137 -19.341 51 3HG2 THR 6 3HG2 THR 6 33.180 25.889 -19.626 52 H ILE 7 H ILE 7 35.698 25.796 -17.172 53 HA ILE 7 HA ILE 7 35.839 27.081 -14.394 54 HB ILE 7 HB ILE 7 38.027 25.321 -15.679 55 1HG1 ILE 7 2HG1 ILE 7 37.675 23.788 -13.493 56 2HG1 ILE 7 1HG1 ILE 7 36.162 24.644 -13.331 57 1HG2 ILE 7 1HG2 ILE 7 37.927 26.619 -12.878 58 2HG2 ILE 7 2HG2 ILE 7 39.254 25.579 -13.492 59 3HG2 ILE 7 3HG2 ILE 7 38.937 27.155 -14.247 60 1HD1 ILE 7 1HD1 ILE 7 35.344 22.893 -14.441 61 2HD1 ILE 7 2HD1 ILE 7 35.949 23.568 -15.930 62 3HD1 ILE 7 3HD1 ILE 7 36.939 22.360 -15.065 63 HA DPR 8 HA PRO 8 38.188 30.271 -16.591 64 1HB DPR 8 1HB PRO 8 37.620 31.547 -14.769 65 2HB DPR 8 2HB PRO 8 36.845 32.574 -15.995 66 1HG DPR 8 1HG PRO 8 35.422 31.628 -13.837 67 2HG DPR 8 2HG PRO 8 34.661 31.718 -15.450 68 1HD DPR 8 2HD PRO 8 35.568 29.254 -13.983 69 2HD DPR 8 1HD PRO 8 34.382 29.392 -15.301 70 H SER 9 H SER 9 38.168 29.719 -18.728 71 HA SER 9 HA SER 9 35.904 30.645 -20.549 72 1HB SER 9 2HB SER 9 37.519 31.321 -22.247 73 2HB SER 9 1HB SER 9 37.800 32.260 -20.777 74 HG SER 9 HG SER 9 39.461 30.754 -20.255 75 H TYR 10 H TYR 10 37.441 28.011 -19.291 76 HA TYR 10 HA TYR 10 37.602 26.470 -21.925 77 1HB TYR 10 1HB TYR 10 39.601 26.861 -20.065 78 2HB TYR 10 2HB TYR 10 38.846 25.530 -19.261 79 HD1 TYR 10 HD1 TYR 10 38.811 23.241 -20.426 80 HD2 TYR 10 HD2 TYR 10 40.796 26.616 -22.205 81 HE1 TYR 10 HE1 TYR 10 40.069 21.747 -21.901 82 HE2 TYR 10 HE2 TYR 10 42.021 25.093 -23.672 83 HH TYR 10 HH TYR 10 41.559 21.581 -23.512 84 H THR 11 H THR 11 36.065 24.933 -22.268 85 HA THR 11 HA THR 11 34.220 24.081 -20.026 86 HB THR 11 HB THR 11 33.973 23.489 -23.029 87 HG1 THR 11 HG1 THR 11 32.936 25.698 -21.582 88 1HG2 THR 11 1HG2 THR 11 31.517 23.360 -22.620 89 2HG2 THR 11 2HG2 THR 11 32.339 22.257 -21.486 90 3HG2 THR 11 3HG2 THR 11 31.736 23.826 -20.909 91 H PHE 12 H PHE 12 34.691 22.323 -19.094 92 HA PHE 12 HA PHE 12 36.574 20.189 -20.364 93 1HB PHE 12 1HB PHE 12 36.058 20.776 -17.427 94 2HB PHE 12 2HB PHE 12 36.889 19.351 -17.982 95 HD1 PHE 12 HD1 PHE 12 37.129 23.097 -17.731 96 HD2 PHE 12 HD2 PHE 12 39.284 19.494 -18.693 97 HE1 PHE 12 HE1 PHE 12 39.236 24.255 -17.439 98 HE2 PHE 12 HE2 PHE 12 41.371 20.712 -18.441 99 HZ PHE 12 HZ PHE 12 41.362 23.089 -17.781 100 H ARG 13 H ARG 13 35.295 18.659 -21.242 101 HA ARG 13 HA ARG 13 32.675 17.824 -19.886 102 1HB ARG 13 2HB ARG 13 32.930 17.671 -22.895 103 2HB ARG 13 1HB ARG 13 31.504 17.629 -21.833 104 1HG ARG 13 2HG ARG 13 31.653 20.099 -21.549 105 2HG ARG 13 1HG ARG 13 33.105 20.129 -22.542 106 1HD ARG 13 1HD ARG 13 31.720 19.132 -24.499 107 2HD ARG 13 2HD ARG 13 30.280 19.301 -23.486 108 HE ARG 13 HE ARG 13 31.469 21.894 -23.504 109 1HH1 ARG 13 2HH1 ARG 13 30.231 19.763 -26.132 110 2HH1 ARG 13 1HH1 ARG 13 29.875 21.254 -27.141 111 1HH2 ARG 13 1HH2 ARG 13 31.012 23.449 -24.757 112 2HH2 ARG 13 2HH2 ARG 13 30.284 23.174 -26.419 113 H GLY 14 H GLY 14 32.751 15.754 -19.265 114 1HA GLY 14 1HA GLY 14 33.655 13.544 -21.019 115 2HA GLY 14 2HA GLY 14 34.838 13.828 -19.747 116 HA PRO 15 HA PRO 15 31.372 11.128 -17.863 117 1HB PRO 15 1HB PRO 15 32.472 8.698 -17.465 118 2HB PRO 15 2HB PRO 15 32.059 9.291 -19.089 119 1HG PRO 15 1HG PRO 15 34.771 9.279 -17.724 120 2HG PRO 15 2HG PRO 15 34.367 8.671 -19.367 121 1HD PRO 15 1HD PRO 15 35.395 11.266 -18.835 122 2HD PRO 15 2HD PRO 15 34.371 10.907 -20.252 123 H GLY 16 H GLY 16 31.005 10.229 -15.753 124 1HA GLY 16 2HA GLY 16 31.302 9.870 -13.400 125 2HA GLY 16 1HA GLY 16 32.975 10.392 -13.545 126 H CYS 17 H CYS 17 29.983 11.286 -12.440 127 HA CYS 17 HA CYS 17 30.383 14.264 -12.551 128 1HB CYS 17 1HB CYS 17 28.188 13.218 -13.135 129 2HB CYS 17 2HB CYS 17 27.986 12.668 -11.458 130 HA PRO 18 HA PRO 18 31.722 14.374 -8.053 131 1HB PRO 18 2HB PRO 18 33.828 16.091 -8.200 132 2HB PRO 18 1HB PRO 18 33.963 14.392 -8.698 133 1HG PRO 18 1HG PRO 18 33.608 16.850 -10.489 134 2HG PRO 18 2HG PRO 18 34.770 15.505 -10.697 135 1HD PRO 18 2HD PRO 18 32.239 15.596 -11.982 136 2HD PRO 18 1HD PRO 18 33.092 14.086 -11.570 137 H THR 19 H THR 19 31.931 16.388 -6.589 138 HA THR 19 HA THR 19 29.808 18.453 -7.197 139 HB THR 19 HB THR 19 30.700 19.230 -4.775 140 HG1 THR 19 HG1 THR 19 31.186 17.455 -3.500 141 1HG2 THR 19 1HG2 THR 19 28.753 16.964 -5.142 142 2HG2 THR 19 2HG2 THR 19 28.967 17.986 -3.660 143 3HG2 THR 19 3HG2 THR 19 28.433 18.727 -5.195 144 H VAL 20 H VAL 20 30.185 20.702 -6.867 145 HA VAL 20 HA VAL 20 32.931 21.541 -7.690 146 HB VAL 20 HB VAL 20 32.047 23.024 -9.537 147 1HG1 VAL 20 1HG1 VAL 20 31.645 20.074 -10.143 148 2HG1 VAL 20 2HG1 VAL 20 32.016 21.363 -11.325 149 3HG1 VAL 20 3HG1 VAL 20 33.204 20.930 -10.082 150 1HG2 VAL 20 1HG2 VAL 20 29.599 23.138 -8.976 151 2HG2 VAL 20 2HG2 VAL 20 29.906 22.743 -10.680 152 3HG2 VAL 20 3HG2 VAL 20 29.403 21.461 -9.539 153 H LYS 21 H LYS 21 33.558 23.640 -7.614 154 HA LYS 21 HA LYS 21 32.986 25.114 -5.262 155 1HB LYS 21 1HB LYS 21 34.226 26.366 -7.792 156 2HB LYS 21 2HB LYS 21 34.464 26.871 -6.140 157 1HG LYS 21 1HG LYS 21 35.711 24.475 -7.567 158 2HG LYS 21 2HG LYS 21 36.485 25.980 -7.096 159 1HD LYS 21 1HD LYS 21 36.084 25.319 -4.639 160 2HD LYS 21 2HD LYS 21 35.427 23.804 -5.251 161 1HE LYS 21 2HE LYS 21 37.630 23.224 -4.614 162 2HE LYS 21 1HE LYS 21 37.748 23.338 -6.365 163 1HZ LYS 21 1HZ LYS 21 38.579 25.452 -4.417 164 2HZ LYS 21 2HZ LYS 21 39.592 24.455 -5.259 165 3HZ LYS 21 3HZ LYS 21 38.700 25.594 -6.058 166 HA PRO 22 HA PRO 22 29.657 28.138 -6.602 167 1HB PRO 22 1HB PRO 22 30.102 30.398 -5.074 168 2HB PRO 22 2HB PRO 22 29.399 28.884 -4.466 169 1HG PRO 22 1HG PRO 22 32.282 29.831 -4.195 170 2HG PRO 22 2HG PRO 22 31.230 29.132 -2.930 171 1HD PRO 22 1HD PRO 22 33.098 27.624 -4.359 172 2HD PRO 22 2HD PRO 22 31.582 26.910 -3.758 173 H DAL 23 H ALA 23 29.982 28.704 -8.666 174 HA DAL 23 HA ALA 23 32.559 30.021 -9.608 175 1HB DAL 23 1HB ALA 23 29.798 31.067 -10.482 176 2HB DAL 23 2HB ALA 23 30.948 31.914 -9.414 177 3HB DAL 23 3HB ALA 23 31.377 31.602 -11.117 178 H VAL 24 H VAL 24 32.608 27.550 -9.762 179 HA VAL 24 HA VAL 24 32.321 26.700 -12.605 180 HB VAL 24 HB VAL 24 33.251 25.116 -10.162 181 1HG1 VAL 24 1HG2 VAL 24 33.651 24.206 -13.115 182 2HG1 VAL 24 2HG2 VAL 24 32.494 23.505 -11.969 183 3HG1 VAL 24 3HG2 VAL 24 34.226 23.350 -11.656 184 1HG2 VAL 24 1HG1 VAL 24 35.065 26.333 -12.350 185 2HG2 VAL 24 2HG1 VAL 24 35.623 25.368 -10.949 186 3HG2 VAL 24 3HG1 VAL 24 34.857 26.944 -10.697 187 H THR 25 H THR 25 30.410 25.722 -13.388 188 HA THR 25 HA THR 25 28.392 24.570 -11.472 189 HB THR 25 HB THR 25 26.688 25.517 -12.951 190 HG1 THR 25 HG1 THR 25 27.190 27.392 -14.125 191 1HG2 THR 25 1HG2 THR 25 26.465 27.797 -11.951 192 2HG2 THR 25 2HG2 THR 25 26.953 26.599 -10.722 193 3HG2 THR 25 3HG2 THR 25 28.160 27.724 -11.401 194 H ILE 26 H ILE 26 28.864 22.673 -12.059 195 HA ILE 26 HA ILE 26 29.457 21.485 -14.506 196 HB ILE 26 HB ILE 26 29.829 20.858 -12.037 197 1HG1 ILE 26 2HG1 ILE 26 28.986 18.253 -13.465 198 2HG1 ILE 26 1HG1 ILE 26 30.200 19.228 -14.193 199 1HG2 ILE 26 1HG2 ILE 26 27.124 19.314 -12.131 200 2HG2 ILE 26 2HG2 ILE 26 27.420 20.791 -11.163 201 3HG2 ILE 26 3HG2 ILE 26 28.308 19.277 -10.803 202 1HD1 ILE 26 1HD1 ILE 26 30.433 18.314 -11.285 203 2HD1 ILE 26 2HD1 ILE 26 31.191 17.474 -12.676 204 3HD1 ILE 26 3HD1 ILE 26 31.664 19.148 -12.242 205 H ARG 27 H ARG 27 28.327 19.703 -15.668 206 HA ARG 27 HA ARG 27 25.334 19.666 -15.574 207 1HB ARG 27 1HB ARG 27 26.746 20.199 -18.199 208 2HB ARG 27 2HB ARG 27 25.082 19.515 -18.054 209 1HG ARG 27 2HG ARG 27 24.229 21.358 -17.013 210 2HG ARG 27 1HG ARG 27 25.837 22.185 -16.961 211 1HD ARG 27 1HD ARG 27 25.828 22.309 -19.492 212 2HD ARG 27 2HD ARG 27 24.238 21.523 -19.531 213 HE ARG 27 HE ARG 27 23.797 23.738 -17.842 214 1HH1 ARG 27 2HH1 ARG 27 25.089 23.583 -21.202 215 2HH1 ARG 27 1HH1 ARG 27 24.442 25.273 -21.503 216 1HH2 ARG 27 2HH2 ARG 27 23.141 25.613 -18.344 217 2HH2 ARG 27 1HH2 ARG 27 23.427 26.328 -20.009 218 H CYS 28 H CYS 28 25.334 17.909 -15.009 219 HA CYS 28 HA CYS 28 26.834 15.496 -16.148 220 1HB CYS 28 1HB CYS 28 25.251 15.770 -13.515 221 2HB CYS 28 2HB CYS 28 26.073 14.296 -14.085 222 H GLU 29 H GLU 29 25.647 15.406 -18.013 223 HA GLU 29 HA GLU 29 22.859 16.155 -18.281 224 1HB GLU 29 1HB GLU 29 24.744 14.760 -20.288 225 2HB GLU 29 2HB GLU 29 23.104 15.204 -20.730 226 1HG GLU 29 1HG GLU 29 23.558 17.617 -20.342 227 2HG GLU 29 2HG GLU 29 25.218 17.243 -19.862 Start of MODEL 37 1 1H SER 1 1H SER 1 25.655 9.543 -18.529 2 2H SER 1 2H SER 1 24.698 9.034 -17.282 3 3H SER 1 3H SER 1 26.306 8.653 -17.299 4 HA SER 1 HA SER 1 25.150 11.377 -17.033 5 1HB SER 1 1HB SER 1 26.557 9.572 -14.977 6 2HB SER 1 2HB SER 1 26.139 11.272 -14.703 7 HG SER 1 HG SER 1 23.964 10.731 -15.153 8 H LYS 2 H LYS 2 26.547 12.907 -17.623 9 HA LYS 2 HA LYS 2 29.544 12.531 -17.504 10 1HB LYS 2 2HB LYS 2 30.033 13.360 -19.719 11 2HB LYS 2 1HB LYS 2 29.200 11.825 -19.741 12 1HG LYS 2 2HG LYS 2 27.061 13.009 -20.487 13 2HG LYS 2 1HG LYS 2 27.944 14.517 -20.468 14 1HD LYS 2 2HD LYS 2 27.976 14.030 -22.711 15 2HD LYS 2 1HD LYS 2 29.581 13.519 -22.235 16 1HE LYS 2 1HE LYS 2 28.743 11.092 -22.221 17 2HE LYS 2 2HE LYS 2 27.146 11.667 -22.730 18 1HZ LYS 2 1HZ LYS 2 28.190 12.602 -24.735 19 2HZ LYS 2 2HZ LYS 2 28.489 10.980 -24.629 20 3HZ LYS 2 3HZ LYS 2 29.678 12.065 -24.258 21 H TYR 3 H TYR 3 30.632 14.372 -16.953 22 HA TYR 3 HA TYR 3 28.963 16.668 -15.972 23 1HB TYR 3 1HB TYR 3 30.811 17.521 -14.837 24 2HB TYR 3 2HB TYR 3 30.555 15.892 -14.370 25 HD1 TYR 3 HD1 TYR 3 33.008 18.286 -15.636 26 HD2 TYR 3 HD2 TYR 3 32.247 14.063 -15.287 27 HE1 TYR 3 HE1 TYR 3 35.373 17.815 -15.921 28 HE2 TYR 3 HE2 TYR 3 34.640 13.652 -15.526 29 HH TYR 3 HH TYR 3 36.949 16.283 -16.010 30 H GLU 4 H GLU 4 28.834 18.617 -17.005 31 HA GLU 4 HA GLU 4 31.150 19.432 -18.924 32 1HB GLU 4 1HB GLU 4 29.361 18.967 -20.299 33 2HB GLU 4 2HB GLU 4 28.156 19.805 -19.340 34 1HG GLU 4 2HG GLU 4 29.163 22.012 -19.944 35 2HG GLU 4 1HG GLU 4 30.430 21.191 -20.848 36 H TYR 5 H TYR 5 32.384 20.487 -17.482 37 HA TYR 5 HA TYR 5 31.099 22.547 -15.642 38 1HB TYR 5 2HB TYR 5 32.303 22.103 -13.823 39 2HB TYR 5 1HB TYR 5 31.997 20.495 -14.380 40 HD1 TYR 5 HD1 TYR 5 34.535 20.291 -16.337 41 HD2 TYR 5 HD2 TYR 5 33.976 21.445 -12.248 42 HE1 TYR 5 HE1 TYR 5 36.943 20.023 -15.889 43 HE2 TYR 5 HE2 TYR 5 36.351 21.205 -11.857 44 HH TYR 5 HH TYR 5 38.308 20.635 -12.693 45 H THR 6 H THR 6 31.602 24.305 -16.075 46 HA THR 6 HA THR 6 33.776 24.903 -18.124 47 HB THR 6 HB THR 6 31.429 26.778 -17.378 48 HG1 THR 6 HG1 THR 6 30.266 25.734 -18.996 49 1HG2 THR 6 1HG2 THR 6 33.178 27.591 -19.060 50 2HG2 THR 6 2HG2 THR 6 32.781 26.183 -20.067 51 3HG2 THR 6 3HG2 THR 6 31.523 27.394 -19.772 52 H ILE 7 H ILE 7 35.470 26.193 -17.647 53 HA ILE 7 HA ILE 7 35.581 27.717 -14.999 54 HB ILE 7 HB ILE 7 37.742 25.731 -15.942 55 1HG1 ILE 7 2HG1 ILE 7 37.141 24.515 -13.554 56 2HG1 ILE 7 1HG1 ILE 7 35.635 25.385 -13.735 57 1HG2 ILE 7 1HG2 ILE 7 38.877 26.148 -13.769 58 2HG2 ILE 7 2HG2 ILE 7 37.590 27.312 -13.311 59 3HG2 ILE 7 3HG2 ILE 7 38.670 27.648 -14.697 60 1HD1 ILE 7 1HD1 ILE 7 35.153 23.312 -14.516 61 2HD1 ILE 7 2HD1 ILE 7 36.756 23.012 -15.263 62 3HD1 ILE 7 3HD1 ILE 7 35.537 24.036 -16.075 63 HA DPR 8 HA PRO 8 38.167 30.509 -17.425 64 1HB DPR 8 1HB PRO 8 37.429 32.168 -16.029 65 2HB DPR 8 2HB PRO 8 36.748 32.883 -17.501 66 1HG DPR 8 2HG PRO 8 35.153 32.393 -15.329 67 2HG DPR 8 1HG PRO 8 34.540 32.052 -16.973 68 1HD DPR 8 2HD PRO 8 35.483 30.060 -14.897 69 2HD DPR 8 1HD PRO 8 34.288 29.844 -16.196 70 H SER 9 H SER 9 38.626 30.212 -19.456 71 HA SER 9 HA SER 9 36.776 30.857 -21.760 72 1HB SER 9 2HB SER 9 38.740 30.467 -23.179 73 2HB SER 9 1HB SER 9 39.127 31.621 -21.900 74 HG SER 9 HG SER 9 39.677 28.830 -21.878 75 H TYR 10 H TYR 10 37.577 27.978 -19.921 76 HA TYR 10 HA TYR 10 37.280 26.194 -22.390 77 1HB TYR 10 1HB TYR 10 38.614 25.854 -19.629 78 2HB TYR 10 2HB TYR 10 37.971 24.435 -20.352 79 HD1 TYR 10 HD1 TYR 10 40.677 26.935 -20.693 80 HD2 TYR 10 HD2 TYR 10 38.823 23.483 -22.494 81 HE1 TYR 10 HE1 TYR 10 42.687 26.469 -21.963 82 HE2 TYR 10 HE2 TYR 10 40.837 23.055 -23.738 83 HH TYR 10 HH TYR 10 42.915 23.716 -24.191 84 H THR 11 H THR 11 35.626 24.824 -22.656 85 HA THR 11 HA THR 11 33.620 24.307 -20.410 86 HB THR 11 HB THR 11 33.382 23.682 -23.409 87 HG1 THR 11 HG1 THR 11 33.605 25.924 -23.068 88 1HG2 THR 11 1HG2 THR 11 30.877 23.809 -22.990 89 2HG2 THR 11 2HG2 THR 11 31.675 22.509 -22.078 90 3HG2 THR 11 3HG2 THR 11 31.203 24.010 -21.243 91 H PHE 12 H PHE 12 34.497 22.740 -19.330 92 HA PHE 12 HA PHE 12 36.380 20.659 -20.642 93 1HB PHE 12 2HB PHE 12 35.942 21.289 -17.704 94 2HB PHE 12 1HB PHE 12 36.845 19.907 -18.233 95 HD1 PHE 12 HD1 PHE 12 36.999 23.542 -17.699 96 HD2 PHE 12 HD2 PHE 12 39.097 20.203 -19.430 97 HE1 PHE 12 HE1 PHE 12 39.121 24.658 -17.338 98 HE2 PHE 12 HE2 PHE 12 41.188 21.396 -19.116 99 HZ PHE 12 HZ PHE 12 41.208 23.611 -18.007 100 H ARG 13 H ARG 13 34.983 19.087 -21.459 101 HA ARG 13 HA ARG 13 32.680 18.058 -19.786 102 1HB ARG 13 1HB ARG 13 32.282 17.612 -22.692 103 2HB ARG 13 2HB ARG 13 31.244 18.214 -21.429 104 1HG ARG 13 1HG ARG 13 31.153 19.972 -22.822 105 2HG ARG 13 2HG ARG 13 32.404 20.471 -21.693 106 1HD ARG 13 1HD ARG 13 33.255 21.147 -23.785 107 2HD ARG 13 2HD ARG 13 34.179 19.687 -23.435 108 HE ARG 13 HE ARG 13 31.754 19.085 -25.038 109 1HH1 ARG 13 1HH2 ARG 13 35.121 20.290 -25.485 110 2HH1 ARG 13 2HH2 ARG 13 35.061 19.745 -27.237 111 1HH2 ARG 13 1HH1 ARG 13 31.854 18.537 -27.017 112 2HH2 ARG 13 2HH1 ARG 13 33.355 18.831 -28.031 113 H GLY 14 H GLY 14 32.778 16.023 -19.172 114 1HA GLY 14 1HA GLY 14 33.819 13.786 -20.849 115 2HA GLY 14 2HA GLY 14 34.944 14.219 -19.568 116 HA PRO 15 HA PRO 15 31.385 11.372 -17.916 117 1HB PRO 15 1HB PRO 15 32.327 8.812 -17.858 118 2HB PRO 15 2HB PRO 15 31.703 9.590 -19.327 119 1HG PRO 15 1HG PRO 15 34.601 9.293 -18.440 120 2HG PRO 15 2HG PRO 15 33.893 8.860 -20.033 121 1HD PRO 15 2HD PRO 15 35.177 11.305 -19.575 122 2HD PRO 15 1HD PRO 15 33.796 11.177 -20.698 123 H GLY 16 H GLY 16 31.158 10.210 -15.929 124 1HA GLY 16 2HA GLY 16 31.535 9.795 -13.549 125 2HA GLY 16 1HA GLY 16 33.222 10.249 -13.774 126 H CYS 17 H CYS 17 30.075 11.405 -12.885 127 HA CYS 17 HA CYS 17 30.966 14.329 -12.784 128 1HB CYS 17 2HB CYS 17 28.882 14.975 -13.184 129 2HB CYS 17 1HB CYS 17 29.081 13.617 -14.269 130 HA PRO 18 HA PRO 18 30.613 13.912 -8.133 131 1HB PRO 18 2HB PRO 18 33.003 14.915 -7.337 132 2HB PRO 18 1HB PRO 18 32.856 13.282 -8.018 133 1HG PRO 18 1HG PRO 18 33.829 15.817 -9.424 134 2HG PRO 18 2HG PRO 18 34.582 14.193 -9.446 135 1HD PRO 18 1HD PRO 18 32.779 15.150 -11.433 136 2HD PRO 18 2HD PRO 18 33.033 13.425 -11.076 137 H THR 19 H THR 19 30.875 15.756 -6.425 138 HA THR 19 HA THR 19 29.438 18.231 -7.235 139 HB THR 19 HB THR 19 30.125 18.906 -4.782 140 HG1 THR 19 HG1 THR 19 30.586 17.163 -3.454 141 1HG2 THR 19 1HG2 THR 19 28.228 16.604 -5.110 142 2HG2 THR 19 2HG2 THR 19 27.881 18.361 -5.268 143 3HG2 THR 19 3HG2 THR 19 28.387 17.703 -3.681 144 H VAL 20 H VAL 20 30.225 20.327 -7.256 145 HA VAL 20 HA VAL 20 33.151 20.756 -6.897 146 HB VAL 20 HB VAL 20 33.537 21.940 -9.050 147 1HG1 VAL 20 1HG1 VAL 20 32.730 19.055 -9.660 148 2HG1 VAL 20 2HG1 VAL 20 34.244 19.563 -8.866 149 3HG1 VAL 20 3HG1 VAL 20 33.923 20.040 -10.544 150 1HG2 VAL 20 1HG2 VAL 20 32.058 21.752 -11.082 151 2HG2 VAL 20 2HG2 VAL 20 31.305 22.667 -9.758 152 3HG2 VAL 20 3HG2 VAL 20 30.815 20.988 -10.057 153 H LYS 21 H LYS 21 33.821 23.063 -7.295 154 HA LYS 21 HA LYS 21 32.895 24.404 -5.019 155 1HB LYS 21 2HB LYS 21 34.931 24.949 -7.232 156 2HB LYS 21 1HB LYS 21 34.334 26.409 -6.558 157 1HG LYS 21 1HG LYS 21 36.328 25.938 -5.507 158 2HG LYS 21 2HG LYS 21 35.060 25.804 -4.289 159 1HD LYS 21 1HD LYS 21 35.141 23.359 -4.387 160 2HD LYS 21 2HD LYS 21 36.364 23.396 -5.668 161 1HE LYS 21 1HE LYS 21 37.988 24.527 -4.058 162 2HE LYS 21 2HE LYS 21 36.757 24.458 -2.781 163 1HZ LYS 21 1HZ LYS 21 38.270 22.569 -2.655 164 2HZ LYS 21 2HZ LYS 21 37.896 22.089 -4.191 165 3HZ LYS 21 3HZ LYS 21 36.749 22.025 -3.003 166 HA PRO 22 HA PRO 22 29.692 27.449 -6.219 167 1HB PRO 22 2HB PRO 22 30.035 29.560 -4.471 168 2HB PRO 22 1HB PRO 22 29.401 27.966 -4.018 169 1HG PRO 22 1HG PRO 22 32.190 29.058 -3.546 170 2HG PRO 22 2HG PRO 22 31.183 28.072 -2.451 171 1HD PRO 22 2HD PRO 22 33.241 27.068 -4.167 172 2HD PRO 22 1HD PRO 22 31.963 26.049 -3.499 173 H DAL 23 H ALA 23 29.925 28.354 -8.184 174 HA DAL 23 HA ALA 23 32.466 29.856 -8.962 175 1HB DAL 23 1HB ALA 23 31.185 31.544 -10.262 176 2HB DAL 23 2HB ALA 23 29.645 30.850 -9.688 177 3HB DAL 23 3HB ALA 23 30.763 31.621 -8.531 178 H VAL 24 H VAL 24 32.508 27.353 -9.356 179 HA VAL 24 HA VAL 24 32.378 26.894 -12.307 180 HB VAL 24 HB VAL 24 33.282 25.030 -10.058 181 1HG1 VAL 24 1HG2 VAL 24 32.634 23.660 -12.051 182 2HG1 VAL 24 2HG2 VAL 24 33.703 24.579 -13.101 183 3HG1 VAL 24 3HG2 VAL 24 34.384 23.548 -11.806 184 1HG2 VAL 24 1HG1 VAL 24 34.861 26.929 -10.254 185 2HG2 VAL 24 2HG1 VAL 24 35.676 25.441 -10.746 186 3HG2 VAL 24 3HG1 VAL 24 35.116 26.615 -11.978 187 H THR 25 H THR 25 30.404 26.196 -13.202 188 HA THR 25 HA THR 25 28.318 24.919 -11.424 189 HB THR 25 HB THR 25 26.701 25.923 -12.926 190 HG1 THR 25 HG1 THR 25 28.831 27.615 -13.684 191 1HG2 THR 25 1HG2 THR 25 26.945 27.002 -10.697 192 2HG2 THR 25 2HG2 THR 25 28.203 28.088 -11.347 193 3HG2 THR 25 3HG2 THR 25 26.524 28.211 -11.940 194 H ILE 26 H ILE 26 28.873 23.056 -12.005 195 HA ILE 26 HA ILE 26 29.382 21.832 -14.486 196 HB ILE 26 HB ILE 26 29.877 21.235 -12.058 197 1HG1 ILE 26 1HG1 ILE 26 29.024 18.547 -13.285 198 2HG1 ILE 26 2HG1 ILE 26 30.089 19.536 -14.200 199 1HG2 ILE 26 1HG2 ILE 26 27.239 19.649 -11.884 200 2HG2 ILE 26 2HG2 ILE 26 27.595 21.177 -11.006 201 3HG2 ILE 26 3HG2 ILE 26 28.542 19.698 -10.662 202 1HD1 ILE 26 1HD1 ILE 26 31.434 18.002 -12.773 203 2HD1 ILE 26 2HD1 ILE 26 31.718 19.712 -12.296 204 3HD1 ILE 26 3HD1 ILE 26 30.653 18.699 -11.308 205 H ARG 27 H ARG 27 28.164 19.951 -15.465 206 HA ARG 27 HA ARG 27 25.187 19.974 -15.230 207 1HB ARG 27 2HB ARG 27 26.475 20.240 -17.972 208 2HB ARG 27 1HB ARG 27 24.820 19.599 -17.677 209 1HG ARG 27 1HG ARG 27 24.081 21.596 -16.761 210 2HG ARG 27 2HG ARG 27 25.718 22.351 -16.943 211 1HD ARG 27 2HD ARG 27 25.493 22.181 -19.454 212 2HD ARG 27 1HD ARG 27 23.883 21.458 -19.271 213 HE ARG 27 HE ARG 27 23.925 23.994 -17.824 214 1HH1 ARG 27 2HH2 ARG 27 23.865 22.927 -21.265 215 2HH1 ARG 27 1HH2 ARG 27 23.074 24.519 -21.719 216 1HH2 ARG 27 2HH1 ARG 27 23.042 25.714 -18.500 217 2HH2 ARG 27 1HH1 ARG 27 22.647 25.969 -20.274 218 H CYS 28 H CYS 28 25.131 18.232 -14.648 219 HA CYS 28 HA CYS 28 26.707 15.801 -15.685 220 1HB CYS 28 2HB CYS 28 26.924 15.924 -13.299 221 2HB CYS 28 1HB CYS 28 25.172 15.877 -13.021 222 H GLU 29 H GLU 29 25.602 15.492 -17.434 223 HA GLU 29 HA GLU 29 22.833 16.275 -17.926 224 1HB GLU 29 1HB GLU 29 24.798 14.730 -19.734 225 2HB GLU 29 2HB GLU 29 23.188 15.159 -20.289 226 1HG GLU 29 2HG GLU 29 23.654 17.588 -20.042 227 2HG GLU 29 1HG GLU 29 25.283 17.232 -19.453 Start of MODEL 38 1 1H SER 1 1H SER 1 25.071 8.793 -17.889 2 2H SER 1 2H SER 1 26.690 8.467 -17.858 3 3H SER 1 3H SER 1 26.045 9.330 -19.111 4 HA SER 1 HA SER 1 25.435 11.151 -17.639 5 1HB SER 1 2HB SER 1 26.850 9.409 -15.536 6 2HB SER 1 1HB SER 1 26.356 11.092 -15.280 7 HG SER 1 HG SER 1 24.654 8.940 -16.016 8 H LYS 2 H LYS 2 26.798 12.747 -18.119 9 HA LYS 2 HA LYS 2 29.812 12.420 -17.996 10 1HB LYS 2 2HB LYS 2 30.272 13.419 -20.132 11 2HB LYS 2 1HB LYS 2 29.448 11.885 -20.268 12 1HG LYS 2 1HG LYS 2 27.307 13.113 -20.921 13 2HG LYS 2 2HG LYS 2 28.183 14.625 -20.790 14 1HD LYS 2 2HD LYS 2 28.224 14.283 -23.081 15 2HD LYS 2 1HD LYS 2 29.813 13.742 -22.622 16 1HE LYS 2 1HE LYS 2 29.122 12.150 -24.217 17 2HE LYS 2 2HE LYS 2 28.867 11.297 -22.695 18 1HZ LYS 2 1HZ LYS 2 26.745 12.675 -24.286 19 2HZ LYS 2 2HZ LYS 2 26.982 11.043 -24.198 20 3HZ LYS 2 3HZ LYS 2 26.484 11.878 -22.862 21 H TYR 3 H TYR 3 30.820 14.168 -17.186 22 HA TYR 3 HA TYR 3 29.131 16.448 -16.162 23 1HB TYR 3 1HB TYR 3 30.800 17.031 -14.725 24 2HB TYR 3 2HB TYR 3 30.603 15.332 -14.561 25 HD1 TYR 3 HD1 TYR 3 32.506 13.938 -16.251 26 HD2 TYR 3 HD2 TYR 3 33.068 17.794 -14.431 27 HE1 TYR 3 HE1 TYR 3 34.932 13.706 -16.429 28 HE2 TYR 3 HE2 TYR 3 35.467 17.458 -14.526 29 HH TYR 3 HH TYR 3 36.896 14.570 -15.981 30 H GLU 4 H GLU 4 29.192 18.389 -17.054 31 HA GLU 4 HA GLU 4 31.619 19.297 -18.769 32 1HB GLU 4 2HB GLU 4 30.119 19.226 -20.424 33 2HB GLU 4 1HB GLU 4 28.699 19.456 -19.462 34 1HG GLU 4 2HG GLU 4 29.271 21.944 -19.263 35 2HG GLU 4 1HG GLU 4 30.619 21.689 -20.359 36 H TYR 5 H TYR 5 32.791 20.243 -17.247 37 HA TYR 5 HA TYR 5 31.471 22.139 -15.265 38 1HB TYR 5 2HB TYR 5 32.662 21.567 -13.475 39 2HB TYR 5 1HB TYR 5 32.502 19.992 -14.186 40 HD1 TYR 5 HD1 TYR 5 34.949 19.911 -16.086 41 HD2 TYR 5 HD2 TYR 5 34.494 21.175 -12.003 42 HE1 TYR 5 HE1 TYR 5 37.353 19.632 -15.682 43 HE2 TYR 5 HE2 TYR 5 36.874 20.954 -11.677 44 HH TYR 5 HH TYR 5 39.005 19.791 -14.263 45 H THR 6 H THR 6 31.940 23.978 -15.617 46 HA THR 6 HA THR 6 34.070 24.660 -17.671 47 HB THR 6 HB THR 6 31.735 26.525 -16.861 48 HG1 THR 6 HG1 THR 6 31.654 24.399 -18.730 49 1HG2 THR 6 1HG2 THR 6 31.838 27.194 -19.235 50 2HG2 THR 6 2HG2 THR 6 33.058 25.941 -19.566 51 3HG2 THR 6 3HG2 THR 6 33.502 27.330 -18.538 52 H ILE 7 H ILE 7 35.687 25.982 -17.201 53 HA ILE 7 HA ILE 7 35.890 27.246 -14.419 54 HB ILE 7 HB ILE 7 38.107 25.576 -15.778 55 1HG1 ILE 7 2HG1 ILE 7 37.864 24.006 -13.598 56 2HG1 ILE 7 1HG1 ILE 7 36.318 24.796 -13.413 57 1HG2 ILE 7 1HG2 ILE 7 38.969 27.431 -14.336 58 2HG2 ILE 7 2HG2 ILE 7 39.365 25.861 -13.603 59 3HG2 ILE 7 3HG2 ILE 7 38.005 26.838 -12.958 60 1HD1 ILE 7 1HD1 ILE 7 35.994 23.758 -15.942 61 2HD1 ILE 7 2HD1 ILE 7 37.191 22.620 -15.254 62 3HD1 ILE 7 3HD1 ILE 7 35.636 22.946 -14.433 63 HA DPR 8 HA PRO 8 38.070 30.521 -16.649 64 1HB DPR 8 1HB PRO 8 37.493 31.769 -14.811 65 2HB DPR 8 2HB PRO 8 36.659 32.774 -16.016 66 1HG DPR 8 2HG PRO 8 35.312 31.770 -13.837 67 2HG DPR 8 1HG PRO 8 34.517 31.839 -15.435 68 1HD DPR 8 1HD PRO 8 35.538 29.403 -13.997 69 2HD DPR 8 2HD PRO 8 34.323 29.504 -15.292 70 H SER 9 H SER 9 38.043 30.012 -18.791 71 HA SER 9 HA SER 9 35.698 30.832 -20.561 72 1HB SER 9 2HB SER 9 37.495 32.579 -20.755 73 2HB SER 9 1HB SER 9 38.674 31.321 -21.179 74 HG SER 9 HG SER 9 37.320 30.784 -22.946 75 H TYR 10 H TYR 10 37.316 28.262 -19.345 76 HA TYR 10 HA TYR 10 37.561 26.760 -21.999 77 1HB TYR 10 2HB TYR 10 39.559 27.238 -20.173 78 2HB TYR 10 1HB TYR 10 38.874 25.880 -19.348 79 HD1 TYR 10 HD1 TYR 10 38.909 23.581 -20.505 80 HD2 TYR 10 HD2 TYR 10 40.745 27.022 -22.319 81 HE1 TYR 10 HE1 TYR 10 40.210 22.130 -21.985 82 HE2 TYR 10 HE2 TYR 10 42.012 25.541 -23.792 83 HH TYR 10 HH TYR 10 42.455 23.468 -24.383 84 H THR 11 H THR 11 36.101 25.152 -22.339 85 HA THR 11 HA THR 11 34.269 24.258 -20.110 86 HB THR 11 HB THR 11 34.082 23.615 -23.103 87 HG1 THR 11 HG1 THR 11 32.969 25.821 -21.715 88 1HG2 THR 11 1HG2 THR 11 31.642 23.386 -22.750 89 2HG2 THR 11 2HG2 THR 11 32.443 22.395 -21.500 90 3HG2 THR 11 3HG2 THR 11 31.776 23.980 -21.072 91 H PHE 12 H PHE 12 34.854 22.538 -19.112 92 HA PHE 12 HA PHE 12 36.810 20.463 -20.358 93 1HB PHE 12 1HB PHE 12 36.307 21.104 -17.425 94 2HB PHE 12 2HB PHE 12 37.185 19.699 -17.955 95 HD1 PHE 12 HD1 PHE 12 39.539 19.914 -18.820 96 HD2 PHE 12 HD2 PHE 12 37.313 23.435 -17.719 97 HE1 PHE 12 HE1 PHE 12 41.594 21.200 -18.659 98 HE2 PHE 12 HE2 PHE 12 39.392 24.661 -17.522 99 HZ PHE 12 HZ PHE 12 41.536 23.571 -17.979 100 H ARG 13 H ARG 13 35.626 18.797 -21.127 101 HA ARG 13 HA ARG 13 33.040 17.940 -19.731 102 1HB ARG 13 1HB ARG 13 33.251 17.806 -22.753 103 2HB ARG 13 2HB ARG 13 31.838 17.712 -21.684 104 1HG ARG 13 1HG ARG 13 31.931 20.161 -21.316 105 2HG ARG 13 2HG ARG 13 33.368 20.251 -22.293 106 1HD ARG 13 1HD ARG 13 31.609 20.993 -23.707 107 2HD ARG 13 2HD ARG 13 32.080 19.411 -24.315 108 HE ARG 13 HE ARG 13 29.774 19.181 -22.477 109 1HH1 ARG 13 2HH2 ARG 13 30.480 20.074 -25.895 110 2HH1 ARG 13 1HH2 ARG 13 28.749 19.657 -26.337 111 1HH2 ARG 13 1HH1 ARG 13 27.880 18.760 -23.138 112 2HH2 ARG 13 2HH1 ARG 13 27.397 18.972 -24.896 113 H GLY 14 H GLY 14 33.108 15.873 -19.117 114 1HA GLY 14 1HA GLY 14 34.130 13.669 -20.851 115 2HA GLY 14 2HA GLY 14 35.200 13.965 -19.486 116 HA PRO 15 HA PRO 15 31.629 11.151 -17.993 117 1HB PRO 15 1HB PRO 15 32.779 8.777 -17.401 118 2HB PRO 15 2HB PRO 15 32.511 9.315 -19.074 119 1HG PRO 15 2HG PRO 15 35.064 9.468 -17.433 120 2HG PRO 15 1HG PRO 15 34.863 8.799 -19.089 121 1HD PRO 15 2HD PRO 15 35.722 11.441 -18.567 122 2HD PRO 15 1HD PRO 15 34.812 11.010 -20.040 123 H GLY 16 H GLY 16 31.055 10.225 -15.900 124 1HA GLY 16 2HA GLY 16 31.099 10.000 -13.513 125 2HA GLY 16 1HA GLY 16 32.693 10.744 -13.463 126 H CYS 17 H CYS 17 29.528 11.265 -12.756 127 HA CYS 17 HA CYS 17 29.680 14.308 -12.856 128 1HB CYS 17 2HB CYS 17 27.265 12.479 -12.296 129 2HB CYS 17 1HB CYS 17 27.227 14.248 -12.359 130 HA PRO 18 HA PRO 18 30.314 14.321 -8.239 131 1HB PRO 18 2HB PRO 18 32.574 15.826 -8.042 132 2HB PRO 18 1HB PRO 18 32.621 14.103 -8.475 133 1HG PRO 18 2HG PRO 18 32.880 16.505 -10.341 134 2HG PRO 18 1HG PRO 18 33.877 15.020 -10.316 135 1HD PRO 18 2HD PRO 18 31.607 15.413 -12.010 136 2HD PRO 18 1HD PRO 18 32.222 13.813 -11.524 137 H THR 19 H THR 19 30.438 16.363 -6.839 138 HA THR 19 HA THR 19 28.909 18.696 -8.096 139 HB THR 19 HB THR 19 27.533 17.870 -6.427 140 HG1 THR 19 HG1 THR 19 27.750 20.050 -6.836 141 1HG2 THR 19 1HG2 THR 19 29.040 16.866 -4.672 142 2HG2 THR 19 2HG2 THR 19 29.631 18.506 -4.264 143 3HG2 THR 19 3HG2 THR 19 27.916 18.075 -3.976 144 H VAL 20 H VAL 20 29.512 20.779 -7.385 145 HA VAL 20 HA VAL 20 32.576 21.109 -7.241 146 HB VAL 20 HB VAL 20 32.474 22.862 -9.023 147 1HG1 VAL 20 1HG2 VAL 20 32.508 21.362 -10.995 148 2HG1 VAL 20 2HG2 VAL 20 33.299 20.630 -9.580 149 3HG1 VAL 20 3HG2 VAL 20 31.662 20.113 -10.035 150 1HG2 VAL 20 1HG1 VAL 20 30.681 23.159 -10.655 151 2HG2 VAL 20 2HG1 VAL 20 29.659 21.955 -9.819 152 3HG2 VAL 20 3HG1 VAL 20 30.057 23.495 -9.023 153 H LYS 21 H LYS 21 33.437 23.149 -6.881 154 HA LYS 21 HA LYS 21 32.365 24.421 -4.443 155 1HB LYS 21 2HB LYS 21 34.512 25.044 -4.110 156 2HB LYS 21 1HB LYS 21 34.824 23.649 -5.093 157 1HG LYS 21 2HG LYS 21 35.200 26.578 -5.721 158 2HG LYS 21 1HG LYS 21 36.421 25.339 -5.587 159 1HD LYS 21 2HD LYS 21 34.324 25.425 -7.811 160 2HD LYS 21 1HD LYS 21 35.775 26.393 -7.885 161 1HE LYS 21 1HE LYS 21 35.922 23.298 -7.618 162 2HE LYS 21 2HE LYS 21 35.721 24.067 -9.179 163 1HZ LYS 21 1HZ LYS 21 38.049 23.645 -8.717 164 2HZ LYS 21 2HZ LYS 21 38.014 24.563 -7.344 165 3HZ LYS 21 3HZ LYS 21 37.812 25.277 -8.819 166 HA PRO 22 HA PRO 22 30.471 28.146 -6.206 167 1HB PRO 22 1HB PRO 22 31.229 30.398 -4.797 168 2HB PRO 22 2HB PRO 22 30.304 29.045 -4.131 169 1HG PRO 22 2HG PRO 22 33.220 29.679 -3.692 170 2HG PRO 22 1HG PRO 22 32.038 28.986 -2.550 171 1HD PRO 22 1HD PRO 22 33.948 27.537 -4.180 172 2HD PRO 22 2HD PRO 22 32.604 26.772 -3.305 173 H DAL 23 H ALA 23 30.685 29.073 -8.176 174 HA DAL 23 HA ALA 23 33.443 29.951 -9.192 175 1HB DAL 23 1HB ALA 23 32.114 32.002 -8.812 176 2HB DAL 23 2HB ALA 23 32.376 31.724 -10.553 177 3HB DAL 23 3HB ALA 23 30.790 31.361 -9.824 178 H VAL 24 H VAL 24 33.217 27.544 -9.430 179 HA VAL 24 HA VAL 24 32.611 26.814 -12.252 180 HB VAL 24 HB VAL 24 33.659 25.094 -9.948 181 1HG1 VAL 24 1HG1 VAL 24 32.655 23.593 -11.723 182 2HG1 VAL 24 2HG1 VAL 24 33.748 24.268 -12.948 183 3HG1 VAL 24 3HG1 VAL 24 34.394 23.337 -11.569 184 1HG2 VAL 24 1HG2 VAL 24 35.337 26.815 -10.518 185 2HG2 VAL 24 2HG2 VAL 24 35.980 25.249 -11.036 186 3HG2 VAL 24 3HG2 VAL 24 35.284 26.370 -12.235 187 H THR 25 H THR 25 30.734 25.665 -12.938 188 HA THR 25 HA THR 25 28.775 24.590 -10.950 189 HB THR 25 HB THR 25 27.003 25.589 -12.342 190 HG1 THR 25 HG1 THR 25 29.035 27.369 -13.156 191 1HG2 THR 25 1HG2 THR 25 28.550 27.733 -10.772 192 2HG2 THR 25 2HG2 THR 25 26.834 27.836 -11.251 193 3HG2 THR 25 3HG2 THR 25 27.362 26.593 -10.085 194 H ILE 26 H ILE 26 29.116 22.666 -11.637 195 HA ILE 26 HA ILE 26 29.587 21.638 -14.207 196 HB ILE 26 HB ILE 26 30.085 20.845 -11.785 197 1HG1 ILE 26 1HG1 ILE 26 29.282 18.338 -13.402 198 2HG1 ILE 26 2HG1 ILE 26 30.423 19.426 -14.095 199 1HG2 ILE 26 1HG2 ILE 26 27.438 19.221 -11.918 200 2HG2 ILE 26 2HG2 ILE 26 27.721 20.623 -10.838 201 3HG2 ILE 26 3HG2 ILE 26 28.675 19.120 -10.646 202 1HD1 ILE 26 1HD1 ILE 26 30.808 18.265 -11.284 203 2HD1 ILE 26 2HD1 ILE 26 31.588 17.624 -12.767 204 3HD1 ILE 26 3HD1 ILE 26 31.945 19.279 -12.172 205 H ARG 27 H ARG 27 28.285 19.868 -15.282 206 HA ARG 27 HA ARG 27 25.335 20.070 -15.209 207 1HB ARG 27 1HB ARG 27 25.761 21.737 -16.853 208 2HB ARG 27 2HB ARG 27 26.795 20.591 -17.815 209 1HG ARG 27 1HG ARG 27 24.926 19.282 -18.328 210 2HG ARG 27 2HG ARG 27 23.828 20.283 -17.346 211 1HD ARG 27 1HD ARG 27 25.348 21.358 -19.834 212 2HD ARG 27 2HD ARG 27 23.777 20.573 -19.946 213 HE ARG 27 HE ARG 27 23.276 22.590 -18.054 214 1HH1 ARG 27 2HH1 ARG 27 24.595 22.776 -21.401 215 2HH1 ARG 27 1HH1 ARG 27 23.907 24.471 -21.552 216 1HH2 ARG 27 2HH2 ARG 27 22.575 24.486 -18.387 217 2HH2 ARG 27 1HH2 ARG 27 22.854 25.358 -19.977 218 H CYS 28 H CYS 28 24.988 18.288 -15.212 219 HA CYS 28 HA CYS 28 26.668 15.876 -16.189 220 1HB CYS 28 1HB CYS 28 26.061 15.719 -13.741 221 2HB CYS 28 2HB CYS 28 24.345 15.579 -14.192 222 H GLU 29 H GLU 29 25.992 15.266 -18.120 223 HA GLU 29 HA GLU 29 23.381 16.214 -19.287 224 1HB GLU 29 1HB GLU 29 25.800 14.815 -20.585 225 2HB GLU 29 2HB GLU 29 24.344 15.203 -21.489 226 1HG GLU 29 2HG GLU 29 24.648 17.642 -21.083 227 2HG GLU 29 1HG GLU 29 26.113 17.317 -20.147 Start of MODEL 39 1 1H SER 1 1H SER 1 26.545 8.671 -18.305 2 2H SER 1 2H SER 1 25.881 9.595 -19.502 3 3H SER 1 3H SER 1 24.930 9.017 -18.281 4 HA SER 1 HA SER 1 25.329 11.355 -17.937 5 1HB SER 1 2HB SER 1 25.050 9.843 -15.972 6 2HB SER 1 1HB SER 1 26.794 9.523 -15.949 7 HG SER 1 HG SER 1 27.105 11.777 -15.656 8 H LYS 2 H LYS 2 26.701 12.950 -18.420 9 HA LYS 2 HA LYS 2 29.712 12.590 -18.337 10 1HB LYS 2 1HB LYS 2 30.146 13.696 -20.416 11 2HB LYS 2 2HB LYS 2 29.408 12.137 -20.615 12 1HG LYS 2 1HG LYS 2 27.922 14.817 -21.031 13 2HG LYS 2 2HG LYS 2 28.813 13.983 -22.296 14 1HD LYS 2 2HD LYS 2 27.277 11.970 -22.060 15 2HD LYS 2 1HD LYS 2 26.389 12.831 -20.816 16 1HE LYS 2 2HE LYS 2 25.049 13.120 -22.714 17 2HE LYS 2 1HE LYS 2 25.855 14.676 -22.598 18 1HZ LYS 2 1HZ LYS 2 27.414 13.892 -24.342 19 2HZ LYS 2 2HZ LYS 2 25.848 13.829 -24.864 20 3HZ LYS 2 3HZ LYS 2 26.629 12.441 -24.428 21 H TYR 3 H TYR 3 30.643 14.221 -17.354 22 HA TYR 3 HA TYR 3 29.007 16.545 -16.340 23 1HB TYR 3 2HB TYR 3 30.639 16.944 -14.761 24 2HB TYR 3 1HB TYR 3 30.347 15.251 -14.737 25 HD1 TYR 3 HD1 TYR 3 32.935 17.588 -14.379 26 HD2 TYR 3 HD2 TYR 3 32.249 13.879 -16.439 27 HE1 TYR 3 HE1 TYR 3 35.316 17.155 -14.440 28 HE2 TYR 3 HE2 TYR 3 34.672 13.577 -16.619 29 HH TYR 3 HH TYR 3 36.656 14.316 -16.069 30 H GLU 4 H GLU 4 29.126 18.480 -17.264 31 HA GLU 4 HA GLU 4 31.652 19.345 -18.843 32 1HB GLU 4 2HB GLU 4 30.171 19.392 -20.518 33 2HB GLU 4 1HB GLU 4 28.755 19.688 -19.568 34 1HG GLU 4 1HG GLU 4 29.479 22.122 -19.283 35 2HG GLU 4 2HG GLU 4 30.832 21.814 -20.360 36 H TYR 5 H TYR 5 32.833 20.118 -17.214 37 HA TYR 5 HA TYR 5 31.561 22.017 -15.195 38 1HB TYR 5 1HB TYR 5 32.713 21.329 -13.422 39 2HB TYR 5 2HB TYR 5 32.535 19.792 -14.204 40 HD1 TYR 5 HD1 TYR 5 34.928 19.582 -16.046 41 HD2 TYR 5 HD2 TYR 5 34.598 21.022 -12.010 42 HE1 TYR 5 HE1 TYR 5 37.315 19.204 -15.670 43 HE2 TYR 5 HE2 TYR 5 36.969 20.691 -11.705 44 HH TYR 5 HH TYR 5 38.854 19.945 -12.577 45 H THR 6 H THR 6 32.068 23.868 -15.527 46 HA THR 6 HA THR 6 34.251 24.530 -17.529 47 HB THR 6 HB THR 6 31.941 26.435 -16.743 48 HG1 THR 6 HG1 THR 6 30.758 25.477 -18.396 49 1HG2 THR 6 1HG2 THR 6 32.105 27.114 -19.112 50 2HG2 THR 6 2HG2 THR 6 33.311 25.840 -19.422 51 3HG2 THR 6 3HG2 THR 6 33.755 27.215 -18.375 52 H ILE 7 H ILE 7 35.916 25.741 -16.966 53 HA ILE 7 HA ILE 7 36.065 26.958 -14.161 54 HB ILE 7 HB ILE 7 38.279 25.285 -15.512 55 1HG1 ILE 7 2HG1 ILE 7 38.038 23.612 -13.494 56 2HG1 ILE 7 1HG1 ILE 7 36.522 24.394 -13.143 57 1HG2 ILE 7 1HG2 ILE 7 39.498 25.486 -13.306 58 2HG2 ILE 7 2HG2 ILE 7 38.129 26.444 -12.651 59 3HG2 ILE 7 3HG2 ILE 7 39.127 27.086 -13.983 60 1HD1 ILE 7 1HD1 ILE 7 35.596 22.799 -14.374 61 2HD1 ILE 7 2HD1 ILE 7 36.221 23.503 -15.840 62 3HD1 ILE 7 3HD1 ILE 7 37.172 22.240 -15.022 63 HA DPR 8 HA PRO 8 38.351 30.232 -16.284 64 1HB DPR 8 1HB PRO 8 37.752 31.450 -14.429 65 2HB DPR 8 2HB PRO 8 36.969 32.497 -15.634 66 1HG DPR 8 1HG PRO 8 35.545 31.477 -13.512 67 2HG DPR 8 2HG PRO 8 34.794 31.591 -15.130 68 1HD DPR 8 1HD PRO 8 35.734 29.109 -13.715 69 2HD DPR 8 2HD PRO 8 34.555 29.256 -15.039 70 H SER 9 H SER 9 38.329 29.690 -18.427 71 HA SER 9 HA SER 9 36.062 30.617 -20.239 72 1HB SER 9 2HB SER 9 39.068 31.047 -20.765 73 2HB SER 9 1HB SER 9 37.773 31.300 -21.942 74 HG SER 9 HG SER 9 36.842 32.802 -20.496 75 H TYR 10 H TYR 10 37.683 28.001 -19.043 76 HA TYR 10 HA TYR 10 37.958 26.564 -21.727 77 1HB TYR 10 2HB TYR 10 39.902 26.934 -19.830 78 2HB TYR 10 1HB TYR 10 39.154 25.574 -19.062 79 HD1 TYR 10 HD1 TYR 10 41.161 26.741 -21.928 80 HD2 TYR 10 HD2 TYR 10 39.158 23.307 -20.286 81 HE1 TYR 10 HE1 TYR 10 42.443 25.264 -23.394 82 HE2 TYR 10 HE2 TYR 10 40.475 21.859 -21.757 83 HH TYR 10 HH TYR 10 42.015 21.744 -23.326 84 H THR 11 H THR 11 36.453 25.028 -22.169 85 HA THR 11 HA THR 11 34.500 24.152 -20.042 86 HB THR 11 HB THR 11 34.402 23.604 -23.059 87 HG1 THR 11 HG1 THR 11 33.134 25.472 -23.198 88 1HG2 THR 11 1HG2 THR 11 31.941 23.505 -22.812 89 2HG2 THR 11 2HG2 THR 11 32.637 22.434 -21.565 90 3HG2 THR 11 3HG2 THR 11 32.037 24.039 -21.112 91 H PHE 12 H PHE 12 34.954 22.363 -19.077 92 HA PHE 12 HA PHE 12 36.842 20.229 -20.330 93 1HB PHE 12 2HB PHE 12 36.271 20.793 -17.397 94 2HB PHE 12 1HB PHE 12 37.098 19.366 -17.948 95 HD1 PHE 12 HD1 PHE 12 39.510 19.481 -18.589 96 HD2 PHE 12 HD2 PHE 12 37.380 23.109 -17.667 97 HE1 PHE 12 HE1 PHE 12 41.606 20.664 -18.258 98 HE2 PHE 12 HE2 PHE 12 39.494 24.229 -17.284 99 HZ PHE 12 HZ PHE 12 41.612 23.032 -17.571 100 H ARG 13 H ARG 13 35.573 18.689 -21.220 101 HA ARG 13 HA ARG 13 32.914 17.908 -19.918 102 1HB ARG 13 1HB ARG 13 33.186 17.852 -22.932 103 2HB ARG 13 2HB ARG 13 31.752 17.805 -21.886 104 1HG ARG 13 1HG ARG 13 31.990 20.244 -21.453 105 2HG ARG 13 2HG ARG 13 33.427 20.268 -22.434 106 1HD ARG 13 1HD ARG 13 31.710 21.136 -23.829 107 2HD ARG 13 2HD ARG 13 32.080 19.538 -24.466 108 HE ARG 13 HE ARG 13 29.754 19.515 -22.597 109 1HH1 ARG 13 1HH1 ARG 13 30.574 20.045 -26.065 110 2HH1 ARG 13 2HH1 ARG 13 28.833 19.673 -26.508 111 1HH2 ARG 13 1HH2 ARG 13 27.855 19.127 -23.262 112 2HH2 ARG 13 2HH2 ARG 13 27.419 19.194 -25.043 113 H GLY 14 H GLY 14 32.908 15.814 -19.352 114 1HA GLY 14 1HA GLY 14 33.789 13.620 -21.141 115 2HA GLY 14 2HA GLY 14 34.952 13.848 -19.840 116 HA PRO 15 HA PRO 15 31.387 11.158 -18.128 117 1HB PRO 15 1HB PRO 15 32.443 8.708 -17.743 118 2HB PRO 15 2HB PRO 15 32.094 9.343 -19.366 119 1HG PRO 15 2HG PRO 15 34.755 9.269 -17.905 120 2HG PRO 15 1HG PRO 15 34.403 8.701 -19.574 121 1HD PRO 15 2HD PRO 15 35.443 11.269 -18.958 122 2HD PRO 15 1HD PRO 15 34.453 10.956 -20.410 123 H GLY 16 H GLY 16 30.920 10.217 -16.054 124 1HA GLY 16 2HA GLY 16 31.094 9.832 -13.697 125 2HA GLY 16 1HA GLY 16 32.785 10.309 -13.761 126 H CYS 17 H CYS 17 29.768 11.279 -12.776 127 HA CYS 17 HA CYS 17 30.289 14.243 -12.779 128 1HB CYS 17 1HB CYS 17 28.068 13.348 -13.448 129 2HB CYS 17 2HB CYS 17 27.797 12.730 -11.805 130 HA PRO 18 HA PRO 18 31.547 14.149 -8.264 131 1HB PRO 18 1HB PRO 18 33.689 15.832 -8.317 132 2HB PRO 18 2HB PRO 18 33.803 14.145 -8.861 133 1HG PRO 18 2HG PRO 18 33.527 16.660 -10.586 134 2HG PRO 18 1HG PRO 18 34.669 15.300 -10.812 135 1HD PRO 18 1HD PRO 18 32.171 15.473 -12.146 136 2HD PRO 18 2HD PRO 18 32.981 13.934 -11.748 137 H THR 19 H THR 19 31.758 16.103 -6.730 138 HA THR 19 HA THR 19 29.685 18.230 -7.299 139 HB THR 19 HB THR 19 30.517 18.924 -4.858 140 HG1 THR 19 HG1 THR 19 31.098 17.149 -3.625 141 1HG2 THR 19 1HG2 THR 19 28.275 18.315 -5.283 142 2HG2 THR 19 2HG2 THR 19 28.855 17.573 -3.762 143 3HG2 THR 19 3HG2 THR 19 28.688 16.570 -5.262 144 H VAL 20 H VAL 20 30.115 20.455 -6.963 145 HA VAL 20 HA VAL 20 32.959 21.271 -7.356 146 HB VAL 20 HB VAL 20 32.442 22.897 -9.198 147 1HG1 VAL 20 1HG1 VAL 20 32.557 21.331 -11.116 148 2HG1 VAL 20 2HG1 VAL 20 33.549 20.772 -9.752 149 3HG1 VAL 20 3HG1 VAL 20 31.973 20.012 -10.067 150 1HG2 VAL 20 1HG2 VAL 20 29.743 21.529 -9.701 151 2HG2 VAL 20 2HG2 VAL 20 29.962 23.153 -9.006 152 3HG2 VAL 20 3HG2 VAL 20 30.487 22.831 -10.674 153 H LYS 21 H LYS 21 33.475 23.558 -7.134 154 HA LYS 21 HA LYS 21 32.224 24.614 -4.638 155 1HB LYS 21 1HB LYS 21 34.216 26.054 -4.565 156 2HB LYS 21 2HB LYS 21 34.603 24.357 -4.681 157 1HG LYS 21 1HG LYS 21 36.275 25.626 -5.749 158 2HG LYS 21 2HG LYS 21 35.469 24.650 -6.967 159 1HD LYS 21 1HD LYS 21 34.277 26.532 -7.859 160 2HD LYS 21 2HD LYS 21 34.757 27.618 -6.567 161 1HE LYS 21 1HE LYS 21 36.791 26.392 -8.565 162 2HE LYS 21 2HE LYS 21 35.947 27.913 -8.840 163 1HZ LYS 21 1HZ LYS 21 38.111 28.303 -7.872 164 2HZ LYS 21 2HZ LYS 21 37.752 27.406 -6.532 165 3HZ LYS 21 3HZ LYS 21 36.945 28.819 -6.821 166 HA PRO 22 HA PRO 22 29.953 27.979 -6.729 167 1HB PRO 22 2HB PRO 22 30.280 30.347 -5.291 168 2HB PRO 22 1HB PRO 22 29.309 28.951 -4.787 169 1HG PRO 22 2HG PRO 22 32.143 29.641 -3.920 170 2HG PRO 22 1HG PRO 22 30.767 29.149 -2.893 171 1HD PRO 22 2HD PRO 22 32.710 27.377 -3.727 172 2HD PRO 22 1HD PRO 22 31.022 26.842 -3.525 173 H DAL 23 H ALA 23 30.346 28.969 -8.607 174 HA DAL 23 HA ALA 23 33.205 29.842 -9.308 175 1HB DAL 23 1HB ALA 23 30.645 31.235 -10.283 176 2HB DAL 23 2HB ALA 23 32.307 31.595 -10.821 177 3HB DAL 23 3HB ALA 23 31.833 31.900 -9.129 178 H VAL 24 H VAL 24 33.039 27.432 -9.552 179 HA VAL 24 HA VAL 24 32.602 26.607 -12.400 180 HB VAL 24 HB VAL 24 33.523 24.967 -9.993 181 1HG1 VAL 24 1HG2 VAL 24 34.286 23.138 -11.497 182 2HG1 VAL 24 2HG2 VAL 24 32.576 23.461 -11.816 183 3HG1 VAL 24 3HG2 VAL 24 33.796 24.044 -12.959 184 1HG2 VAL 24 1HG1 VAL 24 35.351 26.054 -12.233 185 2HG2 VAL 24 2HG1 VAL 24 35.877 25.064 -10.836 186 3HG2 VAL 24 3HG1 VAL 24 35.224 26.695 -10.594 187 H THR 25 H THR 25 30.719 25.630 -13.046 188 HA THR 25 HA THR 25 28.854 24.339 -11.120 189 HB THR 25 HB THR 25 27.953 26.302 -10.895 190 HG1 THR 25 HG1 THR 25 26.373 24.824 -12.698 191 1HG2 THR 25 1HG2 THR 25 26.672 27.726 -12.558 192 2HG2 THR 25 2HG2 THR 25 27.299 26.724 -13.895 193 3HG2 THR 25 3HG2 THR 25 28.416 27.732 -12.936 194 H ILE 26 H ILE 26 28.980 22.704 -11.838 195 HA ILE 26 HA ILE 26 29.508 21.633 -14.376 196 HB ILE 26 HB ILE 26 29.858 20.842 -11.928 197 1HG1 ILE 26 2HG1 ILE 26 29.180 18.342 -13.597 198 2HG1 ILE 26 1HG1 ILE 26 30.379 19.440 -14.183 199 1HG2 ILE 26 1HG2 ILE 26 28.365 19.113 -10.877 200 2HG2 ILE 26 2HG2 ILE 26 27.223 19.219 -12.237 201 3HG2 ILE 26 3HG2 ILE 26 27.427 20.619 -11.142 202 1HD1 ILE 26 1HD1 ILE 26 30.542 18.283 -11.350 203 2HD1 ILE 26 2HD1 ILE 26 31.749 19.277 -12.183 204 3HD1 ILE 26 3HD1 ILE 26 31.406 17.616 -12.776 205 H ARG 27 H ARG 27 28.354 20.021 -15.667 206 HA ARG 27 HA ARG 27 25.343 19.998 -15.580 207 1HB ARG 27 2HB ARG 27 25.683 21.724 -17.086 208 2HB ARG 27 1HB ARG 27 26.760 20.661 -18.122 209 1HG ARG 27 2HG ARG 27 24.890 19.319 -18.670 210 2HG ARG 27 1HG ARG 27 23.798 20.286 -17.648 211 1HD ARG 27 2HD ARG 27 25.293 21.449 -20.113 212 2HD ARG 27 1HD ARG 27 23.737 20.642 -20.246 213 HE ARG 27 HE ARG 27 23.614 22.815 -18.242 214 1HH1 ARG 27 2HH1 ARG 27 23.342 22.273 -21.793 215 2HH1 ARG 27 1HH1 ARG 27 22.363 23.819 -21.930 216 1HH2 ARG 27 1HH2 ARG 27 22.510 24.510 -18.570 217 2HH2 ARG 27 2HH2 ARG 27 21.932 24.982 -20.246 218 H CYS 28 H CYS 28 25.336 18.230 -15.170 219 HA CYS 28 HA CYS 28 26.883 15.821 -16.314 220 1HB CYS 28 1HB CYS 28 25.226 16.050 -13.727 221 2HB CYS 28 2HB CYS 28 26.008 14.569 -14.331 222 H GLU 29 H GLU 29 25.803 15.555 -18.188 223 HA GLU 29 HA GLU 29 22.932 16.161 -18.575 224 1HB GLU 29 1HB GLU 29 25.038 15.023 -20.515 225 2HB GLU 29 2HB GLU 29 23.377 15.308 -21.012 226 1HG GLU 29 1HG GLU 29 23.571 17.747 -20.561 227 2HG GLU 29 2HG GLU 29 25.244 17.531 -20.028 Start of MODEL 40 1 1H SER 1 1H SER 1 26.131 9.405 -19.659 2 2H SER 1 2H SER 1 26.615 8.458 -18.395 3 3H SER 1 3H SER 1 25.011 8.780 -18.618 4 HA SER 1 HA SER 1 25.307 11.114 -18.156 5 1HB SER 1 2HB SER 1 24.745 9.549 -16.300 6 2HB SER 1 1HB SER 1 26.468 9.241 -16.011 7 HG SER 1 HG SER 1 26.703 11.487 -15.613 8 H LYS 2 H LYS 2 26.717 12.721 -18.451 9 HA LYS 2 HA LYS 2 29.684 12.393 -17.903 10 1HB LYS 2 1HB LYS 2 30.457 13.362 -19.924 11 2HB LYS 2 2HB LYS 2 29.496 11.946 -20.266 12 1HG LYS 2 1HG LYS 2 27.624 13.419 -21.071 13 2HG LYS 2 2HG LYS 2 28.565 14.851 -20.727 14 1HD LYS 2 2HD LYS 2 29.523 12.677 -22.701 15 2HD LYS 2 1HD LYS 2 28.420 13.941 -23.177 16 1HE LYS 2 2HE LYS 2 31.216 14.568 -22.052 17 2HE LYS 2 1HE LYS 2 30.912 14.260 -23.762 18 1HZ LYS 2 1HZ LYS 2 29.384 16.156 -23.802 19 2HZ LYS 2 2HZ LYS 2 30.886 16.623 -23.294 20 3HZ LYS 2 3HZ LYS 2 29.657 16.464 -22.202 21 H TYR 3 H TYR 3 30.735 14.213 -17.224 22 HA TYR 3 HA TYR 3 29.020 16.489 -16.185 23 1HB TYR 3 2HB TYR 3 30.660 17.133 -14.757 24 2HB TYR 3 1HB TYR 3 30.507 15.433 -14.546 25 HD1 TYR 3 HD1 TYR 3 32.424 13.969 -15.970 26 HD2 TYR 3 HD2 TYR 3 32.916 18.049 -14.707 27 HE1 TYR 3 HE1 TYR 3 34.854 13.754 -16.122 28 HE2 TYR 3 HE2 TYR 3 35.326 17.739 -14.769 29 HH TYR 3 HH TYR 3 36.801 14.704 -15.808 30 H GLU 4 H GLU 4 29.096 18.440 -17.073 31 HA GLU 4 HA GLU 4 31.484 19.282 -18.870 32 1HB GLU 4 2HB GLU 4 30.013 19.084 -20.536 33 2HB GLU 4 1HB GLU 4 28.573 19.256 -19.595 34 1HG GLU 4 1HG GLU 4 28.976 21.790 -19.511 35 2HG GLU 4 2HG GLU 4 30.335 21.559 -20.601 36 H TYR 5 H TYR 5 32.630 20.387 -17.413 37 HA TYR 5 HA TYR 5 31.217 22.375 -15.588 38 1HB TYR 5 2HB TYR 5 32.401 21.982 -13.742 39 2HB TYR 5 1HB TYR 5 32.183 20.364 -14.317 40 HD1 TYR 5 HD1 TYR 5 34.732 20.200 -16.201 41 HD2 TYR 5 HD2 TYR 5 34.086 21.422 -12.138 42 HE1 TYR 5 HE1 TYR 5 37.132 19.958 -15.698 43 HE2 TYR 5 HE2 TYR 5 36.455 21.220 -11.705 44 HH TYR 5 HH TYR 5 38.431 20.653 -12.494 45 H THR 6 H THR 6 31.712 24.192 -15.974 46 HA THR 6 HA THR 6 33.879 24.811 -18.024 47 HB THR 6 HB THR 6 31.559 26.735 -17.314 48 HG1 THR 6 HG1 THR 6 30.670 24.676 -17.647 49 1HG2 THR 6 1HG2 THR 6 32.805 25.967 -20.004 50 2HG2 THR 6 2HG2 THR 6 33.332 27.390 -19.074 51 3HG2 THR 6 3HG2 THR 6 31.643 27.273 -19.714 52 H ILE 7 H ILE 7 35.552 26.156 -17.574 53 HA ILE 7 HA ILE 7 35.645 27.660 -14.916 54 HB ILE 7 HB ILE 7 37.846 25.709 -15.850 55 1HG1 ILE 7 2HG1 ILE 7 37.229 24.475 -13.470 56 2HG1 ILE 7 1HG1 ILE 7 35.703 25.306 -13.678 57 1HG2 ILE 7 1HG2 ILE 7 38.722 27.645 -14.587 58 2HG2 ILE 7 2HG2 ILE 7 38.947 26.147 -13.659 59 3HG2 ILE 7 3HG2 ILE 7 37.631 27.285 -13.218 60 1HD1 ILE 7 1HD1 ILE 7 35.693 23.968 -16.031 61 2HD1 ILE 7 2HD1 ILE 7 35.268 23.241 -14.490 62 3HD1 ILE 7 3HD1 ILE 7 36.893 22.954 -15.180 63 HA DPR 8 HA PRO 8 38.177 30.524 -17.289 64 1HB DPR 8 2HB PRO 8 37.351 32.152 -15.910 65 2HB DPR 8 1HB PRO 8 36.687 32.852 -17.397 66 1HG DPR 8 2HG PRO 8 35.051 32.306 -15.270 67 2HG DPR 8 1HG PRO 8 34.493 31.948 -16.930 68 1HD DPR 8 2HD PRO 8 35.452 29.982 -14.833 69 2HD DPR 8 1HD PRO 8 34.293 29.730 -16.157 70 H SER 9 H SER 9 38.697 30.249 -19.316 71 HA SER 9 HA SER 9 36.882 30.851 -21.661 72 1HB SER 9 2HB SER 9 38.894 30.532 -23.031 73 2HB SER 9 1HB SER 9 39.210 31.693 -21.739 74 HG SER 9 HG SER 9 40.139 29.966 -20.540 75 H TYR 10 H TYR 10 37.683 28.003 -19.796 76 HA TYR 10 HA TYR 10 37.526 26.195 -22.261 77 1HB TYR 10 1HB TYR 10 38.825 25.938 -19.473 78 2HB TYR 10 2HB TYR 10 38.219 24.486 -20.157 79 HD1 TYR 10 HD1 TYR 10 40.870 27.037 -20.557 80 HD2 TYR 10 HD2 TYR 10 39.114 23.486 -22.257 81 HE1 TYR 10 HE1 TYR 10 42.900 26.580 -21.798 82 HE2 TYR 10 HE2 TYR 10 41.147 23.066 -23.474 83 HH TYR 10 HH TYR 10 43.951 25.258 -23.218 84 H THR 11 H THR 11 35.910 24.785 -22.552 85 HA THR 11 HA THR 11 33.890 24.218 -20.332 86 HB THR 11 HB THR 11 33.726 23.553 -23.326 87 HG1 THR 11 HG1 THR 11 33.807 25.797 -22.988 88 1HG2 THR 11 1HG2 THR 11 31.273 23.331 -22.998 89 2HG2 THR 11 2HG2 THR 11 31.408 23.875 -21.300 90 3HG2 THR 11 3HG2 THR 11 32.087 22.314 -21.784 91 H PHE 12 H PHE 12 34.754 22.666 -19.232 92 HA PHE 12 HA PHE 12 36.718 20.610 -20.455 93 1HB PHE 12 1HB PHE 12 36.137 21.263 -17.540 94 2HB PHE 12 2HB PHE 12 37.046 19.859 -18.006 95 HD1 PHE 12 HD1 PHE 12 37.197 23.537 -17.628 96 HD2 PHE 12 HD2 PHE 12 39.371 20.090 -19.023 97 HE1 PHE 12 HE1 PHE 12 39.296 24.683 -17.256 98 HE2 PHE 12 HE2 PHE 12 41.447 21.308 -18.702 99 HZ PHE 12 HZ PHE 12 41.421 23.596 -17.768 100 H ARG 13 H ARG 13 35.584 18.819 -21.153 101 HA ARG 13 HA ARG 13 33.007 17.954 -19.734 102 1HB ARG 13 2HB ARG 13 33.249 17.722 -22.747 103 2HB ARG 13 1HB ARG 13 31.826 17.615 -21.690 104 1HG ARG 13 2HG ARG 13 31.821 20.066 -21.391 105 2HG ARG 13 1HG ARG 13 33.278 20.185 -22.338 106 1HD ARG 13 2HD ARG 13 31.523 20.830 -23.806 107 2HD ARG 13 1HD ARG 13 32.074 19.257 -24.369 108 HE ARG 13 HE ARG 13 29.747 18.929 -22.591 109 1HH1 ARG 13 2HH2 ARG 13 30.448 19.932 -25.979 110 2HH1 ARG 13 1HH2 ARG 13 28.741 19.452 -26.449 111 1HH2 ARG 13 1HH1 ARG 13 27.880 18.444 -23.281 112 2HH2 ARG 13 2HH1 ARG 13 27.405 18.677 -25.038 113 H GLY 14 H GLY 14 33.156 15.946 -19.001 114 1HA GLY 14 2HA GLY 14 34.281 13.674 -20.606 115 2HA GLY 14 1HA GLY 14 35.267 14.069 -19.203 116 HA PRO 15 HA PRO 15 31.597 11.280 -17.846 117 1HB PRO 15 1HB PRO 15 32.646 8.850 -17.268 118 2HB PRO 15 2HB PRO 15 32.407 9.420 -18.934 119 1HG PRO 15 2HG PRO 15 34.956 9.459 -17.276 120 2HG PRO 15 1HG PRO 15 34.738 8.814 -18.940 121 1HD PRO 15 2HD PRO 15 35.700 11.410 -18.407 122 2HD PRO 15 1HD PRO 15 34.753 11.037 -19.872 123 H GLY 16 H GLY 16 30.946 10.341 -15.787 124 1HA GLY 16 1HA GLY 16 30.911 10.097 -13.402 125 2HA GLY 16 2HA GLY 16 32.531 10.777 -13.300 126 H CYS 17 H CYS 17 29.361 11.424 -12.685 127 HA CYS 17 HA CYS 17 29.652 14.459 -12.741 128 1HB CYS 17 2HB CYS 17 27.159 12.707 -12.227 129 2HB CYS 17 1HB CYS 17 27.175 14.474 -12.282 130 HA PRO 18 HA PRO 18 30.086 14.462 -8.105 131 1HB PRO 18 2HB PRO 18 32.448 15.780 -7.805 132 2HB PRO 18 1HB PRO 18 32.374 14.055 -8.222 133 1HG PRO 18 1HG PRO 18 32.945 16.406 -10.084 134 2HG PRO 18 2HG PRO 18 33.790 14.831 -10.008 135 1HD PRO 18 2HD PRO 18 31.636 15.450 -11.806 136 2HD PRO 18 1HD PRO 18 32.106 13.800 -11.323 137 H THR 19 H THR 19 30.252 16.459 -6.710 138 HA THR 19 HA THR 19 29.071 18.943 -8.052 139 HB THR 19 HB THR 19 27.491 18.395 -6.510 140 HG1 THR 19 HG1 THR 19 27.518 20.310 -5.348 141 1HG2 THR 19 1HG2 THR 19 29.483 18.609 -4.169 142 2HG2 THR 19 2HG2 THR 19 27.701 18.478 -4.028 143 3HG2 THR 19 3HG2 THR 19 28.652 17.108 -4.680 144 H VAL 20 H VAL 20 29.971 20.893 -7.531 145 HA VAL 20 HA VAL 20 32.964 20.848 -6.823 146 HB VAL 20 HB VAL 20 33.613 22.021 -8.930 147 1HG1 VAL 20 1HG2 VAL 20 33.779 20.053 -10.401 148 2HG1 VAL 20 2HG2 VAL 20 33.955 19.545 -8.709 149 3HG1 VAL 20 3HG2 VAL 20 32.418 19.267 -9.562 150 1HG2 VAL 20 1HG1 VAL 20 30.794 21.548 -9.953 151 2HG2 VAL 20 2HG1 VAL 20 31.653 23.085 -9.806 152 3HG2 VAL 20 3HG1 VAL 20 32.156 21.920 -11.054 153 H LYS 21 H LYS 21 34.049 22.774 -6.581 154 HA LYS 21 HA LYS 21 33.800 24.736 -4.962 155 1HB LYS 21 1HB LYS 21 34.339 25.620 -7.852 156 2HB LYS 21 2HB LYS 21 34.929 26.406 -6.406 157 1HG LYS 21 2HG LYS 21 35.902 23.722 -7.505 158 2HG LYS 21 1HG LYS 21 36.657 25.289 -7.750 159 1HD LYS 21 1HD LYS 21 37.068 25.479 -5.285 160 2HD LYS 21 2HD LYS 21 36.331 23.897 -5.036 161 1HE LYS 21 2HE LYS 21 38.849 24.302 -6.805 162 2HE LYS 21 1HE LYS 21 38.930 24.058 -5.067 163 1HZ LYS 21 1HZ LYS 21 37.729 22.109 -6.964 164 2HZ LYS 21 2HZ LYS 21 39.204 21.975 -6.234 165 3HZ LYS 21 3HZ LYS 21 37.825 21.911 -5.327 166 HA PRO 22 HA PRO 22 30.214 27.628 -5.853 167 1HB PRO 22 1HB PRO 22 30.708 29.761 -4.164 168 2HB PRO 22 2HB PRO 22 30.070 28.187 -3.643 169 1HG PRO 22 1HG PRO 22 32.939 29.182 -3.444 170 2HG PRO 22 2HG PRO 22 31.976 28.338 -2.198 171 1HD PRO 22 1HD PRO 22 33.802 27.040 -3.880 172 2HD PRO 22 2HD PRO 22 32.361 26.218 -3.228 173 H DAL 23 H ALA 23 30.320 28.540 -7.822 174 HA DAL 23 HA ALA 23 32.865 29.906 -8.809 175 1HB DAL 23 1HB ALA 23 30.059 31.062 -9.319 176 2HB DAL 23 2HB ALA 23 31.305 31.766 -8.253 177 3HB DAL 23 3HB ALA 23 31.589 31.664 -10.012 178 H VAL 24 H VAL 24 32.856 27.446 -9.250 179 HA VAL 24 HA VAL 24 32.303 26.964 -12.139 180 HB VAL 24 HB VAL 24 33.395 25.032 -10.044 181 1HG1 VAL 24 1HG1 VAL 24 32.512 23.834 -12.109 182 2HG1 VAL 24 2HG1 VAL 24 34.258 23.595 -11.947 183 3HG1 VAL 24 3HG1 VAL 24 33.605 24.749 -13.146 184 1HG2 VAL 24 1HG2 VAL 24 35.733 25.368 -10.889 185 2HG2 VAL 24 2HG2 VAL 24 35.142 26.645 -12.003 186 3HG2 VAL 24 3HG2 VAL 24 35.027 26.855 -10.245 187 H THR 25 H THR 25 30.344 26.006 -12.832 188 HA THR 25 HA THR 25 28.541 24.616 -10.867 189 HB THR 25 HB THR 25 26.679 25.559 -12.161 190 HG1 THR 25 HG1 THR 25 28.562 27.509 -12.943 191 1HG2 THR 25 1HG2 THR 25 28.117 27.731 -10.529 192 2HG2 THR 25 2HG2 THR 25 27.029 26.479 -9.871 193 3HG2 THR 25 3HG2 THR 25 26.387 27.734 -10.964 194 H ILE 26 H ILE 26 29.035 22.786 -11.641 195 HA ILE 26 HA ILE 26 29.506 21.827 -14.236 196 HB ILE 26 HB ILE 26 30.011 20.973 -11.889 197 1HG1 ILE 26 1HG1 ILE 26 29.178 18.426 -13.393 198 2HG1 ILE 26 2HG1 ILE 26 30.231 19.512 -14.203 199 1HG2 ILE 26 1HG2 ILE 26 27.367 19.358 -11.911 200 2HG2 ILE 26 2HG2 ILE 26 27.698 20.775 -10.858 201 3HG2 ILE 26 3HG2 ILE 26 28.652 19.273 -10.680 202 1HD1 ILE 26 1HD1 ILE 26 30.803 18.409 -11.395 203 2HD1 ILE 26 2HD1 ILE 26 31.857 19.510 -12.281 204 3HD1 ILE 26 3HD1 ILE 26 31.591 17.849 -12.907 205 H ARG 27 H ARG 27 28.223 20.030 -15.349 206 HA ARG 27 HA ARG 27 25.259 20.272 -15.307 207 1HB ARG 27 1HB ARG 27 25.749 21.896 -16.962 208 2HB ARG 27 2HB ARG 27 26.768 20.708 -17.892 209 1HG ARG 27 1HG ARG 27 24.877 19.437 -18.409 210 2HG ARG 27 2HG ARG 27 23.789 20.476 -17.455 211 1HD ARG 27 2HD ARG 27 25.359 21.483 -19.940 212 2HD ARG 27 1HD ARG 27 23.774 20.729 -20.060 213 HE ARG 27 HE ARG 27 23.569 22.912 -18.141 214 1HH1 ARG 27 2HH1 ARG 27 23.870 22.525 -21.710 215 2HH1 ARG 27 1HH1 ARG 27 23.047 24.150 -21.931 216 1HH2 ARG 27 1HH2 ARG 27 22.667 24.702 -18.563 217 2HH2 ARG 27 2HH2 ARG 27 22.422 25.282 -20.286 218 H CYS 28 H CYS 28 24.906 18.519 -15.210 219 HA CYS 28 HA CYS 28 26.438 16.037 -16.240 220 1HB CYS 28 1HB CYS 28 26.035 15.977 -13.719 221 2HB CYS 28 2HB CYS 28 24.294 15.827 -14.031 222 H GLU 29 H GLU 29 25.431 15.040 -17.927 223 HA GLU 29 HA GLU 29 23.345 16.318 -19.306 224 1HB GLU 29 2HB GLU 29 23.363 14.766 -21.055 225 2HB GLU 29 1HB GLU 29 24.990 15.148 -20.531 226 1HG GLU 29 2HG GLU 29 25.199 12.989 -19.414 227 2HG GLU 29 1HG GLU 29 23.506 12.595 -19.780 Start of MODEL 41 1 1H SER 1 1H SER 1 24.871 8.780 -18.042 2 2H SER 1 2H SER 1 26.049 9.206 -19.120 3 3H SER 1 3H SER 1 26.462 8.542 -17.665 4 HA SER 1 HA SER 1 25.122 11.164 -18.046 5 1HB SER 1 2HB SER 1 26.154 9.779 -15.501 6 2HB SER 1 1HB SER 1 25.571 11.452 -15.568 7 HG SER 1 HG SER 1 23.954 9.986 -14.968 8 H LYS 2 H LYS 2 26.505 12.786 -18.411 9 HA LYS 2 HA LYS 2 29.459 12.556 -17.761 10 1HB LYS 2 2HB LYS 2 30.249 13.364 -19.864 11 2HB LYS 2 1HB LYS 2 29.397 11.849 -20.044 12 1HG LYS 2 1HG LYS 2 27.461 13.012 -21.077 13 2HG LYS 2 2HG LYS 2 28.209 14.577 -20.866 14 1HD LYS 2 1HD LYS 2 29.490 12.314 -22.562 15 2HD LYS 2 2HD LYS 2 28.250 13.389 -23.184 16 1HE LYS 2 2HE LYS 2 29.710 15.392 -22.839 17 2HE LYS 2 1HE LYS 2 30.989 14.359 -22.176 18 1HZ LYS 2 1HZ LYS 2 31.053 13.169 -24.310 19 2HZ LYS 2 2HZ LYS 2 31.328 14.782 -24.540 20 3HZ LYS 2 3HZ LYS 2 29.860 14.131 -24.929 21 H TYR 3 H TYR 3 30.477 14.405 -17.232 22 HA TYR 3 HA TYR 3 28.681 16.716 -16.406 23 1HB TYR 3 1HB TYR 3 30.224 17.380 -14.838 24 2HB TYR 3 2HB TYR 3 29.900 15.708 -14.603 25 HD1 TYR 3 HD1 TYR 3 31.871 14.086 -15.921 26 HD2 TYR 3 HD2 TYR 3 32.493 18.059 -14.404 27 HE1 TYR 3 HE1 TYR 3 34.278 13.698 -15.797 28 HE2 TYR 3 HE2 TYR 3 34.868 17.593 -14.225 29 HH TYR 3 HH TYR 3 36.241 14.490 -15.229 30 H GLU 4 H GLU 4 28.868 18.637 -17.293 31 HA GLU 4 HA GLU 4 31.383 19.421 -18.930 32 1HB GLU 4 1HB GLU 4 29.992 19.373 -20.669 33 2HB GLU 4 2HB GLU 4 28.516 19.572 -19.787 34 1HG GLU 4 2HG GLU 4 29.078 22.076 -19.543 35 2HG GLU 4 1HG GLU 4 30.442 21.821 -20.622 36 H TYR 5 H TYR 5 32.506 20.391 -17.365 37 HA TYR 5 HA TYR 5 31.113 22.367 -15.515 38 1HB TYR 5 2HB TYR 5 32.126 21.762 -13.630 39 2HB TYR 5 1HB TYR 5 31.904 20.196 -14.327 40 HD1 TYR 5 HD1 TYR 5 33.737 21.150 -11.982 41 HD2 TYR 5 HD2 TYR 5 34.569 20.059 -16.049 42 HE1 TYR 5 HE1 TYR 5 36.069 20.863 -11.431 43 HE2 TYR 5 HE2 TYR 5 36.920 19.691 -15.415 44 HH TYR 5 HH TYR 5 38.063 20.239 -12.128 45 H THR 6 H THR 6 31.698 24.161 -15.821 46 HA THR 6 HA THR 6 34.029 24.757 -17.679 47 HB THR 6 HB THR 6 31.656 26.651 -17.066 48 HG1 THR 6 HG1 THR 6 30.863 24.620 -17.700 49 1HG2 THR 6 1HG2 THR 6 33.588 27.512 -18.503 50 2HG2 THR 6 2HG2 THR 6 32.015 27.399 -19.391 51 3HG2 THR 6 3HG2 THR 6 33.276 26.165 -19.627 52 H ILE 7 H ILE 7 35.623 26.045 -17.062 53 HA ILE 7 HA ILE 7 35.620 27.305 -14.268 54 HB ILE 7 HB ILE 7 37.869 25.543 -15.423 55 1HG1 ILE 7 2HG1 ILE 7 37.295 24.049 -13.173 56 2HG1 ILE 7 1HG1 ILE 7 35.751 24.863 -13.280 57 1HG2 ILE 7 1HG2 ILE 7 37.627 26.824 -12.631 58 2HG2 ILE 7 2HG2 ILE 7 38.716 27.343 -13.948 59 3HG2 ILE 7 3HG2 ILE 7 38.964 25.761 -13.180 60 1HD1 ILE 7 1HD1 ILE 7 35.637 23.799 -15.697 61 2HD1 ILE 7 2HD1 ILE 7 35.425 22.831 -14.238 62 3HD1 ILE 7 3HD1 ILE 7 36.979 22.775 -15.101 63 HA DPR 8 HA PRO 8 38.126 30.492 -16.282 64 1HB DPR 8 2HB PRO 8 37.466 31.759 -14.489 65 2HB DPR 8 1HB PRO 8 36.770 32.803 -15.746 66 1HG DPR 8 2HG PRO 8 35.222 31.852 -13.679 67 2HG DPR 8 1HG PRO 8 34.552 31.963 -15.331 68 1HD DPR 8 2HD PRO 8 35.355 29.478 -13.840 69 2HD DPR 8 1HD PRO 8 34.244 29.640 -15.219 70 H SER 9 H SER 9 38.260 30.037 -18.428 71 HA SER 9 HA SER 9 36.085 30.956 -20.364 72 1HB SER 9 2HB SER 9 37.970 32.614 -20.407 73 2HB SER 9 1HB SER 9 39.119 31.304 -20.747 74 HG SER 9 HG SER 9 36.847 32.013 -22.300 75 H TYR 10 H TYR 10 37.446 28.303 -19.045 76 HA TYR 10 HA TYR 10 37.801 26.784 -21.677 77 1HB TYR 10 2HB TYR 10 39.686 27.187 -19.698 78 2HB TYR 10 1HB TYR 10 38.895 25.848 -18.949 79 HD1 TYR 10 HD1 TYR 10 38.958 23.560 -20.118 80 HD2 TYR 10 HD2 TYR 10 41.007 26.962 -21.772 81 HE1 TYR 10 HE1 TYR 10 40.312 22.085 -21.522 82 HE2 TYR 10 HE2 TYR 10 42.328 25.457 -23.170 83 HH TYR 10 HH TYR 10 41.894 21.939 -23.046 84 H THR 11 H THR 11 36.314 25.216 -22.109 85 HA THR 11 HA THR 11 34.332 24.364 -19.989 86 HB THR 11 HB THR 11 34.295 23.739 -22.991 87 HG1 THR 11 HG1 THR 11 34.411 25.974 -22.648 88 1HG2 THR 11 1HG2 THR 11 31.886 24.157 -21.092 89 2HG2 THR 11 2HG2 THR 11 32.541 22.556 -21.474 90 3HG2 THR 11 3HG2 THR 11 31.835 23.557 -22.773 91 H PHE 12 H PHE 12 34.820 22.644 -18.977 92 HA PHE 12 HA PHE 12 36.793 20.520 -20.113 93 1HB PHE 12 2HB PHE 12 36.144 21.167 -17.208 94 2HB PHE 12 1HB PHE 12 37.023 19.747 -17.698 95 HD1 PHE 12 HD1 PHE 12 37.212 23.474 -17.417 96 HD2 PHE 12 HD2 PHE 12 39.423 19.921 -18.447 97 HE1 PHE 12 HE1 PHE 12 39.303 24.651 -17.087 98 HE2 PHE 12 HE2 PHE 12 41.492 21.161 -18.158 99 HZ PHE 12 HZ PHE 12 41.445 23.523 -17.445 100 H ARG 13 H ARG 13 35.620 18.871 -20.933 101 HA ARG 13 HA ARG 13 32.940 18.079 -19.673 102 1HB ARG 13 1HB ARG 13 33.328 17.973 -22.691 103 2HB ARG 13 2HB ARG 13 31.848 17.861 -21.718 104 1HG ARG 13 2HG ARG 13 31.934 20.303 -21.284 105 2HG ARG 13 1HG ARG 13 33.425 20.404 -22.173 106 1HD ARG 13 1HD ARG 13 31.749 21.191 -23.665 107 2HD ARG 13 2HD ARG 13 32.272 19.633 -24.288 108 HE ARG 13 HE ARG 13 29.559 20.293 -23.137 109 1HH1 ARG 13 1HH2 ARG 13 31.583 17.610 -24.431 110 2HH1 ARG 13 2HH2 ARG 13 30.065 16.603 -24.652 111 1HH2 ARG 13 1HH1 ARG 13 27.967 19.040 -23.447 112 2HH2 ARG 13 2HH1 ARG 13 28.181 17.354 -24.138 113 H GLY 14 H GLY 14 32.877 16.005 -19.110 114 1HA GLY 14 1HA GLY 14 33.955 13.779 -20.758 115 2HA GLY 14 2HA GLY 14 34.990 14.086 -19.370 116 HA PRO 15 HA PRO 15 31.257 11.352 -18.041 117 1HB PRO 15 1HB PRO 15 32.170 8.807 -17.825 118 2HB PRO 15 2HB PRO 15 31.768 9.563 -19.381 119 1HG PRO 15 1HG PRO 15 34.501 9.263 -18.082 120 2HG PRO 15 2HG PRO 15 34.024 8.811 -19.756 121 1HD PRO 15 2HD PRO 15 35.250 11.264 -19.125 122 2HD PRO 15 1HD PRO 15 34.079 11.116 -20.463 123 H GLY 16 H GLY 16 30.761 10.312 -16.051 124 1HA GLY 16 2HA GLY 16 30.854 9.882 -13.677 125 2HA GLY 16 1HA GLY 16 32.587 10.185 -13.728 126 H CYS 17 H CYS 17 29.601 11.507 -12.877 127 HA CYS 17 HA CYS 17 30.392 14.384 -12.902 128 1HB CYS 17 2HB CYS 17 27.783 13.101 -11.934 129 2HB CYS 17 1HB CYS 17 28.080 14.828 -12.170 130 HA PRO 18 HA PRO 18 31.572 14.222 -8.348 131 1HB PRO 18 2HB PRO 18 33.712 15.932 -8.348 132 2HB PRO 18 1HB PRO 18 33.837 14.255 -8.910 133 1HG PRO 18 1HG PRO 18 33.525 16.790 -10.613 134 2HG PRO 18 2HG PRO 18 34.706 15.463 -10.843 135 1HD PRO 18 1HD PRO 18 32.244 15.543 -12.227 136 2HD PRO 18 2HD PRO 18 33.050 14.029 -11.742 137 H THR 19 H THR 19 31.713 16.029 -6.743 138 HA THR 19 HA THR 19 29.711 18.225 -7.297 139 HB THR 19 HB THR 19 30.520 18.625 -4.664 140 HG1 THR 19 HG1 THR 19 30.247 16.634 -3.670 141 1HG2 THR 19 1HG2 THR 19 28.326 17.844 -3.979 142 2HG2 THR 19 2HG2 THR 19 28.075 17.142 -5.625 143 3HG2 THR 19 3HG2 THR 19 28.278 18.903 -5.417 144 H VAL 20 H VAL 20 30.088 20.360 -6.977 145 HA VAL 20 HA VAL 20 32.858 21.078 -7.842 146 HB VAL 20 HB VAL 20 31.914 23.157 -8.894 147 1HG1 VAL 20 1HG1 VAL 20 31.156 22.144 -10.969 148 2HG1 VAL 20 2HG1 VAL 20 30.724 20.631 -10.121 149 3HG1 VAL 20 3HG1 VAL 20 32.419 21.135 -10.237 150 1HG2 VAL 20 1HG2 VAL 20 29.741 23.479 -7.705 151 2HG2 VAL 20 2HG2 VAL 20 29.086 22.026 -8.497 152 3HG2 VAL 20 3HG2 VAL 20 29.504 23.458 -9.467 153 H LYS 21 H LYS 21 33.912 22.990 -7.346 154 HA LYS 21 HA LYS 21 33.491 24.074 -4.548 155 1HB LYS 21 2HB LYS 21 35.726 25.013 -4.718 156 2HB LYS 21 1HB LYS 21 35.693 23.282 -4.902 157 1HG LYS 21 2HG LYS 21 37.470 24.202 -6.146 158 2HG LYS 21 1HG LYS 21 36.352 23.426 -7.250 159 1HD LYS 21 1HD LYS 21 35.538 25.530 -8.134 160 2HD LYS 21 2HD LYS 21 36.288 26.465 -6.853 161 1HE LYS 21 1HE LYS 21 37.648 26.901 -8.725 162 2HE LYS 21 2HE LYS 21 38.605 25.785 -7.758 163 1HZ LYS 21 1HZ LYS 21 38.652 25.208 -10.106 164 2HZ LYS 21 2HZ LYS 21 37.901 23.989 -9.282 165 3HZ LYS 21 3HZ LYS 21 37.008 25.055 -10.175 166 HA PRO 22 HA PRO 22 31.485 27.665 -6.065 167 1HB PRO 22 2HB PRO 22 32.336 29.971 -4.734 168 2HB PRO 22 1HB PRO 22 31.407 28.639 -4.028 169 1HG PRO 22 2HG PRO 22 34.416 29.075 -3.883 170 2HG PRO 22 1HG PRO 22 33.298 28.677 -2.548 171 1HD PRO 22 2HD PRO 22 34.812 26.770 -3.824 172 2HD PRO 22 1HD PRO 22 33.173 26.372 -3.237 173 H DAL 23 H ALA 23 31.359 28.889 -7.811 174 HA DAL 23 HA ALA 23 33.781 30.160 -9.174 175 1HB DAL 23 1HB ALA 23 31.812 31.662 -8.852 176 2HB DAL 23 2HB ALA 23 32.099 31.346 -10.577 177 3HB DAL 23 3HB ALA 23 30.776 30.504 -9.730 178 H VAL 24 H VAL 24 31.761 27.314 -9.413 179 HA VAL 24 HA VAL 24 32.349 26.899 -12.360 180 HB VAL 24 HB VAL 24 32.848 24.961 -10.060 181 1HG1 VAL 24 1HG1 VAL 24 33.531 24.487 -13.082 182 2HG1 VAL 24 2HG1 VAL 24 32.192 23.730 -12.204 183 3HG1 VAL 24 3HG1 VAL 24 33.859 23.330 -11.767 184 1HG2 VAL 24 1HG2 VAL 24 35.345 24.993 -10.580 185 2HG2 VAL 24 2HG2 VAL 24 35.046 26.295 -11.773 186 3HG2 VAL 24 3HG2 VAL 24 34.717 26.562 -10.055 187 H THR 25 H THR 25 30.426 26.037 -13.350 188 HA THR 25 HA THR 25 28.162 25.107 -11.592 189 HB THR 25 HB THR 25 26.674 26.167 -13.213 190 HG1 THR 25 HG1 THR 25 27.431 27.967 -14.370 191 1HG2 THR 25 1HG2 THR 25 26.576 28.480 -12.267 192 2HG2 THR 25 2HG2 THR 25 28.210 28.270 -11.582 193 3HG2 THR 25 3HG2 THR 25 26.858 27.270 -10.986 194 H ILE 26 H ILE 26 28.515 23.157 -12.113 195 HA ILE 26 HA ILE 26 29.163 21.925 -14.557 196 HB ILE 26 HB ILE 26 29.348 21.258 -12.025 197 1HG1 ILE 26 1HG1 ILE 26 28.641 18.670 -13.551 198 2HG1 ILE 26 2HG1 ILE 26 29.825 19.684 -14.267 199 1HG2 ILE 26 1HG2 ILE 26 26.908 21.181 -11.362 200 2HG2 ILE 26 2HG2 ILE 26 26.679 19.750 -12.409 201 3HG2 ILE 26 3HG2 ILE 26 27.753 19.639 -10.992 202 1HD1 ILE 26 1HD1 ILE 26 31.226 19.702 -12.244 203 2HD1 ILE 26 2HD1 ILE 26 30.037 18.719 -11.366 204 3HD1 ILE 26 3HD1 ILE 26 30.913 18.020 -12.785 205 H ARG 27 H ARG 27 27.992 20.228 -15.708 206 HA ARG 27 HA ARG 27 24.992 20.244 -15.705 207 1HB ARG 27 1HB ARG 27 25.357 21.840 -17.357 208 2HB ARG 27 2HB ARG 27 26.448 20.693 -18.281 209 1HG ARG 27 1HG ARG 27 24.592 19.291 -18.751 210 2HG ARG 27 2HG ARG 27 23.486 20.332 -17.807 211 1HD ARG 27 1HD ARG 27 23.882 22.209 -19.483 212 2HD ARG 27 2HD ARG 27 24.950 21.141 -20.415 213 HE ARG 27 HE ARG 27 22.252 19.957 -19.958 214 1HH1 ARG 27 2HH2 ARG 27 24.044 22.070 -22.261 215 2HH1 ARG 27 1HH2 ARG 27 22.799 21.679 -23.551 216 1HH2 ARG 27 2HH1 ARG 27 20.954 19.626 -21.509 217 2HH2 ARG 27 1HH1 ARG 27 21.190 20.404 -23.154 218 H CYS 28 H CYS 28 24.956 18.503 -15.230 219 HA CYS 28 HA CYS 28 26.587 16.052 -16.190 220 1HB CYS 28 2HB CYS 28 26.652 16.212 -13.755 221 2HB CYS 28 1HB CYS 28 24.882 16.038 -13.656 222 H GLU 29 H GLU 29 25.609 15.357 -17.903 223 HA GLU 29 HA GLU 29 22.836 16.080 -18.658 224 1HB GLU 29 1HB GLU 29 24.990 14.446 -20.153 225 2HB GLU 29 2HB GLU 29 23.402 14.720 -20.846 226 1HG GLU 29 1HG GLU 29 23.737 17.186 -20.856 227 2HG GLU 29 2HG GLU 29 25.340 16.986 -20.136 Start of MODEL 42 1 1H SER 1 1H SER 1 26.647 8.554 -17.722 2 2H SER 1 2H SER 1 25.984 9.381 -18.989 3 3H SER 1 3H SER 1 25.025 8.867 -17.746 4 HA SER 1 HA SER 1 25.373 11.233 -17.556 5 1HB SER 1 1HB SER 1 26.822 9.553 -15.425 6 2HB SER 1 2HB SER 1 26.316 11.237 -15.204 7 HG SER 1 HG SER 1 24.626 9.054 -15.873 8 H LYS 2 H LYS 2 26.720 12.831 -18.072 9 HA LYS 2 HA LYS 2 29.735 12.532 -17.964 10 1HB LYS 2 2HB LYS 2 30.179 13.497 -20.118 11 2HB LYS 2 1HB LYS 2 29.374 11.950 -20.222 12 1HG LYS 2 1HG LYS 2 27.216 13.135 -20.895 13 2HG LYS 2 2HG LYS 2 28.071 14.662 -20.793 14 1HD LYS 2 2HD LYS 2 28.113 14.279 -23.078 15 2HD LYS 2 1HD LYS 2 29.710 13.770 -22.612 16 1HE LYS 2 1HE LYS 2 29.039 12.139 -24.176 17 2HE LYS 2 2HE LYS 2 28.798 11.310 -22.639 18 1HZ LYS 2 1HZ LYS 2 26.407 11.855 -22.813 19 2HZ LYS 2 2HZ LYS 2 26.655 12.630 -24.251 20 3HZ LYS 2 3HZ LYS 2 26.915 11.003 -24.134 21 H TYR 3 H TYR 3 30.721 14.291 -17.174 22 HA TYR 3 HA TYR 3 29.017 16.605 -16.232 23 1HB TYR 3 2HB TYR 3 30.652 17.188 -14.729 24 2HB TYR 3 1HB TYR 3 30.468 15.485 -14.576 25 HD1 TYR 3 HD1 TYR 3 32.916 18.025 -14.549 26 HD2 TYR 3 HD2 TYR 3 32.391 14.107 -16.235 27 HE1 TYR 3 HE1 TYR 3 35.321 17.682 -14.576 28 HE2 TYR 3 HE2 TYR 3 34.822 13.865 -16.351 29 HH TYR 3 HH TYR 3 36.777 14.747 -15.899 30 H GLU 4 H GLU 4 29.116 18.511 -17.201 31 HA GLU 4 HA GLU 4 31.631 19.347 -18.814 32 1HB GLU 4 1HB GLU 4 30.197 19.226 -20.508 33 2HB GLU 4 2HB GLU 4 28.733 19.534 -19.642 34 1HG GLU 4 1HG GLU 4 30.783 21.719 -20.297 35 2HG GLU 4 2HG GLU 4 29.456 21.257 -21.375 36 H TYR 5 H TYR 5 32.743 20.376 -17.330 37 HA TYR 5 HA TYR 5 31.364 22.317 -15.425 38 1HB TYR 5 1HB TYR 5 32.532 21.799 -13.597 39 2HB TYR 5 2HB TYR 5 32.390 20.205 -14.262 40 HD1 TYR 5 HD1 TYR 5 34.334 21.428 -12.085 41 HD2 TYR 5 HD2 TYR 5 34.857 20.091 -16.126 42 HE1 TYR 5 HE1 TYR 5 36.714 21.250 -11.718 43 HE2 TYR 5 HE2 TYR 5 37.273 19.902 -15.704 44 HH TYR 5 HH TYR 5 38.671 20.680 -12.557 45 H THR 6 H THR 6 31.806 24.150 -15.908 46 HA THR 6 HA THR 6 33.988 24.760 -17.933 47 HB THR 6 HB THR 6 31.584 26.593 -17.255 48 HG1 THR 6 HG1 THR 6 31.597 24.382 -19.023 49 1HG2 THR 6 1HG2 THR 6 32.945 25.930 -19.918 50 2HG2 THR 6 2HG2 THR 6 33.339 27.375 -18.956 51 3HG2 THR 6 3HG2 THR 6 31.683 27.147 -19.654 52 H ILE 7 H ILE 7 35.640 26.113 -17.442 53 HA ILE 7 HA ILE 7 35.645 27.655 -14.802 54 HB ILE 7 HB ILE 7 37.883 25.720 -15.668 55 1HG1 ILE 7 2HG1 ILE 7 37.232 24.510 -13.284 56 2HG1 ILE 7 1HG1 ILE 7 35.707 25.333 -13.526 57 1HG2 ILE 7 1HG2 ILE 7 38.724 27.669 -14.417 58 2HG2 ILE 7 2HG2 ILE 7 37.611 27.321 -13.061 59 3HG2 ILE 7 3HG2 ILE 7 38.939 26.184 -13.467 60 1HD1 ILE 7 1HD1 ILE 7 35.783 23.961 -15.879 61 2HD1 ILE 7 2HD1 ILE 7 35.251 23.293 -14.358 62 3HD1 ILE 7 3HD1 ILE 7 36.913 22.942 -14.942 63 HA DPR 8 HA PRO 8 38.206 30.522 -17.152 64 1HB DPR 8 1HB PRO 8 37.353 32.150 -15.789 65 2HB DPR 8 2HB PRO 8 36.708 32.842 -17.289 66 1HG DPR 8 2HG PRO 8 35.044 32.297 -15.182 67 2HG DPR 8 1HG PRO 8 34.510 31.934 -16.849 68 1HD DPR 8 2HD PRO 8 35.438 29.974 -14.735 69 2HD DPR 8 1HD PRO 8 34.307 29.716 -16.081 70 H SER 9 H SER 9 38.753 30.234 -19.173 71 HA SER 9 HA SER 9 36.956 30.818 -21.542 72 1HB SER 9 2HB SER 9 39.326 31.675 -21.515 73 2HB SER 9 1HB SER 9 39.913 30.006 -21.413 74 HG SER 9 HG SER 9 38.273 31.112 -23.457 75 H TYR 10 H TYR 10 37.760 27.982 -19.647 76 HA TYR 10 HA TYR 10 37.695 26.167 -22.108 77 1HB TYR 10 1HB TYR 10 38.897 25.932 -19.279 78 2HB TYR 10 2HB TYR 10 38.300 24.472 -19.953 79 HD1 TYR 10 HD1 TYR 10 39.266 23.416 -21.988 80 HD2 TYR 10 HD2 TYR 10 40.955 27.031 -20.354 81 HE1 TYR 10 HE1 TYR 10 41.324 22.990 -23.163 82 HE2 TYR 10 HE2 TYR 10 43.010 26.567 -21.553 83 HH TYR 10 HH TYR 10 43.386 23.699 -23.608 84 H THR 11 H THR 11 36.078 24.780 -22.482 85 HA THR 11 HA THR 11 33.985 24.182 -20.340 86 HB THR 11 HB THR 11 33.902 23.583 -23.350 87 HG1 THR 11 HG1 THR 11 32.772 25.796 -21.973 88 1HG2 THR 11 1HG2 THR 11 31.430 23.430 -23.096 89 2HG2 THR 11 2HG2 THR 11 32.196 22.352 -21.907 90 3HG2 THR 11 3HG2 THR 11 31.539 23.908 -21.376 91 H PHE 12 H PHE 12 34.828 22.607 -19.243 92 HA PHE 12 HA PHE 12 36.772 20.539 -20.483 93 1HB PHE 12 1HB PHE 12 36.157 21.110 -17.566 94 2HB PHE 12 2HB PHE 12 37.102 19.741 -18.071 95 HD1 PHE 12 HD1 PHE 12 37.183 23.377 -17.472 96 HD2 PHE 12 HD2 PHE 12 39.440 20.081 -19.076 97 HE1 PHE 12 HE1 PHE 12 39.254 24.551 -17.024 98 HE2 PHE 12 HE2 PHE 12 41.487 21.326 -18.667 99 HZ PHE 12 HZ PHE 12 41.402 23.558 -17.594 100 H ARG 13 H ARG 13 35.607 18.781 -21.219 101 HA ARG 13 HA ARG 13 33.000 17.942 -19.835 102 1HB ARG 13 2HB ARG 13 33.248 17.745 -22.854 103 2HB ARG 13 1HB ARG 13 31.828 17.673 -21.785 104 1HG ARG 13 1HG ARG 13 32.023 20.144 -21.440 105 2HG ARG 13 2HG ARG 13 33.391 20.162 -22.514 106 1HD ARG 13 1HD ARG 13 31.600 20.907 -23.861 107 2HD ARG 13 2HD ARG 13 31.913 19.265 -24.411 108 HE ARG 13 HE ARG 13 29.751 19.359 -22.369 109 1HH1 ARG 13 2HH1 ARG 13 30.256 19.795 -25.909 110 2HH1 ARG 13 1HH1 ARG 13 28.475 19.448 -26.182 111 1HH2 ARG 13 2HH2 ARG 13 27.793 18.994 -22.847 112 2HH2 ARG 13 1HH2 ARG 13 27.195 19.030 -24.582 113 H GLY 14 H GLY 14 33.027 15.900 -19.189 114 1HA GLY 14 1HA GLY 14 34.030 13.644 -20.846 115 2HA GLY 14 2HA GLY 14 35.112 13.958 -19.494 116 HA PRO 15 HA PRO 15 31.508 11.224 -17.934 117 1HB PRO 15 2HB PRO 15 32.647 8.869 -17.243 118 2HB PRO 15 1HB PRO 15 32.375 9.340 -18.935 119 1HG PRO 15 1HG PRO 15 34.936 9.550 -17.307 120 2HG PRO 15 2HG PRO 15 34.727 8.815 -18.935 121 1HD PRO 15 1HD PRO 15 35.600 11.468 -18.535 122 2HD PRO 15 2HD PRO 15 34.664 10.986 -19.976 123 H GLY 16 H GLY 16 30.926 10.370 -15.814 124 1HA GLY 16 2HA GLY 16 30.957 10.189 -13.436 125 2HA GLY 16 1HA GLY 16 32.574 10.881 -13.402 126 H CYS 17 H CYS 17 29.418 11.509 -12.694 127 HA CYS 17 HA CYS 17 29.738 14.551 -12.691 128 1HB CYS 17 2HB CYS 17 27.193 12.892 -12.161 129 2HB CYS 17 1HB CYS 17 27.293 14.653 -12.279 130 HA PRO 18 HA PRO 18 30.360 14.186 -8.077 131 1HB PRO 18 1HB PRO 18 32.754 15.427 -7.763 132 2HB PRO 18 2HB PRO 18 32.633 13.765 -8.377 133 1HG PRO 18 2HG PRO 18 33.097 16.327 -9.983 134 2HG PRO 18 1HG PRO 18 33.970 14.771 -10.126 135 1HD PRO 18 2HD PRO 18 31.738 15.506 -11.752 136 2HD PRO 18 1HD PRO 18 32.221 13.825 -11.402 137 H THR 19 H THR 19 30.691 16.025 -6.450 138 HA THR 19 HA THR 19 29.158 18.530 -7.158 139 HB THR 19 HB THR 19 29.837 19.068 -4.658 140 HG1 THR 19 HG1 THR 19 31.300 17.345 -4.466 141 1HG2 THR 19 1HG2 THR 19 27.579 18.723 -5.238 142 2HG2 THR 19 2HG2 THR 19 27.974 17.941 -3.675 143 3HG2 THR 19 3HG2 THR 19 27.786 16.938 -5.173 144 H VAL 20 H VAL 20 30.057 20.582 -7.092 145 HA VAL 20 HA VAL 20 33.021 20.753 -6.843 146 HB VAL 20 HB VAL 20 33.368 22.013 -8.977 147 1HG1 VAL 20 1HG1 VAL 20 33.466 20.108 -10.558 148 2HG1 VAL 20 2HG1 VAL 20 32.299 19.204 -9.566 149 3HG1 VAL 20 3HG1 VAL 20 33.913 19.594 -8.921 150 1HG2 VAL 20 1HG2 VAL 20 31.783 22.041 -10.906 151 2HG2 VAL 20 2HG2 VAL 20 31.102 22.884 -9.500 152 3HG2 VAL 20 3HG2 VAL 20 30.544 21.247 -9.891 153 H LYS 21 H LYS 21 33.998 22.733 -6.647 154 HA LYS 21 HA LYS 21 33.649 24.640 -4.906 155 1HB LYS 21 1HB LYS 21 34.198 25.563 -7.787 156 2HB LYS 21 2HB LYS 21 34.731 26.369 -6.329 157 1HG LYS 21 2HG LYS 21 35.838 23.738 -7.431 158 2HG LYS 21 1HG LYS 21 36.528 25.340 -7.643 159 1HD LYS 21 1HD LYS 21 36.858 25.494 -5.118 160 2HD LYS 21 2HD LYS 21 36.211 23.858 -4.999 161 1HE LYS 21 1HE LYS 21 38.539 23.530 -4.860 162 2HE LYS 21 2HE LYS 21 38.183 23.056 -6.515 163 1HZ LYS 21 1HZ LYS 21 39.296 25.696 -5.654 164 2HZ LYS 21 2HZ LYS 21 38.968 25.287 -7.221 165 3HZ LYS 21 3HZ LYS 21 40.140 24.477 -6.384 166 HA PRO 22 HA PRO 22 29.957 27.374 -5.887 167 1HB PRO 22 2HB PRO 22 30.292 29.511 -4.169 168 2HB PRO 22 1HB PRO 22 29.732 27.901 -3.672 169 1HG PRO 22 1HG PRO 22 32.532 29.057 -3.391 170 2HG PRO 22 2HG PRO 22 31.589 28.145 -2.179 171 1HD PRO 22 1HD PRO 22 33.534 26.982 -3.836 172 2HD PRO 22 2HD PRO 22 32.142 26.066 -3.203 173 H DAL 23 H ALA 23 30.066 28.333 -7.847 174 HA DAL 23 HA ALA 23 32.573 29.823 -8.739 175 1HB DAL 23 1HB ALA 23 29.738 30.890 -9.285 176 2HB DAL 23 2HB ALA 23 30.932 31.610 -8.171 177 3HB DAL 23 3HB ALA 23 31.260 31.566 -9.924 178 H VAL 24 H VAL 24 32.591 27.340 -9.212 179 HA VAL 24 HA VAL 24 32.243 26.954 -12.147 180 HB VAL 24 HB VAL 24 33.196 24.967 -10.036 181 1HG1 VAL 24 1HG2 VAL 24 33.581 24.744 -13.122 182 2HG1 VAL 24 2HG2 VAL 24 32.464 23.779 -12.148 183 3HG1 VAL 24 3HG2 VAL 24 34.206 23.583 -11.919 184 1HG2 VAL 24 1HG1 VAL 24 34.829 26.813 -10.110 185 2HG2 VAL 24 2HG1 VAL 24 35.045 26.634 -11.861 186 3HG2 VAL 24 3HG1 VAL 24 35.586 25.344 -10.738 187 H THR 25 H THR 25 30.273 26.150 -12.974 188 HA THR 25 HA THR 25 28.300 24.791 -11.140 189 HB THR 25 HB THR 25 26.576 25.810 -12.544 190 HG1 THR 25 HG1 THR 25 27.916 26.550 -14.192 191 1HG2 THR 25 1HG2 THR 25 26.335 28.019 -11.403 192 2HG2 THR 25 2HG2 THR 25 28.035 27.933 -10.869 193 3HG2 THR 25 3HG2 THR 25 26.846 26.754 -10.254 194 H ILE 26 H ILE 26 28.807 22.958 -11.855 195 HA ILE 26 HA ILE 26 29.380 21.938 -14.414 196 HB ILE 26 HB ILE 26 29.773 21.158 -11.978 197 1HG1 ILE 26 2HG1 ILE 26 29.158 18.617 -13.600 198 2HG1 ILE 26 1HG1 ILE 26 30.295 19.746 -14.234 199 1HG2 ILE 26 1HG2 ILE 26 27.392 20.888 -11.148 200 2HG2 ILE 26 2HG2 ILE 26 27.202 19.457 -12.216 201 3HG2 ILE 26 3HG2 ILE 26 28.382 19.419 -10.880 202 1HD1 ILE 26 1HD1 ILE 26 31.676 19.690 -12.166 203 2HD1 ILE 26 2HD1 ILE 26 30.532 18.568 -11.405 204 3HD1 ILE 26 3HD1 ILE 26 31.482 18.035 -12.838 205 H ARG 27 H ARG 27 28.155 20.105 -15.518 206 HA ARG 27 HA ARG 27 25.191 20.275 -15.557 207 1HB ARG 27 1HB ARG 27 25.669 21.866 -17.248 208 2HB ARG 27 2HB ARG 27 26.741 20.682 -18.122 209 1HG ARG 27 2HG ARG 27 24.894 19.338 -18.633 210 2HG ARG 27 1HG ARG 27 23.761 20.377 -17.734 211 1HD ARG 27 2HD ARG 27 25.348 21.339 -20.225 212 2HD ARG 27 1HD ARG 27 23.784 20.544 -20.341 213 HE ARG 27 HE ARG 27 23.307 22.689 -18.535 214 1HH1 ARG 27 1HH1 ARG 27 24.403 22.562 -21.965 215 2HH1 ARG 27 2HH1 ARG 27 23.664 24.220 -22.237 216 1HH2 ARG 27 1HH2 ARG 27 22.538 24.528 -19.008 217 2HH2 ARG 27 2HH2 ARG 27 22.692 25.241 -20.692 218 H CYS 28 H CYS 28 24.897 18.504 -15.408 219 HA CYS 28 HA CYS 28 26.595 16.048 -16.238 220 1HB CYS 28 2HB CYS 28 26.050 16.051 -13.779 221 2HB CYS 28 1HB CYS 28 24.323 15.870 -14.176 222 H GLU 29 H GLU 29 25.893 15.360 -18.128 223 HA GLU 29 HA GLU 29 23.258 16.225 -19.295 224 1HB GLU 29 1HB GLU 29 25.662 14.768 -20.560 225 2HB GLU 29 2HB GLU 29 24.189 15.098 -21.459 226 1HG GLU 29 2HG GLU 29 24.481 17.556 -21.193 227 2HG GLU 29 1HG GLU 29 25.963 17.295 -20.263
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